data_15914_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15914
_Entry.PDB_ID 2K9A
_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 50
_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 14 14 PHE CA C 13 58.199 56.748 1.451 1
1 2 . 1 1 1 A 14 14 PHE CB C 13 39.717 40.189 -0.472 1
1 3 . 1 1 1 A 15 15 SER H H 14 8.299 8.959 -0.660 1
1 4 . 1 1 1 A 15 15 SER HA H 14 4.359 5.386 -1.027 1
1 7 . 1 1 1 A 15 15 SER CA C 14 58.249 56.517 1.732 1
1 8 . 1 1 1 A 15 15 SER CB C 14 63.936 64.871 -0.935 1
1 9 . 1 1 1 A 15 15 SER N N 14 117.379 117.575 -0.196 1
1 10 . 1 1 1 A 16 16 SER H H 15 8.255 8.861 -0.606 1
1 11 . 1 1 1 A 16 16 SER HA H 15 3.729 4.620 -0.891 1
1 14 . 1 1 1 A 16 16 SER CA C 15 58.224 59.393 -1.169 1
1 15 . 1 1 1 A 16 16 SER CB C 15 63.886 63.711 0.175 1
1 16 . 1 1 1 A 16 16 SER N N 15 117.694 117.715 -0.021 1
1 17 . 1 1 1 A 17 17 ALA H H 16 8.333 8.506 -0.173 1
1 18 . 1 1 1 A 17 17 ALA HA H 16 4.252 4.313 -0.061 1
1 22 . 1 1 1 A 17 17 ALA CA C 16 53.377 53.878 -0.501 1
1 23 . 1 1 1 A 17 17 ALA CB C 16 18.896 18.459 0.437 1
1 24 . 1 1 1 A 17 17 ALA N N 16 125.462 125.342 0.120 1
1 25 . 1 1 1 A 18 18 SER H H 17 8.219 8.218 0.001 1
1 26 . 1 1 1 A 18 18 SER HA H 17 4.332 4.282 0.050 1
1 29 . 1 1 1 A 18 18 SER CA C 17 59.105 61.632 -2.527 1
1 30 . 1 1 1 A 18 18 SER CB C 17 63.592 63.583 0.009 1
1 31 . 1 1 1 A 18 18 SER N N 17 114.821 113.941 0.880 1
1 32 . 1 1 1 A 19 19 ASP H H 18 8.309 8.177 0.132 1
1 33 . 1 1 1 A 19 19 ASP HA H 18 4.554 5.070 -0.516 1
1 36 . 1 1 1 A 19 19 ASP C C 18 176.528 176.977 -0.449 1
1 37 . 1 1 1 A 19 19 ASP CA C 18 55.272 54.943 0.329 1
1 38 . 1 1 1 A 19 19 ASP CB C 18 40.883 44.256 -3.373 1
1 39 . 1 1 1 A 19 19 ASP N N 18 123.367 117.936 5.431 1
1 40 . 1 1 1 A 20 20 ALA H H 19 8.133 8.350 -0.217 1
1 41 . 1 1 1 A 20 20 ALA HA H 19 4.170 4.066 0.104 1
1 45 . 1 1 1 A 20 20 ALA C C 19 179.857 178.808 1.049 1
1 46 . 1 1 1 A 20 20 ALA CA C 19 54.341 55.630 -1.289 1
1 47 . 1 1 1 A 20 20 ALA CB C 19 18.660 18.585 0.075 1
1 48 . 1 1 1 A 20 20 ALA N N 19 123.350 122.420 0.930 1
1 49 . 1 1 1 A 21 21 GLU H H 20 8.140 8.100 0.040 1
1 50 . 1 1 1 A 21 21 GLU HA H 20 4.128 4.153 -0.025 1
1 55 . 1 1 1 A 21 21 GLU C C 20 177.675 178.898 -1.223 1
1 56 . 1 1 1 A 21 21 GLU CA C 20 58.520 59.436 -0.916 1
1 57 . 1 1 1 A 21 21 GLU CB C 20 29.765 29.356 0.409 1
1 59 . 1 1 1 A 21 21 GLU N N 20 119.063 118.763 0.300 1
1 60 . 1 1 1 A 22 22 PHE H H 21 8.009 7.989 0.020 1
1 61 . 1 1 1 A 22 22 PHE HA H 21 4.123 4.393 -0.270 1
1 68 . 1 1 1 A 22 22 PHE C C 21 176.410 177.115 -0.705 1
1 69 . 1 1 1 A 22 22 PHE CA C 21 62.202 61.505 0.697 1
1 70 . 1 1 1 A 22 22 PHE CB C 21 39.223 39.213 0.010 1
1 75 . 1 1 1 A 22 22 PHE N N 21 121.211 121.120 0.091 1
1 76 . 1 1 1 A 23 23 ASP H H 22 8.261 8.326 -0.065 1
1 77 . 1 1 1 A 23 23 ASP HA H 22 4.041 4.488 -0.447 1
1 80 . 1 1 1 A 23 23 ASP C C 22 179.078 178.640 0.438 1
1 81 . 1 1 1 A 23 23 ASP CA C 22 57.048 57.235 -0.187 1
1 82 . 1 1 1 A 23 23 ASP CB C 22 40.154 40.125 0.029 1
1 83 . 1 1 1 A 23 23 ASP N N 22 116.876 118.808 -1.932 1
1 84 . 1 1 1 A 24 24 ALA H H 23 7.651 7.677 -0.026 1
1 85 . 1 1 1 A 24 24 ALA HA H 23 3.785 3.861 -0.076 1
1 89 . 1 1 1 A 24 24 ALA C C 23 179.577 179.798 -0.221 1
1 90 . 1 1 1 A 24 24 ALA CA C 23 54.341 55.260 -0.919 1
1 91 . 1 1 1 A 24 24 ALA CB C 23 17.762 18.250 -0.488 1
1 92 . 1 1 1 A 24 24 ALA N N 23 121.873 122.785 -0.912 1
1 93 . 1 1 1 A 25 25 VAL H H 24 7.718 7.935 -0.217 1
1 94 . 1 1 1 A 25 25 VAL HA H 24 3.216 3.545 -0.329 1
1 102 . 1 1 1 A 25 25 VAL C C 24 177.805 178.313 -0.508 1
1 103 . 1 1 1 A 25 25 VAL CA C 24 66.789 66.677 0.112 1
1 104 . 1 1 1 A 25 25 VAL CB C 24 31.277 31.276 0.001 1
1 107 . 1 1 1 A 25 25 VAL N N 24 117.890 118.445 -0.555 1
1 108 . 1 1 1 A 26 26 VAL H H 25 7.867 7.867 0.000 1
1 109 . 1 1 1 A 26 26 VAL HA H 25 3.274 3.674 -0.400 1
1 117 . 1 1 1 A 26 26 VAL C C 25 177.788 177.892 -0.104 1
1 118 . 1 1 1 A 26 26 VAL CA C 25 67.282 66.416 0.866 1
1 119 . 1 1 1 A 26 26 VAL CB C 25 31.266 31.549 -0.283 1
1 122 . 1 1 1 A 26 26 VAL N N 25 118.170 120.262 -2.092 1
1 123 . 1 1 1 A 27 27 GLY H H 26 7.544 7.863 -0.319 1
1 124 . 1 1 1 A 27 27 GLY HA2 H 26 3.592 3.519 0.073 1
1 125 . 1 1 1 A 27 27 GLY HA3 H 26 3.721 3.640 0.081 1
1 126 . 1 1 1 A 27 27 GLY C C 26 176.717 176.167 0.550 1
1 127 . 1 1 1 A 27 27 GLY CA C 26 47.085 47.223 -0.138 1
1 128 . 1 1 1 A 27 27 GLY N N 26 105.795 107.654 -1.859 1
1 129 . 1 1 1 A 28 28 TYR H H 27 7.625 7.406 0.219 1
1 130 . 1 1 1 A 28 28 TYR HA H 27 4.546 4.590 -0.044 1
1 137 . 1 1 1 A 28 28 TYR C C 27 178.991 178.605 0.386 1
1 138 . 1 1 1 A 28 28 TYR CA C 27 58.845 59.992 -1.147 1
1 139 . 1 1 1 A 28 28 TYR CB C 27 37.602 37.408 0.194 1
1 144 . 1 1 1 A 28 28 TYR N N 27 119.933 121.769 -1.836 1
1 145 . 1 1 1 A 29 29 LEU H H 28 8.517 8.057 0.460 1
1 146 . 1 1 1 A 29 29 LEU HA H 28 3.728 3.884 -0.156 1
1 156 . 1 1 1 A 29 29 LEU CA C 28 58.281 57.988 0.293 1
1 157 . 1 1 1 A 29 29 LEU CB C 28 41.948 41.633 0.315 1
1 161 . 1 1 1 A 29 29 LEU N N 28 119.669 120.983 -1.314 1
1 162 . 1 1 1 A 30 30 GLU H H 29 8.072 8.043 0.029 1
1 163 . 1 1 1 A 30 30 GLU HA H 29 3.722 3.884 -0.162 1
1 168 . 1 1 1 A 30 30 GLU C C 29 177.731 179.066 -1.335 1
1 169 . 1 1 1 A 30 30 GLU CA C 29 59.763 59.999 -0.236 1
1 170 . 1 1 1 A 30 30 GLU CB C 29 28.844 29.272 -0.428 1
1 172 . 1 1 1 A 30 30 GLU N N 29 117.666 117.687 -0.021 1
1 173 . 1 1 1 A 31 31 ASP H H 30 7.243 8.136 -0.893 1
1 174 . 1 1 1 A 31 31 ASP HA H 30 4.297 4.409 -0.112 1
1 177 . 1 1 1 A 31 31 ASP CA C 30 56.953 57.257 -0.304 1
1 178 . 1 1 1 A 31 31 ASP CB C 30 40.730 42.283 -1.553 1
1 179 . 1 1 1 A 31 31 ASP N N 30 116.720 119.172 -2.452 1
1 180 . 1 1 1 A 32 32 ILE H H 31 7.940 7.365 0.575 1
1 181 . 1 1 1 A 32 32 ILE HA H 31 3.640 3.888 -0.248 1
1 191 . 1 1 1 A 32 32 ILE C C 31 177.980 178.382 -0.402 1
1 192 . 1 1 1 A 32 32 ILE CA C 31 64.692 63.997 0.695 1
1 193 . 1 1 1 A 32 32 ILE CB C 31 38.938 37.116 1.822 1
1 197 . 1 1 1 A 32 32 ILE N N 31 119.728 117.488 2.240 1
1 198 . 1 1 1 A 33 33 ILE H H 32 7.984 7.837 0.147 1
1 199 . 1 1 1 A 33 33 ILE HA H 32 3.598 3.250 0.348 1
1 209 . 1 1 1 A 33 33 ILE C C 32 176.723 177.229 -0.506 1
1 210 . 1 1 1 A 33 33 ILE CA C 32 63.241 64.561 -1.320 1
1 211 . 1 1 1 A 33 33 ILE CB C 32 37.580 37.922 -0.342 1
1 215 . 1 1 1 A 33 33 ILE N N 32 113.919 121.301 -7.382 1
1 216 . 1 1 1 A 34 34 MET H H 33 7.288 7.692 -0.404 1
1 217 . 1 1 1 A 34 34 MET HA H 33 4.496 4.690 -0.194 1
1 225 . 1 1 1 A 34 34 MET C C 33 176.423 175.785 0.638 1
1 226 . 1 1 1 A 34 34 MET CA C 33 54.634 54.311 0.323 1
1 227 . 1 1 1 A 34 34 MET CB C 33 31.934 31.780 0.154 1
1 230 . 1 1 1 A 34 34 MET N N 33 115.130 116.565 -1.435 1
1 231 . 1 1 1 A 35 35 ASP H H 34 7.405 7.680 -0.275 1
1 232 . 1 1 1 A 35 35 ASP HA H 34 4.484 4.521 -0.037 1
1 235 . 1 1 1 A 35 35 ASP C C 34 177.139 176.994 0.145 1
1 236 . 1 1 1 A 35 35 ASP CA C 34 54.625 54.725 -0.100 1
1 237 . 1 1 1 A 35 35 ASP CB C 34 43.554 42.574 0.980 1
1 238 . 1 1 1 A 35 35 ASP N N 34 121.814 121.887 -0.073 1
1 239 . 1 1 1 A 36 36 ASP H H 35 8.765 8.813 -0.048 1
1 240 . 1 1 1 A 36 36 ASP HA H 35 4.235 4.295 -0.060 1
1 243 . 1 1 1 A 36 36 ASP C C 35 178.320 178.411 -0.091 1
1 244 . 1 1 1 A 36 36 ASP CA C 35 57.832 57.982 -0.150 1
1 245 . 1 1 1 A 36 36 ASP CB C 35 40.914 40.410 0.504 1
1 246 . 1 1 1 A 36 36 ASP N N 35 125.883 125.221 0.662 1
1 247 . 1 1 1 A 37 37 GLU H H 36 8.905 8.350 0.555 1
1 248 . 1 1 1 A 37 37 GLU HA H 36 3.933 4.038 -0.105 1
1 253 . 1 1 1 A 37 37 GLU C C 36 179.304 179.086 0.218 1
1 254 . 1 1 1 A 37 37 GLU CA C 36 59.828 59.260 0.568 1
1 255 . 1 1 1 A 37 37 GLU CB C 36 29.380 29.347 0.033 1
1 257 . 1 1 1 A 37 37 GLU N N 36 119.077 120.227 -1.150 1
1 258 . 1 1 1 A 38 38 PHE H H 37 7.460 8.271 -0.811 1
1 259 . 1 1 1 A 38 38 PHE HA H 37 3.642 4.096 -0.454 1
1 267 . 1 1 1 A 38 38 PHE C C 37 176.483 178.084 -1.601 1
1 268 . 1 1 1 A 38 38 PHE CA C 37 61.411 61.355 0.056 1
1 269 . 1 1 1 A 38 38 PHE CB C 37 39.355 39.038 0.317 1
1 275 . 1 1 1 A 38 38 PHE N N 37 119.968 120.572 -0.604 1
1 276 . 1 1 1 A 39 39 GLN H H 38 7.968 7.985 -0.017 1
1 277 . 1 1 1 A 39 39 GLN HA H 38 3.712 3.786 -0.074 1
1 284 . 1 1 1 A 39 39 GLN CA C 38 59.153 58.767 0.386 1
1 285 . 1 1 1 A 39 39 GLN CB C 38 28.213 28.318 -0.105 1
1 287 . 1 1 1 A 39 39 GLN N N 38 116.433 118.128 -1.695 1
1 289 . 1 1 1 A 40 40 LEU H H 39 7.930 7.498 0.432 1
1 290 . 1 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 1 1 1 A 40 40 LEU C C 39 177.731 178.189 -0.458 1
1 301 . 1 1 1 A 40 40 LEU CA C 39 57.915 57.990 -0.075 1
1 302 . 1 1 1 A 40 40 LEU CB C 39 41.989 41.782 0.207 1
1 306 . 1 1 1 A 40 40 LEU N N 39 119.505 121.388 -1.883 1
1 307 . 1 1 1 A 41 41 LEU H H 40 7.174 7.804 -0.630 1
1 308 . 1 1 1 A 41 41 LEU HA H 40 3.835 4.011 -0.176 1
1 318 . 1 1 1 A 41 41 LEU C C 40 179.738 178.288 1.450 1
1 319 . 1 1 1 A 41 41 LEU CA C 40 58.266 58.381 -0.115 1
1 320 . 1 1 1 A 41 41 LEU CB C 40 42.050 41.340 0.710 1
1 324 . 1 1 1 A 41 41 LEU N N 40 120.971 119.656 1.315 1
1 325 . 1 1 1 A 42 42 GLN H H 41 8.058 7.925 0.133 1
1 326 . 1 1 1 A 42 42 GLN HA H 41 3.556 3.767 -0.211 1
1 333 . 1 1 1 A 42 42 GLN C C 41 177.642 178.555 -0.913 1
1 334 . 1 1 1 A 42 42 GLN CA C 41 59.826 59.185 0.641 1
1 335 . 1 1 1 A 42 42 GLN CB C 41 28.762 28.174 0.588 1
1 337 . 1 1 1 A 42 42 GLN N N 41 117.899 118.059 -0.160 1
1 339 . 1 1 1 A 43 43 ARG H H 42 8.179 7.735 0.444 1
1 340 . 1 1 1 A 43 43 ARG HA H 42 3.655 4.005 -0.350 1
1 347 . 1 1 1 A 43 43 ARG C C 42 178.051 178.808 -0.757 1
1 348 . 1 1 1 A 43 43 ARG CA C 42 59.766 58.941 0.825 1
1 349 . 1 1 1 A 43 43 ARG CB C 42 29.941 29.701 0.240 1
1 352 . 1 1 1 A 43 43 ARG N N 42 119.392 118.559 0.833 1
1 353 . 1 1 1 A 44 44 ASN H H 43 8.525 8.160 0.365 1
1 354 . 1 1 1 A 44 44 ASN HA H 43 4.332 4.359 -0.027 1
1 359 . 1 1 1 A 44 44 ASN C C 43 178.150 177.714 0.436 1
1 360 . 1 1 1 A 44 44 ASN CA C 43 55.841 56.154 -0.313 1
1 361 . 1 1 1 A 44 44 ASN CB C 43 37.632 39.297 -1.665 1
1 362 . 1 1 1 A 44 44 ASN N N 43 116.214 117.587 -1.373 1
1 364 . 1 1 1 A 45 45 PHE H H 44 7.586 7.800 -0.214 1
1 365 . 1 1 1 A 45 45 PHE HA H 44 4.132 4.301 -0.169 1
1 372 . 1 1 1 A 45 45 PHE C C 44 176.691 178.258 -1.567 1
1 373 . 1 1 1 A 45 45 PHE CA C 44 62.333 60.780 1.553 1
1 374 . 1 1 1 A 45 45 PHE CB C 44 39.449 38.436 1.013 1
1 379 . 1 1 1 A 45 45 PHE N N 44 121.501 117.404 4.097 1
1 380 . 1 1 1 A 46 46 MET H H 45 8.190 8.302 -0.112 1
1 381 . 1 1 1 A 46 46 MET HA H 45 4.060 4.352 -0.292 1
1 389 . 1 1 1 A 46 46 MET C C 45 179.754 178.128 1.626 1
1 390 . 1 1 1 A 46 46 MET CA C 45 57.742 57.722 0.020 1
1 391 . 1 1 1 A 46 46 MET CB C 45 29.912 31.117 -1.205 1
1 394 . 1 1 1 A 46 46 MET N N 45 116.727 117.385 -0.658 1
1 395 . 1 1 1 A 47 47 ASP H H 46 8.579 8.195 0.384 1
1 396 . 1 1 1 A 47 47 ASP HA H 46 4.804 4.618 0.186 1
1 399 . 1 1 1 A 47 47 ASP C C 46 177.854 178.323 -0.469 1
1 400 . 1 1 1 A 47 47 ASP CA C 46 57.277 57.245 0.032 1
1 401 . 1 1 1 A 47 47 ASP CB C 46 40.776 41.487 -0.711 1
1 402 . 1 1 1 A 47 47 ASP N N 46 117.798 120.678 -2.880 1
1 403 . 1 1 1 A 48 48 LYS H H 47 7.339 7.705 -0.366 1
1 404 . 1 1 1 A 48 48 LYS HA H 47 3.828 4.222 -0.394 1
1 413 . 1 1 1 A 48 48 LYS C C 47 178.812 178.683 0.129 1
1 414 . 1 1 1 A 48 48 LYS CA C 47 58.953 58.443 0.510 1
1 415 . 1 1 1 A 48 48 LYS CB C 47 32.796 33.048 -0.252 1
1 419 . 1 1 1 A 48 48 LYS N N 47 117.852 119.714 -1.862 1
1 420 . 1 1 1 A 49 49 TYR H H 48 6.841 8.732 -1.891 1
1 421 . 1 1 1 A 49 49 TYR HA H 48 4.995 4.185 0.810 1
1 428 . 1 1 1 A 49 49 TYR C C 48 178.138 178.489 -0.351 1
1 429 . 1 1 1 A 49 49 TYR CA C 48 58.620 59.788 -1.168 1
1 430 . 1 1 1 A 49 49 TYR CB C 48 42.939 38.078 4.861 1
1 435 . 1 1 1 A 49 49 TYR N N 48 112.109 119.817 -7.708 1
1 436 . 1 1 1 A 50 50 TYR H H 49 8.491 7.908 0.583 1
1 437 . 1 1 1 A 50 50 TYR HA H 49 4.598 4.082 0.516 1
1 444 . 1 1 1 A 50 50 TYR C C 49 176.015 177.616 -1.601 1
1 445 . 1 1 1 A 50 50 TYR CA C 49 62.442 59.490 2.952 1
1 446 . 1 1 1 A 50 50 TYR CB C 49 36.588 36.972 -0.384 1
1 451 . 1 1 1 A 50 50 TYR N N 49 118.294 119.668 -1.374 1
1 452 . 1 1 1 A 51 51 LEU H H 50 7.512 7.520 -0.008 1
1 453 . 1 1 1 A 51 51 LEU HA H 50 3.878 3.523 0.355 1
1 463 . 1 1 1 A 51 51 LEU C C 50 178.625 178.340 0.285 1
1 464 . 1 1 1 A 51 51 LEU CA C 50 55.994 57.118 -1.124 1
1 465 . 1 1 1 A 51 51 LEU CB C 50 40.743 41.358 -0.615 1
1 469 . 1 1 1 A 51 51 LEU N N 50 118.478 121.545 -3.067 1
1 470 . 1 1 1 A 52 52 GLU H H 51 8.042 7.868 0.174 1
1 471 . 1 1 1 A 52 52 GLU HA H 51 4.197 3.863 0.334 1
1 476 . 1 1 1 A 52 52 GLU C C 51 177.629 177.666 -0.037 1
1 477 . 1 1 1 A 52 52 GLU CA C 51 56.141 59.469 -3.328 1
1 478 . 1 1 1 A 52 52 GLU CB C 51 29.162 28.952 0.210 1
1 480 . 1 1 1 A 52 52 GLU N N 51 115.067 118.127 -3.060 1
1 481 . 1 1 1 A 53 53 PHE H H 52 7.465 7.836 -0.371 1
1 482 . 1 1 1 A 53 53 PHE HA H 52 4.431 4.468 -0.037 1
1 490 . 1 1 1 A 53 53 PHE C C 52 174.325 174.828 -0.503 1
1 491 . 1 1 1 A 53 53 PHE CA C 52 58.986 57.446 1.540 1
1 492 . 1 1 1 A 53 53 PHE CB C 52 40.183 37.667 2.516 1
1 498 . 1 1 1 A 53 53 PHE N N 52 116.768 118.969 -2.201 1
1 499 . 1 1 1 A 54 54 GLU H H 53 7.484 8.595 -1.111 1
1 500 . 1 1 1 A 54 54 GLU HA H 53 4.583 4.965 -0.382 1
1 505 . 1 1 1 A 54 54 GLU C C 53 175.722 175.560 0.162 1
1 506 . 1 1 1 A 54 54 GLU CA C 53 54.248 54.620 -0.372 1
1 507 . 1 1 1 A 54 54 GLU CB C 53 34.409 32.619 1.790 1
1 509 . 1 1 1 A 54 54 GLU N N 53 118.844 125.502 -6.658 1
1 510 . 1 1 1 A 55 55 ASP H H 54 9.008 8.773 0.235 1
1 511 . 1 1 1 A 55 55 ASP HA H 54 4.735 4.838 -0.103 1
1 514 . 1 1 1 A 55 55 ASP C C 54 175.421 175.963 -0.542 1
1 515 . 1 1 1 A 55 55 ASP CA C 54 52.888 54.262 -1.374 1
1 516 . 1 1 1 A 55 55 ASP CB C 54 38.894 40.785 -1.891 1
1 517 . 1 1 1 A 55 55 ASP N N 54 123.654 127.667 -4.013 1
1 518 . 1 1 1 A 56 56 THR H H 55 7.819 8.454 -0.635 1
1 519 . 1 1 1 A 56 56 THR HA H 55 4.574 4.945 -0.371 1
1 524 . 1 1 1 A 56 56 THR C C 55 174.096 174.304 -0.208 1
1 525 . 1 1 1 A 56 56 THR CA C 55 59.172 59.699 -0.527 1
1 526 . 1 1 1 A 56 56 THR CB C 55 71.889 72.263 -0.374 1
1 528 . 1 1 1 A 56 56 THR N N 55 112.015 118.341 -6.326 1
1 529 . 1 1 1 A 57 57 GLU H H 56 8.527 8.798 -0.271 1
1 530 . 1 1 1 A 57 57 GLU HA H 56 4.217 4.417 -0.200 1
1 535 . 1 1 1 A 57 57 GLU C C 56 177.042 176.019 1.023 1
1 536 . 1 1 1 A 57 57 GLU CA C 56 56.869 56.643 0.226 1
1 537 . 1 1 1 A 57 57 GLU CB C 56 29.731 30.611 -0.880 1
1 539 . 1 1 1 A 57 57 GLU N N 56 117.531 118.580 -1.049 1
1 540 . 1 1 1 A 58 58 GLU H H 57 7.587 7.691 -0.104 1
1 541 . 1 1 1 A 58 58 GLU HA H 57 3.941 4.944 -1.003 1
1 546 . 1 1 1 A 58 58 GLU C C 57 176.849 175.074 1.775 1
1 547 . 1 1 1 A 58 58 GLU CA C 57 56.924 55.255 1.669 1
1 548 . 1 1 1 A 58 58 GLU CB C 57 30.251 32.077 -1.826 1
1 550 . 1 1 1 A 58 58 GLU N N 57 119.183 117.466 1.717 1
1 551 . 1 1 1 A 59 59 ASN H H 58 9.120 8.764 0.356 1
1 552 . 1 1 1 A 59 59 ASN HA H 58 4.922 5.058 -0.136 1
1 557 . 1 1 1 A 59 59 ASN C C 58 174.254 174.654 -0.400 1
1 558 . 1 1 1 A 59 59 ASN CA C 58 51.956 52.075 -0.119 1
1 559 . 1 1 1 A 59 59 ASN CB C 58 37.404 40.796 -3.392 1
1 560 . 1 1 1 A 59 59 ASN N N 58 126.767 121.734 5.033 1
1 562 . 1 1 1 A 60 60 LYS H H 59 5.892 8.820 -2.928 1
1 563 . 1 1 1 A 60 60 LYS HA H 59 3.798 4.545 -0.747 1
1 572 . 1 1 1 A 60 60 LYS C C 59 177.908 178.142 -0.234 1
1 573 . 1 1 1 A 60 60 LYS CA C 59 56.623 54.890 1.733 1
1 574 . 1 1 1 A 60 60 LYS CB C 59 32.279 34.218 -1.939 1
1 578 . 1 1 1 A 60 60 LYS N N 59 121.527 124.720 -3.193 1
1 579 . 1 1 1 A 61 61 LEU H H 60 8.473 8.921 -0.448 1
1 580 . 1 1 1 A 61 61 LEU HA H 60 3.891 4.216 -0.325 1
1 590 . 1 1 1 A 61 61 LEU C C 60 179.843 178.043 1.800 1
1 591 . 1 1 1 A 61 61 LEU CA C 60 58.301 57.262 1.039 1
1 592 . 1 1 1 A 61 61 LEU CB C 60 41.305 41.907 -0.602 1
1 596 . 1 1 1 A 61 61 LEU N N 60 125.639 125.290 0.349 1
1 597 . 1 1 1 A 62 62 ILE H H 61 7.698 8.108 -0.410 1
1 598 . 1 1 1 A 62 62 ILE HA H 61 3.952 3.927 0.025 1
1 608 . 1 1 1 A 62 62 ILE C C 61 175.392 177.130 -1.738 1
1 609 . 1 1 1 A 62 62 ILE CA C 61 61.743 63.368 -1.625 1
1 610 . 1 1 1 A 62 62 ILE CB C 61 39.108 37.812 1.296 1
1 614 . 1 1 1 A 62 62 ILE N N 61 114.111 118.874 -4.763 1
1 615 . 1 1 1 A 63 63 TYR H H 62 7.273 7.929 -0.656 1
1 616 . 1 1 1 A 63 63 TYR HA H 62 4.343 4.124 0.219 1
1 623 . 1 1 1 A 63 63 TYR C C 62 178.264 178.516 -0.252 1
1 624 . 1 1 1 A 63 63 TYR CA C 62 57.231 61.095 -3.864 1
1 625 . 1 1 1 A 63 63 TYR CB C 62 36.332 37.870 -1.538 1
1 630 . 1 1 1 A 63 63 TYR N N 62 117.689 121.373 -3.684 1
1 631 . 1 1 1 A 64 64 THR H H 63 7.747 8.064 -0.317 1
1 632 . 1 1 1 A 64 64 THR HA H 63 4.266 4.220 0.046 1
1 637 . 1 1 1 A 64 64 THR CA C 63 69.362 67.593 1.769 1
1 638 . 1 1 1 A 64 64 THR CB C 63 66.962 67.409 -0.447 1
1 640 . 1 1 1 A 64 64 THR N N 63 113.755 116.192 -2.437 1
1 641 . 1 1 1 A 65 65 PRO HA H 64 4.372 4.381 -0.009 1
1 648 . 1 1 1 A 65 65 PRO C C 64 179.913 179.362 0.551 1
1 649 . 1 1 1 A 65 65 PRO CA C 64 66.011 66.015 -0.004 1
1 650 . 1 1 1 A 65 65 PRO CB C 64 30.642 30.728 -0.086 1
1 653 . 1 1 1 A 66 66 ILE H H 65 7.377 7.309 0.068 1
1 654 . 1 1 1 A 66 66 ILE HA H 65 3.530 3.852 -0.322 1
1 664 . 1 1 1 A 66 66 ILE C C 65 177.543 178.251 -0.708 1
1 665 . 1 1 1 A 66 66 ILE CA C 65 66.647 64.182 2.465 1
1 666 . 1 1 1 A 66 66 ILE CB C 65 38.029 37.614 0.415 1
1 670 . 1 1 1 A 66 66 ILE N N 65 118.353 116.682 1.671 1
1 671 . 1 1 1 A 67 67 PHE H H 66 8.480 8.465 0.015 1
1 672 . 1 1 1 A 67 67 PHE HA H 66 4.115 4.348 -0.233 1
1 680 . 1 1 1 A 67 67 PHE C C 66 177.293 177.793 -0.500 1
1 681 . 1 1 1 A 67 67 PHE CA C 66 59.570 62.300 -2.730 1
1 682 . 1 1 1 A 67 67 PHE CB C 66 38.865 39.522 -0.657 1
1 688 . 1 1 1 A 67 67 PHE N N 66 122.420 120.416 2.004 1
1 689 . 1 1 1 A 68 68 ASN H H 67 8.595 8.239 0.356 1
1 690 . 1 1 1 A 68 68 ASN HA H 67 4.211 4.334 -0.123 1
1 695 . 1 1 1 A 68 68 ASN C C 67 178.697 178.266 0.431 1
1 696 . 1 1 1 A 68 68 ASN CA C 67 56.056 56.291 -0.235 1
1 697 . 1 1 1 A 68 68 ASN CB C 67 37.704 38.022 -0.318 1
1 698 . 1 1 1 A 68 68 ASN N N 67 115.573 117.568 -1.995 1
1 700 . 1 1 1 A 69 69 GLU H H 68 8.414 8.100 0.314 1
1 701 . 1 1 1 A 69 69 GLU HA H 68 4.102 4.191 -0.089 1
1 706 . 1 1 1 A 69 69 GLU C C 68 177.880 178.841 -0.961 1
1 707 . 1 1 1 A 69 69 GLU CA C 68 59.399 59.436 -0.037 1
1 708 . 1 1 1 A 69 69 GLU CB C 68 29.855 29.476 0.379 1
1 710 . 1 1 1 A 69 69 GLU N N 68 123.510 120.012 3.498 1
1 711 . 1 1 1 A 70 70 TYR H H 69 8.659 8.089 0.570 1
1 712 . 1 1 1 A 70 70 TYR HA H 69 3.362 4.090 -0.728 1
1 719 . 1 1 1 A 70 70 TYR C C 69 178.143 177.021 1.122 1
1 720 . 1 1 1 A 70 70 TYR CA C 69 60.686 61.015 -0.329 1
1 721 . 1 1 1 A 70 70 TYR CB C 69 38.560 38.950 -0.390 1
1 726 . 1 1 1 A 70 70 TYR N N 69 122.130 120.783 1.347 1
1 727 . 1 1 1 A 71 71 ILE H H 70 8.031 7.784 0.247 1
1 728 . 1 1 1 A 71 71 ILE HA H 70 3.265 3.668 -0.403 1
1 738 . 1 1 1 A 71 71 ILE C C 70 178.056 177.280 0.776 1
1 739 . 1 1 1 A 71 71 ILE CA C 70 63.756 63.982 -0.226 1
1 740 . 1 1 1 A 71 71 ILE CB C 70 37.321 36.696 0.625 1
1 744 . 1 1 1 A 71 71 ILE N N 70 118.906 120.111 -1.205 1
1 745 . 1 1 1 A 72 72 SER H H 71 7.803 7.714 0.089 1
1 746 . 1 1 1 A 72 72 SER HA H 71 4.029 4.376 -0.347 1
1 749 . 1 1 1 A 72 72 SER CA C 71 61.380 60.952 0.428 1
1 750 . 1 1 1 A 72 72 SER CB C 71 63.288 63.273 0.015 1
1 751 . 1 1 1 A 72 72 SER N N 71 113.735 116.764 -3.029 1
1 752 . 1 1 1 A 73 73 LEU H H 72 7.952 8.031 -0.079 1
1 753 . 1 1 1 A 73 73 LEU HA H 72 4.418 4.121 0.297 1
1 763 . 1 1 1 A 73 73 LEU C C 72 177.767 178.340 -0.573 1
1 764 . 1 1 1 A 73 73 LEU CA C 72 56.543 57.431 -0.888 1
1 765 . 1 1 1 A 73 73 LEU CB C 72 44.517 41.706 2.811 1
1 769 . 1 1 1 A 73 73 LEU N N 72 119.411 122.499 -3.088 1
1 770 . 1 1 1 A 74 74 VAL H H 73 8.021 7.525 0.496 1
1 771 . 1 1 1 A 74 74 VAL HA H 73 3.532 3.353 0.179 1
1 779 . 1 1 1 A 74 74 VAL C C 73 177.126 177.950 -0.824 1
1 780 . 1 1 1 A 74 74 VAL CA C 73 66.250 66.321 -0.071 1
1 781 . 1 1 1 A 74 74 VAL CB C 73 31.212 31.193 0.019 1
1 784 . 1 1 1 A 74 74 VAL N N 73 118.747 119.071 -0.324 1
1 785 . 1 1 1 A 75 75 GLU H H 74 7.232 7.911 -0.679 1
1 786 . 1 1 1 A 75 75 GLU HA H 74 3.013 4.194 -1.181 1
1 791 . 1 1 1 A 75 75 GLU C C 74 178.804 179.091 -0.287 1
1 792 . 1 1 1 A 75 75 GLU CA C 74 60.536 60.052 0.484 1
1 793 . 1 1 1 A 75 75 GLU CB C 74 27.009 29.099 -2.090 1
1 795 . 1 1 1 A 75 75 GLU N N 74 118.660 119.782 -1.122 1
1 796 . 1 1 1 A 76 76 LYS H H 75 7.051 7.738 -0.687 1
1 797 . 1 1 1 A 76 76 LYS HA H 75 3.765 4.022 -0.257 1
1 806 . 1 1 1 A 76 76 LYS C C 75 177.765 178.172 -0.407 1
1 807 . 1 1 1 A 76 76 LYS CA C 75 58.357 58.717 -0.360 1
1 808 . 1 1 1 A 76 76 LYS CB C 75 31.939 31.963 -0.024 1
1 812 . 1 1 1 A 76 76 LYS N N 75 116.112 119.920 -3.808 1
1 813 . 1 1 1 A 77 77 TYR H H 76 7.067 7.637 -0.570 1
1 814 . 1 1 1 A 77 77 TYR HA H 76 4.036 4.166 -0.130 1
1 821 . 1 1 1 A 77 77 TYR C C 76 177.752 177.329 0.423 1
1 822 . 1 1 1 A 77 77 TYR CA C 76 61.820 61.150 0.670 1
1 823 . 1 1 1 A 77 77 TYR CB C 76 38.480 38.543 -0.063 1
1 828 . 1 1 1 A 77 77 TYR N N 76 118.434 120.552 -2.118 1
1 829 . 1 1 1 A 78 78 ILE H H 77 7.554 8.403 -0.849 1
1 830 . 1 1 1 A 78 78 ILE HA H 77 3.159 3.653 -0.494 1
1 840 . 1 1 1 A 78 78 ILE C C 77 177.341 178.126 -0.785 1
1 841 . 1 1 1 A 78 78 ILE CA C 77 65.177 65.470 -0.293 1
1 842 . 1 1 1 A 78 78 ILE CB C 77 37.339 37.789 -0.450 1
1 846 . 1 1 1 A 78 78 ILE N N 77 117.672 121.081 -3.409 1
1 847 . 1 1 1 A 79 79 GLU H H 78 8.296 7.920 0.376 1
1 848 . 1 1 1 A 79 79 GLU HA H 78 3.557 3.752 -0.195 1
1 853 . 1 1 1 A 79 79 GLU C C 78 177.742 178.782 -1.040 1
1 854 . 1 1 1 A 79 79 GLU CA C 78 60.847 60.068 0.779 1
1 855 . 1 1 1 A 79 79 GLU CB C 78 29.594 29.198 0.396 1
1 857 . 1 1 1 A 79 79 GLU N N 78 118.701 120.616 -1.915 1
1 858 . 1 1 1 A 80 80 GLU H H 79 8.330 8.343 -0.013 1
1 859 . 1 1 1 A 80 80 GLU HA H 79 3.774 3.984 -0.210 1
1 864 . 1 1 1 A 80 80 GLU C C 79 179.926 179.255 0.671 1
1 865 . 1 1 1 A 80 80 GLU CA C 79 59.581 59.005 0.576 1
1 866 . 1 1 1 A 80 80 GLU CB C 79 29.062 29.083 -0.021 1
1 868 . 1 1 1 A 80 80 GLU N N 79 116.767 118.021 -1.254 1
1 869 . 1 1 1 A 81 81 GLN H H 80 7.634 7.769 -0.135 1
1 870 . 1 1 1 A 81 81 GLN HA H 80 3.605 4.105 -0.500 1
1 877 . 1 1 1 A 81 81 GLN C C 80 179.681 178.514 1.167 1
1 878 . 1 1 1 A 81 81 GLN CA C 80 57.765 58.418 -0.653 1
1 879 . 1 1 1 A 81 81 GLN CB C 80 28.079 28.001 0.078 1
1 881 . 1 1 1 A 81 81 GLN N N 80 116.325 118.606 -2.281 1
1 883 . 1 1 1 A 82 82 LEU H H 81 8.156 7.454 0.702 1
1 884 . 1 1 1 A 82 82 LEU HA H 81 3.536 3.808 -0.272 1
1 894 . 1 1 1 A 82 82 LEU C C 81 178.945 179.451 -0.506 1
1 895 . 1 1 1 A 82 82 LEU CA C 81 57.761 56.808 0.953 1
1 896 . 1 1 1 A 82 82 LEU CB C 81 40.961 40.968 -0.007 1
1 900 . 1 1 1 A 82 82 LEU N N 81 121.546 120.167 1.379 1
1 901 . 1 1 1 A 83 83 LEU H H 82 8.326 7.960 0.366 1
1 902 . 1 1 1 A 83 83 LEU HA H 82 4.198 4.209 -0.011 1
1 912 . 1 1 1 A 83 83 LEU C C 82 178.631 179.031 -0.400 1
1 913 . 1 1 1 A 83 83 LEU CA C 82 57.016 57.142 -0.126 1
1 914 . 1 1 1 A 83 83 LEU CB C 82 42.182 40.786 1.396 1
1 918 . 1 1 1 A 83 83 LEU N N 82 120.426 119.169 1.257 1
1 919 . 1 1 1 A 84 84 GLN H H 83 6.992 7.652 -0.660 1
1 920 . 1 1 1 A 84 84 GLN HA H 83 3.877 3.985 -0.108 1
1 927 . 1 1 1 A 84 84 GLN C C 83 177.008 177.378 -0.370 1
1 928 . 1 1 1 A 84 84 GLN CA C 83 57.543 58.610 -1.067 1
1 929 . 1 1 1 A 84 84 GLN CB C 83 28.688 28.536 0.152 1
1 931 . 1 1 1 A 84 84 GLN N N 83 114.001 117.244 -3.243 1
1 933 . 1 1 1 A 85 85 ARG H H 84 7.072 7.503 -0.431 1
1 934 . 1 1 1 A 85 85 ARG HA H 84 4.047 4.485 -0.438 1
1 942 . 1 1 1 A 85 85 ARG C C 84 175.999 175.475 0.524 1
1 943 . 1 1 1 A 85 85 ARG CA C 84 56.764 56.281 0.483 1
1 944 . 1 1 1 A 85 85 ARG CB C 84 32.044 31.633 0.411 1
1 947 . 1 1 1 A 85 85 ARG N N 84 115.827 113.936 1.891 1
1 949 . 1 1 1 A 86 86 ILE H H 85 8.238 7.384 0.854 1
1 950 . 1 1 1 A 86 86 ILE HA H 85 4.389 4.590 -0.201 1
1 960 . 1 1 1 A 86 86 ILE CA C 85 58.007 57.965 0.042 1
1 961 . 1 1 1 A 86 86 ILE CB C 85 39.604 38.964 0.640 1
1 965 . 1 1 1 A 86 86 ILE N N 85 119.285 120.079 -0.794 1
1 966 . 1 1 1 A 87 87 PRO HA H 86 4.392 4.578 -0.186 1
1 973 . 1 1 1 A 87 87 PRO C C 86 177.622 176.321 1.301 1
1 974 . 1 1 1 A 87 87 PRO CA C 86 64.665 64.204 0.461 1
1 975 . 1 1 1 A 87 87 PRO CB C 86 32.020 31.784 0.236 1
1 978 . 1 1 1 A 88 88 GLU H H 87 8.312 8.212 0.100 1
1 979 . 1 1 1 A 88 88 GLU HA H 87 4.208 4.579 -0.371 1
1 984 . 1 1 1 A 88 88 GLU C C 87 175.554 175.836 -0.282 1
1 985 . 1 1 1 A 88 88 GLU CA C 87 56.045 56.190 -0.145 1
1 986 . 1 1 1 A 88 88 GLU CB C 87 28.654 30.516 -1.862 1
1 988 . 1 1 1 A 88 88 GLU N N 87 114.256 116.832 -2.576 1
1 989 . 1 1 1 A 89 89 PHE H H 88 7.946 7.395 0.551 1
1 990 . 1 1 1 A 89 89 PHE HA H 88 3.993 4.351 -0.358 1
1 998 . 1 1 1 A 89 89 PHE C C 88 173.460 174.400 -0.940 1
1 999 . 1 1 1 A 89 89 PHE CA C 88 60.119 59.473 0.646 1
1 1000 . 1 1 1 A 89 89 PHE CB C 88 39.994 39.645 0.349 1
1 1006 . 1 1 1 A 89 89 PHE N N 88 121.550 123.380 -1.830 1
1 1007 . 1 1 1 A 90 90 ASN H H 89 7.266 7.784 -0.518 1
1 1008 . 1 1 1 A 90 90 ASN HA H 89 4.454 5.021 -0.567 1
1 1013 . 1 1 1 A 90 90 ASN C C 89 173.921 175.198 -1.277 1
1 1014 . 1 1 1 A 90 90 ASN CA C 89 51.839 51.602 0.237 1
1 1015 . 1 1 1 A 90 90 ASN CB C 89 40.674 39.428 1.246 1
1 1016 . 1 1 1 A 90 90 ASN N N 89 125.344 124.630 0.714 1
1 1018 . 1 1 1 A 91 91 MET H H 90 8.968 8.536 0.432 1
1 1019 . 1 1 1 A 91 91 MET HA H 90 4.049 4.117 -0.068 1
1 1027 . 1 1 1 A 91 91 MET C C 90 177.475 178.017 -0.542 1
1 1028 . 1 1 1 A 91 91 MET CA C 90 57.758 58.252 -0.494 1
1 1029 . 1 1 1 A 91 91 MET CB C 90 32.250 32.208 0.042 1
1 1032 . 1 1 1 A 91 91 MET N N 90 127.052 124.410 2.642 1
1 1033 . 1 1 1 A 92 92 ALA H H 91 8.292 8.120 0.172 1
1 1034 . 1 1 1 A 92 92 ALA HA H 91 4.059 4.124 -0.065 1
1 1038 . 1 1 1 A 92 92 ALA C C 91 180.412 180.013 0.399 1
1 1039 . 1 1 1 A 92 92 ALA CA C 91 55.368 55.041 0.327 1
1 1040 . 1 1 1 A 92 92 ALA CB C 91 17.527 18.503 -0.976 1
1 1041 . 1 1 1 A 92 92 ALA N N 91 123.752 121.354 2.398 1
1 1042 . 1 1 1 A 93 93 ALA H H 92 7.931 7.955 -0.024 1
1 1043 . 1 1 1 A 93 93 ALA HA H 92 4.054 4.271 -0.217 1
1 1047 . 1 1 1 A 93 93 ALA C C 92 180.482 180.038 0.444 1
1 1048 . 1 1 1 A 93 93 ALA CA C 92 54.614 54.824 -0.210 1
1 1049 . 1 1 1 A 93 93 ALA CB C 92 18.098 18.195 -0.097 1
1 1050 . 1 1 1 A 93 93 ALA N N 92 121.158 120.069 1.089 1
1 1051 . 1 1 1 A 94 94 PHE H H 93 8.110 7.831 0.279 1
1 1052 . 1 1 1 A 94 94 PHE HA H 93 4.304 4.084 0.220 1
1 1060 . 1 1 1 A 94 94 PHE C C 93 177.350 177.046 0.304 1
1 1061 . 1 1 1 A 94 94 PHE CA C 93 61.641 61.443 0.198 1
1 1062 . 1 1 1 A 94 94 PHE CB C 93 40.014 39.358 0.656 1
1 1068 . 1 1 1 A 94 94 PHE N N 93 119.807 119.746 0.061 1
1 1069 . 1 1 1 A 95 95 THR H H 94 8.726 8.324 0.402 1
1 1070 . 1 1 1 A 95 95 THR HA H 94 3.569 3.990 -0.421 1
1 1075 . 1 1 1 A 95 95 THR C C 94 176.932 176.428 0.504 1
1 1076 . 1 1 1 A 95 95 THR CA C 94 66.833 65.647 1.186 1
1 1077 . 1 1 1 A 95 95 THR CB C 94 68.445 68.346 0.099 1
1 1079 . 1 1 1 A 95 95 THR N N 94 113.074 112.059 1.015 1
1 1080 . 1 1 1 A 96 96 THR H H 95 7.657 7.888 -0.231 1
1 1081 . 1 1 1 A 96 96 THR HA H 95 3.945 4.107 -0.162 1
1 1086 . 1 1 1 A 96 96 THR C C 95 176.386 177.477 -1.091 1
1 1087 . 1 1 1 A 96 96 THR CA C 95 66.550 65.690 0.860 1
1 1088 . 1 1 1 A 96 96 THR CB C 95 68.583 67.915 0.668 1
1 1090 . 1 1 1 A 96 96 THR N N 95 117.927 113.860 4.067 1
1 1091 . 1 1 1 A 97 97 THR H H 96 7.699 7.837 -0.138 1
1 1092 . 1 1 1 A 97 97 THR HA H 96 3.905 4.047 -0.142 1
1 1097 . 1 1 1 A 97 97 THR C C 96 176.572 176.404 0.168 1
1 1098 . 1 1 1 A 97 97 THR CA C 96 65.979 66.678 -0.699 1
1 1099 . 1 1 1 A 97 97 THR CB C 96 68.553 68.380 0.173 1
1 1101 . 1 1 1 A 97 97 THR N N 96 118.518 117.645 0.873 1
1 1102 . 1 1 1 A 98 98 LEU H H 97 8.304 8.243 0.061 1
1 1103 . 1 1 1 A 98 98 LEU HA H 97 3.725 3.974 -0.249 1
1 1113 . 1 1 1 A 98 98 LEU C C 97 178.490 178.481 0.009 1
1 1114 . 1 1 1 A 98 98 LEU CA C 97 58.517 58.147 0.370 1
1 1115 . 1 1 1 A 98 98 LEU CB C 97 41.697 41.102 0.595 1
1 1119 . 1 1 1 A 98 98 LEU N N 97 122.882 122.116 0.766 1
1 1120 . 1 1 1 A 99 99 GLN H H 98 7.639 7.909 -0.270 1
1 1121 . 1 1 1 A 99 99 GLN HA H 98 3.927 3.982 -0.055 1
1 1128 . 1 1 1 A 99 99 GLN C C 98 178.068 178.508 -0.440 1
1 1129 . 1 1 1 A 99 99 GLN CA C 98 58.735 59.444 -0.709 1
1 1130 . 1 1 1 A 99 99 GLN CB C 98 27.986 28.198 -0.212 1
1 1132 . 1 1 1 A 99 99 GLN N N 98 114.302 118.176 -3.874 1
1 1134 . 1 1 1 A 100 100 HIS H H 99 7.575 7.394 0.181 1
1 1135 . 1 1 1 A 100 100 HIS HA H 99 4.524 4.414 0.110 1
1 1139 . 1 1 1 A 100 100 HIS C C 99 174.789 177.520 -2.731 1
1 1140 . 1 1 1 A 100 100 HIS CA C 99 56.154 59.802 -3.648 1
1 1141 . 1 1 1 A 100 100 HIS CB C 99 28.946 30.836 -1.890 1
1 1143 . 1 1 1 A 100 100 HIS N N 99 114.778 118.860 -4.082 1
1 1144 . 1 1 1 A 101 101 HIS H H 100 7.773 8.233 -0.460 1
1 1145 . 1 1 1 A 101 101 HIS HA H 100 4.704 3.939 0.765 1
1 1149 . 1 1 1 A 101 101 HIS C C 100 174.818 176.917 -2.099 1
1 1150 . 1 1 1 A 101 101 HIS CA C 100 54.830 58.240 -3.410 1
1 1151 . 1 1 1 A 101 101 HIS CB C 100 29.749 30.050 -0.301 1
1 1153 . 1 1 1 A 101 101 HIS N N 100 117.397 119.078 -1.681 1
1 1154 . 1 1 1 A 102 102 LYS H H 101 7.324 8.110 -0.786 1
1 1155 . 1 1 1 A 102 102 LYS HA H 101 3.611 4.081 -0.470 1
1 1164 . 1 1 1 A 102 102 LYS C C 101 176.823 177.987 -1.164 1
1 1165 . 1 1 1 A 102 102 LYS CA C 101 59.915 58.868 1.047 1
1 1166 . 1 1 1 A 102 102 LYS CB C 101 32.825 32.123 0.702 1
1 1170 . 1 1 1 A 102 102 LYS N N 101 120.533 118.812 1.721 1
1 1171 . 1 1 1 A 103 103 ASP H H 102 8.361 7.588 0.773 1
1 1172 . 1 1 1 A 103 103 ASP HA H 102 4.421 4.361 0.060 1
1 1175 . 1 1 1 A 103 103 ASP C C 102 176.793 177.790 -0.997 1
1 1176 . 1 1 1 A 103 103 ASP CA C 102 55.500 56.459 -0.959 1
1 1177 . 1 1 1 A 103 103 ASP CB C 102 40.178 40.636 -0.458 1
1 1178 . 1 1 1 A 103 103 ASP N N 102 114.814 119.417 -4.603 1
1 1179 . 1 1 1 A 104 104 GLU H H 103 7.858 7.753 0.105 1
1 1180 . 1 1 1 A 104 104 GLU HA H 103 4.339 4.207 0.132 1
1 1183 . 1 1 1 A 104 104 GLU C C 103 175.777 176.758 -0.981 1
1 1184 . 1 1 1 A 104 104 GLU CA C 103 56.356 57.826 -1.470 1
1 1185 . 1 1 1 A 104 104 GLU CB C 103 31.293 30.210 1.083 1
1 1186 . 1 1 1 A 104 104 GLU N N 103 116.826 118.388 -1.562 1
1 1187 . 1 1 1 A 105 105 VAL H H 104 7.201 7.520 -0.319 1
1 1188 . 1 1 1 A 105 105 VAL HA H 104 4.296 4.135 0.161 1
1 1196 . 1 1 1 A 105 105 VAL C C 104 174.482 175.606 -1.124 1
1 1197 . 1 1 1 A 105 105 VAL CA C 104 60.370 62.621 -2.251 1
1 1198 . 1 1 1 A 105 105 VAL CB C 104 34.341 32.886 1.455 1
1 1201 . 1 1 1 A 105 105 VAL N N 104 116.422 119.379 -2.957 1
1 1202 . 1 1 1 A 106 106 ALA H H 105 8.487 8.480 0.007 1
1 1203 . 1 1 1 A 106 106 ALA HA H 105 4.172 4.369 -0.197 1
1 1207 . 1 1 1 A 106 106 ALA C C 105 179.030 178.688 0.342 1
1 1208 . 1 1 1 A 106 106 ALA CA C 105 52.966 52.327 0.639 1
1 1209 . 1 1 1 A 106 106 ALA CB C 105 19.371 19.114 0.257 1
1 1210 . 1 1 1 A 106 106 ALA N N 105 128.313 128.749 -0.436 1
1 1211 . 1 1 1 A 107 107 GLY H H 106 8.738 8.775 -0.037 1
1 1212 . 1 1 1 A 107 107 GLY HA2 H 106 3.773 3.850 -0.077 1
1 1213 . 1 1 1 A 107 107 GLY HA3 H 106 3.998 3.912 0.086 1
1 1214 . 1 1 1 A 107 107 GLY C C 106 174.958 175.661 -0.703 1
1 1215 . 1 1 1 A 107 107 GLY CA C 106 47.449 47.254 0.195 1
1 1216 . 1 1 1 A 107 107 GLY N N 106 110.612 110.715 -0.103 1
1 1217 . 1 1 1 A 108 108 ASP H H 107 8.535 8.354 0.181 1
1 1218 . 1 1 1 A 108 108 ASP HA H 107 4.333 4.688 -0.355 1
1 1221 . 1 1 1 A 108 108 ASP C C 107 179.133 178.611 0.522 1
1 1222 . 1 1 1 A 108 108 ASP CA C 107 56.721 57.085 -0.364 1
1 1223 . 1 1 1 A 108 108 ASP CB C 107 39.336 42.280 -2.944 1
1 1224 . 1 1 1 A 108 108 ASP N N 107 117.474 121.537 -4.063 1
1 1225 . 1 1 1 A 109 109 ILE H H 108 7.459 7.861 -0.402 1
1 1226 . 1 1 1 A 109 109 ILE HA H 108 3.688 3.893 -0.205 1
1 1236 . 1 1 1 A 109 109 ILE C C 108 176.735 178.535 -1.800 1
1 1237 . 1 1 1 A 109 109 ILE CA C 108 63.474 65.307 -1.833 1
1 1238 . 1 1 1 A 109 109 ILE CB C 108 37.340 37.819 -0.479 1
1 1242 . 1 1 1 A 109 109 ILE N N 108 119.609 119.766 -0.157 1
1 1243 . 1 1 1 A 110 110 PHE H H 109 7.920 8.315 -0.395 1
1 1244 . 1 1 1 A 110 110 PHE HA H 109 3.759 4.097 -0.338 1
1 1252 . 1 1 1 A 110 110 PHE C C 109 177.132 177.320 -0.188 1
1 1253 . 1 1 1 A 110 110 PHE CA C 109 62.766 61.206 1.560 1
1 1254 . 1 1 1 A 110 110 PHE CB C 109 39.752 39.292 0.460 1
1 1260 . 1 1 1 A 110 110 PHE N N 109 120.906 120.290 0.616 1
1 1261 . 1 1 1 A 111 111 ASP H H 110 8.639 8.203 0.436 1
1 1262 . 1 1 1 A 111 111 ASP HA H 110 4.216 4.139 0.077 1
1 1265 . 1 1 1 A 111 111 ASP C C 110 178.900 178.620 0.280 1
1 1266 . 1 1 1 A 111 111 ASP CA C 110 57.105 57.234 -0.129 1
1 1267 . 1 1 1 A 111 111 ASP CB C 110 39.697 40.567 -0.870 1
1 1268 . 1 1 1 A 111 111 ASP N N 110 117.124 118.474 -1.350 1
1 1269 . 1 1 1 A 112 112 MET H H 111 7.331 7.603 -0.272 1
1 1270 . 1 1 1 A 112 112 MET HA H 111 4.081 4.160 -0.079 1
1 1278 . 1 1 1 A 112 112 MET C C 111 179.052 178.149 0.903 1
1 1279 . 1 1 1 A 112 112 MET CA C 111 58.202 58.099 0.103 1
1 1280 . 1 1 1 A 112 112 MET CB C 111 31.827 32.453 -0.626 1
1 1283 . 1 1 1 A 112 112 MET N N 111 118.061 119.448 -1.387 1
1 1284 . 1 1 1 A 113 113 LEU H H 112 8.001 8.027 -0.026 1
1 1285 . 1 1 1 A 113 113 LEU HA H 112 3.723 3.550 0.173 1
1 1295 . 1 1 1 A 113 113 LEU C C 112 179.747 178.488 1.259 1
1 1296 . 1 1 1 A 113 113 LEU CA C 112 57.371 57.382 -0.011 1
1 1297 . 1 1 1 A 113 113 LEU CB C 112 40.671 41.099 -0.428 1
1 1301 . 1 1 1 A 113 113 LEU N N 112 120.426 119.655 0.771 1
1 1302 . 1 1 1 A 114 114 LEU H H 113 7.744 7.742 0.002 1
1 1303 . 1 1 1 A 114 114 LEU HA H 113 4.007 3.491 0.516 1
1 1313 . 1 1 1 A 114 114 LEU C C 113 179.358 178.529 0.829 1
1 1314 . 1 1 1 A 114 114 LEU CA C 113 57.202 57.494 -0.292 1
1 1315 . 1 1 1 A 114 114 LEU CB C 113 41.727 41.619 0.108 1
1 1319 . 1 1 1 A 114 114 LEU N N 113 119.584 119.519 0.065 1
1 1320 . 1 1 1 A 115 115 THR H H 114 7.353 7.591 -0.238 1
1 1321 . 1 1 1 A 115 115 THR HA H 114 4.071 4.102 -0.031 1
1 1327 . 1 1 1 A 115 115 THR C C 114 173.591 176.458 -2.867 1
1 1328 . 1 1 1 A 115 115 THR CA C 114 65.332 64.391 0.941 1
1 1329 . 1 1 1 A 115 115 THR CB C 114 70.319 68.681 1.638 1
1 1331 . 1 1 1 A 115 115 THR N N 114 107.535 112.392 -4.857 1
1 1332 . 1 1 1 A 116 116 PHE H H 115 6.979 7.804 -0.825 1
1 1333 . 1 1 1 A 116 116 PHE HA H 115 5.022 4.251 0.771 1
1 1341 . 1 1 1 A 116 116 PHE C C 115 176.488 176.492 -0.004 1
1 1342 . 1 1 1 A 116 116 PHE CA C 115 55.911 60.879 -4.968 1
1 1343 . 1 1 1 A 116 116 PHE CB C 115 38.521 39.108 -0.587 1
1 1349 . 1 1 1 A 116 116 PHE N N 115 112.366 120.039 -7.673 1
1 1350 . 1 1 1 A 117 117 THR H H 116 7.564 7.397 0.167 1
1 1351 . 1 1 1 A 117 117 THR HA H 116 4.626 4.861 -0.235 1
1 1356 . 1 1 1 A 117 117 THR C C 116 174.085 174.419 -0.334 1
1 1357 . 1 1 1 A 117 117 THR CA C 116 61.636 62.015 -0.379 1
1 1358 . 1 1 1 A 117 117 THR CB C 116 70.915 70.789 0.126 1
1 1360 . 1 1 1 A 117 117 THR N N 116 105.498 105.919 -0.421 1
1 1361 . 1 1 1 A 118 118 ASP H H 117 8.270 7.695 0.575 1
1 1362 . 1 1 1 A 118 118 ASP HA H 117 4.955 4.699 0.256 1
1 1365 . 1 1 1 A 118 118 ASP C C 117 176.328 176.438 -0.110 1
1 1366 . 1 1 1 A 118 118 ASP CA C 117 53.417 53.434 -0.017 1
1 1367 . 1 1 1 A 118 118 ASP CB C 117 43.388 40.459 2.929 1
1 1368 . 1 1 1 A 118 118 ASP N N 117 124.409 122.314 2.095 1
1 1369 . 1 1 1 A 119 119 PHE H H 118 8.973 8.836 0.137 1
1 1370 . 1 1 1 A 119 119 PHE HA H 118 3.506 4.270 -0.764 1
1 1378 . 1 1 1 A 119 119 PHE CA C 118 61.490 61.058 0.432 1
1 1379 . 1 1 1 A 119 119 PHE CB C 118 39.246 39.658 -0.412 1
1 1385 . 1 1 1 A 119 119 PHE N N 118 126.688 126.482 0.206 1
1 1386 . 1 1 1 A 120 120 LEU H H 119 8.099 8.219 -0.120 1
1 1387 . 1 1 1 A 120 120 LEU HA H 119 3.842 4.046 -0.204 1
1 1397 . 1 1 1 A 120 120 LEU C C 119 179.601 179.702 -0.101 1
1 1398 . 1 1 1 A 120 120 LEU CA C 119 58.174 57.685 0.489 1
1 1399 . 1 1 1 A 120 120 LEU CB C 119 40.315 40.884 -0.569 1
1 1403 . 1 1 1 A 120 120 LEU N N 119 117.930 119.710 -1.780 1
1 1404 . 1 1 1 A 121 121 ALA H H 120 7.729 7.997 -0.268 1
1 1405 . 1 1 1 A 121 121 ALA HA H 120 3.996 4.126 -0.130 1
1 1409 . 1 1 1 A 121 121 ALA C C 120 180.995 179.495 1.500 1
1 1410 . 1 1 1 A 121 121 ALA CA C 120 54.832 54.701 0.131 1
1 1411 . 1 1 1 A 121 121 ALA CB C 120 17.706 18.370 -0.664 1
1 1412 . 1 1 1 A 121 121 ALA N N 120 123.195 121.606 1.589 1
1 1413 . 1 1 1 A 122 122 PHE H H 121 7.943 7.939 0.004 1
1 1414 . 1 1 1 A 122 122 PHE HA H 121 3.887 3.856 0.031 1
1 1419 . 1 1 1 A 122 122 PHE C C 121 175.410 176.829 -1.419 1
1 1420 . 1 1 1 A 122 122 PHE CA C 121 61.075 60.730 0.345 1
1 1421 . 1 1 1 A 122 122 PHE CB C 121 38.115 38.801 -0.686 1
1 1424 . 1 1 1 A 122 122 PHE N N 121 121.798 120.464 1.334 1
1 1425 . 1 1 1 A 123 123 LYS H H 122 8.468 7.867 0.601 1
1 1426 . 1 1 1 A 123 123 LYS HA H 122 3.077 3.826 -0.749 1
1 1435 . 1 1 1 A 123 123 LYS C C 122 178.453 178.758 -0.305 1
1 1436 . 1 1 1 A 123 123 LYS CA C 122 59.855 59.953 -0.098 1
1 1437 . 1 1 1 A 123 123 LYS CB C 122 32.374 32.179 0.195 1
1 1441 . 1 1 1 A 123 123 LYS N N 122 120.614 118.535 2.079 1
1 1442 . 1 1 1 A 124 124 GLU H H 123 8.100 7.938 0.162 1
1 1443 . 1 1 1 A 124 124 GLU HA H 123 3.652 4.050 -0.398 1
1 1448 . 1 1 1 A 124 124 GLU C C 123 177.743 178.590 -0.847 1
1 1449 . 1 1 1 A 124 124 GLU CA C 123 59.406 59.382 0.024 1
1 1450 . 1 1 1 A 124 124 GLU CB C 123 28.811 29.449 -0.638 1
1 1452 . 1 1 1 A 124 124 GLU N N 123 117.404 118.739 -1.335 1
1 1453 . 1 1 1 A 125 125 MET H H 124 7.537 7.552 -0.015 1
1 1454 . 1 1 1 A 125 125 MET HA H 124 3.860 3.974 -0.114 1
1 1462 . 1 1 1 A 125 125 MET C C 124 179.522 178.301 1.221 1
1 1463 . 1 1 1 A 125 125 MET CA C 124 58.832 58.351 0.481 1
1 1464 . 1 1 1 A 125 125 MET CB C 124 31.765 31.490 0.275 1
1 1467 . 1 1 1 A 125 125 MET N N 124 119.413 119.149 0.264 1
1 1468 . 1 1 1 A 126 126 PHE H H 125 7.148 7.451 -0.303 1
1 1469 . 1 1 1 A 126 126 PHE HA H 125 3.633 4.220 -0.587 1
1 1476 . 1 1 1 A 126 126 PHE C C 125 178.994 178.369 0.625 1
1 1477 . 1 1 1 A 126 126 PHE CA C 125 63.148 61.035 2.113 1
1 1478 . 1 1 1 A 126 126 PHE CB C 125 39.830 38.303 1.527 1
1 1483 . 1 1 1 A 126 126 PHE N N 125 120.013 118.876 1.137 1
1 1484 . 1 1 1 A 127 127 LEU H H 126 8.369 8.568 -0.199 1
1 1485 . 1 1 1 A 127 127 LEU HA H 126 3.972 4.035 -0.063 1
1 1495 . 1 1 1 A 127 127 LEU C C 126 180.621 179.235 1.386 1
1 1496 . 1 1 1 A 127 127 LEU CA C 126 57.944 57.972 -0.028 1
1 1497 . 1 1 1 A 127 127 LEU CB C 126 40.543 41.367 -0.824 1
1 1501 . 1 1 1 A 127 127 LEU N N 126 119.692 119.791 -0.099 1
1 1502 . 1 1 1 A 128 128 ASP H H 127 8.578 8.047 0.531 1
1 1503 . 1 1 1 A 128 128 ASP HA H 127 4.308 4.358 -0.050 1
1 1506 . 1 1 1 A 128 128 ASP C C 127 178.254 178.094 0.160 1
1 1507 . 1 1 1 A 128 128 ASP CA C 127 56.964 57.144 -0.180 1
1 1508 . 1 1 1 A 128 128 ASP CB C 127 39.735 40.513 -0.778 1
1 1509 . 1 1 1 A 128 128 ASP N N 127 121.926 119.630 2.296 1
1 1510 . 1 1 1 A 129 129 TYR H H 128 7.710 8.041 -0.331 1
1 1511 . 1 1 1 A 129 129 TYR HA H 128 3.908 3.983 -0.075 1
1 1518 . 1 1 1 A 129 129 TYR C C 128 177.633 177.659 -0.026 1
1 1519 . 1 1 1 A 129 129 TYR CA C 128 61.796 61.562 0.234 1
1 1520 . 1 1 1 A 129 129 TYR CB C 128 39.372 38.860 0.512 1
1 1525 . 1 1 1 A 129 129 TYR N N 128 122.548 120.377 2.171 1
1 1526 . 1 1 1 A 130 130 ARG H H 129 8.622 8.363 0.259 1
1 1527 . 1 1 1 A 130 130 ARG HA H 129 3.722 4.044 -0.322 1
1 1535 . 1 1 1 A 130 130 ARG CA C 129 60.084 59.558 0.526 1
1 1536 . 1 1 1 A 130 130 ARG CB C 129 29.902 29.997 -0.095 1
1 1539 . 1 1 1 A 130 130 ARG N N 129 118.302 119.521 -1.219 1
1 1541 . 1 1 1 A 131 131 ALA H H 130 7.936 7.909 0.027 1
1 1542 . 1 1 1 A 131 131 ALA HA H 130 3.997 4.035 -0.038 1
1 1546 . 1 1 1 A 131 131 ALA C C 130 180.456 179.513 0.943 1
1 1547 . 1 1 1 A 131 131 ALA CA C 130 55.133 54.978 0.155 1
1 1548 . 1 1 1 A 131 131 ALA CB C 130 17.750 18.034 -0.284 1
1 1549 . 1 1 1 A 131 131 ALA N N 130 119.788 121.798 -2.010 1
1 1550 . 1 1 1 A 132 132 GLU H H 131 7.622 7.686 -0.064 1
1 1551 . 1 1 1 A 132 132 GLU HA H 131 3.862 3.981 -0.119 1
1 1556 . 1 1 1 A 132 132 GLU C C 131 179.528 178.833 0.695 1
1 1557 . 1 1 1 A 132 132 GLU CA C 131 58.849 58.885 -0.036 1
1 1558 . 1 1 1 A 132 132 GLU CB C 131 28.930 29.175 -0.245 1
1 1560 . 1 1 1 A 132 132 GLU N N 131 118.428 118.861 -0.433 1
1 1561 . 1 1 1 A 133 133 LYS H H 132 7.853 7.590 0.263 1
1 1562 . 1 1 1 A 133 133 LYS HA H 132 3.722 3.982 -0.260 1
1 1571 . 1 1 1 A 133 133 LYS C C 132 175.725 178.463 -2.738 1
1 1572 . 1 1 1 A 133 133 LYS CA C 132 57.544 58.809 -1.265 1
1 1573 . 1 1 1 A 133 133 LYS CB C 132 31.770 31.797 -0.027 1
1 1577 . 1 1 1 A 133 133 LYS N N 132 119.473 118.466 1.007 1
1 1578 . 1 1 1 A 134 134 GLU H H 133 8.151 7.589 0.562 1
1 1579 . 1 1 1 A 134 134 GLU HA H 133 4.161 4.368 -0.207 1
1 1584 . 1 1 1 A 134 134 GLU C C 133 177.453 176.835 0.618 1
1 1585 . 1 1 1 A 134 134 GLU CA C 133 57.222 56.005 1.217 1
1 1586 . 1 1 1 A 134 134 GLU CB C 133 30.091 30.229 -0.138 1
1 1588 . 1 1 1 A 134 134 GLU N N 133 116.525 116.950 -0.425 1
1 1589 . 1 1 1 A 135 135 GLY H H 134 7.702 8.254 -0.552 1
1 1590 . 1 1 1 A 135 135 GLY HA2 H 134 3.896 3.876 0.020 1
1 1591 . 1 1 1 A 135 135 GLY HA3 H 134 3.897 3.886 0.011 1
1 1592 . 1 1 1 A 135 135 GLY C C 134 174.538 173.465 1.073 1
1 1593 . 1 1 1 A 135 135 GLY CA C 134 45.975 46.583 -0.608 1
1 1594 . 1 1 1 A 135 135 GLY N N 134 107.924 109.373 -1.449 1
1 1595 . 1 1 1 A 136 136 ARG H H 135 8.045 7.736 0.309 1
1 1596 . 1 1 1 A 136 136 ARG HA H 135 4.323 4.590 -0.267 1
1 1604 . 1 1 1 A 136 136 ARG C C 135 175.864 175.282 0.582 1
1 1605 . 1 1 1 A 136 136 ARG CA C 135 56.016 56.016 0.000 1
1 1606 . 1 1 1 A 136 136 ARG CB C 135 30.987 33.173 -2.186 1
1 1609 . 1 1 1 A 136 136 ARG N N 135 119.708 121.452 -1.744 1
1 1 . 2 1 1 A 14 14 PHE CA C 13 58.199 59.238 -1.039 1
1 2 . 2 1 1 A 14 14 PHE CB C 13 39.717 40.606 -0.889 1
1 3 . 2 1 1 A 15 15 SER H H 14 8.299 8.231 0.068 1
1 4 . 2 1 1 A 15 15 SER HA H 14 4.359 4.838 -0.479 1
1 7 . 2 1 1 A 15 15 SER CA C 14 58.249 56.737 1.512 1
1 8 . 2 1 1 A 15 15 SER CB C 14 63.936 64.793 -0.857 1
1 9 . 2 1 1 A 15 15 SER N N 14 117.379 112.640 4.739 1
1 10 . 2 1 1 A 16 16 SER H H 15 8.255 8.775 -0.520 1
1 11 . 2 1 1 A 16 16 SER HA H 15 3.729 4.728 -0.999 1
1 14 . 2 1 1 A 16 16 SER CA C 15 58.224 59.596 -1.372 1
1 15 . 2 1 1 A 16 16 SER CB C 15 63.886 66.279 -2.393 1
1 16 . 2 1 1 A 16 16 SER N N 15 117.694 116.116 1.578 1
1 17 . 2 1 1 A 17 17 ALA H H 16 8.333 8.134 0.199 1
1 18 . 2 1 1 A 17 17 ALA HA H 16 4.252 4.268 -0.016 1
1 22 . 2 1 1 A 17 17 ALA CA C 16 53.377 54.309 -0.932 1
1 23 . 2 1 1 A 17 17 ALA CB C 16 18.896 18.107 0.789 1
1 24 . 2 1 1 A 17 17 ALA N N 16 125.462 124.080 1.382 1
1 25 . 2 1 1 A 18 18 SER H H 17 8.219 7.863 0.356 1
1 26 . 2 1 1 A 18 18 SER HA H 17 4.332 4.449 -0.117 1
1 29 . 2 1 1 A 18 18 SER CA C 17 59.105 58.207 0.898 1
1 30 . 2 1 1 A 18 18 SER CB C 17 63.592 64.254 -0.662 1
1 31 . 2 1 1 A 18 18 SER N N 17 114.821 108.813 6.008 1
1 32 . 2 1 1 A 19 19 ASP H H 18 8.309 7.634 0.675 1
1 33 . 2 1 1 A 19 19 ASP HA H 18 4.554 4.856 -0.302 1
1 36 . 2 1 1 A 19 19 ASP C C 18 176.528 177.113 -0.585 1
1 37 . 2 1 1 A 19 19 ASP CA C 18 55.272 53.157 2.115 1
1 38 . 2 1 1 A 19 19 ASP CB C 18 40.883 42.330 -1.447 1
1 39 . 2 1 1 A 19 19 ASP N N 18 123.367 122.243 1.124 1
1 40 . 2 1 1 A 20 20 ALA H H 19 8.133 8.782 -0.649 1
1 41 . 2 1 1 A 20 20 ALA HA H 19 4.170 4.086 0.084 1
1 45 . 2 1 1 A 20 20 ALA C C 19 179.857 179.744 0.113 1
1 46 . 2 1 1 A 20 20 ALA CA C 19 54.341 55.072 -0.731 1
1 47 . 2 1 1 A 20 20 ALA CB C 19 18.660 18.205 0.455 1
1 48 . 2 1 1 A 20 20 ALA N N 19 123.350 122.690 0.660 1
1 49 . 2 1 1 A 21 21 GLU H H 20 8.140 8.221 -0.081 1
1 50 . 2 1 1 A 21 21 GLU HA H 20 4.128 4.111 0.017 1
1 55 . 2 1 1 A 21 21 GLU C C 20 177.675 178.651 -0.976 1
1 56 . 2 1 1 A 21 21 GLU CA C 20 58.520 59.469 -0.949 1
1 57 . 2 1 1 A 21 21 GLU CB C 20 29.765 29.587 0.178 1
1 59 . 2 1 1 A 21 21 GLU N N 20 119.063 119.519 -0.456 1
1 60 . 2 1 1 A 22 22 PHE H H 21 8.009 7.928 0.081 1
1 61 . 2 1 1 A 22 22 PHE HA H 21 4.123 4.344 -0.221 1
1 68 . 2 1 1 A 22 22 PHE C C 21 176.410 177.586 -1.176 1
1 69 . 2 1 1 A 22 22 PHE CA C 21 62.202 61.303 0.899 1
1 70 . 2 1 1 A 22 22 PHE CB C 21 39.223 39.191 0.032 1
1 75 . 2 1 1 A 22 22 PHE N N 21 121.211 121.187 0.024 1
1 76 . 2 1 1 A 23 23 ASP H H 22 8.261 8.563 -0.302 1
1 77 . 2 1 1 A 23 23 ASP HA H 22 4.041 4.472 -0.431 1
1 80 . 2 1 1 A 23 23 ASP C C 22 179.078 178.262 0.816 1
1 81 . 2 1 1 A 23 23 ASP CA C 22 57.048 57.610 -0.562 1
1 82 . 2 1 1 A 23 23 ASP CB C 22 40.154 41.832 -1.678 1
1 83 . 2 1 1 A 23 23 ASP N N 22 116.876 119.517 -2.641 1
1 84 . 2 1 1 A 24 24 ALA H H 23 7.651 7.944 -0.293 1
1 85 . 2 1 1 A 24 24 ALA HA H 23 3.785 3.879 -0.094 1
1 89 . 2 1 1 A 24 24 ALA C C 23 179.577 179.441 0.136 1
1 90 . 2 1 1 A 24 24 ALA CA C 23 54.341 55.120 -0.779 1
1 91 . 2 1 1 A 24 24 ALA CB C 23 17.762 17.945 -0.183 1
1 92 . 2 1 1 A 24 24 ALA N N 23 121.873 121.352 0.521 1
1 93 . 2 1 1 A 25 25 VAL H H 24 7.718 7.938 -0.220 1
1 94 . 2 1 1 A 25 25 VAL HA H 24 3.216 3.574 -0.358 1
1 102 . 2 1 1 A 25 25 VAL C C 24 177.805 178.176 -0.371 1
1 103 . 2 1 1 A 25 25 VAL CA C 24 66.789 66.890 -0.101 1
1 104 . 2 1 1 A 25 25 VAL CB C 24 31.277 31.313 -0.036 1
1 107 . 2 1 1 A 25 25 VAL N N 24 117.890 117.911 -0.021 1
1 108 . 2 1 1 A 26 26 VAL H H 25 7.867 7.742 0.125 1
1 109 . 2 1 1 A 26 26 VAL HA H 25 3.274 3.475 -0.201 1
1 117 . 2 1 1 A 26 26 VAL C C 25 177.788 177.971 -0.183 1
1 118 . 2 1 1 A 26 26 VAL CA C 25 67.282 66.416 0.866 1
1 119 . 2 1 1 A 26 26 VAL CB C 25 31.266 31.421 -0.155 1
1 122 . 2 1 1 A 26 26 VAL N N 25 118.170 119.680 -1.510 1
1 123 . 2 1 1 A 27 27 GLY H H 26 7.544 7.669 -0.125 1
1 124 . 2 1 1 A 27 27 GLY HA2 H 26 3.592 3.510 0.082 1
1 125 . 2 1 1 A 27 27 GLY HA3 H 26 3.721 3.638 0.083 1
1 126 . 2 1 1 A 27 27 GLY C C 26 176.717 176.562 0.155 1
1 127 . 2 1 1 A 27 27 GLY CA C 26 47.085 47.239 -0.154 1
1 128 . 2 1 1 A 27 27 GLY N N 26 105.795 107.480 -1.685 1
1 129 . 2 1 1 A 28 28 TYR H H 27 7.625 7.486 0.139 1
1 130 . 2 1 1 A 28 28 TYR HA H 27 4.546 4.602 -0.056 1
1 137 . 2 1 1 A 28 28 TYR C C 27 178.991 178.196 0.795 1
1 138 . 2 1 1 A 28 28 TYR CA C 27 58.845 59.697 -0.852 1
1 139 . 2 1 1 A 28 28 TYR CB C 27 37.602 37.395 0.207 1
1 144 . 2 1 1 A 28 28 TYR N N 27 119.933 122.177 -2.244 1
1 145 . 2 1 1 A 29 29 LEU H H 28 8.517 8.213 0.304 1
1 146 . 2 1 1 A 29 29 LEU HA H 28 3.728 3.810 -0.082 1
1 156 . 2 1 1 A 29 29 LEU CA C 28 58.281 57.945 0.336 1
1 157 . 2 1 1 A 29 29 LEU CB C 28 41.948 41.333 0.615 1
1 161 . 2 1 1 A 29 29 LEU N N 28 119.669 120.547 -0.878 1
1 162 . 2 1 1 A 30 30 GLU H H 29 8.072 8.179 -0.107 1
1 163 . 2 1 1 A 30 30 GLU HA H 29 3.722 3.854 -0.132 1
1 168 . 2 1 1 A 30 30 GLU C C 29 177.731 179.016 -1.285 1
1 169 . 2 1 1 A 30 30 GLU CA C 29 59.763 59.998 -0.235 1
1 170 . 2 1 1 A 30 30 GLU CB C 29 28.844 29.388 -0.544 1
1 172 . 2 1 1 A 30 30 GLU N N 29 117.666 117.869 -0.203 1
1 173 . 2 1 1 A 31 31 ASP H H 30 7.243 8.054 -0.811 1
1 174 . 2 1 1 A 31 31 ASP HA H 30 4.297 4.373 -0.076 1
1 177 . 2 1 1 A 31 31 ASP CA C 30 56.953 57.215 -0.262 1
1 178 . 2 1 1 A 31 31 ASP CB C 30 40.730 42.254 -1.524 1
1 179 . 2 1 1 A 31 31 ASP N N 30 116.720 119.216 -2.496 1
1 180 . 2 1 1 A 32 32 ILE H H 31 7.940 7.306 0.634 1
1 181 . 2 1 1 A 32 32 ILE HA H 31 3.640 3.724 -0.084 1
1 191 . 2 1 1 A 32 32 ILE C C 31 177.980 178.252 -0.272 1
1 192 . 2 1 1 A 32 32 ILE CA C 31 64.692 64.104 0.588 1
1 193 . 2 1 1 A 32 32 ILE CB C 31 38.938 37.278 1.660 1
1 197 . 2 1 1 A 32 32 ILE N N 31 119.728 117.811 1.917 1
1 198 . 2 1 1 A 33 33 ILE H H 32 7.984 7.830 0.154 1
1 199 . 2 1 1 A 33 33 ILE HA H 32 3.598 3.093 0.505 1
1 209 . 2 1 1 A 33 33 ILE C C 32 176.723 176.968 -0.245 1
1 210 . 2 1 1 A 33 33 ILE CA C 32 63.241 64.524 -1.283 1
1 211 . 2 1 1 A 33 33 ILE CB C 32 37.580 37.781 -0.201 1
1 215 . 2 1 1 A 33 33 ILE N N 32 113.919 120.313 -6.394 1
1 216 . 2 1 1 A 34 34 MET H H 33 7.288 7.755 -0.467 1
1 217 . 2 1 1 A 34 34 MET HA H 33 4.496 4.715 -0.219 1
1 225 . 2 1 1 A 34 34 MET C C 33 176.423 175.592 0.831 1
1 226 . 2 1 1 A 34 34 MET CA C 33 54.634 54.178 0.456 1
1 227 . 2 1 1 A 34 34 MET CB C 33 31.934 31.565 0.369 1
1 230 . 2 1 1 A 34 34 MET N N 33 115.130 116.964 -1.834 1
1 231 . 2 1 1 A 35 35 ASP H H 34 7.405 7.621 -0.216 1
1 232 . 2 1 1 A 35 35 ASP HA H 34 4.484 4.702 -0.218 1
1 235 . 2 1 1 A 35 35 ASP C C 34 177.139 175.892 1.247 1
1 236 . 2 1 1 A 35 35 ASP CA C 34 54.625 54.288 0.337 1
1 237 . 2 1 1 A 35 35 ASP CB C 34 43.554 43.285 0.269 1
1 238 . 2 1 1 A 35 35 ASP N N 34 121.814 122.638 -0.824 1
1 239 . 2 1 1 A 36 36 ASP H H 35 8.765 9.195 -0.430 1
1 240 . 2 1 1 A 36 36 ASP HA H 35 4.235 4.215 0.020 1
1 243 . 2 1 1 A 36 36 ASP C C 35 178.320 177.868 0.452 1
1 244 . 2 1 1 A 36 36 ASP CA C 35 57.832 58.553 -0.721 1
1 245 . 2 1 1 A 36 36 ASP CB C 35 40.914 41.177 -0.263 1
1 246 . 2 1 1 A 36 36 ASP N N 35 125.883 127.456 -1.573 1
1 247 . 2 1 1 A 37 37 GLU H H 36 8.905 8.139 0.766 1
1 248 . 2 1 1 A 37 37 GLU HA H 36 3.933 4.091 -0.158 1
1 253 . 2 1 1 A 37 37 GLU C C 36 179.304 179.086 0.218 1
1 254 . 2 1 1 A 37 37 GLU CA C 36 59.828 59.263 0.565 1
1 255 . 2 1 1 A 37 37 GLU CB C 36 29.380 29.323 0.057 1
1 257 . 2 1 1 A 37 37 GLU N N 36 119.077 119.043 0.034 1
1 258 . 2 1 1 A 38 38 PHE H H 37 7.460 8.150 -0.690 1
1 259 . 2 1 1 A 38 38 PHE HA H 37 3.642 3.982 -0.340 1
1 267 . 2 1 1 A 38 38 PHE C C 37 176.483 177.886 -1.403 1
1 268 . 2 1 1 A 38 38 PHE CA C 37 61.411 61.101 0.310 1
1 269 . 2 1 1 A 38 38 PHE CB C 37 39.355 39.033 0.322 1
1 275 . 2 1 1 A 38 38 PHE N N 37 119.968 120.574 -0.606 1
1 276 . 2 1 1 A 39 39 GLN H H 38 7.968 7.897 0.071 1
1 277 . 2 1 1 A 39 39 GLN HA H 38 3.712 3.837 -0.125 1
1 284 . 2 1 1 A 39 39 GLN CA C 38 59.153 58.860 0.293 1
1 285 . 2 1 1 A 39 39 GLN CB C 38 28.213 28.539 -0.326 1
1 287 . 2 1 1 A 39 39 GLN N N 38 116.433 118.461 -2.028 1
1 289 . 2 1 1 A 40 40 LEU H H 39 7.930 7.678 0.252 1
1 290 . 2 1 1 A 40 40 LEU HA H 39 3.916 4.011 -0.095 1
1 300 . 2 1 1 A 40 40 LEU C C 39 177.731 178.024 -0.293 1
1 301 . 2 1 1 A 40 40 LEU CA C 39 57.915 57.910 0.005 1
1 302 . 2 1 1 A 40 40 LEU CB C 39 41.989 41.464 0.525 1
1 306 . 2 1 1 A 40 40 LEU N N 39 119.505 121.568 -2.063 1
1 307 . 2 1 1 A 41 41 LEU H H 40 7.174 7.830 -0.656 1
1 308 . 2 1 1 A 41 41 LEU HA H 40 3.835 3.977 -0.142 1
1 318 . 2 1 1 A 41 41 LEU C C 40 179.738 178.372 1.366 1
1 319 . 2 1 1 A 41 41 LEU CA C 40 58.266 58.307 -0.041 1
1 320 . 2 1 1 A 41 41 LEU CB C 40 42.050 41.582 0.468 1
1 324 . 2 1 1 A 41 41 LEU N N 40 120.971 119.802 1.169 1
1 325 . 2 1 1 A 42 42 GLN H H 41 8.058 7.792 0.266 1
1 326 . 2 1 1 A 42 42 GLN HA H 41 3.556 3.691 -0.135 1
1 333 . 2 1 1 A 42 42 GLN C C 41 177.642 178.490 -0.848 1
1 334 . 2 1 1 A 42 42 GLN CA C 41 59.826 59.206 0.620 1
1 335 . 2 1 1 A 42 42 GLN CB C 41 28.762 28.221 0.541 1
1 337 . 2 1 1 A 42 42 GLN N N 41 117.899 117.983 -0.084 1
1 339 . 2 1 1 A 43 43 ARG H H 42 8.179 7.684 0.495 1
1 340 . 2 1 1 A 43 43 ARG HA H 42 3.655 3.873 -0.218 1
1 347 . 2 1 1 A 43 43 ARG C C 42 178.051 178.259 -0.208 1
1 348 . 2 1 1 A 43 43 ARG CA C 42 59.766 58.601 1.165 1
1 349 . 2 1 1 A 43 43 ARG CB C 42 29.941 30.115 -0.174 1
1 352 . 2 1 1 A 43 43 ARG N N 42 119.392 119.536 -0.144 1
1 353 . 2 1 1 A 44 44 ASN H H 43 8.525 8.182 0.343 1
1 354 . 2 1 1 A 44 44 ASN HA H 43 4.332 4.354 -0.022 1
1 359 . 2 1 1 A 44 44 ASN C C 43 178.150 177.633 0.517 1
1 360 . 2 1 1 A 44 44 ASN CA C 43 55.841 56.142 -0.301 1
1 361 . 2 1 1 A 44 44 ASN CB C 43 37.632 39.288 -1.656 1
1 362 . 2 1 1 A 44 44 ASN N N 43 116.214 117.563 -1.349 1
1 364 . 2 1 1 A 45 45 PHE H H 44 7.586 7.760 -0.174 1
1 365 . 2 1 1 A 45 45 PHE HA H 44 4.132 4.314 -0.182 1
1 372 . 2 1 1 A 45 45 PHE C C 44 176.691 178.269 -1.578 1
1 373 . 2 1 1 A 45 45 PHE CA C 44 62.333 60.787 1.546 1
1 374 . 2 1 1 A 45 45 PHE CB C 44 39.449 38.427 1.022 1
1 379 . 2 1 1 A 45 45 PHE N N 44 121.501 117.735 3.766 1
1 380 . 2 1 1 A 46 46 MET H H 45 8.190 8.335 -0.145 1
1 381 . 2 1 1 A 46 46 MET HA H 45 4.060 4.340 -0.280 1
1 389 . 2 1 1 A 46 46 MET C C 45 179.754 178.135 1.619 1
1 390 . 2 1 1 A 46 46 MET CA C 45 57.742 57.662 0.080 1
1 391 . 2 1 1 A 46 46 MET CB C 45 29.912 30.953 -1.041 1
1 394 . 2 1 1 A 46 46 MET N N 45 116.727 117.379 -0.652 1
1 395 . 2 1 1 A 47 47 ASP H H 46 8.579 8.219 0.360 1
1 396 . 2 1 1 A 47 47 ASP HA H 46 4.804 4.585 0.219 1
1 399 . 2 1 1 A 47 47 ASP C C 46 177.854 178.346 -0.492 1
1 400 . 2 1 1 A 47 47 ASP CA C 46 57.277 57.346 -0.069 1
1 401 . 2 1 1 A 47 47 ASP CB C 46 40.776 41.486 -0.710 1
1 402 . 2 1 1 A 47 47 ASP N N 46 117.798 120.695 -2.897 1
1 403 . 2 1 1 A 48 48 LYS H H 47 7.339 7.656 -0.317 1
1 404 . 2 1 1 A 48 48 LYS HA H 47 3.828 4.217 -0.389 1
1 413 . 2 1 1 A 48 48 LYS C C 47 178.812 178.662 0.150 1
1 414 . 2 1 1 A 48 48 LYS CA C 47 58.953 58.432 0.521 1
1 415 . 2 1 1 A 48 48 LYS CB C 47 32.796 32.981 -0.185 1
1 419 . 2 1 1 A 48 48 LYS N N 47 117.852 119.706 -1.854 1
1 420 . 2 1 1 A 49 49 TYR H H 48 6.841 8.745 -1.904 1
1 421 . 2 1 1 A 49 49 TYR HA H 48 4.995 4.157 0.838 1
1 428 . 2 1 1 A 49 49 TYR C C 48 178.138 178.382 -0.244 1
1 429 . 2 1 1 A 49 49 TYR CA C 48 58.620 59.697 -1.077 1
1 430 . 2 1 1 A 49 49 TYR CB C 48 42.939 38.062 4.877 1
1 435 . 2 1 1 A 49 49 TYR N N 48 112.109 119.782 -7.673 1
1 436 . 2 1 1 A 50 50 TYR H H 49 8.491 7.839 0.652 1
1 437 . 2 1 1 A 50 50 TYR HA H 49 4.598 4.006 0.592 1
1 444 . 2 1 1 A 50 50 TYR C C 49 176.015 177.575 -1.560 1
1 445 . 2 1 1 A 50 50 TYR CA C 49 62.442 59.291 3.151 1
1 446 . 2 1 1 A 50 50 TYR CB C 49 36.588 36.831 -0.243 1
1 451 . 2 1 1 A 50 50 TYR N N 49 118.294 119.627 -1.333 1
1 452 . 2 1 1 A 51 51 LEU H H 50 7.512 7.672 -0.160 1
1 453 . 2 1 1 A 51 51 LEU HA H 50 3.878 3.506 0.372 1
1 463 . 2 1 1 A 51 51 LEU C C 50 178.625 178.414 0.211 1
1 464 . 2 1 1 A 51 51 LEU CA C 50 55.994 57.126 -1.132 1
1 465 . 2 1 1 A 51 51 LEU CB C 50 40.743 41.266 -0.523 1
1 469 . 2 1 1 A 51 51 LEU N N 50 118.478 121.846 -3.368 1
1 470 . 2 1 1 A 52 52 GLU H H 51 8.042 7.782 0.260 1
1 471 . 2 1 1 A 52 52 GLU HA H 51 4.197 3.886 0.311 1
1 476 . 2 1 1 A 52 52 GLU C C 51 177.629 177.726 -0.097 1
1 477 . 2 1 1 A 52 52 GLU CA C 51 56.141 59.583 -3.442 1
1 478 . 2 1 1 A 52 52 GLU CB C 51 29.162 28.932 0.230 1
1 480 . 2 1 1 A 52 52 GLU N N 51 115.067 118.120 -3.053 1
1 481 . 2 1 1 A 53 53 PHE H H 52 7.465 7.841 -0.376 1
1 482 . 2 1 1 A 53 53 PHE HA H 52 4.431 4.509 -0.078 1
1 490 . 2 1 1 A 53 53 PHE C C 52 174.325 174.886 -0.561 1
1 491 . 2 1 1 A 53 53 PHE CA C 52 58.986 57.206 1.780 1
1 492 . 2 1 1 A 53 53 PHE CB C 52 40.183 37.680 2.503 1
1 498 . 2 1 1 A 53 53 PHE N N 52 116.768 118.949 -2.181 1
1 499 . 2 1 1 A 54 54 GLU H H 53 7.484 8.453 -0.969 1
1 500 . 2 1 1 A 54 54 GLU HA H 53 4.583 4.914 -0.331 1
1 505 . 2 1 1 A 54 54 GLU C C 53 175.722 175.704 0.018 1
1 506 . 2 1 1 A 54 54 GLU CA C 53 54.248 54.812 -0.564 1
1 507 . 2 1 1 A 54 54 GLU CB C 53 34.409 32.321 2.088 1
1 509 . 2 1 1 A 54 54 GLU N N 53 118.844 125.439 -6.595 1
1 510 . 2 1 1 A 55 55 ASP H H 54 9.008 8.769 0.239 1
1 511 . 2 1 1 A 55 55 ASP HA H 54 4.735 4.807 -0.072 1
1 514 . 2 1 1 A 55 55 ASP C C 54 175.421 175.785 -0.364 1
1 515 . 2 1 1 A 55 55 ASP CA C 54 52.888 54.201 -1.313 1
1 516 . 2 1 1 A 55 55 ASP CB C 54 38.894 40.662 -1.768 1
1 517 . 2 1 1 A 55 55 ASP N N 54 123.654 126.832 -3.178 1
1 518 . 2 1 1 A 56 56 THR H H 55 7.819 7.920 -0.101 1
1 519 . 2 1 1 A 56 56 THR HA H 55 4.574 4.973 -0.399 1
1 524 . 2 1 1 A 56 56 THR C C 55 174.096 174.386 -0.290 1
1 525 . 2 1 1 A 56 56 THR CA C 55 59.172 59.327 -0.155 1
1 526 . 2 1 1 A 56 56 THR CB C 55 71.889 72.582 -0.693 1
1 528 . 2 1 1 A 56 56 THR N N 55 112.015 117.278 -5.263 1
1 529 . 2 1 1 A 57 57 GLU H H 56 8.527 8.871 -0.344 1
1 530 . 2 1 1 A 57 57 GLU HA H 56 4.217 4.390 -0.173 1
1 535 . 2 1 1 A 57 57 GLU C C 56 177.042 176.537 0.505 1
1 536 . 2 1 1 A 57 57 GLU CA C 56 56.869 57.147 -0.278 1
1 537 . 2 1 1 A 57 57 GLU CB C 56 29.731 30.780 -1.049 1
1 539 . 2 1 1 A 57 57 GLU N N 56 117.531 119.269 -1.738 1
1 540 . 2 1 1 A 58 58 GLU H H 57 7.587 7.910 -0.323 1
1 541 . 2 1 1 A 58 58 GLU HA H 57 3.941 4.636 -0.695 1
1 546 . 2 1 1 A 58 58 GLU C C 57 176.849 175.068 1.781 1
1 547 . 2 1 1 A 58 58 GLU CA C 57 56.924 54.774 2.150 1
1 548 . 2 1 1 A 58 58 GLU CB C 57 30.251 30.983 -0.732 1
1 550 . 2 1 1 A 58 58 GLU N N 57 119.183 117.979 1.204 1
1 551 . 2 1 1 A 59 59 ASN H H 58 9.120 8.686 0.434 1
1 552 . 2 1 1 A 59 59 ASN HA H 58 4.922 5.323 -0.401 1
1 557 . 2 1 1 A 59 59 ASN C C 58 174.254 174.285 -0.031 1
1 558 . 2 1 1 A 59 59 ASN CA C 58 51.956 51.652 0.304 1
1 559 . 2 1 1 A 59 59 ASN CB C 58 37.404 42.034 -4.630 1
1 560 . 2 1 1 A 59 59 ASN N N 58 126.767 120.843 5.924 1
1 562 . 2 1 1 A 60 60 LYS H H 59 5.892 8.611 -2.719 1
1 563 . 2 1 1 A 60 60 LYS HA H 59 3.798 4.675 -0.877 1
1 572 . 2 1 1 A 60 60 LYS C C 59 177.908 178.160 -0.252 1
1 573 . 2 1 1 A 60 60 LYS CA C 59 56.623 54.764 1.859 1
1 574 . 2 1 1 A 60 60 LYS CB C 59 32.279 34.734 -2.455 1
1 578 . 2 1 1 A 60 60 LYS N N 59 121.527 123.888 -2.361 1
1 579 . 2 1 1 A 61 61 LEU H H 60 8.473 8.891 -0.418 1
1 580 . 2 1 1 A 61 61 LEU HA H 60 3.891 4.235 -0.344 1
1 590 . 2 1 1 A 61 61 LEU C C 60 179.843 178.015 1.828 1
1 591 . 2 1 1 A 61 61 LEU CA C 60 58.301 57.333 0.968 1
1 592 . 2 1 1 A 61 61 LEU CB C 60 41.305 41.883 -0.578 1
1 596 . 2 1 1 A 61 61 LEU N N 60 125.639 124.877 0.762 1
1 597 . 2 1 1 A 62 62 ILE H H 61 7.698 8.038 -0.340 1
1 598 . 2 1 1 A 62 62 ILE HA H 61 3.952 3.927 0.025 1
1 608 . 2 1 1 A 62 62 ILE C C 61 175.392 177.154 -1.762 1
1 609 . 2 1 1 A 62 62 ILE CA C 61 61.743 63.458 -1.715 1
1 610 . 2 1 1 A 62 62 ILE CB C 61 39.108 37.862 1.246 1
1 614 . 2 1 1 A 62 62 ILE N N 61 114.111 118.879 -4.768 1
1 615 . 2 1 1 A 63 63 TYR H H 62 7.273 7.953 -0.680 1
1 616 . 2 1 1 A 63 63 TYR HA H 62 4.343 4.182 0.161 1
1 623 . 2 1 1 A 63 63 TYR C C 62 178.264 178.548 -0.284 1
1 624 . 2 1 1 A 63 63 TYR CA C 62 57.231 60.906 -3.675 1
1 625 . 2 1 1 A 63 63 TYR CB C 62 36.332 37.366 -1.034 1
1 630 . 2 1 1 A 63 63 TYR N N 62 117.689 121.269 -3.580 1
1 631 . 2 1 1 A 64 64 THR H H 63 7.747 8.133 -0.386 1
1 632 . 2 1 1 A 64 64 THR HA H 63 4.266 4.230 0.036 1
1 637 . 2 1 1 A 64 64 THR CA C 63 69.362 67.580 1.782 1
1 638 . 2 1 1 A 64 64 THR CB C 63 66.962 67.475 -0.513 1
1 640 . 2 1 1 A 64 64 THR N N 63 113.755 116.099 -2.344 1
1 641 . 2 1 1 A 65 65 PRO HA H 64 4.372 4.385 -0.013 1
1 648 . 2 1 1 A 65 65 PRO C C 64 179.913 179.300 0.613 1
1 649 . 2 1 1 A 65 65 PRO CA C 64 66.011 66.002 0.009 1
1 650 . 2 1 1 A 65 65 PRO CB C 64 30.642 30.683 -0.041 1
1 653 . 2 1 1 A 66 66 ILE H H 65 7.377 7.331 0.046 1
1 654 . 2 1 1 A 66 66 ILE HA H 65 3.530 3.839 -0.309 1
1 664 . 2 1 1 A 66 66 ILE C C 65 177.543 178.260 -0.717 1
1 665 . 2 1 1 A 66 66 ILE CA C 65 66.647 64.316 2.331 1
1 666 . 2 1 1 A 66 66 ILE CB C 65 38.029 37.623 0.406 1
1 670 . 2 1 1 A 66 66 ILE N N 65 118.353 116.671 1.682 1
1 671 . 2 1 1 A 67 67 PHE H H 66 8.480 8.520 -0.040 1
1 672 . 2 1 1 A 67 67 PHE HA H 66 4.115 4.343 -0.228 1
1 680 . 2 1 1 A 67 67 PHE C C 66 177.293 178.072 -0.779 1
1 681 . 2 1 1 A 67 67 PHE CA C 66 59.570 62.096 -2.526 1
1 682 . 2 1 1 A 67 67 PHE CB C 66 38.865 39.643 -0.778 1
1 688 . 2 1 1 A 67 67 PHE N N 66 122.420 120.500 1.920 1
1 689 . 2 1 1 A 68 68 ASN H H 67 8.595 8.083 0.512 1
1 690 . 2 1 1 A 68 68 ASN HA H 67 4.211 4.363 -0.152 1
1 695 . 2 1 1 A 68 68 ASN C C 67 178.697 178.277 0.420 1
1 696 . 2 1 1 A 68 68 ASN CA C 67 56.056 56.399 -0.343 1
1 697 . 2 1 1 A 68 68 ASN CB C 67 37.704 37.921 -0.217 1
1 698 . 2 1 1 A 68 68 ASN N N 67 115.573 117.271 -1.698 1
1 700 . 2 1 1 A 69 69 GLU H H 68 8.414 8.217 0.197 1
1 701 . 2 1 1 A 69 69 GLU HA H 68 4.102 4.204 -0.102 1
1 706 . 2 1 1 A 69 69 GLU C C 68 177.880 178.825 -0.945 1
1 707 . 2 1 1 A 69 69 GLU CA C 68 59.399 59.369 0.030 1
1 708 . 2 1 1 A 69 69 GLU CB C 68 29.855 29.399 0.456 1
1 710 . 2 1 1 A 69 69 GLU N N 68 123.510 120.029 3.481 1
1 711 . 2 1 1 A 70 70 TYR H H 69 8.659 8.003 0.656 1
1 712 . 2 1 1 A 70 70 TYR HA H 69 3.362 4.069 -0.707 1
1 719 . 2 1 1 A 70 70 TYR C C 69 178.143 177.014 1.129 1
1 720 . 2 1 1 A 70 70 TYR CA C 69 60.686 61.006 -0.320 1
1 721 . 2 1 1 A 70 70 TYR CB C 69 38.560 38.880 -0.320 1
1 726 . 2 1 1 A 70 70 TYR N N 69 122.130 120.715 1.415 1
1 727 . 2 1 1 A 71 71 ILE H H 70 8.031 7.710 0.321 1
1 728 . 2 1 1 A 71 71 ILE HA H 70 3.265 3.704 -0.439 1
1 738 . 2 1 1 A 71 71 ILE C C 70 178.056 177.539 0.517 1
1 739 . 2 1 1 A 71 71 ILE CA C 70 63.756 63.980 -0.224 1
1 740 . 2 1 1 A 71 71 ILE CB C 70 37.321 36.608 0.713 1
1 744 . 2 1 1 A 71 71 ILE N N 70 118.906 120.120 -1.214 1
1 745 . 2 1 1 A 72 72 SER H H 71 7.803 7.787 0.016 1
1 746 . 2 1 1 A 72 72 SER HA H 71 4.029 4.344 -0.315 1
1 749 . 2 1 1 A 72 72 SER CA C 71 61.380 61.173 0.207 1
1 750 . 2 1 1 A 72 72 SER CB C 71 63.288 63.297 -0.009 1
1 751 . 2 1 1 A 72 72 SER N N 71 113.735 116.804 -3.069 1
1 752 . 2 1 1 A 73 73 LEU H H 72 7.952 7.989 -0.037 1
1 753 . 2 1 1 A 73 73 LEU HA H 72 4.418 4.148 0.270 1
1 763 . 2 1 1 A 73 73 LEU C C 72 177.767 178.325 -0.558 1
1 764 . 2 1 1 A 73 73 LEU CA C 72 56.543 57.441 -0.898 1
1 765 . 2 1 1 A 73 73 LEU CB C 72 44.517 41.708 2.809 1
1 769 . 2 1 1 A 73 73 LEU N N 72 119.411 122.432 -3.021 1
1 770 . 2 1 1 A 74 74 VAL H H 73 8.021 7.574 0.447 1
1 771 . 2 1 1 A 74 74 VAL HA H 73 3.532 3.328 0.204 1
1 779 . 2 1 1 A 74 74 VAL C C 73 177.126 177.965 -0.839 1
1 780 . 2 1 1 A 74 74 VAL CA C 73 66.250 66.313 -0.063 1
1 781 . 2 1 1 A 74 74 VAL CB C 73 31.212 31.123 0.089 1
1 784 . 2 1 1 A 74 74 VAL N N 73 118.747 119.218 -0.471 1
1 785 . 2 1 1 A 75 75 GLU H H 74 7.232 8.016 -0.784 1
1 786 . 2 1 1 A 75 75 GLU HA H 74 3.013 4.230 -1.217 1
1 791 . 2 1 1 A 75 75 GLU C C 74 178.804 179.133 -0.329 1
1 792 . 2 1 1 A 75 75 GLU CA C 74 60.536 59.796 0.740 1
1 793 . 2 1 1 A 75 75 GLU CB C 74 27.009 29.152 -2.143 1
1 795 . 2 1 1 A 75 75 GLU N N 74 118.660 119.765 -1.105 1
1 796 . 2 1 1 A 76 76 LYS H H 75 7.051 7.977 -0.926 1
1 797 . 2 1 1 A 76 76 LYS HA H 75 3.765 4.103 -0.338 1
1 806 . 2 1 1 A 76 76 LYS C C 75 177.765 178.057 -0.292 1
1 807 . 2 1 1 A 76 76 LYS CA C 75 58.357 58.255 0.102 1
1 808 . 2 1 1 A 76 76 LYS CB C 75 31.939 32.436 -0.497 1
1 812 . 2 1 1 A 76 76 LYS N N 75 116.112 119.464 -3.352 1
1 813 . 2 1 1 A 77 77 TYR H H 76 7.067 7.930 -0.863 1
1 814 . 2 1 1 A 77 77 TYR HA H 76 4.036 4.175 -0.139 1
1 821 . 2 1 1 A 77 77 TYR C C 76 177.752 177.137 0.615 1
1 822 . 2 1 1 A 77 77 TYR CA C 76 61.820 61.221 0.599 1
1 823 . 2 1 1 A 77 77 TYR CB C 76 38.480 38.741 -0.261 1
1 828 . 2 1 1 A 77 77 TYR N N 76 118.434 121.676 -3.242 1
1 829 . 2 1 1 A 78 78 ILE H H 77 7.554 8.550 -0.996 1
1 830 . 2 1 1 A 78 78 ILE HA H 77 3.159 3.585 -0.426 1
1 840 . 2 1 1 A 78 78 ILE C C 77 177.341 177.647 -0.306 1
1 841 . 2 1 1 A 78 78 ILE CA C 77 65.177 65.747 -0.570 1
1 842 . 2 1 1 A 78 78 ILE CB C 77 37.339 37.646 -0.307 1
1 846 . 2 1 1 A 78 78 ILE N N 77 117.672 121.635 -3.963 1
1 847 . 2 1 1 A 79 79 GLU H H 78 8.296 8.132 0.164 1
1 848 . 2 1 1 A 79 79 GLU HA H 78 3.557 3.787 -0.230 1
1 853 . 2 1 1 A 79 79 GLU C C 78 177.742 179.076 -1.334 1
1 854 . 2 1 1 A 79 79 GLU CA C 78 60.847 60.095 0.752 1
1 855 . 2 1 1 A 79 79 GLU CB C 78 29.594 29.259 0.335 1
1 857 . 2 1 1 A 79 79 GLU N N 78 118.701 121.104 -2.403 1
1 858 . 2 1 1 A 80 80 GLU H H 79 8.330 8.324 0.006 1
1 859 . 2 1 1 A 80 80 GLU HA H 79 3.774 4.020 -0.246 1
1 864 . 2 1 1 A 80 80 GLU C C 79 179.926 179.177 0.749 1
1 865 . 2 1 1 A 80 80 GLU CA C 79 59.581 58.950 0.631 1
1 866 . 2 1 1 A 80 80 GLU CB C 79 29.062 29.392 -0.330 1
1 868 . 2 1 1 A 80 80 GLU N N 79 116.767 118.025 -1.258 1
1 869 . 2 1 1 A 81 81 GLN H H 80 7.634 7.665 -0.031 1
1 870 . 2 1 1 A 81 81 GLN HA H 80 3.605 3.874 -0.269 1
1 877 . 2 1 1 A 81 81 GLN C C 80 179.681 178.452 1.229 1
1 878 . 2 1 1 A 81 81 GLN CA C 80 57.765 58.397 -0.632 1
1 879 . 2 1 1 A 81 81 GLN CB C 80 28.079 28.065 0.014 1
1 881 . 2 1 1 A 81 81 GLN N N 80 116.325 118.600 -2.275 1
1 883 . 2 1 1 A 82 82 LEU H H 81 8.156 7.583 0.573 1
1 884 . 2 1 1 A 82 82 LEU HA H 81 3.536 3.803 -0.267 1
1 894 . 2 1 1 A 82 82 LEU C C 81 178.945 179.334 -0.389 1
1 895 . 2 1 1 A 82 82 LEU CA C 81 57.761 56.995 0.766 1
1 896 . 2 1 1 A 82 82 LEU CB C 81 40.961 40.892 0.069 1
1 900 . 2 1 1 A 82 82 LEU N N 81 121.546 120.565 0.981 1
1 901 . 2 1 1 A 83 83 LEU H H 82 8.326 8.051 0.275 1
1 902 . 2 1 1 A 83 83 LEU HA H 82 4.198 4.209 -0.011 1
1 912 . 2 1 1 A 83 83 LEU C C 82 178.631 179.489 -0.858 1
1 913 . 2 1 1 A 83 83 LEU CA C 82 57.016 57.086 -0.070 1
1 914 . 2 1 1 A 83 83 LEU CB C 82 42.182 40.619 1.563 1
1 918 . 2 1 1 A 83 83 LEU N N 82 120.426 119.121 1.305 1
1 919 . 2 1 1 A 84 84 GLN H H 83 6.992 7.568 -0.576 1
1 920 . 2 1 1 A 84 84 GLN HA H 83 3.877 4.013 -0.136 1
1 927 . 2 1 1 A 84 84 GLN C C 83 177.008 176.839 0.169 1
1 928 . 2 1 1 A 84 84 GLN CA C 83 57.543 58.305 -0.762 1
1 929 . 2 1 1 A 84 84 GLN CB C 83 28.688 28.677 0.011 1
1 931 . 2 1 1 A 84 84 GLN N N 83 114.001 117.232 -3.231 1
1 933 . 2 1 1 A 85 85 ARG H H 84 7.072 7.422 -0.350 1
1 934 . 2 1 1 A 85 85 ARG HA H 84 4.047 4.369 -0.322 1
1 942 . 2 1 1 A 85 85 ARG C C 84 175.999 175.730 0.269 1
1 943 . 2 1 1 A 85 85 ARG CA C 84 56.764 56.169 0.595 1
1 944 . 2 1 1 A 85 85 ARG CB C 84 32.044 32.748 -0.704 1
1 947 . 2 1 1 A 85 85 ARG N N 84 115.827 116.994 -1.167 1
1 949 . 2 1 1 A 86 86 ILE H H 85 8.238 7.834 0.404 1
1 950 . 2 1 1 A 86 86 ILE HA H 85 4.389 4.535 -0.146 1
1 960 . 2 1 1 A 86 86 ILE CA C 85 58.007 57.844 0.163 1
1 961 . 2 1 1 A 86 86 ILE CB C 85 39.604 38.900 0.704 1
1 965 . 2 1 1 A 86 86 ILE N N 85 119.285 120.178 -0.893 1
1 966 . 2 1 1 A 87 87 PRO HA H 86 4.392 4.520 -0.128 1
1 973 . 2 1 1 A 87 87 PRO C C 86 177.622 176.446 1.176 1
1 974 . 2 1 1 A 87 87 PRO CA C 86 64.665 64.315 0.350 1
1 975 . 2 1 1 A 87 87 PRO CB C 86 32.020 31.723 0.297 1
1 978 . 2 1 1 A 88 88 GLU H H 87 8.312 8.214 0.098 1
1 979 . 2 1 1 A 88 88 GLU HA H 87 4.208 4.581 -0.373 1
1 984 . 2 1 1 A 88 88 GLU C C 87 175.554 175.795 -0.241 1
1 985 . 2 1 1 A 88 88 GLU CA C 87 56.045 56.207 -0.162 1
1 986 . 2 1 1 A 88 88 GLU CB C 87 28.654 30.626 -1.972 1
1 988 . 2 1 1 A 88 88 GLU N N 87 114.256 116.740 -2.484 1
1 989 . 2 1 1 A 89 89 PHE H H 88 7.946 7.639 0.307 1
1 990 . 2 1 1 A 89 89 PHE HA H 88 3.993 4.436 -0.443 1
1 998 . 2 1 1 A 89 89 PHE C C 88 173.460 174.804 -1.344 1
1 999 . 2 1 1 A 89 89 PHE CA C 88 60.119 59.241 0.878 1
1 1000 . 2 1 1 A 89 89 PHE CB C 88 39.994 39.750 0.244 1
1 1006 . 2 1 1 A 89 89 PHE N N 88 121.550 123.271 -1.721 1
1 1007 . 2 1 1 A 90 90 ASN H H 89 7.266 7.717 -0.451 1
1 1008 . 2 1 1 A 90 90 ASN HA H 89 4.454 4.955 -0.501 1
1 1013 . 2 1 1 A 90 90 ASN C C 89 173.921 175.067 -1.146 1
1 1014 . 2 1 1 A 90 90 ASN CA C 89 51.839 51.318 0.521 1
1 1015 . 2 1 1 A 90 90 ASN CB C 89 40.674 39.538 1.136 1
1 1016 . 2 1 1 A 90 90 ASN N N 89 125.344 124.536 0.808 1
1 1018 . 2 1 1 A 91 91 MET H H 90 8.968 8.736 0.232 1
1 1019 . 2 1 1 A 91 91 MET HA H 90 4.049 4.237 -0.188 1
1 1027 . 2 1 1 A 91 91 MET C C 90 177.475 177.995 -0.520 1
1 1028 . 2 1 1 A 91 91 MET CA C 90 57.758 58.016 -0.258 1
1 1029 . 2 1 1 A 91 91 MET CB C 90 32.250 32.302 -0.052 1
1 1032 . 2 1 1 A 91 91 MET N N 90 127.052 125.464 1.588 1
1 1033 . 2 1 1 A 92 92 ALA H H 91 8.292 7.911 0.381 1
1 1034 . 2 1 1 A 92 92 ALA HA H 91 4.059 4.145 -0.086 1
1 1038 . 2 1 1 A 92 92 ALA C C 91 180.412 180.021 0.391 1
1 1039 . 2 1 1 A 92 92 ALA CA C 91 55.368 55.044 0.324 1
1 1040 . 2 1 1 A 92 92 ALA CB C 91 17.527 18.446 -0.919 1
1 1041 . 2 1 1 A 92 92 ALA N N 91 123.752 121.316 2.436 1
1 1042 . 2 1 1 A 93 93 ALA H H 92 7.931 7.878 0.053 1
1 1043 . 2 1 1 A 93 93 ALA HA H 92 4.054 4.114 -0.060 1
1 1047 . 2 1 1 A 93 93 ALA C C 92 180.482 179.798 0.684 1
1 1048 . 2 1 1 A 93 93 ALA CA C 92 54.614 54.903 -0.289 1
1 1049 . 2 1 1 A 93 93 ALA CB C 92 18.098 18.214 -0.116 1
1 1050 . 2 1 1 A 93 93 ALA N N 92 121.158 119.915 1.243 1
1 1051 . 2 1 1 A 94 94 PHE H H 93 8.110 7.792 0.318 1
1 1052 . 2 1 1 A 94 94 PHE HA H 93 4.304 4.132 0.172 1
1 1060 . 2 1 1 A 94 94 PHE C C 93 177.350 177.411 -0.061 1
1 1061 . 2 1 1 A 94 94 PHE CA C 93 61.641 61.422 0.219 1
1 1062 . 2 1 1 A 94 94 PHE CB C 93 40.014 38.973 1.041 1
1 1068 . 2 1 1 A 94 94 PHE N N 93 119.807 120.115 -0.308 1
1 1069 . 2 1 1 A 95 95 THR H H 94 8.726 8.216 0.510 1
1 1070 . 2 1 1 A 95 95 THR HA H 94 3.569 4.027 -0.458 1
1 1075 . 2 1 1 A 95 95 THR C C 94 176.932 177.021 -0.089 1
1 1076 . 2 1 1 A 95 95 THR CA C 94 66.833 65.557 1.276 1
1 1077 . 2 1 1 A 95 95 THR CB C 94 68.445 68.136 0.309 1
1 1079 . 2 1 1 A 95 95 THR N N 94 113.074 112.207 0.867 1
1 1080 . 2 1 1 A 96 96 THR H H 95 7.657 7.845 -0.188 1
1 1081 . 2 1 1 A 96 96 THR HA H 95 3.945 4.007 -0.062 1
1 1086 . 2 1 1 A 96 96 THR C C 95 176.386 176.308 0.078 1
1 1087 . 2 1 1 A 96 96 THR CA C 95 66.550 66.130 0.420 1
1 1088 . 2 1 1 A 96 96 THR CB C 95 68.583 68.670 -0.087 1
1 1090 . 2 1 1 A 96 96 THR N N 95 117.927 116.486 1.441 1
1 1091 . 2 1 1 A 97 97 THR H H 96 7.699 7.816 -0.117 1
1 1092 . 2 1 1 A 97 97 THR HA H 96 3.905 4.225 -0.320 1
1 1097 . 2 1 1 A 97 97 THR C C 96 176.572 176.618 -0.046 1
1 1098 . 2 1 1 A 97 97 THR CA C 96 65.979 66.380 -0.401 1
1 1099 . 2 1 1 A 97 97 THR CB C 96 68.553 68.418 0.135 1
1 1101 . 2 1 1 A 97 97 THR N N 96 118.518 116.578 1.940 1
1 1102 . 2 1 1 A 98 98 LEU H H 97 8.304 8.210 0.094 1
1 1103 . 2 1 1 A 98 98 LEU HA H 97 3.725 3.906 -0.181 1
1 1113 . 2 1 1 A 98 98 LEU C C 97 178.490 178.445 0.045 1
1 1114 . 2 1 1 A 98 98 LEU CA C 97 58.517 58.101 0.416 1
1 1115 . 2 1 1 A 98 98 LEU CB C 97 41.697 41.204 0.493 1
1 1119 . 2 1 1 A 98 98 LEU N N 97 122.882 122.242 0.640 1
1 1120 . 2 1 1 A 99 99 GLN H H 98 7.639 8.222 -0.583 1
1 1121 . 2 1 1 A 99 99 GLN HA H 98 3.927 4.204 -0.277 1
1 1128 . 2 1 1 A 99 99 GLN C C 98 178.068 177.415 0.653 1
1 1129 . 2 1 1 A 99 99 GLN CA C 98 58.735 58.087 0.648 1
1 1130 . 2 1 1 A 99 99 GLN CB C 98 27.986 28.016 -0.030 1
1 1132 . 2 1 1 A 99 99 GLN N N 98 114.302 116.273 -1.971 1
1 1134 . 2 1 1 A 100 100 HIS H H 99 7.575 7.249 0.326 1
1 1135 . 2 1 1 A 100 100 HIS HA H 99 4.524 4.455 0.069 1
1 1139 . 2 1 1 A 100 100 HIS C C 99 174.789 177.699 -2.910 1
1 1140 . 2 1 1 A 100 100 HIS CA C 99 56.154 59.553 -3.399 1
1 1141 . 2 1 1 A 100 100 HIS CB C 99 28.946 30.676 -1.730 1
1 1143 . 2 1 1 A 100 100 HIS N N 99 114.778 118.290 -3.512 1
1 1144 . 2 1 1 A 101 101 HIS H H 100 7.773 8.099 -0.326 1
1 1145 . 2 1 1 A 101 101 HIS HA H 100 4.704 4.409 0.295 1
1 1149 . 2 1 1 A 101 101 HIS C C 100 174.818 177.165 -2.347 1
1 1150 . 2 1 1 A 101 101 HIS CA C 100 54.830 58.608 -3.778 1
1 1151 . 2 1 1 A 101 101 HIS CB C 100 29.749 28.594 1.155 1
1 1153 . 2 1 1 A 101 101 HIS N N 100 117.397 117.261 0.136 1
1 1154 . 2 1 1 A 102 102 LYS H H 101 7.324 8.097 -0.773 1
1 1155 . 2 1 1 A 102 102 LYS HA H 101 3.611 4.094 -0.483 1
1 1164 . 2 1 1 A 102 102 LYS C C 101 176.823 178.324 -1.501 1
1 1165 . 2 1 1 A 102 102 LYS CA C 101 59.915 59.011 0.904 1
1 1166 . 2 1 1 A 102 102 LYS CB C 101 32.825 32.170 0.655 1
1 1170 . 2 1 1 A 102 102 LYS N N 101 120.533 122.095 -1.562 1
1 1171 . 2 1 1 A 103 103 ASP H H 102 8.361 7.576 0.785 1
1 1172 . 2 1 1 A 103 103 ASP HA H 102 4.421 4.529 -0.108 1
1 1175 . 2 1 1 A 103 103 ASP C C 102 176.793 177.017 -0.224 1
1 1176 . 2 1 1 A 103 103 ASP CA C 102 55.500 55.737 -0.237 1
1 1177 . 2 1 1 A 103 103 ASP CB C 102 40.178 40.527 -0.349 1
1 1178 . 2 1 1 A 103 103 ASP N N 102 114.814 119.549 -4.735 1
1 1179 . 2 1 1 A 104 104 GLU H H 103 7.858 8.042 -0.184 1
1 1180 . 2 1 1 A 104 104 GLU HA H 103 4.339 4.433 -0.094 1
1 1183 . 2 1 1 A 104 104 GLU C C 103 175.777 176.487 -0.710 1
1 1184 . 2 1 1 A 104 104 GLU CA C 103 56.356 57.473 -1.117 1
1 1185 . 2 1 1 A 104 104 GLU CB C 103 31.293 31.701 -0.408 1
1 1186 . 2 1 1 A 104 104 GLU N N 103 116.826 117.845 -1.019 1
1 1187 . 2 1 1 A 105 105 VAL H H 104 7.201 7.705 -0.504 1
1 1188 . 2 1 1 A 105 105 VAL HA H 104 4.296 4.123 0.173 1
1 1196 . 2 1 1 A 105 105 VAL C C 104 174.482 175.799 -1.317 1
1 1197 . 2 1 1 A 105 105 VAL CA C 104 60.370 62.727 -2.357 1
1 1198 . 2 1 1 A 105 105 VAL CB C 104 34.341 33.278 1.063 1
1 1201 . 2 1 1 A 105 105 VAL N N 104 116.422 119.955 -3.533 1
1 1202 . 2 1 1 A 106 106 ALA H H 105 8.487 8.480 0.007 1
1 1203 . 2 1 1 A 106 106 ALA HA H 105 4.172 4.439 -0.267 1
1 1207 . 2 1 1 A 106 106 ALA C C 105 179.030 178.929 0.101 1
1 1208 . 2 1 1 A 106 106 ALA CA C 105 52.966 52.702 0.264 1
1 1209 . 2 1 1 A 106 106 ALA CB C 105 19.371 19.600 -0.229 1
1 1210 . 2 1 1 A 106 106 ALA N N 105 128.313 129.010 -0.697 1
1 1211 . 2 1 1 A 107 107 GLY H H 106 8.738 8.810 -0.072 1
1 1212 . 2 1 1 A 107 107 GLY HA2 H 106 3.773 3.885 -0.112 1
1 1213 . 2 1 1 A 107 107 GLY HA3 H 106 3.998 3.961 0.037 1
1 1214 . 2 1 1 A 107 107 GLY C C 106 174.958 175.609 -0.651 1
1 1215 . 2 1 1 A 107 107 GLY CA C 106 47.449 47.169 0.280 1
1 1216 . 2 1 1 A 107 107 GLY N N 106 110.612 111.050 -0.438 1
1 1217 . 2 1 1 A 108 108 ASP H H 107 8.535 7.938 0.597 1
1 1218 . 2 1 1 A 108 108 ASP HA H 107 4.333 4.368 -0.035 1
1 1221 . 2 1 1 A 108 108 ASP C C 107 179.133 178.962 0.171 1
1 1222 . 2 1 1 A 108 108 ASP CA C 107 56.721 56.643 0.078 1
1 1223 . 2 1 1 A 108 108 ASP CB C 107 39.336 40.762 -1.426 1
1 1224 . 2 1 1 A 108 108 ASP N N 107 117.474 123.098 -5.624 1
1 1225 . 2 1 1 A 109 109 ILE H H 108 7.459 7.903 -0.444 1
1 1226 . 2 1 1 A 109 109 ILE HA H 108 3.688 3.720 -0.032 1
1 1236 . 2 1 1 A 109 109 ILE C C 108 176.735 178.373 -1.638 1
1 1237 . 2 1 1 A 109 109 ILE CA C 108 63.474 65.645 -2.171 1
1 1238 . 2 1 1 A 109 109 ILE CB C 108 37.340 37.860 -0.520 1
1 1242 . 2 1 1 A 109 109 ILE N N 108 119.609 119.572 0.037 1
1 1243 . 2 1 1 A 110 110 PHE H H 109 7.920 8.336 -0.416 1
1 1244 . 2 1 1 A 110 110 PHE HA H 109 3.759 4.087 -0.328 1
1 1252 . 2 1 1 A 110 110 PHE C C 109 177.132 177.282 -0.150 1
1 1253 . 2 1 1 A 110 110 PHE CA C 109 62.766 61.196 1.570 1
1 1254 . 2 1 1 A 110 110 PHE CB C 109 39.752 39.289 0.463 1
1 1260 . 2 1 1 A 110 110 PHE N N 109 120.906 120.250 0.656 1
1 1261 . 2 1 1 A 111 111 ASP H H 110 8.639 8.387 0.252 1
1 1262 . 2 1 1 A 111 111 ASP HA H 110 4.216 4.208 0.008 1
1 1265 . 2 1 1 A 111 111 ASP C C 110 178.900 178.241 0.659 1
1 1266 . 2 1 1 A 111 111 ASP CA C 110 57.105 57.333 -0.228 1
1 1267 . 2 1 1 A 111 111 ASP CB C 110 39.697 42.099 -2.402 1
1 1268 . 2 1 1 A 111 111 ASP N N 110 117.124 118.756 -1.632 1
1 1269 . 2 1 1 A 112 112 MET H H 111 7.331 7.636 -0.305 1
1 1270 . 2 1 1 A 112 112 MET HA H 111 4.081 4.113 -0.032 1
1 1278 . 2 1 1 A 112 112 MET C C 111 179.052 178.125 0.927 1
1 1279 . 2 1 1 A 112 112 MET CA C 111 58.202 57.968 0.234 1
1 1280 . 2 1 1 A 112 112 MET CB C 111 31.827 32.182 -0.355 1
1 1283 . 2 1 1 A 112 112 MET N N 111 118.061 119.349 -1.288 1
1 1284 . 2 1 1 A 113 113 LEU H H 112 8.001 7.944 0.057 1
1 1285 . 2 1 1 A 113 113 LEU HA H 112 3.723 3.597 0.126 1
1 1295 . 2 1 1 A 113 113 LEU C C 112 179.747 178.811 0.936 1
1 1296 . 2 1 1 A 113 113 LEU CA C 112 57.371 57.446 -0.075 1
1 1297 . 2 1 1 A 113 113 LEU CB C 112 40.671 40.976 -0.305 1
1 1301 . 2 1 1 A 113 113 LEU N N 112 120.426 119.639 0.787 1
1 1302 . 2 1 1 A 114 114 LEU H H 113 7.744 7.389 0.355 1
1 1303 . 2 1 1 A 114 114 LEU HA H 113 4.007 3.662 0.345 1
1 1313 . 2 1 1 A 114 114 LEU C C 113 179.358 178.668 0.690 1
1 1314 . 2 1 1 A 114 114 LEU CA C 113 57.202 57.462 -0.260 1
1 1315 . 2 1 1 A 114 114 LEU CB C 113 41.727 41.164 0.563 1
1 1319 . 2 1 1 A 114 114 LEU N N 113 119.584 118.431 1.153 1
1 1320 . 2 1 1 A 115 115 THR H H 114 7.353 7.630 -0.277 1
1 1321 . 2 1 1 A 115 115 THR HA H 114 4.071 4.072 -0.001 1
1 1327 . 2 1 1 A 115 115 THR C C 114 173.591 176.712 -3.121 1
1 1328 . 2 1 1 A 115 115 THR CA C 114 65.332 64.791 0.541 1
1 1329 . 2 1 1 A 115 115 THR CB C 114 70.319 68.459 1.860 1
1 1331 . 2 1 1 A 115 115 THR N N 114 107.535 110.519 -2.984 1
1 1332 . 2 1 1 A 116 116 PHE H H 115 6.979 7.881 -0.902 1
1 1333 . 2 1 1 A 116 116 PHE HA H 115 5.022 4.249 0.773 1
1 1341 . 2 1 1 A 116 116 PHE C C 115 176.488 176.534 -0.046 1
1 1342 . 2 1 1 A 116 116 PHE CA C 115 55.911 60.879 -4.968 1
1 1343 . 2 1 1 A 116 116 PHE CB C 115 38.521 39.184 -0.663 1
1 1349 . 2 1 1 A 116 116 PHE N N 115 112.366 119.971 -7.605 1
1 1350 . 2 1 1 A 117 117 THR H H 116 7.564 7.536 0.028 1
1 1351 . 2 1 1 A 117 117 THR HA H 116 4.626 4.814 -0.188 1
1 1356 . 2 1 1 A 117 117 THR C C 116 174.085 174.349 -0.264 1
1 1357 . 2 1 1 A 117 117 THR CA C 116 61.636 62.090 -0.454 1
1 1358 . 2 1 1 A 117 117 THR CB C 116 70.915 70.784 0.131 1
1 1360 . 2 1 1 A 117 117 THR N N 116 105.498 105.663 -0.165 1
1 1361 . 2 1 1 A 118 118 ASP H H 117 8.270 7.842 0.428 1
1 1362 . 2 1 1 A 118 118 ASP HA H 117 4.955 4.696 0.259 1
1 1365 . 2 1 1 A 118 118 ASP C C 117 176.328 176.418 -0.090 1
1 1366 . 2 1 1 A 118 118 ASP CA C 117 53.417 53.428 -0.011 1
1 1367 . 2 1 1 A 118 118 ASP CB C 117 43.388 40.467 2.921 1
1 1368 . 2 1 1 A 118 118 ASP N N 117 124.409 122.030 2.379 1
1 1369 . 2 1 1 A 119 119 PHE H H 118 8.973 8.818 0.155 1
1 1370 . 2 1 1 A 119 119 PHE HA H 118 3.506 4.256 -0.750 1
1 1378 . 2 1 1 A 119 119 PHE CA C 118 61.490 61.385 0.105 1
1 1379 . 2 1 1 A 119 119 PHE CB C 118 39.246 39.542 -0.296 1
1 1385 . 2 1 1 A 119 119 PHE N N 118 126.688 126.780 -0.092 1
1 1386 . 2 1 1 A 120 120 LEU H H 119 8.099 8.373 -0.274 1
1 1387 . 2 1 1 A 120 120 LEU HA H 119 3.842 4.109 -0.267 1
1 1397 . 2 1 1 A 120 120 LEU C C 119 179.601 178.789 0.812 1
1 1398 . 2 1 1 A 120 120 LEU CA C 119 58.174 58.059 0.115 1
1 1399 . 2 1 1 A 120 120 LEU CB C 119 40.315 41.404 -1.089 1
1 1403 . 2 1 1 A 120 120 LEU N N 119 117.930 120.627 -2.697 1
1 1404 . 2 1 1 A 121 121 ALA H H 120 7.729 7.848 -0.119 1
1 1405 . 2 1 1 A 121 121 ALA HA H 120 3.996 4.104 -0.108 1
1 1409 . 2 1 1 A 121 121 ALA C C 120 180.995 179.513 1.482 1
1 1410 . 2 1 1 A 121 121 ALA CA C 120 54.832 54.650 0.182 1
1 1411 . 2 1 1 A 121 121 ALA CB C 120 17.706 18.338 -0.632 1
1 1412 . 2 1 1 A 121 121 ALA N N 120 123.195 121.288 1.907 1
1 1413 . 2 1 1 A 122 122 PHE H H 121 7.943 7.877 0.066 1
1 1414 . 2 1 1 A 122 122 PHE HA H 121 3.887 3.818 0.069 1
1 1419 . 2 1 1 A 122 122 PHE C C 121 175.410 176.818 -1.408 1
1 1420 . 2 1 1 A 122 122 PHE CA C 121 61.075 60.742 0.333 1
1 1421 . 2 1 1 A 122 122 PHE CB C 121 38.115 38.835 -0.720 1
1 1424 . 2 1 1 A 122 122 PHE N N 121 121.798 120.501 1.297 1
1 1425 . 2 1 1 A 123 123 LYS H H 122 8.468 7.814 0.654 1
1 1426 . 2 1 1 A 123 123 LYS HA H 122 3.077 3.831 -0.754 1
1 1435 . 2 1 1 A 123 123 LYS C C 122 178.453 178.827 -0.374 1
1 1436 . 2 1 1 A 123 123 LYS CA C 122 59.855 59.869 -0.014 1
1 1437 . 2 1 1 A 123 123 LYS CB C 122 32.374 32.245 0.129 1
1 1441 . 2 1 1 A 123 123 LYS N N 122 120.614 118.532 2.082 1
1 1442 . 2 1 1 A 124 124 GLU H H 123 8.100 7.870 0.230 1
1 1443 . 2 1 1 A 124 124 GLU HA H 123 3.652 4.058 -0.406 1
1 1448 . 2 1 1 A 124 124 GLU C C 123 177.743 178.489 -0.746 1
1 1449 . 2 1 1 A 124 124 GLU CA C 123 59.406 59.432 -0.026 1
1 1450 . 2 1 1 A 124 124 GLU CB C 123 28.811 29.419 -0.608 1
1 1452 . 2 1 1 A 124 124 GLU N N 123 117.404 118.832 -1.428 1
1 1453 . 2 1 1 A 125 125 MET H H 124 7.537 7.645 -0.108 1
1 1454 . 2 1 1 A 125 125 MET HA H 124 3.860 3.971 -0.111 1
1 1462 . 2 1 1 A 125 125 MET C C 124 179.522 178.286 1.236 1
1 1463 . 2 1 1 A 125 125 MET CA C 124 58.832 58.351 0.481 1
1 1464 . 2 1 1 A 125 125 MET CB C 124 31.765 31.493 0.272 1
1 1467 . 2 1 1 A 125 125 MET N N 124 119.413 119.145 0.268 1
1 1468 . 2 1 1 A 126 126 PHE H H 125 7.148 7.442 -0.294 1
1 1469 . 2 1 1 A 126 126 PHE HA H 125 3.633 4.221 -0.588 1
1 1476 . 2 1 1 A 126 126 PHE C C 125 178.994 178.279 0.715 1
1 1477 . 2 1 1 A 126 126 PHE CA C 125 63.148 61.100 2.048 1
1 1478 . 2 1 1 A 126 126 PHE CB C 125 39.830 38.239 1.591 1
1 1483 . 2 1 1 A 126 126 PHE N N 125 120.013 118.967 1.046 1
1 1484 . 2 1 1 A 127 127 LEU H H 126 8.369 8.578 -0.209 1
1 1485 . 2 1 1 A 127 127 LEU HA H 126 3.972 4.027 -0.055 1
1 1495 . 2 1 1 A 127 127 LEU C C 126 180.621 179.238 1.383 1
1 1496 . 2 1 1 A 127 127 LEU CA C 126 57.944 57.849 0.095 1
1 1497 . 2 1 1 A 127 127 LEU CB C 126 40.543 40.873 -0.330 1
1 1501 . 2 1 1 A 127 127 LEU N N 126 119.692 119.648 0.044 1
1 1502 . 2 1 1 A 128 128 ASP H H 127 8.578 8.032 0.546 1
1 1503 . 2 1 1 A 128 128 ASP HA H 127 4.308 4.337 -0.029 1
1 1506 . 2 1 1 A 128 128 ASP C C 127 178.254 178.205 0.049 1
1 1507 . 2 1 1 A 128 128 ASP CA C 127 56.964 57.141 -0.177 1
1 1508 . 2 1 1 A 128 128 ASP CB C 127 39.735 40.904 -1.169 1
1 1509 . 2 1 1 A 128 128 ASP N N 127 121.926 119.947 1.979 1
1 1510 . 2 1 1 A 129 129 TYR H H 128 7.710 8.125 -0.415 1
1 1511 . 2 1 1 A 129 129 TYR HA H 128 3.908 3.993 -0.085 1
1 1518 . 2 1 1 A 129 129 TYR C C 128 177.633 177.461 0.172 1
1 1519 . 2 1 1 A 129 129 TYR CA C 128 61.796 61.514 0.282 1
1 1520 . 2 1 1 A 129 129 TYR CB C 128 39.372 38.867 0.505 1
1 1525 . 2 1 1 A 129 129 TYR N N 128 122.548 120.152 2.396 1
1 1526 . 2 1 1 A 130 130 ARG H H 129 8.622 8.385 0.237 1
1 1527 . 2 1 1 A 130 130 ARG HA H 129 3.722 3.756 -0.034 1
1 1535 . 2 1 1 A 130 130 ARG CA C 129 60.084 59.679 0.405 1
1 1536 . 2 1 1 A 130 130 ARG CB C 129 29.902 29.868 0.034 1
1 1539 . 2 1 1 A 130 130 ARG N N 129 118.302 119.355 -1.053 1
1 1541 . 2 1 1 A 131 131 ALA H H 130 7.936 7.993 -0.057 1
1 1542 . 2 1 1 A 131 131 ALA HA H 130 3.997 4.027 -0.030 1
1 1546 . 2 1 1 A 131 131 ALA C C 130 180.456 180.118 0.338 1
1 1547 . 2 1 1 A 131 131 ALA CA C 130 55.133 54.835 0.298 1
1 1548 . 2 1 1 A 131 131 ALA CB C 130 17.750 18.096 -0.346 1
1 1549 . 2 1 1 A 131 131 ALA N N 130 119.788 120.465 -0.677 1
1 1550 . 2 1 1 A 132 132 GLU H H 131 7.622 7.349 0.273 1
1 1551 . 2 1 1 A 132 132 GLU HA H 131 3.862 3.988 -0.126 1
1 1556 . 2 1 1 A 132 132 GLU C C 131 179.528 178.972 0.556 1
1 1557 . 2 1 1 A 132 132 GLU CA C 131 58.849 58.420 0.429 1
1 1558 . 2 1 1 A 132 132 GLU CB C 131 28.930 29.050 -0.120 1
1 1560 . 2 1 1 A 132 132 GLU N N 131 118.428 118.180 0.248 1
1 1561 . 2 1 1 A 133 133 LYS H H 132 7.853 7.503 0.350 1
1 1562 . 2 1 1 A 133 133 LYS HA H 132 3.722 3.896 -0.174 1
1 1571 . 2 1 1 A 133 133 LYS C C 132 175.725 178.685 -2.960 1
1 1572 . 2 1 1 A 133 133 LYS CA C 132 57.544 59.352 -1.808 1
1 1573 . 2 1 1 A 133 133 LYS CB C 132 31.770 31.849 -0.079 1
1 1577 . 2 1 1 A 133 133 LYS N N 132 119.473 119.179 0.294 1
1 1578 . 2 1 1 A 134 134 GLU H H 133 8.151 8.237 -0.086 1
1 1579 . 2 1 1 A 134 134 GLU HA H 133 4.161 4.191 -0.030 1
1 1584 . 2 1 1 A 134 134 GLU C C 133 177.453 178.068 -0.615 1
1 1585 . 2 1 1 A 134 134 GLU CA C 133 57.222 58.641 -1.419 1
1 1586 . 2 1 1 A 134 134 GLU CB C 133 30.091 29.165 0.926 1
1 1588 . 2 1 1 A 134 134 GLU N N 133 116.525 118.563 -2.038 1
1 1589 . 2 1 1 A 135 135 GLY H H 134 7.702 7.743 -0.041 1
1 1590 . 2 1 1 A 135 135 GLY HA2 H 134 3.896 3.908 -0.012 1
1 1591 . 2 1 1 A 135 135 GLY HA3 H 134 3.897 3.919 -0.022 1
1 1592 . 2 1 1 A 135 135 GLY C C 134 174.538 173.202 1.336 1
1 1593 . 2 1 1 A 135 135 GLY CA C 134 45.975 46.128 -0.153 1
1 1594 . 2 1 1 A 135 135 GLY N N 134 107.924 108.062 -0.138 1
1 1595 . 2 1 1 A 136 136 ARG H H 135 8.045 7.667 0.378 1
1 1596 . 2 1 1 A 136 136 ARG HA H 135 4.323 4.073 0.250 1
1 1604 . 2 1 1 A 136 136 ARG C C 135 175.864 175.547 0.317 1
1 1605 . 2 1 1 A 136 136 ARG CA C 135 56.016 56.602 -0.586 1
1 1606 . 2 1 1 A 136 136 ARG CB C 135 30.987 28.932 2.055 1
1 1609 . 2 1 1 A 136 136 ARG N N 135 119.708 113.358 6.350 1
1 1 . 3 1 1 A 14 14 PHE CA C 13 58.199 59.125 -0.926 1
1 2 . 3 1 1 A 14 14 PHE CB C 13 39.717 41.617 -1.900 1
1 3 . 3 1 1 A 15 15 SER H H 14 8.299 8.033 0.266 1
1 4 . 3 1 1 A 15 15 SER HA H 14 4.359 4.757 -0.398 1
1 7 . 3 1 1 A 15 15 SER CA C 14 58.249 57.499 0.750 1
1 8 . 3 1 1 A 15 15 SER CB C 14 63.936 66.939 -3.003 1
1 9 . 3 1 1 A 15 15 SER N N 14 117.379 111.761 5.618 1
1 10 . 3 1 1 A 16 16 SER H H 15 8.255 8.922 -0.667 1
1 11 . 3 1 1 A 16 16 SER HA H 15 3.729 4.583 -0.854 1
1 14 . 3 1 1 A 16 16 SER CA C 15 58.224 58.766 -0.542 1
1 15 . 3 1 1 A 16 16 SER CB C 15 63.886 63.807 0.079 1
1 16 . 3 1 1 A 16 16 SER N N 15 117.694 117.395 0.299 1
1 17 . 3 1 1 A 17 17 ALA H H 16 8.333 7.988 0.345 1
1 18 . 3 1 1 A 17 17 ALA HA H 16 4.252 4.163 0.089 1
1 22 . 3 1 1 A 17 17 ALA CA C 16 53.377 53.555 -0.178 1
1 23 . 3 1 1 A 17 17 ALA CB C 16 18.896 18.388 0.508 1
1 24 . 3 1 1 A 17 17 ALA N N 16 125.462 123.499 1.963 1
1 25 . 3 1 1 A 18 18 SER H H 17 8.219 7.861 0.358 1
1 26 . 3 1 1 A 18 18 SER HA H 17 4.332 4.545 -0.213 1
1 29 . 3 1 1 A 18 18 SER CA C 17 59.105 58.289 0.816 1
1 30 . 3 1 1 A 18 18 SER CB C 17 63.592 63.433 0.159 1
1 31 . 3 1 1 A 18 18 SER N N 17 114.821 113.741 1.080 1
1 32 . 3 1 1 A 19 19 ASP H H 18 8.309 7.767 0.542 1
1 33 . 3 1 1 A 19 19 ASP HA H 18 4.554 4.217 0.337 1
1 36 . 3 1 1 A 19 19 ASP C C 18 176.528 176.643 -0.115 1
1 37 . 3 1 1 A 19 19 ASP CA C 18 55.272 56.313 -1.041 1
1 38 . 3 1 1 A 19 19 ASP CB C 18 40.883 38.543 2.340 1
1 39 . 3 1 1 A 19 19 ASP N N 18 123.367 118.092 5.275 1
1 40 . 3 1 1 A 20 20 ALA H H 19 8.133 8.575 -0.442 1
1 41 . 3 1 1 A 20 20 ALA HA H 19 4.170 4.038 0.132 1
1 45 . 3 1 1 A 20 20 ALA C C 19 179.857 179.385 0.472 1
1 46 . 3 1 1 A 20 20 ALA CA C 19 54.341 55.481 -1.140 1
1 47 . 3 1 1 A 20 20 ALA CB C 19 18.660 18.253 0.407 1
1 48 . 3 1 1 A 20 20 ALA N N 19 123.350 122.652 0.698 1
1 49 . 3 1 1 A 21 21 GLU H H 20 8.140 8.097 0.043 1
1 50 . 3 1 1 A 21 21 GLU HA H 20 4.128 4.050 0.078 1
1 55 . 3 1 1 A 21 21 GLU C C 20 177.675 178.562 -0.887 1
1 56 . 3 1 1 A 21 21 GLU CA C 20 58.520 59.473 -0.953 1
1 57 . 3 1 1 A 21 21 GLU CB C 20 29.765 29.560 0.205 1
1 59 . 3 1 1 A 21 21 GLU N N 20 119.063 118.775 0.288 1
1 60 . 3 1 1 A 22 22 PHE H H 21 8.009 8.012 -0.003 1
1 61 . 3 1 1 A 22 22 PHE HA H 21 4.123 4.268 -0.145 1
1 68 . 3 1 1 A 22 22 PHE C C 21 176.410 176.818 -0.408 1
1 69 . 3 1 1 A 22 22 PHE CA C 21 62.202 61.478 0.724 1
1 70 . 3 1 1 A 22 22 PHE CB C 21 39.223 39.028 0.195 1
1 75 . 3 1 1 A 22 22 PHE N N 21 121.211 121.035 0.176 1
1 76 . 3 1 1 A 23 23 ASP H H 22 8.261 8.373 -0.112 1
1 77 . 3 1 1 A 23 23 ASP HA H 22 4.041 4.352 -0.311 1
1 80 . 3 1 1 A 23 23 ASP C C 22 179.078 178.055 1.023 1
1 81 . 3 1 1 A 23 23 ASP CA C 22 57.048 57.782 -0.734 1
1 82 . 3 1 1 A 23 23 ASP CB C 22 40.154 41.922 -1.768 1
1 83 . 3 1 1 A 23 23 ASP N N 22 116.876 119.107 -2.231 1
1 84 . 3 1 1 A 24 24 ALA H H 23 7.651 7.643 0.008 1
1 85 . 3 1 1 A 24 24 ALA HA H 23 3.785 3.874 -0.089 1
1 89 . 3 1 1 A 24 24 ALA C C 23 179.577 179.572 0.005 1
1 90 . 3 1 1 A 24 24 ALA CA C 23 54.341 55.154 -0.813 1
1 91 . 3 1 1 A 24 24 ALA CB C 23 17.762 18.262 -0.500 1
1 92 . 3 1 1 A 24 24 ALA N N 23 121.873 121.584 0.289 1
1 93 . 3 1 1 A 25 25 VAL H H 24 7.718 7.874 -0.156 1
1 94 . 3 1 1 A 25 25 VAL HA H 24 3.216 3.640 -0.424 1
1 102 . 3 1 1 A 25 25 VAL C C 24 177.805 178.346 -0.541 1
1 103 . 3 1 1 A 25 25 VAL CA C 24 66.789 66.590 0.199 1
1 104 . 3 1 1 A 25 25 VAL CB C 24 31.277 31.380 -0.103 1
1 107 . 3 1 1 A 25 25 VAL N N 24 117.890 118.253 -0.363 1
1 108 . 3 1 1 A 26 26 VAL H H 25 7.867 7.744 0.123 1
1 109 . 3 1 1 A 26 26 VAL HA H 25 3.274 3.588 -0.314 1
1 117 . 3 1 1 A 26 26 VAL C C 25 177.788 178.180 -0.392 1
1 118 . 3 1 1 A 26 26 VAL CA C 25 67.282 66.257 1.025 1
1 119 . 3 1 1 A 26 26 VAL CB C 25 31.266 31.381 -0.115 1
1 122 . 3 1 1 A 26 26 VAL N N 25 118.170 120.244 -2.074 1
1 123 . 3 1 1 A 27 27 GLY H H 26 7.544 7.730 -0.186 1
1 124 . 3 1 1 A 27 27 GLY HA2 H 26 3.592 3.481 0.111 1
1 125 . 3 1 1 A 27 27 GLY HA3 H 26 3.721 3.608 0.113 1
1 126 . 3 1 1 A 27 27 GLY C C 26 176.717 176.475 0.242 1
1 127 . 3 1 1 A 27 27 GLY CA C 26 47.085 47.255 -0.170 1
1 128 . 3 1 1 A 27 27 GLY N N 26 105.795 107.542 -1.747 1
1 129 . 3 1 1 A 28 28 TYR H H 27 7.625 7.441 0.184 1
1 130 . 3 1 1 A 28 28 TYR HA H 27 4.546 4.595 -0.049 1
1 137 . 3 1 1 A 28 28 TYR C C 27 178.991 178.206 0.785 1
1 138 . 3 1 1 A 28 28 TYR CA C 27 58.845 59.727 -0.882 1
1 139 . 3 1 1 A 28 28 TYR CB C 27 37.602 37.366 0.236 1
1 144 . 3 1 1 A 28 28 TYR N N 27 119.933 122.165 -2.232 1
1 145 . 3 1 1 A 29 29 LEU H H 28 8.517 8.088 0.429 1
1 146 . 3 1 1 A 29 29 LEU HA H 28 3.728 3.798 -0.070 1
1 156 . 3 1 1 A 29 29 LEU CA C 28 58.281 58.138 0.143 1
1 157 . 3 1 1 A 29 29 LEU CB C 28 41.948 41.421 0.527 1
1 161 . 3 1 1 A 29 29 LEU N N 28 119.669 120.612 -0.943 1
1 162 . 3 1 1 A 30 30 GLU H H 29 8.072 7.967 0.105 1
1 163 . 3 1 1 A 30 30 GLU HA H 29 3.722 3.946 -0.224 1
1 168 . 3 1 1 A 30 30 GLU C C 29 177.731 179.418 -1.687 1
1 169 . 3 1 1 A 30 30 GLU CA C 29 59.763 59.794 -0.031 1
1 170 . 3 1 1 A 30 30 GLU CB C 29 28.844 29.058 -0.214 1
1 172 . 3 1 1 A 30 30 GLU N N 29 117.666 117.593 0.073 1
1 173 . 3 1 1 A 31 31 ASP H H 30 7.243 7.907 -0.664 1
1 174 . 3 1 1 A 31 31 ASP HA H 30 4.297 4.406 -0.109 1
1 177 . 3 1 1 A 31 31 ASP CA C 30 56.953 56.986 -0.033 1
1 178 . 3 1 1 A 31 31 ASP CB C 30 40.730 41.640 -0.910 1
1 179 . 3 1 1 A 31 31 ASP N N 30 116.720 119.422 -2.702 1
1 180 . 3 1 1 A 32 32 ILE H H 31 7.940 7.279 0.661 1
1 181 . 3 1 1 A 32 32 ILE HA H 31 3.640 3.831 -0.191 1
1 191 . 3 1 1 A 32 32 ILE C C 31 177.980 178.200 -0.220 1
1 192 . 3 1 1 A 32 32 ILE CA C 31 64.692 63.976 0.716 1
1 193 . 3 1 1 A 32 32 ILE CB C 31 38.938 36.735 2.203 1
1 197 . 3 1 1 A 32 32 ILE N N 31 119.728 117.573 2.155 1
1 198 . 3 1 1 A 33 33 ILE H H 32 7.984 7.685 0.299 1
1 199 . 3 1 1 A 33 33 ILE HA H 32 3.598 3.130 0.468 1
1 209 . 3 1 1 A 33 33 ILE C C 32 176.723 176.969 -0.246 1
1 210 . 3 1 1 A 33 33 ILE CA C 32 63.241 64.594 -1.353 1
1 211 . 3 1 1 A 33 33 ILE CB C 32 37.580 37.675 -0.095 1
1 215 . 3 1 1 A 33 33 ILE N N 32 113.919 121.613 -7.694 1
1 216 . 3 1 1 A 34 34 MET H H 33 7.288 7.672 -0.384 1
1 217 . 3 1 1 A 34 34 MET HA H 33 4.496 4.676 -0.180 1
1 225 . 3 1 1 A 34 34 MET C C 33 176.423 175.769 0.654 1
1 226 . 3 1 1 A 34 34 MET CA C 33 54.634 54.338 0.296 1
1 227 . 3 1 1 A 34 34 MET CB C 33 31.934 31.512 0.422 1
1 230 . 3 1 1 A 34 34 MET N N 33 115.130 116.920 -1.790 1
1 231 . 3 1 1 A 35 35 ASP H H 34 7.405 7.563 -0.158 1
1 232 . 3 1 1 A 35 35 ASP HA H 34 4.484 4.536 -0.052 1
1 235 . 3 1 1 A 35 35 ASP C C 34 177.139 176.969 0.170 1
1 236 . 3 1 1 A 35 35 ASP CA C 34 54.625 54.724 -0.099 1
1 237 . 3 1 1 A 35 35 ASP CB C 34 43.554 42.675 0.879 1
1 238 . 3 1 1 A 35 35 ASP N N 34 121.814 121.903 -0.089 1
1 239 . 3 1 1 A 36 36 ASP H H 35 8.765 8.799 -0.034 1
1 240 . 3 1 1 A 36 36 ASP HA H 35 4.235 4.327 -0.092 1
1 243 . 3 1 1 A 36 36 ASP C C 35 178.320 178.457 -0.137 1
1 244 . 3 1 1 A 36 36 ASP CA C 35 57.832 58.016 -0.184 1
1 245 . 3 1 1 A 36 36 ASP CB C 35 40.914 40.457 0.457 1
1 246 . 3 1 1 A 36 36 ASP N N 35 125.883 125.318 0.565 1
1 247 . 3 1 1 A 37 37 GLU H H 36 8.905 8.269 0.636 1
1 248 . 3 1 1 A 37 37 GLU HA H 36 3.933 4.090 -0.157 1
1 253 . 3 1 1 A 37 37 GLU C C 36 179.304 179.091 0.213 1
1 254 . 3 1 1 A 37 37 GLU CA C 36 59.828 59.219 0.609 1
1 255 . 3 1 1 A 37 37 GLU CB C 36 29.380 29.287 0.093 1
1 257 . 3 1 1 A 37 37 GLU N N 36 119.077 120.343 -1.266 1
1 258 . 3 1 1 A 38 38 PHE H H 37 7.460 8.327 -0.867 1
1 259 . 3 1 1 A 38 38 PHE HA H 37 3.642 4.138 -0.496 1
1 267 . 3 1 1 A 38 38 PHE C C 37 176.483 177.889 -1.406 1
1 268 . 3 1 1 A 38 38 PHE CA C 37 61.411 61.262 0.149 1
1 269 . 3 1 1 A 38 38 PHE CB C 37 39.355 39.121 0.234 1
1 275 . 3 1 1 A 38 38 PHE N N 37 119.968 120.819 -0.851 1
1 276 . 3 1 1 A 39 39 GLN H H 38 7.968 8.196 -0.228 1
1 277 . 3 1 1 A 39 39 GLN HA H 38 3.712 3.842 -0.130 1
1 284 . 3 1 1 A 39 39 GLN CA C 38 59.153 58.628 0.525 1
1 285 . 3 1 1 A 39 39 GLN CB C 38 28.213 28.195 0.018 1
1 287 . 3 1 1 A 39 39 GLN N N 38 116.433 118.243 -1.810 1
1 289 . 3 1 1 A 40 40 LEU H H 39 7.930 7.499 0.431 1
1 290 . 3 1 1 A 40 40 LEU HA H 39 3.916 4.013 -0.097 1
1 300 . 3 1 1 A 40 40 LEU C C 39 177.731 178.240 -0.509 1
1 301 . 3 1 1 A 40 40 LEU CA C 39 57.915 57.990 -0.075 1
1 302 . 3 1 1 A 40 40 LEU CB C 39 41.989 41.802 0.187 1
1 306 . 3 1 1 A 40 40 LEU N N 39 119.505 121.675 -2.170 1
1 307 . 3 1 1 A 41 41 LEU H H 40 7.174 7.762 -0.588 1
1 308 . 3 1 1 A 41 41 LEU HA H 40 3.835 4.007 -0.172 1
1 318 . 3 1 1 A 41 41 LEU C C 40 179.738 178.229 1.509 1
1 319 . 3 1 1 A 41 41 LEU CA C 40 58.266 58.312 -0.046 1
1 320 . 3 1 1 A 41 41 LEU CB C 40 42.050 41.569 0.481 1
1 324 . 3 1 1 A 41 41 LEU N N 40 120.971 119.461 1.510 1
1 325 . 3 1 1 A 42 42 GLN H H 41 8.058 8.033 0.025 1
1 326 . 3 1 1 A 42 42 GLN HA H 41 3.556 3.795 -0.239 1
1 333 . 3 1 1 A 42 42 GLN C C 41 177.642 178.276 -0.634 1
1 334 . 3 1 1 A 42 42 GLN CA C 41 59.826 59.261 0.565 1
1 335 . 3 1 1 A 42 42 GLN CB C 41 28.762 27.907 0.855 1
1 337 . 3 1 1 A 42 42 GLN N N 41 117.899 118.190 -0.291 1
1 339 . 3 1 1 A 43 43 ARG H H 42 8.179 7.716 0.463 1
1 340 . 3 1 1 A 43 43 ARG HA H 42 3.655 4.080 -0.425 1
1 347 . 3 1 1 A 43 43 ARG C C 42 178.051 178.868 -0.817 1
1 348 . 3 1 1 A 43 43 ARG CA C 42 59.766 58.947 0.819 1
1 349 . 3 1 1 A 43 43 ARG CB C 42 29.941 29.951 -0.010 1
1 352 . 3 1 1 A 43 43 ARG N N 42 119.392 120.053 -0.661 1
1 353 . 3 1 1 A 44 44 ASN H H 43 8.525 8.193 0.332 1
1 354 . 3 1 1 A 44 44 ASN HA H 43 4.332 4.403 -0.071 1
1 359 . 3 1 1 A 44 44 ASN C C 43 178.150 178.466 -0.316 1
1 360 . 3 1 1 A 44 44 ASN CA C 43 55.841 56.330 -0.489 1
1 361 . 3 1 1 A 44 44 ASN CB C 43 37.632 38.260 -0.628 1
1 362 . 3 1 1 A 44 44 ASN N N 43 116.214 118.206 -1.992 1
1 364 . 3 1 1 A 45 45 PHE H H 44 7.586 8.026 -0.440 1
1 365 . 3 1 1 A 45 45 PHE HA H 44 4.132 4.371 -0.239 1
1 372 . 3 1 1 A 45 45 PHE C C 44 176.691 178.760 -2.069 1
1 373 . 3 1 1 A 45 45 PHE CA C 44 62.333 60.987 1.346 1
1 374 . 3 1 1 A 45 45 PHE CB C 44 39.449 38.769 0.680 1
1 379 . 3 1 1 A 45 45 PHE N N 44 121.501 119.206 2.295 1
1 380 . 3 1 1 A 46 46 MET H H 45 8.190 8.276 -0.086 1
1 381 . 3 1 1 A 46 46 MET HA H 45 4.060 4.342 -0.282 1
1 389 . 3 1 1 A 46 46 MET C C 45 179.754 178.290 1.464 1
1 390 . 3 1 1 A 46 46 MET CA C 45 57.742 58.084 -0.342 1
1 391 . 3 1 1 A 46 46 MET CB C 45 29.912 31.330 -1.418 1
1 394 . 3 1 1 A 46 46 MET N N 45 116.727 118.010 -1.283 1
1 395 . 3 1 1 A 47 47 ASP H H 46 8.579 8.284 0.295 1
1 396 . 3 1 1 A 47 47 ASP HA H 46 4.804 4.687 0.117 1
1 399 . 3 1 1 A 47 47 ASP C C 46 177.854 178.410 -0.556 1
1 400 . 3 1 1 A 47 47 ASP CA C 46 57.277 57.381 -0.104 1
1 401 . 3 1 1 A 47 47 ASP CB C 46 40.776 41.454 -0.678 1
1 402 . 3 1 1 A 47 47 ASP N N 46 117.798 120.674 -2.876 1
1 403 . 3 1 1 A 48 48 LYS H H 47 7.339 7.984 -0.645 1
1 404 . 3 1 1 A 48 48 LYS HA H 47 3.828 4.091 -0.263 1
1 413 . 3 1 1 A 48 48 LYS C C 47 178.812 178.878 -0.066 1
1 414 . 3 1 1 A 48 48 LYS CA C 47 58.953 58.484 0.469 1
1 415 . 3 1 1 A 48 48 LYS CB C 47 32.796 32.542 0.254 1
1 419 . 3 1 1 A 48 48 LYS N N 47 117.852 119.652 -1.800 1
1 420 . 3 1 1 A 49 49 TYR H H 48 6.841 8.570 -1.729 1
1 421 . 3 1 1 A 49 49 TYR HA H 48 4.995 4.185 0.810 1
1 428 . 3 1 1 A 49 49 TYR C C 48 178.138 178.684 -0.546 1
1 429 . 3 1 1 A 49 49 TYR CA C 48 58.620 59.937 -1.317 1
1 430 . 3 1 1 A 49 49 TYR CB C 48 42.939 38.238 4.701 1
1 435 . 3 1 1 A 49 49 TYR N N 48 112.109 119.846 -7.737 1
1 436 . 3 1 1 A 50 50 TYR H H 49 8.491 8.076 0.415 1
1 437 . 3 1 1 A 50 50 TYR HA H 49 4.598 4.255 0.343 1
1 444 . 3 1 1 A 50 50 TYR C C 49 176.015 177.825 -1.810 1
1 445 . 3 1 1 A 50 50 TYR CA C 49 62.442 59.756 2.686 1
1 446 . 3 1 1 A 50 50 TYR CB C 49 36.588 37.086 -0.498 1
1 451 . 3 1 1 A 50 50 TYR N N 49 118.294 119.333 -1.039 1
1 452 . 3 1 1 A 51 51 LEU H H 50 7.512 7.382 0.130 1
1 453 . 3 1 1 A 51 51 LEU HA H 50 3.878 3.480 0.398 1
1 463 . 3 1 1 A 51 51 LEU C C 50 178.625 178.596 0.029 1
1 464 . 3 1 1 A 51 51 LEU CA C 50 55.994 57.196 -1.202 1
1 465 . 3 1 1 A 51 51 LEU CB C 50 40.743 41.341 -0.598 1
1 469 . 3 1 1 A 51 51 LEU N N 50 118.478 121.388 -2.910 1
1 470 . 3 1 1 A 52 52 GLU H H 51 8.042 7.666 0.376 1
1 471 . 3 1 1 A 52 52 GLU HA H 51 4.197 3.840 0.357 1
1 476 . 3 1 1 A 52 52 GLU C C 51 177.629 177.597 0.032 1
1 477 . 3 1 1 A 52 52 GLU CA C 51 56.141 59.497 -3.356 1
1 478 . 3 1 1 A 52 52 GLU CB C 51 29.162 28.891 0.271 1
1 480 . 3 1 1 A 52 52 GLU N N 51 115.067 118.045 -2.978 1
1 481 . 3 1 1 A 53 53 PHE H H 52 7.465 7.853 -0.388 1
1 482 . 3 1 1 A 53 53 PHE HA H 52 4.431 4.520 -0.089 1
1 490 . 3 1 1 A 53 53 PHE C C 52 174.325 174.840 -0.515 1
1 491 . 3 1 1 A 53 53 PHE CA C 52 58.986 56.982 2.004 1
1 492 . 3 1 1 A 53 53 PHE CB C 52 40.183 37.454 2.729 1
1 498 . 3 1 1 A 53 53 PHE N N 52 116.768 118.472 -1.704 1
1 499 . 3 1 1 A 54 54 GLU H H 53 7.484 8.591 -1.107 1
1 500 . 3 1 1 A 54 54 GLU HA H 53 4.583 4.887 -0.304 1
1 505 . 3 1 1 A 54 54 GLU C C 53 175.722 175.526 0.196 1
1 506 . 3 1 1 A 54 54 GLU CA C 53 54.248 54.901 -0.653 1
1 507 . 3 1 1 A 54 54 GLU CB C 53 34.409 31.335 3.074 1
1 509 . 3 1 1 A 54 54 GLU N N 53 118.844 123.928 -5.084 1
1 510 . 3 1 1 A 55 55 ASP H H 54 9.008 8.623 0.385 1
1 511 . 3 1 1 A 55 55 ASP HA H 54 4.735 4.913 -0.178 1
1 514 . 3 1 1 A 55 55 ASP C C 54 175.421 175.853 -0.432 1
1 515 . 3 1 1 A 55 55 ASP CA C 54 52.888 53.524 -0.636 1
1 516 . 3 1 1 A 55 55 ASP CB C 54 38.894 40.851 -1.957 1
1 517 . 3 1 1 A 55 55 ASP N N 54 123.654 122.352 1.302 1
1 518 . 3 1 1 A 56 56 THR H H 55 7.819 8.065 -0.246 1
1 519 . 3 1 1 A 56 56 THR HA H 55 4.574 4.973 -0.399 1
1 524 . 3 1 1 A 56 56 THR C C 55 174.096 174.390 -0.294 1
1 525 . 3 1 1 A 56 56 THR CA C 55 59.172 59.890 -0.718 1
1 526 . 3 1 1 A 56 56 THR CB C 55 71.889 71.898 -0.009 1
1 528 . 3 1 1 A 56 56 THR N N 55 112.015 117.514 -5.499 1
1 529 . 3 1 1 A 57 57 GLU H H 56 8.527 8.856 -0.329 1
1 530 . 3 1 1 A 57 57 GLU HA H 56 4.217 4.559 -0.342 1
1 535 . 3 1 1 A 57 57 GLU C C 56 177.042 176.401 0.641 1
1 536 . 3 1 1 A 57 57 GLU CA C 56 56.869 57.651 -0.782 1
1 537 . 3 1 1 A 57 57 GLU CB C 56 29.731 31.498 -1.767 1
1 539 . 3 1 1 A 57 57 GLU N N 56 117.531 118.427 -0.896 1
1 540 . 3 1 1 A 58 58 GLU H H 57 7.587 7.873 -0.286 1
1 541 . 3 1 1 A 58 58 GLU HA H 57 3.941 4.735 -0.794 1
1 546 . 3 1 1 A 58 58 GLU C C 57 176.849 175.982 0.867 1
1 547 . 3 1 1 A 58 58 GLU CA C 57 56.924 55.094 1.830 1
1 548 . 3 1 1 A 58 58 GLU CB C 57 30.251 32.005 -1.754 1
1 550 . 3 1 1 A 58 58 GLU N N 57 119.183 117.978 1.205 1
1 551 . 3 1 1 A 59 59 ASN H H 58 9.120 8.568 0.552 1
1 552 . 3 1 1 A 59 59 ASN HA H 58 4.922 4.889 0.033 1
1 557 . 3 1 1 A 59 59 ASN C C 58 174.254 174.474 -0.220 1
1 558 . 3 1 1 A 59 59 ASN CA C 58 51.956 52.932 -0.976 1
1 559 . 3 1 1 A 59 59 ASN CB C 58 37.404 39.836 -2.432 1
1 560 . 3 1 1 A 59 59 ASN N N 58 126.767 121.257 5.510 1
1 562 . 3 1 1 A 60 60 LYS H H 59 5.892 8.332 -2.440 1
1 563 . 3 1 1 A 60 60 LYS HA H 59 3.798 4.906 -1.108 1
1 572 . 3 1 1 A 60 60 LYS C C 59 177.908 177.153 0.755 1
1 573 . 3 1 1 A 60 60 LYS CA C 59 56.623 54.621 2.002 1
1 574 . 3 1 1 A 60 60 LYS CB C 59 32.279 35.721 -3.442 1
1 578 . 3 1 1 A 60 60 LYS N N 59 121.527 119.279 2.248 1
1 579 . 3 1 1 A 61 61 LEU H H 60 8.473 8.736 -0.263 1
1 580 . 3 1 1 A 61 61 LEU HA H 60 3.891 4.211 -0.320 1
1 590 . 3 1 1 A 61 61 LEU C C 60 179.843 178.225 1.618 1
1 591 . 3 1 1 A 61 61 LEU CA C 60 58.301 57.285 1.016 1
1 592 . 3 1 1 A 61 61 LEU CB C 60 41.305 41.798 -0.493 1
1 596 . 3 1 1 A 61 61 LEU N N 60 125.639 125.097 0.542 1
1 597 . 3 1 1 A 62 62 ILE H H 61 7.698 8.111 -0.413 1
1 598 . 3 1 1 A 62 62 ILE HA H 61 3.952 3.912 0.040 1
1 608 . 3 1 1 A 62 62 ILE C C 61 175.392 177.283 -1.891 1
1 609 . 3 1 1 A 62 62 ILE CA C 61 61.743 63.526 -1.783 1
1 610 . 3 1 1 A 62 62 ILE CB C 61 39.108 37.821 1.287 1
1 614 . 3 1 1 A 62 62 ILE N N 61 114.111 118.888 -4.777 1
1 615 . 3 1 1 A 63 63 TYR H H 62 7.273 7.962 -0.689 1
1 616 . 3 1 1 A 63 63 TYR HA H 62 4.343 4.167 0.176 1
1 623 . 3 1 1 A 63 63 TYR C C 62 178.264 178.564 -0.300 1
1 624 . 3 1 1 A 63 63 TYR CA C 62 57.231 60.793 -3.562 1
1 625 . 3 1 1 A 63 63 TYR CB C 62 36.332 37.505 -1.173 1
1 630 . 3 1 1 A 63 63 TYR N N 62 117.689 121.438 -3.749 1
1 631 . 3 1 1 A 64 64 THR H H 63 7.747 8.104 -0.357 1
1 632 . 3 1 1 A 64 64 THR HA H 63 4.266 4.245 0.021 1
1 637 . 3 1 1 A 64 64 THR CA C 63 69.362 67.572 1.790 1
1 638 . 3 1 1 A 64 64 THR CB C 63 66.962 67.630 -0.668 1
1 640 . 3 1 1 A 64 64 THR N N 63 113.755 116.070 -2.315 1
1 641 . 3 1 1 A 65 65 PRO HA H 64 4.372 4.388 -0.016 1
1 648 . 3 1 1 A 65 65 PRO C C 64 179.913 179.411 0.502 1
1 649 . 3 1 1 A 65 65 PRO CA C 64 66.011 66.100 -0.089 1
1 650 . 3 1 1 A 65 65 PRO CB C 64 30.642 30.634 0.008 1
1 653 . 3 1 1 A 66 66 ILE H H 65 7.377 7.215 0.162 1
1 654 . 3 1 1 A 66 66 ILE HA H 65 3.530 3.878 -0.348 1
1 664 . 3 1 1 A 66 66 ILE C C 65 177.543 178.546 -1.003 1
1 665 . 3 1 1 A 66 66 ILE CA C 65 66.647 64.218 2.429 1
1 666 . 3 1 1 A 66 66 ILE CB C 65 38.029 37.577 0.452 1
1 670 . 3 1 1 A 66 66 ILE N N 65 118.353 116.880 1.473 1
1 671 . 3 1 1 A 67 67 PHE H H 66 8.480 8.332 0.148 1
1 672 . 3 1 1 A 67 67 PHE HA H 66 4.115 4.384 -0.269 1
1 680 . 3 1 1 A 67 67 PHE C C 66 177.293 177.536 -0.243 1
1 681 . 3 1 1 A 67 67 PHE CA C 66 59.570 62.447 -2.877 1
1 682 . 3 1 1 A 67 67 PHE CB C 66 38.865 39.272 -0.407 1
1 688 . 3 1 1 A 67 67 PHE N N 66 122.420 120.459 1.961 1
1 689 . 3 1 1 A 68 68 ASN H H 67 8.595 8.317 0.278 1
1 690 . 3 1 1 A 68 68 ASN HA H 67 4.211 4.300 -0.089 1
1 695 . 3 1 1 A 68 68 ASN C C 67 178.697 178.218 0.479 1
1 696 . 3 1 1 A 68 68 ASN CA C 67 56.056 56.361 -0.305 1
1 697 . 3 1 1 A 68 68 ASN CB C 67 37.704 37.931 -0.227 1
1 698 . 3 1 1 A 68 68 ASN N N 67 115.573 117.600 -2.027 1
1 700 . 3 1 1 A 69 69 GLU H H 68 8.414 8.108 0.306 1
1 701 . 3 1 1 A 69 69 GLU HA H 68 4.102 4.186 -0.084 1
1 706 . 3 1 1 A 69 69 GLU C C 68 177.880 178.823 -0.943 1
1 707 . 3 1 1 A 69 69 GLU CA C 68 59.399 59.519 -0.120 1
1 708 . 3 1 1 A 69 69 GLU CB C 68 29.855 29.465 0.390 1
1 710 . 3 1 1 A 69 69 GLU N N 68 123.510 119.976 3.534 1
1 711 . 3 1 1 A 70 70 TYR H H 69 8.659 8.057 0.602 1
1 712 . 3 1 1 A 70 70 TYR HA H 69 3.362 4.131 -0.769 1
1 719 . 3 1 1 A 70 70 TYR C C 69 178.143 177.050 1.093 1
1 720 . 3 1 1 A 70 70 TYR CA C 69 60.686 61.116 -0.430 1
1 721 . 3 1 1 A 70 70 TYR CB C 69 38.560 38.969 -0.409 1
1 726 . 3 1 1 A 70 70 TYR N N 69 122.130 120.753 1.377 1
1 727 . 3 1 1 A 71 71 ILE H H 70 8.031 7.657 0.374 1
1 728 . 3 1 1 A 71 71 ILE HA H 70 3.265 3.673 -0.408 1
1 738 . 3 1 1 A 71 71 ILE C C 70 178.056 178.003 0.053 1
1 739 . 3 1 1 A 71 71 ILE CA C 70 63.756 63.948 -0.192 1
1 740 . 3 1 1 A 71 71 ILE CB C 70 37.321 36.561 0.760 1
1 744 . 3 1 1 A 71 71 ILE N N 70 118.906 120.113 -1.207 1
1 745 . 3 1 1 A 72 72 SER H H 71 7.803 7.982 -0.179 1
1 746 . 3 1 1 A 72 72 SER HA H 71 4.029 4.349 -0.320 1
1 749 . 3 1 1 A 72 72 SER CA C 71 61.380 61.239 0.141 1
1 750 . 3 1 1 A 72 72 SER CB C 71 63.288 63.385 -0.097 1
1 751 . 3 1 1 A 72 72 SER N N 71 113.735 118.643 -4.908 1
1 752 . 3 1 1 A 73 73 LEU H H 72 7.952 7.901 0.051 1
1 753 . 3 1 1 A 73 73 LEU HA H 72 4.418 4.101 0.317 1
1 763 . 3 1 1 A 73 73 LEU C C 72 177.767 178.336 -0.569 1
1 764 . 3 1 1 A 73 73 LEU CA C 72 56.543 57.419 -0.876 1
1 765 . 3 1 1 A 73 73 LEU CB C 72 44.517 41.688 2.829 1
1 769 . 3 1 1 A 73 73 LEU N N 72 119.411 122.438 -3.027 1
1 770 . 3 1 1 A 74 74 VAL H H 73 8.021 7.537 0.484 1
1 771 . 3 1 1 A 74 74 VAL HA H 73 3.532 3.367 0.165 1
1 779 . 3 1 1 A 74 74 VAL C C 73 177.126 177.967 -0.841 1
1 780 . 3 1 1 A 74 74 VAL CA C 73 66.250 66.319 -0.069 1
1 781 . 3 1 1 A 74 74 VAL CB C 73 31.212 31.203 0.009 1
1 784 . 3 1 1 A 74 74 VAL N N 73 118.747 119.102 -0.355 1
1 785 . 3 1 1 A 75 75 GLU H H 74 7.232 7.908 -0.676 1
1 786 . 3 1 1 A 75 75 GLU HA H 74 3.013 4.154 -1.141 1
1 791 . 3 1 1 A 75 75 GLU C C 74 178.804 179.012 -0.208 1
1 792 . 3 1 1 A 75 75 GLU CA C 74 60.536 60.020 0.516 1
1 793 . 3 1 1 A 75 75 GLU CB C 74 27.009 29.161 -2.152 1
1 795 . 3 1 1 A 75 75 GLU N N 74 118.660 119.755 -1.095 1
1 796 . 3 1 1 A 76 76 LYS H H 75 7.051 7.578 -0.527 1
1 797 . 3 1 1 A 76 76 LYS HA H 75 3.765 4.038 -0.273 1
1 806 . 3 1 1 A 76 76 LYS C C 75 177.765 178.648 -0.883 1
1 807 . 3 1 1 A 76 76 LYS CA C 75 58.357 58.546 -0.189 1
1 808 . 3 1 1 A 76 76 LYS CB C 75 31.939 31.966 -0.027 1
1 812 . 3 1 1 A 76 76 LYS N N 75 116.112 119.812 -3.700 1
1 813 . 3 1 1 A 77 77 TYR H H 76 7.067 7.693 -0.626 1
1 814 . 3 1 1 A 77 77 TYR HA H 76 4.036 4.071 -0.035 1
1 821 . 3 1 1 A 77 77 TYR C C 76 177.752 177.431 0.321 1
1 822 . 3 1 1 A 77 77 TYR CA C 76 61.820 61.356 0.464 1
1 823 . 3 1 1 A 77 77 TYR CB C 76 38.480 38.736 -0.256 1
1 828 . 3 1 1 A 77 77 TYR N N 76 118.434 120.572 -2.138 1
1 829 . 3 1 1 A 78 78 ILE H H 77 7.554 8.098 -0.544 1
1 830 . 3 1 1 A 78 78 ILE HA H 77 3.159 3.481 -0.322 1
1 840 . 3 1 1 A 78 78 ILE C C 77 177.341 177.812 -0.471 1
1 841 . 3 1 1 A 78 78 ILE CA C 77 65.177 64.872 0.305 1
1 842 . 3 1 1 A 78 78 ILE CB C 77 37.339 37.619 -0.280 1
1 846 . 3 1 1 A 78 78 ILE N N 77 117.672 120.523 -2.851 1
1 847 . 3 1 1 A 79 79 GLU H H 78 8.296 7.911 0.385 1
1 848 . 3 1 1 A 79 79 GLU HA H 78 3.557 3.741 -0.184 1
1 853 . 3 1 1 A 79 79 GLU C C 78 177.742 178.601 -0.859 1
1 854 . 3 1 1 A 79 79 GLU CA C 78 60.847 60.050 0.797 1
1 855 . 3 1 1 A 79 79 GLU CB C 78 29.594 29.106 0.488 1
1 857 . 3 1 1 A 79 79 GLU N N 78 118.701 120.398 -1.697 1
1 858 . 3 1 1 A 80 80 GLU H H 79 8.330 8.418 -0.088 1
1 859 . 3 1 1 A 80 80 GLU HA H 79 3.774 3.917 -0.143 1
1 864 . 3 1 1 A 80 80 GLU C C 79 179.926 179.384 0.542 1
1 865 . 3 1 1 A 80 80 GLU CA C 79 59.581 58.957 0.624 1
1 866 . 3 1 1 A 80 80 GLU CB C 79 29.062 29.036 0.026 1
1 868 . 3 1 1 A 80 80 GLU N N 79 116.767 117.961 -1.194 1
1 869 . 3 1 1 A 81 81 GLN H H 80 7.634 7.680 -0.046 1
1 870 . 3 1 1 A 81 81 GLN HA H 80 3.605 3.833 -0.228 1
1 877 . 3 1 1 A 81 81 GLN C C 80 179.681 178.359 1.322 1
1 878 . 3 1 1 A 81 81 GLN CA C 80 57.765 58.373 -0.608 1
1 879 . 3 1 1 A 81 81 GLN CB C 80 28.079 27.888 0.191 1
1 881 . 3 1 1 A 81 81 GLN N N 80 116.325 118.618 -2.293 1
1 883 . 3 1 1 A 82 82 LEU H H 81 8.156 7.413 0.743 1
1 884 . 3 1 1 A 82 82 LEU HA H 81 3.536 3.752 -0.216 1
1 894 . 3 1 1 A 82 82 LEU C C 81 178.945 179.301 -0.356 1
1 895 . 3 1 1 A 82 82 LEU CA C 81 57.761 56.773 0.988 1
1 896 . 3 1 1 A 82 82 LEU CB C 81 40.961 40.914 0.047 1
1 900 . 3 1 1 A 82 82 LEU N N 81 121.546 120.461 1.085 1
1 901 . 3 1 1 A 83 83 LEU H H 82 8.326 8.062 0.264 1
1 902 . 3 1 1 A 83 83 LEU HA H 82 4.198 4.222 -0.024 1
1 912 . 3 1 1 A 83 83 LEU C C 82 178.631 179.048 -0.417 1
1 913 . 3 1 1 A 83 83 LEU CA C 82 57.016 57.071 -0.055 1
1 914 . 3 1 1 A 83 83 LEU CB C 82 42.182 40.775 1.407 1
1 918 . 3 1 1 A 83 83 LEU N N 82 120.426 119.040 1.386 1
1 919 . 3 1 1 A 84 84 GLN H H 83 6.992 7.718 -0.726 1
1 920 . 3 1 1 A 84 84 GLN HA H 83 3.877 3.990 -0.113 1
1 927 . 3 1 1 A 84 84 GLN C C 83 177.008 176.478 0.530 1
1 928 . 3 1 1 A 84 84 GLN CA C 83 57.543 58.384 -0.841 1
1 929 . 3 1 1 A 84 84 GLN CB C 83 28.688 28.414 0.274 1
1 931 . 3 1 1 A 84 84 GLN N N 83 114.001 117.271 -3.270 1
1 933 . 3 1 1 A 85 85 ARG H H 84 7.072 7.650 -0.578 1
1 934 . 3 1 1 A 85 85 ARG HA H 84 4.047 4.514 -0.467 1
1 942 . 3 1 1 A 85 85 ARG C C 84 175.999 175.325 0.674 1
1 943 . 3 1 1 A 85 85 ARG CA C 84 56.764 56.771 -0.007 1
1 944 . 3 1 1 A 85 85 ARG CB C 84 32.044 32.693 -0.649 1
1 947 . 3 1 1 A 85 85 ARG N N 84 115.827 118.799 -2.972 1
1 949 . 3 1 1 A 86 86 ILE H H 85 8.238 7.526 0.712 1
1 950 . 3 1 1 A 86 86 ILE HA H 85 4.389 4.407 -0.018 1
1 960 . 3 1 1 A 86 86 ILE CA C 85 58.007 57.818 0.189 1
1 961 . 3 1 1 A 86 86 ILE CB C 85 39.604 38.609 0.995 1
1 965 . 3 1 1 A 86 86 ILE N N 85 119.285 118.289 0.996 1
1 966 . 3 1 1 A 87 87 PRO HA H 86 4.392 4.569 -0.177 1
1 973 . 3 1 1 A 87 87 PRO C C 86 177.622 177.507 0.115 1
1 974 . 3 1 1 A 87 87 PRO CA C 86 64.665 64.237 0.428 1
1 975 . 3 1 1 A 87 87 PRO CB C 86 32.020 31.717 0.303 1
1 978 . 3 1 1 A 88 88 GLU H H 87 8.312 8.594 -0.282 1
1 979 . 3 1 1 A 88 88 GLU HA H 87 4.208 4.367 -0.159 1
1 984 . 3 1 1 A 88 88 GLU C C 87 175.554 176.552 -0.998 1
1 985 . 3 1 1 A 88 88 GLU CA C 87 56.045 55.815 0.230 1
1 986 . 3 1 1 A 88 88 GLU CB C 87 28.654 29.169 -0.515 1
1 988 . 3 1 1 A 88 88 GLU N N 87 114.256 115.758 -1.502 1
1 989 . 3 1 1 A 89 89 PHE H H 88 7.946 7.334 0.612 1
1 990 . 3 1 1 A 89 89 PHE HA H 88 3.993 4.286 -0.293 1
1 998 . 3 1 1 A 89 89 PHE C C 88 173.460 174.686 -1.226 1
1 999 . 3 1 1 A 89 89 PHE CA C 88 60.119 59.570 0.549 1
1 1000 . 3 1 1 A 89 89 PHE CB C 88 39.994 39.636 0.358 1
1 1006 . 3 1 1 A 89 89 PHE N N 88 121.550 122.455 -0.905 1
1 1007 . 3 1 1 A 90 90 ASN H H 89 7.266 7.929 -0.663 1
1 1008 . 3 1 1 A 90 90 ASN HA H 89 4.454 5.251 -0.797 1
1 1013 . 3 1 1 A 90 90 ASN C C 89 173.921 174.903 -0.982 1
1 1014 . 3 1 1 A 90 90 ASN CA C 89 51.839 51.455 0.384 1
1 1015 . 3 1 1 A 90 90 ASN CB C 89 40.674 38.537 2.137 1
1 1016 . 3 1 1 A 90 90 ASN N N 89 125.344 123.008 2.336 1
1 1018 . 3 1 1 A 91 91 MET H H 90 8.968 8.341 0.627 1
1 1019 . 3 1 1 A 91 91 MET HA H 90 4.049 4.125 -0.076 1
1 1027 . 3 1 1 A 91 91 MET C C 90 177.475 178.078 -0.603 1
1 1028 . 3 1 1 A 91 91 MET CA C 90 57.758 58.017 -0.259 1
1 1029 . 3 1 1 A 91 91 MET CB C 90 32.250 32.336 -0.086 1
1 1032 . 3 1 1 A 91 91 MET N N 90 127.052 121.355 5.697 1
1 1033 . 3 1 1 A 92 92 ALA H H 91 8.292 8.129 0.163 1
1 1034 . 3 1 1 A 92 92 ALA HA H 91 4.059 4.125 -0.066 1
1 1038 . 3 1 1 A 92 92 ALA C C 91 180.412 180.073 0.339 1
1 1039 . 3 1 1 A 92 92 ALA CA C 91 55.368 55.127 0.241 1
1 1040 . 3 1 1 A 92 92 ALA CB C 91 17.527 18.388 -0.861 1
1 1041 . 3 1 1 A 92 92 ALA N N 91 123.752 121.387 2.365 1
1 1042 . 3 1 1 A 93 93 ALA H H 92 7.931 7.950 -0.019 1
1 1043 . 3 1 1 A 93 93 ALA HA H 92 4.054 4.102 -0.048 1
1 1047 . 3 1 1 A 93 93 ALA C C 92 180.482 179.781 0.701 1
1 1048 . 3 1 1 A 93 93 ALA CA C 92 54.614 54.840 -0.226 1
1 1049 . 3 1 1 A 93 93 ALA CB C 92 18.098 18.174 -0.076 1
1 1050 . 3 1 1 A 93 93 ALA N N 92 121.158 119.943 1.215 1
1 1051 . 3 1 1 A 94 94 PHE H H 93 8.110 7.826 0.284 1
1 1052 . 3 1 1 A 94 94 PHE HA H 93 4.304 4.181 0.123 1
1 1060 . 3 1 1 A 94 94 PHE C C 93 177.350 177.466 -0.116 1
1 1061 . 3 1 1 A 94 94 PHE CA C 93 61.641 61.493 0.148 1
1 1062 . 3 1 1 A 94 94 PHE CB C 93 40.014 39.178 0.836 1
1 1068 . 3 1 1 A 94 94 PHE N N 93 119.807 120.009 -0.202 1
1 1069 . 3 1 1 A 95 95 THR H H 94 8.726 8.385 0.341 1
1 1070 . 3 1 1 A 95 95 THR HA H 94 3.569 3.955 -0.386 1
1 1075 . 3 1 1 A 95 95 THR C C 94 176.932 176.854 0.078 1
1 1076 . 3 1 1 A 95 95 THR CA C 94 66.833 65.674 1.159 1
1 1077 . 3 1 1 A 95 95 THR CB C 94 68.445 68.188 0.257 1
1 1079 . 3 1 1 A 95 95 THR N N 94 113.074 112.242 0.832 1
1 1080 . 3 1 1 A 96 96 THR H H 95 7.657 7.800 -0.143 1
1 1081 . 3 1 1 A 96 96 THR HA H 95 3.945 4.029 -0.084 1
1 1086 . 3 1 1 A 96 96 THR C C 95 176.386 176.305 0.081 1
1 1087 . 3 1 1 A 96 96 THR CA C 95 66.550 66.105 0.445 1
1 1088 . 3 1 1 A 96 96 THR CB C 95 68.583 68.732 -0.149 1
1 1090 . 3 1 1 A 96 96 THR N N 95 117.927 116.549 1.378 1
1 1091 . 3 1 1 A 97 97 THR H H 96 7.699 7.782 -0.083 1
1 1092 . 3 1 1 A 97 97 THR HA H 96 3.905 4.122 -0.217 1
1 1097 . 3 1 1 A 97 97 THR C C 96 176.572 176.524 0.048 1
1 1098 . 3 1 1 A 97 97 THR CA C 96 65.979 66.298 -0.319 1
1 1099 . 3 1 1 A 97 97 THR CB C 96 68.553 68.396 0.157 1
1 1101 . 3 1 1 A 97 97 THR N N 96 118.518 116.654 1.864 1
1 1102 . 3 1 1 A 98 98 LEU H H 97 8.304 7.999 0.305 1
1 1103 . 3 1 1 A 98 98 LEU HA H 97 3.725 3.927 -0.202 1
1 1113 . 3 1 1 A 98 98 LEU C C 97 178.490 178.225 0.265 1
1 1114 . 3 1 1 A 98 98 LEU CA C 97 58.517 58.164 0.353 1
1 1115 . 3 1 1 A 98 98 LEU CB C 97 41.697 41.169 0.528 1
1 1119 . 3 1 1 A 98 98 LEU N N 97 122.882 122.035 0.847 1
1 1120 . 3 1 1 A 99 99 GLN H H 98 7.639 8.135 -0.496 1
1 1121 . 3 1 1 A 99 99 GLN HA H 98 3.927 4.124 -0.197 1
1 1128 . 3 1 1 A 99 99 GLN C C 98 178.068 177.375 0.693 1
1 1129 . 3 1 1 A 99 99 GLN CA C 98 58.735 58.031 0.704 1
1 1130 . 3 1 1 A 99 99 GLN CB C 98 27.986 28.034 -0.048 1
1 1132 . 3 1 1 A 99 99 GLN N N 98 114.302 117.030 -2.728 1
1 1134 . 3 1 1 A 100 100 HIS H H 99 7.575 7.548 0.027 1
1 1135 . 3 1 1 A 100 100 HIS HA H 99 4.524 4.437 0.087 1
1 1139 . 3 1 1 A 100 100 HIS C C 99 174.789 177.571 -2.782 1
1 1140 . 3 1 1 A 100 100 HIS CA C 99 56.154 59.485 -3.331 1
1 1141 . 3 1 1 A 100 100 HIS CB C 99 28.946 30.712 -1.766 1
1 1143 . 3 1 1 A 100 100 HIS N N 99 114.778 118.255 -3.477 1
1 1144 . 3 1 1 A 101 101 HIS H H 100 7.773 8.133 -0.360 1
1 1145 . 3 1 1 A 101 101 HIS HA H 100 4.704 4.018 0.686 1
1 1149 . 3 1 1 A 101 101 HIS C C 100 174.818 176.949 -2.131 1
1 1150 . 3 1 1 A 101 101 HIS CA C 100 54.830 58.155 -3.325 1
1 1151 . 3 1 1 A 101 101 HIS CB C 100 29.749 30.132 -0.383 1
1 1153 . 3 1 1 A 101 101 HIS N N 100 117.397 119.042 -1.645 1
1 1154 . 3 1 1 A 102 102 LYS H H 101 7.324 8.204 -0.880 1
1 1155 . 3 1 1 A 102 102 LYS HA H 101 3.611 4.085 -0.474 1
1 1164 . 3 1 1 A 102 102 LYS C C 101 176.823 178.964 -2.141 1
1 1165 . 3 1 1 A 102 102 LYS CA C 101 59.915 58.877 1.038 1
1 1166 . 3 1 1 A 102 102 LYS CB C 101 32.825 32.183 0.642 1
1 1170 . 3 1 1 A 102 102 LYS N N 101 120.533 118.865 1.668 1
1 1171 . 3 1 1 A 103 103 ASP H H 102 8.361 7.682 0.679 1
1 1172 . 3 1 1 A 103 103 ASP HA H 102 4.421 4.440 -0.019 1
1 1175 . 3 1 1 A 103 103 ASP C C 102 176.793 177.540 -0.747 1
1 1176 . 3 1 1 A 103 103 ASP CA C 102 55.500 56.122 -0.622 1
1 1177 . 3 1 1 A 103 103 ASP CB C 102 40.178 40.568 -0.390 1
1 1178 . 3 1 1 A 103 103 ASP N N 102 114.814 119.183 -4.369 1
1 1179 . 3 1 1 A 104 104 GLU H H 103 7.858 8.095 -0.237 1
1 1180 . 3 1 1 A 104 104 GLU HA H 103 4.339 4.608 -0.269 1
1 1183 . 3 1 1 A 104 104 GLU C C 103 175.777 176.621 -0.844 1
1 1184 . 3 1 1 A 104 104 GLU CA C 103 56.356 57.432 -1.076 1
1 1185 . 3 1 1 A 104 104 GLU CB C 103 31.293 32.800 -1.507 1
1 1186 . 3 1 1 A 104 104 GLU N N 103 116.826 118.347 -1.521 1
1 1187 . 3 1 1 A 105 105 VAL H H 104 7.201 7.200 0.001 1
1 1188 . 3 1 1 A 105 105 VAL HA H 104 4.296 4.175 0.121 1
1 1196 . 3 1 1 A 105 105 VAL C C 104 174.482 175.780 -1.298 1
1 1197 . 3 1 1 A 105 105 VAL CA C 104 60.370 63.161 -2.791 1
1 1198 . 3 1 1 A 105 105 VAL CB C 104 34.341 32.596 1.745 1
1 1201 . 3 1 1 A 105 105 VAL N N 104 116.422 120.939 -4.517 1
1 1202 . 3 1 1 A 106 106 ALA H H 105 8.487 8.481 0.006 1
1 1203 . 3 1 1 A 106 106 ALA HA H 105 4.172 4.419 -0.247 1
1 1207 . 3 1 1 A 106 106 ALA C C 105 179.030 178.937 0.093 1
1 1208 . 3 1 1 A 106 106 ALA CA C 105 52.966 52.612 0.354 1
1 1209 . 3 1 1 A 106 106 ALA CB C 105 19.371 19.710 -0.339 1
1 1210 . 3 1 1 A 106 106 ALA N N 105 128.313 127.866 0.447 1
1 1211 . 3 1 1 A 107 107 GLY H H 106 8.738 8.791 -0.053 1
1 1212 . 3 1 1 A 107 107 GLY HA2 H 106 3.773 3.864 -0.091 1
1 1213 . 3 1 1 A 107 107 GLY HA3 H 106 3.998 3.929 0.069 1
1 1214 . 3 1 1 A 107 107 GLY C C 106 174.958 175.557 -0.599 1
1 1215 . 3 1 1 A 107 107 GLY CA C 106 47.449 47.135 0.314 1
1 1216 . 3 1 1 A 107 107 GLY N N 106 110.612 110.853 -0.241 1
1 1217 . 3 1 1 A 108 108 ASP H H 107 8.535 7.832 0.703 1
1 1218 . 3 1 1 A 108 108 ASP HA H 107 4.333 4.355 -0.022 1
1 1221 . 3 1 1 A 108 108 ASP C C 107 179.133 179.062 0.071 1
1 1222 . 3 1 1 A 108 108 ASP CA C 107 56.721 56.362 0.359 1
1 1223 . 3 1 1 A 108 108 ASP CB C 107 39.336 40.578 -1.242 1
1 1224 . 3 1 1 A 108 108 ASP N N 107 117.474 122.312 -4.838 1
1 1225 . 3 1 1 A 109 109 ILE H H 108 7.459 7.977 -0.518 1
1 1226 . 3 1 1 A 109 109 ILE HA H 108 3.688 3.742 -0.054 1
1 1236 . 3 1 1 A 109 109 ILE C C 108 176.735 178.222 -1.487 1
1 1237 . 3 1 1 A 109 109 ILE CA C 108 63.474 65.535 -2.061 1
1 1238 . 3 1 1 A 109 109 ILE CB C 108 37.340 37.873 -0.533 1
1 1242 . 3 1 1 A 109 109 ILE N N 108 119.609 119.646 -0.037 1
1 1243 . 3 1 1 A 110 110 PHE H H 109 7.920 8.337 -0.417 1
1 1244 . 3 1 1 A 110 110 PHE HA H 109 3.759 4.075 -0.316 1
1 1252 . 3 1 1 A 110 110 PHE C C 109 177.132 177.372 -0.240 1
1 1253 . 3 1 1 A 110 110 PHE CA C 109 62.766 61.232 1.534 1
1 1254 . 3 1 1 A 110 110 PHE CB C 109 39.752 39.292 0.460 1
1 1260 . 3 1 1 A 110 110 PHE N N 109 120.906 120.456 0.450 1
1 1261 . 3 1 1 A 111 111 ASP H H 110 8.639 8.278 0.361 1
1 1262 . 3 1 1 A 111 111 ASP HA H 110 4.216 4.203 0.013 1
1 1265 . 3 1 1 A 111 111 ASP C C 110 178.900 178.376 0.524 1
1 1266 . 3 1 1 A 111 111 ASP CA C 110 57.105 57.269 -0.164 1
1 1267 . 3 1 1 A 111 111 ASP CB C 110 39.697 41.787 -2.090 1
1 1268 . 3 1 1 A 111 111 ASP N N 110 117.124 119.049 -1.925 1
1 1269 . 3 1 1 A 112 112 MET H H 111 7.331 7.518 -0.187 1
1 1270 . 3 1 1 A 112 112 MET HA H 111 4.081 4.123 -0.042 1
1 1278 . 3 1 1 A 112 112 MET C C 111 179.052 178.143 0.909 1
1 1279 . 3 1 1 A 112 112 MET CA C 111 58.202 58.116 0.086 1
1 1280 . 3 1 1 A 112 112 MET CB C 111 31.827 32.399 -0.572 1
1 1283 . 3 1 1 A 112 112 MET N N 111 118.061 119.436 -1.375 1
1 1284 . 3 1 1 A 113 113 LEU H H 112 8.001 8.024 -0.023 1
1 1285 . 3 1 1 A 113 113 LEU HA H 112 3.723 3.462 0.261 1
1 1295 . 3 1 1 A 113 113 LEU C C 112 179.747 178.550 1.197 1
1 1296 . 3 1 1 A 113 113 LEU CA C 112 57.371 57.332 0.039 1
1 1297 . 3 1 1 A 113 113 LEU CB C 112 40.671 41.028 -0.357 1
1 1301 . 3 1 1 A 113 113 LEU N N 112 120.426 119.799 0.627 1
1 1302 . 3 1 1 A 114 114 LEU H H 113 7.744 7.695 0.049 1
1 1303 . 3 1 1 A 114 114 LEU HA H 113 4.007 3.451 0.556 1
1 1313 . 3 1 1 A 114 114 LEU C C 113 179.358 178.443 0.915 1
1 1314 . 3 1 1 A 114 114 LEU CA C 113 57.202 57.462 -0.260 1
1 1315 . 3 1 1 A 114 114 LEU CB C 113 41.727 41.534 0.193 1
1 1319 . 3 1 1 A 114 114 LEU N N 113 119.584 119.576 0.008 1
1 1320 . 3 1 1 A 115 115 THR H H 114 7.353 7.594 -0.241 1
1 1321 . 3 1 1 A 115 115 THR HA H 114 4.071 4.150 -0.079 1
1 1327 . 3 1 1 A 115 115 THR C C 114 173.591 176.440 -2.849 1
1 1328 . 3 1 1 A 115 115 THR CA C 114 65.332 64.368 0.964 1
1 1329 . 3 1 1 A 115 115 THR CB C 114 70.319 68.813 1.506 1
1 1331 . 3 1 1 A 115 115 THR N N 114 107.535 112.360 -4.825 1
1 1332 . 3 1 1 A 116 116 PHE H H 115 6.979 7.829 -0.850 1
1 1333 . 3 1 1 A 116 116 PHE HA H 115 5.022 4.264 0.758 1
1 1341 . 3 1 1 A 116 116 PHE C C 115 176.488 176.566 -0.078 1
1 1342 . 3 1 1 A 116 116 PHE CA C 115 55.911 60.875 -4.964 1
1 1343 . 3 1 1 A 116 116 PHE CB C 115 38.521 39.208 -0.687 1
1 1349 . 3 1 1 A 116 116 PHE N N 115 112.366 120.027 -7.661 1
1 1350 . 3 1 1 A 117 117 THR H H 116 7.564 7.312 0.252 1
1 1351 . 3 1 1 A 117 117 THR HA H 116 4.626 4.793 -0.167 1
1 1356 . 3 1 1 A 117 117 THR C C 116 174.085 174.295 -0.210 1
1 1357 . 3 1 1 A 117 117 THR CA C 116 61.636 61.880 -0.244 1
1 1358 . 3 1 1 A 117 117 THR CB C 116 70.915 70.873 0.042 1
1 1360 . 3 1 1 A 117 117 THR N N 116 105.498 105.751 -0.253 1
1 1361 . 3 1 1 A 118 118 ASP H H 117 8.270 7.704 0.566 1
1 1362 . 3 1 1 A 118 118 ASP HA H 117 4.955 4.677 0.278 1
1 1365 . 3 1 1 A 118 118 ASP C C 117 176.328 176.382 -0.054 1
1 1366 . 3 1 1 A 118 118 ASP CA C 117 53.417 53.300 0.117 1
1 1367 . 3 1 1 A 118 118 ASP CB C 117 43.388 40.294 3.094 1
1 1368 . 3 1 1 A 118 118 ASP N N 117 124.409 122.447 1.962 1
1 1369 . 3 1 1 A 119 119 PHE H H 118 8.973 8.695 0.278 1
1 1370 . 3 1 1 A 119 119 PHE HA H 118 3.506 4.180 -0.674 1
1 1378 . 3 1 1 A 119 119 PHE CA C 118 61.490 61.366 0.124 1
1 1379 . 3 1 1 A 119 119 PHE CB C 118 39.246 39.446 -0.200 1
1 1385 . 3 1 1 A 119 119 PHE N N 118 126.688 126.380 0.308 1
1 1386 . 3 1 1 A 120 120 LEU H H 119 8.099 8.357 -0.258 1
1 1387 . 3 1 1 A 120 120 LEU HA H 119 3.842 3.895 -0.053 1
1 1397 . 3 1 1 A 120 120 LEU C C 119 179.601 179.502 0.099 1
1 1398 . 3 1 1 A 120 120 LEU CA C 119 58.174 57.914 0.260 1
1 1399 . 3 1 1 A 120 120 LEU CB C 119 40.315 41.401 -1.086 1
1 1403 . 3 1 1 A 120 120 LEU N N 119 117.930 120.016 -2.086 1
1 1404 . 3 1 1 A 121 121 ALA H H 120 7.729 7.914 -0.185 1
1 1405 . 3 1 1 A 121 121 ALA HA H 120 3.996 4.079 -0.083 1
1 1409 . 3 1 1 A 121 121 ALA C C 120 180.995 179.548 1.447 1
1 1410 . 3 1 1 A 121 121 ALA CA C 120 54.832 54.662 0.170 1
1 1411 . 3 1 1 A 121 121 ALA CB C 120 17.706 18.369 -0.663 1
1 1412 . 3 1 1 A 121 121 ALA N N 120 123.195 121.274 1.921 1
1 1413 . 3 1 1 A 122 122 PHE H H 121 7.943 7.740 0.203 1
1 1414 . 3 1 1 A 122 122 PHE HA H 121 3.887 3.791 0.096 1
1 1419 . 3 1 1 A 122 122 PHE C C 121 175.410 176.687 -1.277 1
1 1420 . 3 1 1 A 122 122 PHE CA C 121 61.075 60.647 0.428 1
1 1421 . 3 1 1 A 122 122 PHE CB C 121 38.115 38.630 -0.515 1
1 1424 . 3 1 1 A 122 122 PHE N N 121 121.798 120.179 1.619 1
1 1425 . 3 1 1 A 123 123 LYS H H 122 8.468 7.766 0.702 1
1 1426 . 3 1 1 A 123 123 LYS HA H 122 3.077 3.561 -0.484 1
1 1435 . 3 1 1 A 123 123 LYS C C 122 178.453 178.711 -0.258 1
1 1436 . 3 1 1 A 123 123 LYS CA C 122 59.855 59.815 0.040 1
1 1437 . 3 1 1 A 123 123 LYS CB C 122 32.374 32.287 0.087 1
1 1441 . 3 1 1 A 123 123 LYS N N 122 120.614 118.250 2.364 1
1 1442 . 3 1 1 A 124 124 GLU H H 123 8.100 7.710 0.390 1
1 1443 . 3 1 1 A 124 124 GLU HA H 123 3.652 4.015 -0.363 1
1 1448 . 3 1 1 A 124 124 GLU C C 123 177.743 178.478 -0.735 1
1 1449 . 3 1 1 A 124 124 GLU CA C 123 59.406 59.458 -0.052 1
1 1450 . 3 1 1 A 124 124 GLU CB C 123 28.811 29.229 -0.418 1
1 1452 . 3 1 1 A 124 124 GLU N N 123 117.404 118.838 -1.434 1
1 1453 . 3 1 1 A 125 125 MET H H 124 7.537 7.409 0.128 1
1 1454 . 3 1 1 A 125 125 MET HA H 124 3.860 3.928 -0.068 1
1 1462 . 3 1 1 A 125 125 MET C C 124 179.522 178.384 1.138 1
1 1463 . 3 1 1 A 125 125 MET CA C 124 58.832 58.448 0.384 1
1 1464 . 3 1 1 A 125 125 MET CB C 124 31.765 31.342 0.423 1
1 1467 . 3 1 1 A 125 125 MET N N 124 119.413 118.898 0.515 1
1 1468 . 3 1 1 A 126 126 PHE H H 125 7.148 7.390 -0.242 1
1 1469 . 3 1 1 A 126 126 PHE HA H 125 3.633 4.269 -0.636 1
1 1476 . 3 1 1 A 126 126 PHE C C 125 178.994 178.321 0.673 1
1 1477 . 3 1 1 A 126 126 PHE CA C 125 63.148 61.090 2.058 1
1 1478 . 3 1 1 A 126 126 PHE CB C 125 39.830 38.533 1.297 1
1 1483 . 3 1 1 A 126 126 PHE N N 125 120.013 118.492 1.521 1
1 1484 . 3 1 1 A 127 127 LEU H H 126 8.369 8.613 -0.244 1
1 1485 . 3 1 1 A 127 127 LEU HA H 126 3.972 4.041 -0.069 1
1 1495 . 3 1 1 A 127 127 LEU C C 126 180.621 178.753 1.868 1
1 1496 . 3 1 1 A 127 127 LEU CA C 126 57.944 58.227 -0.283 1
1 1497 . 3 1 1 A 127 127 LEU CB C 126 40.543 41.710 -1.167 1
1 1501 . 3 1 1 A 127 127 LEU N N 126 119.692 119.865 -0.173 1
1 1502 . 3 1 1 A 128 128 ASP H H 127 8.578 8.287 0.291 1
1 1503 . 3 1 1 A 128 128 ASP HA H 127 4.308 4.304 0.004 1
1 1506 . 3 1 1 A 128 128 ASP C C 127 178.254 177.995 0.259 1
1 1507 . 3 1 1 A 128 128 ASP CA C 127 56.964 57.357 -0.393 1
1 1508 . 3 1 1 A 128 128 ASP CB C 127 39.735 41.302 -1.567 1
1 1509 . 3 1 1 A 128 128 ASP N N 127 121.926 119.037 2.889 1
1 1510 . 3 1 1 A 129 129 TYR H H 128 7.710 8.229 -0.519 1
1 1511 . 3 1 1 A 129 129 TYR HA H 128 3.908 4.067 -0.159 1
1 1518 . 3 1 1 A 129 129 TYR C C 128 177.633 177.624 0.009 1
1 1519 . 3 1 1 A 129 129 TYR CA C 128 61.796 61.336 0.460 1
1 1520 . 3 1 1 A 129 129 TYR CB C 128 39.372 38.773 0.599 1
1 1525 . 3 1 1 A 129 129 TYR N N 128 122.548 120.448 2.100 1
1 1526 . 3 1 1 A 130 130 ARG H H 129 8.622 8.544 0.078 1
1 1527 . 3 1 1 A 130 130 ARG HA H 129 3.722 3.965 -0.243 1
1 1535 . 3 1 1 A 130 130 ARG CA C 129 60.084 59.659 0.425 1
1 1536 . 3 1 1 A 130 130 ARG CB C 129 29.902 29.856 0.046 1
1 1539 . 3 1 1 A 130 130 ARG N N 129 118.302 119.288 -0.986 1
1 1541 . 3 1 1 A 131 131 ALA H H 130 7.936 8.037 -0.101 1
1 1542 . 3 1 1 A 131 131 ALA HA H 130 3.997 4.092 -0.095 1
1 1546 . 3 1 1 A 131 131 ALA C C 130 180.456 179.824 0.632 1
1 1547 . 3 1 1 A 131 131 ALA CA C 130 55.133 55.074 0.059 1
1 1548 . 3 1 1 A 131 131 ALA CB C 130 17.750 18.205 -0.455 1
1 1549 . 3 1 1 A 131 131 ALA N N 130 119.788 121.786 -1.998 1
1 1550 . 3 1 1 A 132 132 GLU H H 131 7.622 7.571 0.051 1
1 1551 . 3 1 1 A 132 132 GLU HA H 131 3.862 3.963 -0.101 1
1 1556 . 3 1 1 A 132 132 GLU C C 131 179.528 179.030 0.498 1
1 1557 . 3 1 1 A 132 132 GLU CA C 131 58.849 58.970 -0.121 1
1 1558 . 3 1 1 A 132 132 GLU CB C 131 28.930 29.033 -0.103 1
1 1560 . 3 1 1 A 132 132 GLU N N 131 118.428 118.148 0.280 1
1 1561 . 3 1 1 A 133 133 LYS H H 132 7.853 7.513 0.340 1
1 1562 . 3 1 1 A 133 133 LYS HA H 132 3.722 4.005 -0.283 1
1 1571 . 3 1 1 A 133 133 LYS C C 132 175.725 178.477 -2.752 1
1 1572 . 3 1 1 A 133 133 LYS CA C 132 57.544 58.682 -1.138 1
1 1573 . 3 1 1 A 133 133 LYS CB C 132 31.770 32.220 -0.450 1
1 1577 . 3 1 1 A 133 133 LYS N N 132 119.473 119.295 0.178 1
1 1578 . 3 1 1 A 134 134 GLU H H 133 8.151 7.527 0.624 1
1 1579 . 3 1 1 A 134 134 GLU HA H 133 4.161 4.260 -0.099 1
1 1584 . 3 1 1 A 134 134 GLU C C 133 177.453 177.413 0.040 1
1 1585 . 3 1 1 A 134 134 GLU CA C 133 57.222 56.330 0.892 1
1 1586 . 3 1 1 A 134 134 GLU CB C 133 30.091 30.075 0.016 1
1 1588 . 3 1 1 A 134 134 GLU N N 133 116.525 117.439 -0.914 1
1 1589 . 3 1 1 A 135 135 GLY H H 134 7.702 7.802 -0.100 1
1 1590 . 3 1 1 A 135 135 GLY HA2 H 134 3.896 3.898 -0.002 1
1 1591 . 3 1 1 A 135 135 GLY HA3 H 134 3.897 3.905 -0.008 1
1 1592 . 3 1 1 A 135 135 GLY C C 134 174.538 174.783 -0.245 1
1 1593 . 3 1 1 A 135 135 GLY CA C 134 45.975 46.203 -0.228 1
1 1594 . 3 1 1 A 135 135 GLY N N 134 107.924 108.981 -1.057 1
1 1595 . 3 1 1 A 136 136 ARG H H 135 8.045 8.132 -0.087 1
1 1596 . 3 1 1 A 136 136 ARG HA H 135 4.323 4.528 -0.205 1
1 1604 . 3 1 1 A 136 136 ARG C C 135 175.864 175.939 -0.075 1
1 1605 . 3 1 1 A 136 136 ARG CA C 135 56.016 55.716 0.300 1
1 1606 . 3 1 1 A 136 136 ARG CB C 135 30.987 32.000 -1.013 1
1 1609 . 3 1 1 A 136 136 ARG N N 135 119.708 118.873 0.835 1
1 1 . 4 1 1 A 14 14 PHE CA C 13 58.199 55.925 2.274 1
1 2 . 4 1 1 A 14 14 PHE CB C 13 39.717 42.840 -3.123 1
1 3 . 4 1 1 A 15 15 SER H H 14 8.299 8.719 -0.420 1
1 4 . 4 1 1 A 15 15 SER HA H 14 4.359 4.957 -0.598 1
1 7 . 4 1 1 A 15 15 SER CA C 14 58.249 56.996 1.253 1
1 8 . 4 1 1 A 15 15 SER CB C 14 63.936 66.767 -2.831 1
1 9 . 4 1 1 A 15 15 SER N N 14 117.379 114.916 2.463 1
1 10 . 4 1 1 A 16 16 SER H H 15 8.255 8.726 -0.471 1
1 11 . 4 1 1 A 16 16 SER HA H 15 3.729 4.163 -0.434 1
1 14 . 4 1 1 A 16 16 SER CA C 15 58.224 61.216 -2.992 1
1 15 . 4 1 1 A 16 16 SER CB C 15 63.886 61.106 2.780 1
1 16 . 4 1 1 A 16 16 SER N N 15 117.694 113.433 4.261 1
1 17 . 4 1 1 A 17 17 ALA H H 16 8.333 8.633 -0.300 1
1 18 . 4 1 1 A 17 17 ALA HA H 16 4.252 4.113 0.139 1
1 22 . 4 1 1 A 17 17 ALA CA C 16 53.377 55.331 -1.954 1
1 23 . 4 1 1 A 17 17 ALA CB C 16 18.896 18.750 0.146 1
1 24 . 4 1 1 A 17 17 ALA N N 16 125.462 124.521 0.941 1
1 25 . 4 1 1 A 18 18 SER H H 17 8.219 7.928 0.291 1
1 26 . 4 1 1 A 18 18 SER HA H 17 4.332 4.582 -0.250 1
1 29 . 4 1 1 A 18 18 SER CA C 17 59.105 58.151 0.954 1
1 30 . 4 1 1 A 18 18 SER CB C 17 63.592 63.625 -0.033 1
1 31 . 4 1 1 A 18 18 SER N N 17 114.821 108.130 6.691 1
1 32 . 4 1 1 A 19 19 ASP H H 18 8.309 7.635 0.674 1
1 33 . 4 1 1 A 19 19 ASP HA H 18 4.554 5.009 -0.455 1
1 36 . 4 1 1 A 19 19 ASP C C 18 176.528 176.792 -0.264 1
1 37 . 4 1 1 A 19 19 ASP CA C 18 55.272 52.724 2.548 1
1 38 . 4 1 1 A 19 19 ASP CB C 18 40.883 43.649 -2.766 1
1 39 . 4 1 1 A 19 19 ASP N N 18 123.367 121.265 2.102 1
1 40 . 4 1 1 A 20 20 ALA H H 19 8.133 8.553 -0.420 1
1 41 . 4 1 1 A 20 20 ALA HA H 19 4.170 4.103 0.067 1
1 45 . 4 1 1 A 20 20 ALA C C 19 179.857 179.591 0.266 1
1 46 . 4 1 1 A 20 20 ALA CA C 19 54.341 55.095 -0.754 1
1 47 . 4 1 1 A 20 20 ALA CB C 19 18.660 18.332 0.328 1
1 48 . 4 1 1 A 20 20 ALA N N 19 123.350 121.537 1.813 1
1 49 . 4 1 1 A 21 21 GLU H H 20 8.140 8.208 -0.068 1
1 50 . 4 1 1 A 21 21 GLU HA H 20 4.128 4.092 0.036 1
1 55 . 4 1 1 A 21 21 GLU C C 20 177.675 178.657 -0.982 1
1 56 . 4 1 1 A 21 21 GLU CA C 20 58.520 59.497 -0.977 1
1 57 . 4 1 1 A 21 21 GLU CB C 20 29.765 29.553 0.212 1
1 59 . 4 1 1 A 21 21 GLU N N 20 119.063 119.445 -0.382 1
1 60 . 4 1 1 A 22 22 PHE H H 21 8.009 7.932 0.077 1
1 61 . 4 1 1 A 22 22 PHE HA H 21 4.123 4.377 -0.254 1
1 68 . 4 1 1 A 22 22 PHE C C 21 176.410 177.118 -0.708 1
1 69 . 4 1 1 A 22 22 PHE CA C 21 62.202 61.201 1.001 1
1 70 . 4 1 1 A 22 22 PHE CB C 21 39.223 39.154 0.069 1
1 75 . 4 1 1 A 22 22 PHE N N 21 121.211 121.045 0.166 1
1 76 . 4 1 1 A 23 23 ASP H H 22 8.261 8.515 -0.254 1
1 77 . 4 1 1 A 23 23 ASP HA H 22 4.041 4.303 -0.262 1
1 80 . 4 1 1 A 23 23 ASP C C 22 179.078 178.793 0.285 1
1 81 . 4 1 1 A 23 23 ASP CA C 22 57.048 57.283 -0.235 1
1 82 . 4 1 1 A 23 23 ASP CB C 22 40.154 40.087 0.067 1
1 83 . 4 1 1 A 23 23 ASP N N 22 116.876 118.426 -1.550 1
1 84 . 4 1 1 A 24 24 ALA H H 23 7.651 7.735 -0.084 1
1 85 . 4 1 1 A 24 24 ALA HA H 23 3.785 4.008 -0.223 1
1 89 . 4 1 1 A 24 24 ALA C C 23 179.577 179.764 -0.187 1
1 90 . 4 1 1 A 24 24 ALA CA C 23 54.341 55.193 -0.852 1
1 91 . 4 1 1 A 24 24 ALA CB C 23 17.762 18.287 -0.525 1
1 92 . 4 1 1 A 24 24 ALA N N 23 121.873 121.717 0.156 1
1 93 . 4 1 1 A 25 25 VAL H H 24 7.718 7.804 -0.086 1
1 94 . 4 1 1 A 25 25 VAL HA H 24 3.216 3.494 -0.278 1
1 102 . 4 1 1 A 25 25 VAL C C 24 177.805 178.199 -0.394 1
1 103 . 4 1 1 A 25 25 VAL CA C 24 66.789 66.838 -0.049 1
1 104 . 4 1 1 A 25 25 VAL CB C 24 31.277 31.147 0.130 1
1 107 . 4 1 1 A 25 25 VAL N N 24 117.890 118.350 -0.460 1
1 108 . 4 1 1 A 26 26 VAL H H 25 7.867 7.658 0.209 1
1 109 . 4 1 1 A 26 26 VAL HA H 25 3.274 3.448 -0.174 1
1 117 . 4 1 1 A 26 26 VAL C C 25 177.788 177.869 -0.081 1
1 118 . 4 1 1 A 26 26 VAL CA C 25 67.282 66.272 1.010 1
1 119 . 4 1 1 A 26 26 VAL CB C 25 31.266 31.367 -0.101 1
1 122 . 4 1 1 A 26 26 VAL N N 25 118.170 119.715 -1.545 1
1 123 . 4 1 1 A 27 27 GLY H H 26 7.544 7.624 -0.080 1
1 124 . 4 1 1 A 27 27 GLY HA2 H 26 3.592 3.489 0.103 1
1 125 . 4 1 1 A 27 27 GLY HA3 H 26 3.721 3.595 0.126 1
1 126 . 4 1 1 A 27 27 GLY C C 26 176.717 176.336 0.381 1
1 127 . 4 1 1 A 27 27 GLY CA C 26 47.085 47.180 -0.095 1
1 128 . 4 1 1 A 27 27 GLY N N 26 105.795 107.568 -1.773 1
1 129 . 4 1 1 A 28 28 TYR H H 27 7.625 7.503 0.122 1
1 130 . 4 1 1 A 28 28 TYR HA H 27 4.546 4.535 0.011 1
1 137 . 4 1 1 A 28 28 TYR C C 27 178.991 178.478 0.513 1
1 138 . 4 1 1 A 28 28 TYR CA C 27 58.845 59.942 -1.097 1
1 139 . 4 1 1 A 28 28 TYR CB C 27 37.602 37.353 0.249 1
1 144 . 4 1 1 A 28 28 TYR N N 27 119.933 121.683 -1.750 1
1 145 . 4 1 1 A 29 29 LEU H H 28 8.517 7.965 0.552 1
1 146 . 4 1 1 A 29 29 LEU HA H 28 3.728 3.819 -0.091 1
1 156 . 4 1 1 A 29 29 LEU CA C 28 58.281 57.941 0.340 1
1 157 . 4 1 1 A 29 29 LEU CB C 28 41.948 41.449 0.499 1
1 161 . 4 1 1 A 29 29 LEU N N 28 119.669 120.830 -1.161 1
1 162 . 4 1 1 A 30 30 GLU H H 29 8.072 8.007 0.065 1
1 163 . 4 1 1 A 30 30 GLU HA H 29 3.722 3.908 -0.186 1
1 168 . 4 1 1 A 30 30 GLU C C 29 177.731 179.200 -1.469 1
1 169 . 4 1 1 A 30 30 GLU CA C 29 59.763 59.825 -0.062 1
1 170 . 4 1 1 A 30 30 GLU CB C 29 28.844 29.100 -0.256 1
1 172 . 4 1 1 A 30 30 GLU N N 29 117.666 117.741 -0.075 1
1 173 . 4 1 1 A 31 31 ASP H H 30 7.243 7.914 -0.671 1
1 174 . 4 1 1 A 31 31 ASP HA H 30 4.297 4.386 -0.089 1
1 177 . 4 1 1 A 31 31 ASP CA C 30 56.953 57.153 -0.200 1
1 178 . 4 1 1 A 31 31 ASP CB C 30 40.730 41.895 -1.165 1
1 179 . 4 1 1 A 31 31 ASP N N 30 116.720 119.201 -2.481 1
1 180 . 4 1 1 A 32 32 ILE H H 31 7.940 7.206 0.734 1
1 181 . 4 1 1 A 32 32 ILE HA H 31 3.640 3.773 -0.133 1
1 191 . 4 1 1 A 32 32 ILE C C 31 177.980 178.155 -0.175 1
1 192 . 4 1 1 A 32 32 ILE CA C 31 64.692 63.877 0.815 1
1 193 . 4 1 1 A 32 32 ILE CB C 31 38.938 37.568 1.370 1
1 197 . 4 1 1 A 32 32 ILE N N 31 119.728 117.265 2.463 1
1 198 . 4 1 1 A 33 33 ILE H H 32 7.984 7.876 0.108 1
1 199 . 4 1 1 A 33 33 ILE HA H 32 3.598 3.333 0.265 1
1 209 . 4 1 1 A 33 33 ILE C C 32 176.723 177.007 -0.284 1
1 210 . 4 1 1 A 33 33 ILE CA C 32 63.241 64.685 -1.444 1
1 211 . 4 1 1 A 33 33 ILE CB C 32 37.580 37.975 -0.395 1
1 215 . 4 1 1 A 33 33 ILE N N 32 113.919 120.400 -6.481 1
1 216 . 4 1 1 A 34 34 MET H H 33 7.288 7.599 -0.311 1
1 217 . 4 1 1 A 34 34 MET HA H 33 4.496 4.652 -0.156 1
1 225 . 4 1 1 A 34 34 MET C C 33 176.423 175.777 0.646 1
1 226 . 4 1 1 A 34 34 MET CA C 33 54.634 54.096 0.538 1
1 227 . 4 1 1 A 34 34 MET CB C 33 31.934 31.940 -0.006 1
1 230 . 4 1 1 A 34 34 MET N N 33 115.130 116.846 -1.716 1
1 231 . 4 1 1 A 35 35 ASP H H 34 7.405 7.814 -0.409 1
1 232 . 4 1 1 A 35 35 ASP HA H 34 4.484 4.563 -0.079 1
1 235 . 4 1 1 A 35 35 ASP C C 34 177.139 176.766 0.373 1
1 236 . 4 1 1 A 35 35 ASP CA C 34 54.625 54.624 0.001 1
1 237 . 4 1 1 A 35 35 ASP CB C 34 43.554 42.631 0.923 1
1 238 . 4 1 1 A 35 35 ASP N N 34 121.814 122.446 -0.632 1
1 239 . 4 1 1 A 36 36 ASP H H 35 8.765 8.774 -0.009 1
1 240 . 4 1 1 A 36 36 ASP HA H 35 4.235 4.309 -0.074 1
1 243 . 4 1 1 A 36 36 ASP C C 35 178.320 178.593 -0.273 1
1 244 . 4 1 1 A 36 36 ASP CA C 35 57.832 58.092 -0.260 1
1 245 . 4 1 1 A 36 36 ASP CB C 35 40.914 40.420 0.494 1
1 246 . 4 1 1 A 36 36 ASP N N 35 125.883 125.177 0.706 1
1 247 . 4 1 1 A 37 37 GLU H H 36 8.905 8.242 0.663 1
1 248 . 4 1 1 A 37 37 GLU HA H 36 3.933 4.122 -0.189 1
1 253 . 4 1 1 A 37 37 GLU C C 36 179.304 178.769 0.535 1
1 254 . 4 1 1 A 37 37 GLU CA C 36 59.828 58.774 1.054 1
1 255 . 4 1 1 A 37 37 GLU CB C 36 29.380 28.691 0.689 1
1 257 . 4 1 1 A 37 37 GLU N N 36 119.077 117.647 1.430 1
1 258 . 4 1 1 A 38 38 PHE H H 37 7.460 8.562 -1.102 1
1 259 . 4 1 1 A 38 38 PHE HA H 37 3.642 4.092 -0.450 1
1 267 . 4 1 1 A 38 38 PHE C C 37 176.483 178.063 -1.580 1
1 268 . 4 1 1 A 38 38 PHE CA C 37 61.411 61.300 0.111 1
1 269 . 4 1 1 A 38 38 PHE CB C 37 39.355 39.066 0.289 1
1 275 . 4 1 1 A 38 38 PHE N N 37 119.968 121.557 -1.589 1
1 276 . 4 1 1 A 39 39 GLN H H 38 7.968 8.130 -0.162 1
1 277 . 4 1 1 A 39 39 GLN HA H 38 3.712 3.830 -0.118 1
1 284 . 4 1 1 A 39 39 GLN CA C 38 59.153 58.846 0.307 1
1 285 . 4 1 1 A 39 39 GLN CB C 38 28.213 28.596 -0.383 1
1 287 . 4 1 1 A 39 39 GLN N N 38 116.433 118.425 -1.992 1
1 289 . 4 1 1 A 40 40 LEU H H 39 7.930 7.890 0.040 1
1 290 . 4 1 1 A 40 40 LEU HA H 39 3.916 4.021 -0.105 1
1 300 . 4 1 1 A 40 40 LEU C C 39 177.731 178.068 -0.337 1
1 301 . 4 1 1 A 40 40 LEU CA C 39 57.915 58.122 -0.207 1
1 302 . 4 1 1 A 40 40 LEU CB C 39 41.989 41.647 0.342 1
1 306 . 4 1 1 A 40 40 LEU N N 39 119.505 121.902 -2.397 1
1 307 . 4 1 1 A 41 41 LEU H H 40 7.174 7.785 -0.611 1
1 308 . 4 1 1 A 41 41 LEU HA H 40 3.835 3.968 -0.133 1
1 318 . 4 1 1 A 41 41 LEU C C 40 179.738 178.429 1.309 1
1 319 . 4 1 1 A 41 41 LEU CA C 40 58.266 58.368 -0.102 1
1 320 . 4 1 1 A 41 41 LEU CB C 40 42.050 41.179 0.871 1
1 324 . 4 1 1 A 41 41 LEU N N 40 120.971 119.563 1.408 1
1 325 . 4 1 1 A 42 42 GLN H H 41 8.058 7.884 0.174 1
1 326 . 4 1 1 A 42 42 GLN HA H 41 3.556 3.727 -0.171 1
1 333 . 4 1 1 A 42 42 GLN C C 41 177.642 178.520 -0.878 1
1 334 . 4 1 1 A 42 42 GLN CA C 41 59.826 59.304 0.522 1
1 335 . 4 1 1 A 42 42 GLN CB C 41 28.762 28.090 0.672 1
1 337 . 4 1 1 A 42 42 GLN N N 41 117.899 117.910 -0.011 1
1 339 . 4 1 1 A 43 43 ARG H H 42 8.179 7.830 0.349 1
1 340 . 4 1 1 A 43 43 ARG HA H 42 3.655 4.022 -0.367 1
1 347 . 4 1 1 A 43 43 ARG C C 42 178.051 178.863 -0.812 1
1 348 . 4 1 1 A 43 43 ARG CA C 42 59.766 58.901 0.865 1
1 349 . 4 1 1 A 43 43 ARG CB C 42 29.941 29.580 0.361 1
1 352 . 4 1 1 A 43 43 ARG N N 42 119.392 118.858 0.534 1
1 353 . 4 1 1 A 44 44 ASN H H 43 8.525 8.162 0.363 1
1 354 . 4 1 1 A 44 44 ASN HA H 43 4.332 4.377 -0.045 1
1 359 . 4 1 1 A 44 44 ASN C C 43 178.150 178.381 -0.231 1
1 360 . 4 1 1 A 44 44 ASN CA C 43 55.841 56.358 -0.517 1
1 361 . 4 1 1 A 44 44 ASN CB C 43 37.632 38.212 -0.580 1
1 362 . 4 1 1 A 44 44 ASN N N 43 116.214 118.074 -1.860 1
1 364 . 4 1 1 A 45 45 PHE H H 44 7.586 7.948 -0.362 1
1 365 . 4 1 1 A 45 45 PHE HA H 44 4.132 4.268 -0.136 1
1 372 . 4 1 1 A 45 45 PHE C C 44 176.691 178.600 -1.909 1
1 373 . 4 1 1 A 45 45 PHE CA C 44 62.333 60.925 1.408 1
1 374 . 4 1 1 A 45 45 PHE CB C 44 39.449 38.812 0.637 1
1 379 . 4 1 1 A 45 45 PHE N N 44 121.501 119.140 2.361 1
1 380 . 4 1 1 A 46 46 MET H H 45 8.190 8.235 -0.045 1
1 381 . 4 1 1 A 46 46 MET HA H 45 4.060 4.252 -0.192 1
1 389 . 4 1 1 A 46 46 MET C C 45 179.754 178.133 1.621 1
1 390 . 4 1 1 A 46 46 MET CA C 45 57.742 57.951 -0.209 1
1 391 . 4 1 1 A 46 46 MET CB C 45 29.912 31.117 -1.205 1
1 394 . 4 1 1 A 46 46 MET N N 45 116.727 117.749 -1.022 1
1 395 . 4 1 1 A 47 47 ASP H H 46 8.579 8.222 0.357 1
1 396 . 4 1 1 A 47 47 ASP HA H 46 4.804 4.556 0.248 1
1 399 . 4 1 1 A 47 47 ASP C C 46 177.854 178.444 -0.590 1
1 400 . 4 1 1 A 47 47 ASP CA C 46 57.277 57.322 -0.045 1
1 401 . 4 1 1 A 47 47 ASP CB C 46 40.776 41.405 -0.629 1
1 402 . 4 1 1 A 47 47 ASP N N 46 117.798 120.586 -2.788 1
1 403 . 4 1 1 A 48 48 LYS H H 47 7.339 7.916 -0.577 1
1 404 . 4 1 1 A 48 48 LYS HA H 47 3.828 4.209 -0.381 1
1 413 . 4 1 1 A 48 48 LYS C C 47 178.812 178.777 0.035 1
1 414 . 4 1 1 A 48 48 LYS CA C 47 58.953 58.498 0.455 1
1 415 . 4 1 1 A 48 48 LYS CB C 47 32.796 32.610 0.186 1
1 419 . 4 1 1 A 48 48 LYS N N 47 117.852 119.720 -1.868 1
1 420 . 4 1 1 A 49 49 TYR H H 48 6.841 8.564 -1.723 1
1 421 . 4 1 1 A 49 49 TYR HA H 48 4.995 4.176 0.819 1
1 428 . 4 1 1 A 49 49 TYR C C 48 178.138 178.604 -0.466 1
1 429 . 4 1 1 A 49 49 TYR CA C 48 58.620 59.907 -1.287 1
1 430 . 4 1 1 A 49 49 TYR CB C 48 42.939 38.273 4.666 1
1 435 . 4 1 1 A 49 49 TYR N N 48 112.109 119.744 -7.635 1
1 436 . 4 1 1 A 50 50 TYR H H 49 8.491 7.984 0.507 1
1 437 . 4 1 1 A 50 50 TYR HA H 49 4.598 4.080 0.518 1
1 444 . 4 1 1 A 50 50 TYR C C 49 176.015 177.721 -1.706 1
1 445 . 4 1 1 A 50 50 TYR CA C 49 62.442 59.532 2.910 1
1 446 . 4 1 1 A 50 50 TYR CB C 49 36.588 36.881 -0.293 1
1 451 . 4 1 1 A 50 50 TYR N N 49 118.294 119.186 -0.892 1
1 452 . 4 1 1 A 51 51 LEU H H 50 7.512 7.520 -0.008 1
1 453 . 4 1 1 A 51 51 LEU HA H 50 3.878 3.471 0.407 1
1 463 . 4 1 1 A 51 51 LEU C C 50 178.625 178.695 -0.070 1
1 464 . 4 1 1 A 51 51 LEU CA C 50 55.994 57.225 -1.231 1
1 465 . 4 1 1 A 51 51 LEU CB C 50 40.743 41.435 -0.692 1
1 469 . 4 1 1 A 51 51 LEU N N 50 118.478 121.863 -3.385 1
1 470 . 4 1 1 A 52 52 GLU H H 51 8.042 7.833 0.209 1
1 471 . 4 1 1 A 52 52 GLU HA H 51 4.197 3.923 0.274 1
1 476 . 4 1 1 A 52 52 GLU C C 51 177.629 177.664 -0.035 1
1 477 . 4 1 1 A 52 52 GLU CA C 51 56.141 59.487 -3.346 1
1 478 . 4 1 1 A 52 52 GLU CB C 51 29.162 29.173 -0.011 1
1 480 . 4 1 1 A 52 52 GLU N N 51 115.067 117.999 -2.932 1
1 481 . 4 1 1 A 53 53 PHE H H 52 7.465 7.867 -0.402 1
1 482 . 4 1 1 A 53 53 PHE HA H 52 4.431 4.547 -0.116 1
1 490 . 4 1 1 A 53 53 PHE C C 52 174.325 174.708 -0.383 1
1 491 . 4 1 1 A 53 53 PHE CA C 52 58.986 57.222 1.764 1
1 492 . 4 1 1 A 53 53 PHE CB C 52 40.183 37.704 2.479 1
1 498 . 4 1 1 A 53 53 PHE N N 52 116.768 119.039 -2.271 1
1 499 . 4 1 1 A 54 54 GLU H H 53 7.484 8.453 -0.969 1
1 500 . 4 1 1 A 54 54 GLU HA H 53 4.583 4.703 -0.120 1
1 505 . 4 1 1 A 54 54 GLU C C 53 175.722 176.047 -0.325 1
1 506 . 4 1 1 A 54 54 GLU CA C 53 54.248 56.201 -1.953 1
1 507 . 4 1 1 A 54 54 GLU CB C 53 34.409 30.592 3.817 1
1 509 . 4 1 1 A 54 54 GLU N N 53 118.844 124.707 -5.863 1
1 510 . 4 1 1 A 55 55 ASP H H 54 9.008 8.603 0.405 1
1 511 . 4 1 1 A 55 55 ASP HA H 54 4.735 4.816 -0.081 1
1 514 . 4 1 1 A 55 55 ASP C C 54 175.421 175.755 -0.334 1
1 515 . 4 1 1 A 55 55 ASP CA C 54 52.888 53.931 -1.043 1
1 516 . 4 1 1 A 55 55 ASP CB C 54 38.894 39.829 -0.935 1
1 517 . 4 1 1 A 55 55 ASP N N 54 123.654 123.727 -0.073 1
1 518 . 4 1 1 A 56 56 THR H H 55 7.819 8.150 -0.331 1
1 519 . 4 1 1 A 56 56 THR HA H 55 4.574 4.761 -0.187 1
1 524 . 4 1 1 A 56 56 THR C C 55 174.096 174.579 -0.483 1
1 525 . 4 1 1 A 56 56 THR CA C 55 59.172 60.289 -1.117 1
1 526 . 4 1 1 A 56 56 THR CB C 55 71.889 71.829 0.060 1
1 528 . 4 1 1 A 56 56 THR N N 55 112.015 113.833 -1.818 1
1 529 . 4 1 1 A 57 57 GLU H H 56 8.527 8.862 -0.335 1
1 530 . 4 1 1 A 57 57 GLU HA H 56 4.217 4.359 -0.142 1
1 535 . 4 1 1 A 57 57 GLU C C 56 177.042 177.057 -0.015 1
1 536 . 4 1 1 A 57 57 GLU CA C 56 56.869 57.302 -0.433 1
1 537 . 4 1 1 A 57 57 GLU CB C 56 29.731 30.535 -0.804 1
1 539 . 4 1 1 A 57 57 GLU N N 56 117.531 118.811 -1.280 1
1 540 . 4 1 1 A 58 58 GLU H H 57 7.587 8.038 -0.451 1
1 541 . 4 1 1 A 58 58 GLU HA H 57 3.941 4.446 -0.505 1
1 546 . 4 1 1 A 58 58 GLU C C 57 176.849 176.290 0.559 1
1 547 . 4 1 1 A 58 58 GLU CA C 57 56.924 56.829 0.095 1
1 548 . 4 1 1 A 58 58 GLU CB C 57 30.251 30.439 -0.188 1
1 550 . 4 1 1 A 58 58 GLU N N 57 119.183 118.221 0.962 1
1 551 . 4 1 1 A 59 59 ASN H H 58 9.120 8.751 0.369 1
1 552 . 4 1 1 A 59 59 ASN HA H 58 4.922 5.360 -0.438 1
1 557 . 4 1 1 A 59 59 ASN C C 58 174.254 173.334 0.920 1
1 558 . 4 1 1 A 59 59 ASN CA C 58 51.956 51.270 0.686 1
1 559 . 4 1 1 A 59 59 ASN CB C 58 37.404 42.950 -5.546 1
1 560 . 4 1 1 A 59 59 ASN N N 58 126.767 117.661 9.106 1
1 562 . 4 1 1 A 60 60 LYS H H 59 5.892 8.499 -2.607 1
1 563 . 4 1 1 A 60 60 LYS HA H 59 3.798 4.893 -1.095 1
1 572 . 4 1 1 A 60 60 LYS C C 59 177.908 177.061 0.847 1
1 573 . 4 1 1 A 60 60 LYS CA C 59 56.623 54.555 2.068 1
1 574 . 4 1 1 A 60 60 LYS CB C 59 32.279 36.341 -4.062 1
1 578 . 4 1 1 A 60 60 LYS N N 59 121.527 119.319 2.208 1
1 579 . 4 1 1 A 61 61 LEU H H 60 8.473 8.675 -0.202 1
1 580 . 4 1 1 A 61 61 LEU HA H 60 3.891 4.226 -0.335 1
1 590 . 4 1 1 A 61 61 LEU C C 60 179.843 178.102 1.741 1
1 591 . 4 1 1 A 61 61 LEU CA C 60 58.301 57.281 1.020 1
1 592 . 4 1 1 A 61 61 LEU CB C 60 41.305 42.163 -0.858 1
1 596 . 4 1 1 A 61 61 LEU N N 60 125.639 125.034 0.605 1
1 597 . 4 1 1 A 62 62 ILE H H 61 7.698 7.893 -0.195 1
1 598 . 4 1 1 A 62 62 ILE HA H 61 3.952 3.937 0.015 1
1 608 . 4 1 1 A 62 62 ILE C C 61 175.392 177.027 -1.635 1
1 609 . 4 1 1 A 62 62 ILE CA C 61 61.743 63.370 -1.627 1
1 610 . 4 1 1 A 62 62 ILE CB C 61 39.108 37.790 1.318 1
1 614 . 4 1 1 A 62 62 ILE N N 61 114.111 118.793 -4.682 1
1 615 . 4 1 1 A 63 63 TYR H H 62 7.273 7.902 -0.629 1
1 616 . 4 1 1 A 63 63 TYR HA H 62 4.343 4.296 0.047 1
1 623 . 4 1 1 A 63 63 TYR C C 62 178.264 178.596 -0.332 1
1 624 . 4 1 1 A 63 63 TYR CA C 62 57.231 61.152 -3.921 1
1 625 . 4 1 1 A 63 63 TYR CB C 62 36.332 37.457 -1.125 1
1 630 . 4 1 1 A 63 63 TYR N N 62 117.689 121.310 -3.621 1
1 631 . 4 1 1 A 64 64 THR H H 63 7.747 8.089 -0.342 1
1 632 . 4 1 1 A 64 64 THR HA H 63 4.266 4.225 0.041 1
1 637 . 4 1 1 A 64 64 THR CA C 63 69.362 67.558 1.804 1
1 638 . 4 1 1 A 64 64 THR CB C 63 66.962 67.565 -0.603 1
1 640 . 4 1 1 A 64 64 THR N N 63 113.755 116.268 -2.513 1
1 641 . 4 1 1 A 65 65 PRO HA H 64 4.372 4.375 -0.003 1
1 648 . 4 1 1 A 65 65 PRO C C 64 179.913 179.366 0.547 1
1 649 . 4 1 1 A 65 65 PRO CA C 64 66.011 66.006 0.005 1
1 650 . 4 1 1 A 65 65 PRO CB C 64 30.642 30.686 -0.044 1
1 653 . 4 1 1 A 66 66 ILE H H 65 7.377 7.319 0.058 1
1 654 . 4 1 1 A 66 66 ILE HA H 65 3.530 3.882 -0.352 1
1 664 . 4 1 1 A 66 66 ILE C C 65 177.543 178.051 -0.508 1
1 665 . 4 1 1 A 66 66 ILE CA C 65 66.647 64.193 2.454 1
1 666 . 4 1 1 A 66 66 ILE CB C 65 38.029 37.597 0.432 1
1 670 . 4 1 1 A 66 66 ILE N N 65 118.353 116.644 1.709 1
1 671 . 4 1 1 A 67 67 PHE H H 66 8.480 8.408 0.072 1
1 672 . 4 1 1 A 67 67 PHE HA H 66 4.115 4.360 -0.245 1
1 680 . 4 1 1 A 67 67 PHE C C 66 177.293 178.621 -1.328 1
1 681 . 4 1 1 A 67 67 PHE CA C 66 59.570 62.030 -2.460 1
1 682 . 4 1 1 A 67 67 PHE CB C 66 38.865 39.698 -0.833 1
1 688 . 4 1 1 A 67 67 PHE N N 66 122.420 120.386 2.034 1
1 689 . 4 1 1 A 68 68 ASN H H 67 8.595 8.278 0.317 1
1 690 . 4 1 1 A 68 68 ASN HA H 67 4.211 4.530 -0.319 1
1 695 . 4 1 1 A 68 68 ASN C C 67 178.697 178.152 0.545 1
1 696 . 4 1 1 A 68 68 ASN CA C 67 56.056 56.139 -0.083 1
1 697 . 4 1 1 A 68 68 ASN CB C 67 37.704 37.908 -0.204 1
1 698 . 4 1 1 A 68 68 ASN N N 67 115.573 117.312 -1.739 1
1 700 . 4 1 1 A 69 69 GLU H H 68 8.414 8.048 0.366 1
1 701 . 4 1 1 A 69 69 GLU HA H 68 4.102 4.160 -0.058 1
1 706 . 4 1 1 A 69 69 GLU C C 68 177.880 178.794 -0.914 1
1 707 . 4 1 1 A 69 69 GLU CA C 68 59.399 59.203 0.196 1
1 708 . 4 1 1 A 69 69 GLU CB C 68 29.855 29.169 0.686 1
1 710 . 4 1 1 A 69 69 GLU N N 68 123.510 119.885 3.625 1
1 711 . 4 1 1 A 70 70 TYR H H 69 8.659 8.079 0.580 1
1 712 . 4 1 1 A 70 70 TYR HA H 69 3.362 4.104 -0.742 1
1 719 . 4 1 1 A 70 70 TYR C C 69 178.143 176.985 1.158 1
1 720 . 4 1 1 A 70 70 TYR CA C 69 60.686 61.296 -0.610 1
1 721 . 4 1 1 A 70 70 TYR CB C 69 38.560 38.730 -0.170 1
1 726 . 4 1 1 A 70 70 TYR N N 69 122.130 121.001 1.129 1
1 727 . 4 1 1 A 71 71 ILE H H 70 8.031 7.751 0.280 1
1 728 . 4 1 1 A 71 71 ILE HA H 70 3.265 3.694 -0.429 1
1 738 . 4 1 1 A 71 71 ILE C C 70 178.056 177.781 0.275 1
1 739 . 4 1 1 A 71 71 ILE CA C 70 63.756 63.983 -0.227 1
1 740 . 4 1 1 A 71 71 ILE CB C 70 37.321 36.540 0.781 1
1 744 . 4 1 1 A 71 71 ILE N N 70 118.906 120.423 -1.517 1
1 745 . 4 1 1 A 72 72 SER H H 71 7.803 7.748 0.055 1
1 746 . 4 1 1 A 72 72 SER HA H 71 4.029 4.272 -0.243 1
1 749 . 4 1 1 A 72 72 SER CA C 71 61.380 61.171 0.209 1
1 750 . 4 1 1 A 72 72 SER CB C 71 63.288 63.106 0.182 1
1 751 . 4 1 1 A 72 72 SER N N 71 113.735 117.015 -3.280 1
1 752 . 4 1 1 A 73 73 LEU H H 72 7.952 7.896 0.056 1
1 753 . 4 1 1 A 73 73 LEU HA H 72 4.418 4.114 0.304 1
1 763 . 4 1 1 A 73 73 LEU C C 72 177.767 178.236 -0.469 1
1 764 . 4 1 1 A 73 73 LEU CA C 72 56.543 57.415 -0.872 1
1 765 . 4 1 1 A 73 73 LEU CB C 72 44.517 41.792 2.725 1
1 769 . 4 1 1 A 73 73 LEU N N 72 119.411 122.430 -3.019 1
1 770 . 4 1 1 A 74 74 VAL H H 73 8.021 7.649 0.372 1
1 771 . 4 1 1 A 74 74 VAL HA H 73 3.532 3.359 0.173 1
1 779 . 4 1 1 A 74 74 VAL C C 73 177.126 177.988 -0.862 1
1 780 . 4 1 1 A 74 74 VAL CA C 73 66.250 66.371 -0.121 1
1 781 . 4 1 1 A 74 74 VAL CB C 73 31.212 31.186 0.026 1
1 784 . 4 1 1 A 74 74 VAL N N 73 118.747 119.263 -0.516 1
1 785 . 4 1 1 A 75 75 GLU H H 74 7.232 7.964 -0.732 1
1 786 . 4 1 1 A 75 75 GLU HA H 74 3.013 4.044 -1.031 1
1 791 . 4 1 1 A 75 75 GLU C C 74 178.804 179.034 -0.230 1
1 792 . 4 1 1 A 75 75 GLU CA C 74 60.536 59.912 0.624 1
1 793 . 4 1 1 A 75 75 GLU CB C 74 27.009 28.995 -1.986 1
1 795 . 4 1 1 A 75 75 GLU N N 74 118.660 119.769 -1.109 1
1 796 . 4 1 1 A 76 76 LYS H H 75 7.051 7.499 -0.448 1
1 797 . 4 1 1 A 76 76 LYS HA H 75 3.765 3.987 -0.222 1
1 806 . 4 1 1 A 76 76 LYS C C 75 177.765 178.330 -0.565 1
1 807 . 4 1 1 A 76 76 LYS CA C 75 58.357 58.947 -0.590 1
1 808 . 4 1 1 A 76 76 LYS CB C 75 31.939 31.962 -0.023 1
1 812 . 4 1 1 A 76 76 LYS N N 75 116.112 119.773 -3.661 1
1 813 . 4 1 1 A 77 77 TYR H H 76 7.067 7.602 -0.535 1
1 814 . 4 1 1 A 77 77 TYR HA H 76 4.036 4.209 -0.173 1
1 821 . 4 1 1 A 77 77 TYR C C 76 177.752 177.093 0.659 1
1 822 . 4 1 1 A 77 77 TYR CA C 76 61.820 61.233 0.587 1
1 823 . 4 1 1 A 77 77 TYR CB C 76 38.480 38.636 -0.156 1
1 828 . 4 1 1 A 77 77 TYR N N 76 118.434 120.724 -2.290 1
1 829 . 4 1 1 A 78 78 ILE H H 77 7.554 8.354 -0.800 1
1 830 . 4 1 1 A 78 78 ILE HA H 77 3.159 3.527 -0.368 1
1 840 . 4 1 1 A 78 78 ILE C C 77 177.341 177.946 -0.605 1
1 841 . 4 1 1 A 78 78 ILE CA C 77 65.177 65.303 -0.126 1
1 842 . 4 1 1 A 78 78 ILE CB C 77 37.339 38.015 -0.676 1
1 846 . 4 1 1 A 78 78 ILE N N 77 117.672 121.357 -3.685 1
1 847 . 4 1 1 A 79 79 GLU H H 78 8.296 7.978 0.318 1
1 848 . 4 1 1 A 79 79 GLU HA H 78 3.557 3.877 -0.320 1
1 853 . 4 1 1 A 79 79 GLU C C 78 177.742 178.903 -1.161 1
1 854 . 4 1 1 A 79 79 GLU CA C 78 60.847 60.011 0.836 1
1 855 . 4 1 1 A 79 79 GLU CB C 78 29.594 29.156 0.438 1
1 857 . 4 1 1 A 79 79 GLU N N 78 118.701 121.038 -2.337 1
1 858 . 4 1 1 A 80 80 GLU H H 79 8.330 8.168 0.162 1
1 859 . 4 1 1 A 80 80 GLU HA H 79 3.774 4.021 -0.247 1
1 864 . 4 1 1 A 80 80 GLU C C 79 179.926 179.318 0.608 1
1 865 . 4 1 1 A 80 80 GLU CA C 79 59.581 58.993 0.588 1
1 866 . 4 1 1 A 80 80 GLU CB C 79 29.062 29.236 -0.174 1
1 868 . 4 1 1 A 80 80 GLU N N 79 116.767 118.218 -1.451 1
1 869 . 4 1 1 A 81 81 GLN H H 80 7.634 7.757 -0.123 1
1 870 . 4 1 1 A 81 81 GLN HA H 80 3.605 3.867 -0.262 1
1 877 . 4 1 1 A 81 81 GLN C C 80 179.681 178.620 1.061 1
1 878 . 4 1 1 A 81 81 GLN CA C 80 57.765 58.567 -0.802 1
1 879 . 4 1 1 A 81 81 GLN CB C 80 28.079 28.033 0.046 1
1 881 . 4 1 1 A 81 81 GLN N N 80 116.325 118.654 -2.329 1
1 883 . 4 1 1 A 82 82 LEU H H 81 8.156 7.532 0.624 1
1 884 . 4 1 1 A 82 82 LEU HA H 81 3.536 3.762 -0.226 1
1 894 . 4 1 1 A 82 82 LEU C C 81 178.945 179.520 -0.575 1
1 895 . 4 1 1 A 82 82 LEU CA C 81 57.761 56.831 0.930 1
1 896 . 4 1 1 A 82 82 LEU CB C 81 40.961 40.986 -0.025 1
1 900 . 4 1 1 A 82 82 LEU N N 81 121.546 120.261 1.285 1
1 901 . 4 1 1 A 83 83 LEU H H 82 8.326 8.021 0.305 1
1 902 . 4 1 1 A 83 83 LEU HA H 82 4.198 4.226 -0.028 1
1 912 . 4 1 1 A 83 83 LEU C C 82 178.631 179.379 -0.748 1
1 913 . 4 1 1 A 83 83 LEU CA C 82 57.016 56.995 0.021 1
1 914 . 4 1 1 A 83 83 LEU CB C 82 42.182 40.970 1.212 1
1 918 . 4 1 1 A 83 83 LEU N N 82 120.426 119.458 0.968 1
1 919 . 4 1 1 A 84 84 GLN H H 83 6.992 7.626 -0.634 1
1 920 . 4 1 1 A 84 84 GLN HA H 83 3.877 4.019 -0.142 1
1 927 . 4 1 1 A 84 84 GLN C C 83 177.008 176.652 0.356 1
1 928 . 4 1 1 A 84 84 GLN CA C 83 57.543 58.410 -0.867 1
1 929 . 4 1 1 A 84 84 GLN CB C 83 28.688 28.750 -0.062 1
1 931 . 4 1 1 A 84 84 GLN N N 83 114.001 117.572 -3.571 1
1 933 . 4 1 1 A 85 85 ARG H H 84 7.072 7.667 -0.595 1
1 934 . 4 1 1 A 85 85 ARG HA H 84 4.047 4.475 -0.428 1
1 942 . 4 1 1 A 85 85 ARG C C 84 175.999 175.659 0.340 1
1 943 . 4 1 1 A 85 85 ARG CA C 84 56.764 56.754 0.010 1
1 944 . 4 1 1 A 85 85 ARG CB C 84 32.044 32.205 -0.161 1
1 947 . 4 1 1 A 85 85 ARG N N 84 115.827 119.023 -3.196 1
1 949 . 4 1 1 A 86 86 ILE H H 85 8.238 7.837 0.401 1
1 950 . 4 1 1 A 86 86 ILE HA H 85 4.389 4.495 -0.106 1
1 960 . 4 1 1 A 86 86 ILE CA C 85 58.007 57.822 0.185 1
1 961 . 4 1 1 A 86 86 ILE CB C 85 39.604 38.790 0.814 1
1 965 . 4 1 1 A 86 86 ILE N N 85 119.285 118.025 1.260 1
1 966 . 4 1 1 A 87 87 PRO HA H 86 4.392 4.521 -0.129 1
1 973 . 4 1 1 A 87 87 PRO C C 86 177.622 176.614 1.008 1
1 974 . 4 1 1 A 87 87 PRO CA C 86 64.665 64.285 0.380 1
1 975 . 4 1 1 A 87 87 PRO CB C 86 32.020 31.669 0.351 1
1 978 . 4 1 1 A 88 88 GLU H H 87 8.312 8.177 0.135 1
1 979 . 4 1 1 A 88 88 GLU HA H 87 4.208 4.548 -0.340 1
1 984 . 4 1 1 A 88 88 GLU C C 87 175.554 175.837 -0.283 1
1 985 . 4 1 1 A 88 88 GLU CA C 87 56.045 56.261 -0.216 1
1 986 . 4 1 1 A 88 88 GLU CB C 87 28.654 30.452 -1.798 1
1 988 . 4 1 1 A 88 88 GLU N N 87 114.256 116.893 -2.637 1
1 989 . 4 1 1 A 89 89 PHE H H 88 7.946 7.677 0.269 1
1 990 . 4 1 1 A 89 89 PHE HA H 88 3.993 4.518 -0.525 1
1 998 . 4 1 1 A 89 89 PHE C C 88 173.460 174.361 -0.901 1
1 999 . 4 1 1 A 89 89 PHE CA C 88 60.119 58.995 1.124 1
1 1000 . 4 1 1 A 89 89 PHE CB C 88 39.994 39.900 0.094 1
1 1006 . 4 1 1 A 89 89 PHE N N 88 121.550 123.086 -1.536 1
1 1007 . 4 1 1 A 90 90 ASN H H 89 7.266 7.763 -0.497 1
1 1008 . 4 1 1 A 90 90 ASN HA H 89 4.454 4.985 -0.531 1
1 1013 . 4 1 1 A 90 90 ASN C C 89 173.921 175.166 -1.245 1
1 1014 . 4 1 1 A 90 90 ASN CA C 89 51.839 51.282 0.557 1
1 1015 . 4 1 1 A 90 90 ASN CB C 89 40.674 39.466 1.208 1
1 1016 . 4 1 1 A 90 90 ASN N N 89 125.344 124.775 0.569 1
1 1018 . 4 1 1 A 91 91 MET H H 90 8.968 8.807 0.161 1
1 1019 . 4 1 1 A 91 91 MET HA H 90 4.049 4.060 -0.011 1
1 1027 . 4 1 1 A 91 91 MET C C 90 177.475 178.042 -0.567 1
1 1028 . 4 1 1 A 91 91 MET CA C 90 57.758 58.251 -0.493 1
1 1029 . 4 1 1 A 91 91 MET CB C 90 32.250 32.177 0.073 1
1 1032 . 4 1 1 A 91 91 MET N N 90 127.052 125.281 1.771 1
1 1033 . 4 1 1 A 92 92 ALA H H 91 8.292 8.029 0.263 1
1 1034 . 4 1 1 A 92 92 ALA HA H 91 4.059 4.153 -0.094 1
1 1038 . 4 1 1 A 92 92 ALA C C 91 180.412 179.486 0.926 1
1 1039 . 4 1 1 A 92 92 ALA CA C 91 55.368 54.950 0.418 1
1 1040 . 4 1 1 A 92 92 ALA CB C 91 17.527 18.431 -0.904 1
1 1041 . 4 1 1 A 92 92 ALA N N 91 123.752 121.619 2.133 1
1 1042 . 4 1 1 A 93 93 ALA H H 92 7.931 8.087 -0.156 1
1 1043 . 4 1 1 A 93 93 ALA HA H 92 4.054 4.086 -0.032 1
1 1047 . 4 1 1 A 93 93 ALA C C 92 180.482 179.903 0.579 1
1 1048 . 4 1 1 A 93 93 ALA CA C 92 54.614 54.876 -0.262 1
1 1049 . 4 1 1 A 93 93 ALA CB C 92 18.098 18.095 0.003 1
1 1050 . 4 1 1 A 93 93 ALA N N 92 121.158 120.400 0.758 1
1 1051 . 4 1 1 A 94 94 PHE H H 93 8.110 7.873 0.237 1
1 1052 . 4 1 1 A 94 94 PHE HA H 93 4.304 4.166 0.138 1
1 1060 . 4 1 1 A 94 94 PHE C C 93 177.350 177.434 -0.084 1
1 1061 . 4 1 1 A 94 94 PHE CA C 93 61.641 61.422 0.219 1
1 1062 . 4 1 1 A 94 94 PHE CB C 93 40.014 39.319 0.695 1
1 1068 . 4 1 1 A 94 94 PHE N N 93 119.807 119.677 0.130 1
1 1069 . 4 1 1 A 95 95 THR H H 94 8.726 8.104 0.622 1
1 1070 . 4 1 1 A 95 95 THR HA H 94 3.569 3.986 -0.417 1
1 1075 . 4 1 1 A 95 95 THR C C 94 176.932 176.978 -0.046 1
1 1076 . 4 1 1 A 95 95 THR CA C 94 66.833 65.545 1.288 1
1 1077 . 4 1 1 A 95 95 THR CB C 94 68.445 68.331 0.114 1
1 1079 . 4 1 1 A 95 95 THR N N 94 113.074 112.455 0.619 1
1 1080 . 4 1 1 A 96 96 THR H H 95 7.657 7.897 -0.240 1
1 1081 . 4 1 1 A 96 96 THR HA H 95 3.945 4.050 -0.105 1
1 1086 . 4 1 1 A 96 96 THR C C 95 176.386 176.412 -0.026 1
1 1087 . 4 1 1 A 96 96 THR CA C 95 66.550 66.121 0.429 1
1 1088 . 4 1 1 A 96 96 THR CB C 95 68.583 68.760 -0.177 1
1 1090 . 4 1 1 A 96 96 THR N N 95 117.927 116.572 1.355 1
1 1091 . 4 1 1 A 97 97 THR H H 96 7.699 7.824 -0.125 1
1 1092 . 4 1 1 A 97 97 THR HA H 96 3.905 4.048 -0.143 1
1 1097 . 4 1 1 A 97 97 THR C C 96 176.572 176.341 0.231 1
1 1098 . 4 1 1 A 97 97 THR CA C 96 65.979 66.707 -0.728 1
1 1099 . 4 1 1 A 97 97 THR CB C 96 68.553 68.207 0.346 1
1 1101 . 4 1 1 A 97 97 THR N N 96 118.518 116.750 1.768 1
1 1102 . 4 1 1 A 98 98 LEU H H 97 8.304 8.130 0.174 1
1 1103 . 4 1 1 A 98 98 LEU HA H 97 3.725 3.823 -0.098 1
1 1113 . 4 1 1 A 98 98 LEU C C 97 178.490 178.783 -0.293 1
1 1114 . 4 1 1 A 98 98 LEU CA C 97 58.517 58.079 0.438 1
1 1115 . 4 1 1 A 98 98 LEU CB C 97 41.697 41.111 0.586 1
1 1119 . 4 1 1 A 98 98 LEU N N 97 122.882 122.025 0.857 1
1 1120 . 4 1 1 A 99 99 GLN H H 98 7.639 7.945 -0.306 1
1 1121 . 4 1 1 A 99 99 GLN HA H 98 3.927 4.080 -0.153 1
1 1128 . 4 1 1 A 99 99 GLN C C 98 178.068 178.288 -0.220 1
1 1129 . 4 1 1 A 99 99 GLN CA C 98 58.735 58.980 -0.245 1
1 1130 . 4 1 1 A 99 99 GLN CB C 98 27.986 28.242 -0.256 1
1 1132 . 4 1 1 A 99 99 GLN N N 98 114.302 118.089 -3.787 1
1 1134 . 4 1 1 A 100 100 HIS H H 99 7.575 7.527 0.048 1
1 1135 . 4 1 1 A 100 100 HIS HA H 99 4.524 4.434 0.090 1
1 1139 . 4 1 1 A 100 100 HIS C C 99 174.789 177.578 -2.789 1
1 1140 . 4 1 1 A 100 100 HIS CA C 99 56.154 59.563 -3.409 1
1 1141 . 4 1 1 A 100 100 HIS CB C 99 28.946 30.709 -1.763 1
1 1143 . 4 1 1 A 100 100 HIS N N 99 114.778 118.754 -3.976 1
1 1144 . 4 1 1 A 101 101 HIS H H 100 7.773 8.130 -0.357 1
1 1145 . 4 1 1 A 101 101 HIS HA H 100 4.704 4.396 0.308 1
1 1149 . 4 1 1 A 101 101 HIS C C 100 174.818 177.177 -2.359 1
1 1150 . 4 1 1 A 101 101 HIS CA C 100 54.830 58.683 -3.853 1
1 1151 . 4 1 1 A 101 101 HIS CB C 100 29.749 28.596 1.153 1
1 1153 . 4 1 1 A 101 101 HIS N N 100 117.397 117.226 0.171 1
1 1154 . 4 1 1 A 102 102 LYS H H 101 7.324 8.186 -0.862 1
1 1155 . 4 1 1 A 102 102 LYS HA H 101 3.611 4.122 -0.511 1
1 1164 . 4 1 1 A 102 102 LYS C C 101 176.823 177.865 -1.042 1
1 1165 . 4 1 1 A 102 102 LYS CA C 101 59.915 58.915 1.000 1
1 1166 . 4 1 1 A 102 102 LYS CB C 101 32.825 32.131 0.694 1
1 1170 . 4 1 1 A 102 102 LYS N N 101 120.533 122.308 -1.775 1
1 1171 . 4 1 1 A 103 103 ASP H H 102 8.361 7.670 0.691 1
1 1172 . 4 1 1 A 103 103 ASP HA H 102 4.421 4.453 -0.032 1
1 1175 . 4 1 1 A 103 103 ASP C C 102 176.793 176.677 0.116 1
1 1176 . 4 1 1 A 103 103 ASP CA C 102 55.500 56.115 -0.615 1
1 1177 . 4 1 1 A 103 103 ASP CB C 102 40.178 40.625 -0.447 1
1 1178 . 4 1 1 A 103 103 ASP N N 102 114.814 117.893 -3.079 1
1 1179 . 4 1 1 A 104 104 GLU H H 103 7.858 8.275 -0.417 1
1 1180 . 4 1 1 A 104 104 GLU HA H 103 4.339 4.666 -0.327 1
1 1183 . 4 1 1 A 104 104 GLU C C 103 175.777 176.567 -0.790 1
1 1184 . 4 1 1 A 104 104 GLU CA C 103 56.356 58.041 -1.685 1
1 1185 . 4 1 1 A 104 104 GLU CB C 103 31.293 32.071 -0.778 1
1 1186 . 4 1 1 A 104 104 GLU N N 103 116.826 118.709 -1.883 1
1 1187 . 4 1 1 A 105 105 VAL H H 104 7.201 7.838 -0.637 1
1 1188 . 4 1 1 A 105 105 VAL HA H 104 4.296 4.143 0.153 1
1 1196 . 4 1 1 A 105 105 VAL C C 104 174.482 175.624 -1.142 1
1 1197 . 4 1 1 A 105 105 VAL CA C 104 60.370 62.757 -2.387 1
1 1198 . 4 1 1 A 105 105 VAL CB C 104 34.341 32.961 1.380 1
1 1201 . 4 1 1 A 105 105 VAL N N 104 116.422 119.830 -3.408 1
1 1202 . 4 1 1 A 106 106 ALA H H 105 8.487 8.466 0.021 1
1 1203 . 4 1 1 A 106 106 ALA HA H 105 4.172 4.389 -0.217 1
1 1207 . 4 1 1 A 106 106 ALA C C 105 179.030 178.665 0.365 1
1 1208 . 4 1 1 A 106 106 ALA CA C 105 52.966 52.324 0.642 1
1 1209 . 4 1 1 A 106 106 ALA CB C 105 19.371 18.951 0.420 1
1 1210 . 4 1 1 A 106 106 ALA N N 105 128.313 128.755 -0.442 1
1 1211 . 4 1 1 A 107 107 GLY H H 106 8.738 8.782 -0.044 1
1 1212 . 4 1 1 A 107 107 GLY HA2 H 106 3.773 3.874 -0.101 1
1 1213 . 4 1 1 A 107 107 GLY HA3 H 106 3.998 3.939 0.059 1
1 1214 . 4 1 1 A 107 107 GLY C C 106 174.958 175.548 -0.590 1
1 1215 . 4 1 1 A 107 107 GLY CA C 106 47.449 47.148 0.301 1
1 1216 . 4 1 1 A 107 107 GLY N N 106 110.612 110.779 -0.167 1
1 1217 . 4 1 1 A 108 108 ASP H H 107 8.535 8.325 0.210 1
1 1218 . 4 1 1 A 108 108 ASP HA H 107 4.333 4.378 -0.045 1
1 1221 . 4 1 1 A 108 108 ASP C C 107 179.133 178.593 0.540 1
1 1222 . 4 1 1 A 108 108 ASP CA C 107 56.721 56.983 -0.262 1
1 1223 . 4 1 1 A 108 108 ASP CB C 107 39.336 41.502 -2.166 1
1 1224 . 4 1 1 A 108 108 ASP N N 107 117.474 121.733 -4.259 1
1 1225 . 4 1 1 A 109 109 ILE H H 108 7.459 7.908 -0.449 1
1 1226 . 4 1 1 A 109 109 ILE HA H 108 3.688 3.837 -0.149 1
1 1236 . 4 1 1 A 109 109 ILE C C 108 176.735 178.518 -1.783 1
1 1237 . 4 1 1 A 109 109 ILE CA C 108 63.474 65.350 -1.876 1
1 1238 . 4 1 1 A 109 109 ILE CB C 108 37.340 37.724 -0.384 1
1 1242 . 4 1 1 A 109 109 ILE N N 108 119.609 119.669 -0.060 1
1 1243 . 4 1 1 A 110 110 PHE H H 109 7.920 8.339 -0.419 1
1 1244 . 4 1 1 A 110 110 PHE HA H 109 3.759 4.089 -0.330 1
1 1252 . 4 1 1 A 110 110 PHE C C 109 177.132 177.301 -0.169 1
1 1253 . 4 1 1 A 110 110 PHE CA C 109 62.766 61.234 1.532 1
1 1254 . 4 1 1 A 110 110 PHE CB C 109 39.752 39.334 0.418 1
1 1260 . 4 1 1 A 110 110 PHE N N 109 120.906 120.397 0.509 1
1 1261 . 4 1 1 A 111 111 ASP H H 110 8.639 8.290 0.349 1
1 1262 . 4 1 1 A 111 111 ASP HA H 110 4.216 4.231 -0.015 1
1 1265 . 4 1 1 A 111 111 ASP C C 110 178.900 178.401 0.499 1
1 1266 . 4 1 1 A 111 111 ASP CA C 110 57.105 57.319 -0.214 1
1 1267 . 4 1 1 A 111 111 ASP CB C 110 39.697 42.043 -2.346 1
1 1268 . 4 1 1 A 111 111 ASP N N 110 117.124 118.781 -1.657 1
1 1269 . 4 1 1 A 112 112 MET H H 111 7.331 7.610 -0.279 1
1 1270 . 4 1 1 A 112 112 MET HA H 111 4.081 4.156 -0.075 1
1 1278 . 4 1 1 A 112 112 MET C C 111 179.052 178.146 0.906 1
1 1279 . 4 1 1 A 112 112 MET CA C 111 58.202 58.046 0.156 1
1 1280 . 4 1 1 A 112 112 MET CB C 111 31.827 32.390 -0.563 1
1 1283 . 4 1 1 A 112 112 MET N N 111 118.061 119.417 -1.356 1
1 1284 . 4 1 1 A 113 113 LEU H H 112 8.001 8.064 -0.063 1
1 1285 . 4 1 1 A 113 113 LEU HA H 112 3.723 3.584 0.139 1
1 1295 . 4 1 1 A 113 113 LEU C C 112 179.747 178.622 1.125 1
1 1296 . 4 1 1 A 113 113 LEU CA C 112 57.371 57.428 -0.057 1
1 1297 . 4 1 1 A 113 113 LEU CB C 112 40.671 41.158 -0.487 1
1 1301 . 4 1 1 A 113 113 LEU N N 112 120.426 119.628 0.798 1
1 1302 . 4 1 1 A 114 114 LEU H H 113 7.744 7.559 0.185 1
1 1303 . 4 1 1 A 114 114 LEU HA H 113 4.007 3.584 0.423 1
1 1313 . 4 1 1 A 114 114 LEU C C 113 179.358 178.867 0.491 1
1 1314 . 4 1 1 A 114 114 LEU CA C 113 57.202 57.401 -0.199 1
1 1315 . 4 1 1 A 114 114 LEU CB C 113 41.727 41.092 0.635 1
1 1319 . 4 1 1 A 114 114 LEU N N 113 119.584 118.582 1.002 1
1 1320 . 4 1 1 A 115 115 THR H H 114 7.353 7.681 -0.328 1
1 1321 . 4 1 1 A 115 115 THR HA H 114 4.071 4.059 0.012 1
1 1327 . 4 1 1 A 115 115 THR C C 114 173.591 176.612 -3.021 1
1 1328 . 4 1 1 A 115 115 THR CA C 114 65.332 64.759 0.573 1
1 1329 . 4 1 1 A 115 115 THR CB C 114 70.319 68.499 1.820 1
1 1331 . 4 1 1 A 115 115 THR N N 114 107.535 110.731 -3.196 1
1 1332 . 4 1 1 A 116 116 PHE H H 115 6.979 7.800 -0.821 1
1 1333 . 4 1 1 A 116 116 PHE HA H 115 5.022 4.235 0.787 1
1 1341 . 4 1 1 A 116 116 PHE C C 115 176.488 176.552 -0.064 1
1 1342 . 4 1 1 A 116 116 PHE CA C 115 55.911 60.862 -4.951 1
1 1343 . 4 1 1 A 116 116 PHE CB C 115 38.521 39.054 -0.533 1
1 1349 . 4 1 1 A 116 116 PHE N N 115 112.366 119.895 -7.529 1
1 1350 . 4 1 1 A 117 117 THR H H 116 7.564 7.577 -0.013 1
1 1351 . 4 1 1 A 117 117 THR HA H 116 4.626 4.808 -0.182 1
1 1356 . 4 1 1 A 117 117 THR C C 116 174.085 174.458 -0.373 1
1 1357 . 4 1 1 A 117 117 THR CA C 116 61.636 62.436 -0.800 1
1 1358 . 4 1 1 A 117 117 THR CB C 116 70.915 70.576 0.339 1
1 1360 . 4 1 1 A 117 117 THR N N 116 105.498 105.946 -0.448 1
1 1361 . 4 1 1 A 118 118 ASP H H 117 8.270 7.843 0.427 1
1 1362 . 4 1 1 A 118 118 ASP HA H 117 4.955 4.688 0.267 1
1 1365 . 4 1 1 A 118 118 ASP C C 117 176.328 176.421 -0.093 1
1 1366 . 4 1 1 A 118 118 ASP CA C 117 53.417 53.523 -0.106 1
1 1367 . 4 1 1 A 118 118 ASP CB C 117 43.388 40.434 2.954 1
1 1368 . 4 1 1 A 118 118 ASP N N 117 124.409 121.836 2.573 1
1 1369 . 4 1 1 A 119 119 PHE H H 118 8.973 8.796 0.177 1
1 1370 . 4 1 1 A 119 119 PHE HA H 118 3.506 4.289 -0.783 1
1 1378 . 4 1 1 A 119 119 PHE CA C 118 61.490 61.133 0.357 1
1 1379 . 4 1 1 A 119 119 PHE CB C 118 39.246 39.597 -0.351 1
1 1385 . 4 1 1 A 119 119 PHE N N 118 126.688 126.512 0.176 1
1 1386 . 4 1 1 A 120 120 LEU H H 119 8.099 8.257 -0.158 1
1 1387 . 4 1 1 A 120 120 LEU HA H 119 3.842 4.004 -0.162 1
1 1397 . 4 1 1 A 120 120 LEU C C 119 179.601 179.655 -0.054 1
1 1398 . 4 1 1 A 120 120 LEU CA C 119 58.174 57.794 0.380 1
1 1399 . 4 1 1 A 120 120 LEU CB C 119 40.315 40.833 -0.518 1
1 1403 . 4 1 1 A 120 120 LEU N N 119 117.930 119.803 -1.873 1
1 1404 . 4 1 1 A 121 121 ALA H H 120 7.729 7.948 -0.219 1
1 1405 . 4 1 1 A 121 121 ALA HA H 120 3.996 4.107 -0.111 1
1 1409 . 4 1 1 A 121 121 ALA C C 120 180.995 179.596 1.399 1
1 1410 . 4 1 1 A 121 121 ALA CA C 120 54.832 54.731 0.101 1
1 1411 . 4 1 1 A 121 121 ALA CB C 120 17.706 18.317 -0.611 1
1 1412 . 4 1 1 A 121 121 ALA N N 120 123.195 121.470 1.725 1
1 1413 . 4 1 1 A 122 122 PHE H H 121 7.943 7.844 0.099 1
1 1414 . 4 1 1 A 122 122 PHE HA H 121 3.887 3.851 0.036 1
1 1419 . 4 1 1 A 122 122 PHE C C 121 175.410 176.720 -1.310 1
1 1420 . 4 1 1 A 122 122 PHE CA C 121 61.075 60.727 0.348 1
1 1421 . 4 1 1 A 122 122 PHE CB C 121 38.115 38.823 -0.708 1
1 1424 . 4 1 1 A 122 122 PHE N N 121 121.798 120.446 1.352 1
1 1425 . 4 1 1 A 123 123 LYS H H 122 8.468 7.854 0.614 1
1 1426 . 4 1 1 A 123 123 LYS HA H 122 3.077 3.872 -0.795 1
1 1435 . 4 1 1 A 123 123 LYS C C 122 178.453 178.771 -0.318 1
1 1436 . 4 1 1 A 123 123 LYS CA C 122 59.855 59.864 -0.009 1
1 1437 . 4 1 1 A 123 123 LYS CB C 122 32.374 32.183 0.191 1
1 1441 . 4 1 1 A 123 123 LYS N N 122 120.614 118.558 2.056 1
1 1442 . 4 1 1 A 124 124 GLU H H 123 8.100 7.918 0.182 1
1 1443 . 4 1 1 A 124 124 GLU HA H 123 3.652 4.031 -0.379 1
1 1448 . 4 1 1 A 124 124 GLU C C 123 177.743 178.491 -0.748 1
1 1449 . 4 1 1 A 124 124 GLU CA C 123 59.406 59.438 -0.032 1
1 1450 . 4 1 1 A 124 124 GLU CB C 123 28.811 29.216 -0.405 1
1 1452 . 4 1 1 A 124 124 GLU N N 123 117.404 118.902 -1.498 1
1 1453 . 4 1 1 A 125 125 MET H H 124 7.537 7.637 -0.100 1
1 1454 . 4 1 1 A 125 125 MET HA H 124 3.860 3.968 -0.108 1
1 1462 . 4 1 1 A 125 125 MET C C 124 179.522 178.289 1.233 1
1 1463 . 4 1 1 A 125 125 MET CA C 124 58.832 58.498 0.334 1
1 1464 . 4 1 1 A 125 125 MET CB C 124 31.765 31.474 0.291 1
1 1467 . 4 1 1 A 125 125 MET N N 124 119.413 118.789 0.624 1
1 1468 . 4 1 1 A 126 126 PHE H H 125 7.148 7.451 -0.303 1
1 1469 . 4 1 1 A 126 126 PHE HA H 125 3.633 4.211 -0.578 1
1 1476 . 4 1 1 A 126 126 PHE C C 125 178.994 178.305 0.689 1
1 1477 . 4 1 1 A 126 126 PHE CA C 125 63.148 60.928 2.220 1
1 1478 . 4 1 1 A 126 126 PHE CB C 125 39.830 38.862 0.968 1
1 1483 . 4 1 1 A 126 126 PHE N N 125 120.013 119.150 0.863 1
1 1484 . 4 1 1 A 127 127 LEU H H 126 8.369 8.632 -0.263 1
1 1485 . 4 1 1 A 127 127 LEU HA H 126 3.972 4.068 -0.096 1
1 1495 . 4 1 1 A 127 127 LEU C C 126 180.621 179.399 1.222 1
1 1496 . 4 1 1 A 127 127 LEU CA C 126 57.944 57.959 -0.015 1
1 1497 . 4 1 1 A 127 127 LEU CB C 126 40.543 41.168 -0.625 1
1 1501 . 4 1 1 A 127 127 LEU N N 126 119.692 119.859 -0.167 1
1 1502 . 4 1 1 A 128 128 ASP H H 127 8.578 8.077 0.501 1
1 1503 . 4 1 1 A 128 128 ASP HA H 127 4.308 4.359 -0.051 1
1 1506 . 4 1 1 A 128 128 ASP C C 127 178.254 178.079 0.175 1
1 1507 . 4 1 1 A 128 128 ASP CA C 127 56.964 57.195 -0.231 1
1 1508 . 4 1 1 A 128 128 ASP CB C 127 39.735 40.675 -0.940 1
1 1509 . 4 1 1 A 128 128 ASP N N 127 121.926 119.501 2.425 1
1 1510 . 4 1 1 A 129 129 TYR H H 128 7.710 8.160 -0.450 1
1 1511 . 4 1 1 A 129 129 TYR HA H 128 3.908 3.982 -0.074 1
1 1518 . 4 1 1 A 129 129 TYR C C 128 177.633 177.660 -0.027 1
1 1519 . 4 1 1 A 129 129 TYR CA C 128 61.796 61.549 0.247 1
1 1520 . 4 1 1 A 129 129 TYR CB C 128 39.372 38.863 0.509 1
1 1525 . 4 1 1 A 129 129 TYR N N 128 122.548 120.645 1.903 1
1 1526 . 4 1 1 A 130 130 ARG H H 129 8.622 8.279 0.343 1
1 1527 . 4 1 1 A 130 130 ARG HA H 129 3.722 4.022 -0.300 1
1 1535 . 4 1 1 A 130 130 ARG CA C 129 60.084 59.493 0.591 1
1 1536 . 4 1 1 A 130 130 ARG CB C 129 29.902 30.023 -0.121 1
1 1539 . 4 1 1 A 130 130 ARG N N 129 118.302 119.857 -1.555 1
1 1541 . 4 1 1 A 131 131 ALA H H 130 7.936 8.003 -0.067 1
1 1542 . 4 1 1 A 131 131 ALA HA H 130 3.997 4.012 -0.015 1
1 1546 . 4 1 1 A 131 131 ALA C C 130 180.456 179.754 0.702 1
1 1547 . 4 1 1 A 131 131 ALA CA C 130 55.133 54.981 0.152 1
1 1548 . 4 1 1 A 131 131 ALA CB C 130 17.750 18.119 -0.369 1
1 1549 . 4 1 1 A 131 131 ALA N N 130 119.788 121.746 -1.958 1
1 1550 . 4 1 1 A 132 132 GLU H H 131 7.622 7.574 0.048 1
1 1551 . 4 1 1 A 132 132 GLU HA H 131 3.862 4.016 -0.154 1
1 1556 . 4 1 1 A 132 132 GLU C C 131 179.528 178.393 1.135 1
1 1557 . 4 1 1 A 132 132 GLU CA C 131 58.849 58.498 0.351 1
1 1558 . 4 1 1 A 132 132 GLU CB C 131 28.930 28.978 -0.048 1
1 1560 . 4 1 1 A 132 132 GLU N N 131 118.428 117.979 0.449 1
1 1561 . 4 1 1 A 133 133 LYS H H 132 7.853 7.473 0.380 1
1 1562 . 4 1 1 A 133 133 LYS HA H 132 3.722 4.019 -0.297 1
1 1571 . 4 1 1 A 133 133 LYS C C 132 175.725 177.630 -1.905 1
1 1572 . 4 1 1 A 133 133 LYS CA C 132 57.544 58.756 -1.212 1
1 1573 . 4 1 1 A 133 133 LYS CB C 132 31.770 32.118 -0.348 1
1 1577 . 4 1 1 A 133 133 LYS N N 132 119.473 119.077 0.396 1
1 1578 . 4 1 1 A 134 134 GLU H H 133 8.151 7.731 0.420 1
1 1579 . 4 1 1 A 134 134 GLU HA H 133 4.161 4.367 -0.206 1
1 1584 . 4 1 1 A 134 134 GLU C C 133 177.453 177.900 -0.447 1
1 1585 . 4 1 1 A 134 134 GLU CA C 133 57.222 56.466 0.756 1
1 1586 . 4 1 1 A 134 134 GLU CB C 133 30.091 30.122 -0.031 1
1 1588 . 4 1 1 A 134 134 GLU N N 133 116.525 117.583 -1.058 1
1 1589 . 4 1 1 A 135 135 GLY H H 134 7.702 7.719 -0.017 1
1 1590 . 4 1 1 A 135 135 GLY HA2 H 134 3.896 3.997 -0.101 1
1 1591 . 4 1 1 A 135 135 GLY HA3 H 134 3.897 4.004 -0.107 1
1 1592 . 4 1 1 A 135 135 GLY C C 134 174.538 174.916 -0.378 1
1 1593 . 4 1 1 A 135 135 GLY CA C 134 45.975 45.529 0.446 1
1 1594 . 4 1 1 A 135 135 GLY N N 134 107.924 107.938 -0.014 1
1 1595 . 4 1 1 A 136 136 ARG H H 135 8.045 7.710 0.335 1
1 1596 . 4 1 1 A 136 136 ARG HA H 135 4.323 4.262 0.061 1
1 1604 . 4 1 1 A 136 136 ARG C C 135 175.864 176.511 -0.647 1
1 1605 . 4 1 1 A 136 136 ARG CA C 135 56.016 56.453 -0.437 1
1 1606 . 4 1 1 A 136 136 ARG CB C 135 30.987 30.872 0.115 1
1 1609 . 4 1 1 A 136 136 ARG N N 135 119.708 118.971 0.737 1
1 1 . 5 1 1 A 14 14 PHE CA C 13 58.199 58.696 -0.497 1
1 2 . 5 1 1 A 14 14 PHE CB C 13 39.717 37.505 2.212 1
1 3 . 5 1 1 A 15 15 SER H H 14 8.299 8.062 0.237 1
1 4 . 5 1 1 A 15 15 SER HA H 14 4.359 4.707 -0.348 1
1 7 . 5 1 1 A 15 15 SER CA C 14 58.249 56.194 2.055 1
1 8 . 5 1 1 A 15 15 SER CB C 14 63.936 64.093 -0.157 1
1 9 . 5 1 1 A 15 15 SER N N 14 117.379 123.806 -6.427 1
1 10 . 5 1 1 A 16 16 SER H H 15 8.255 8.772 -0.517 1
1 11 . 5 1 1 A 16 16 SER HA H 15 3.729 4.488 -0.759 1
1 14 . 5 1 1 A 16 16 SER CA C 15 58.224 59.203 -0.979 1
1 15 . 5 1 1 A 16 16 SER CB C 15 63.886 65.356 -1.470 1
1 16 . 5 1 1 A 16 16 SER N N 15 117.694 123.625 -5.931 1
1 17 . 5 1 1 A 17 17 ALA H H 16 8.333 8.079 0.254 1
1 18 . 5 1 1 A 17 17 ALA HA H 16 4.252 4.292 -0.040 1
1 22 . 5 1 1 A 17 17 ALA CA C 16 53.377 54.599 -1.222 1
1 23 . 5 1 1 A 17 17 ALA CB C 16 18.896 18.157 0.739 1
1 24 . 5 1 1 A 17 17 ALA N N 16 125.462 123.772 1.690 1
1 25 . 5 1 1 A 18 18 SER H H 17 8.219 7.920 0.299 1
1 26 . 5 1 1 A 18 18 SER HA H 17 4.332 4.521 -0.189 1
1 29 . 5 1 1 A 18 18 SER CA C 17 59.105 57.809 1.296 1
1 30 . 5 1 1 A 18 18 SER CB C 17 63.592 63.762 -0.170 1
1 31 . 5 1 1 A 18 18 SER N N 17 114.821 112.312 2.509 1
1 32 . 5 1 1 A 19 19 ASP H H 18 8.309 7.732 0.577 1
1 33 . 5 1 1 A 19 19 ASP HA H 18 4.554 4.766 -0.212 1
1 36 . 5 1 1 A 19 19 ASP C C 18 176.528 176.805 -0.277 1
1 37 . 5 1 1 A 19 19 ASP CA C 18 55.272 52.432 2.840 1
1 38 . 5 1 1 A 19 19 ASP CB C 18 40.883 43.409 -2.526 1
1 39 . 5 1 1 A 19 19 ASP N N 18 123.367 121.580 1.787 1
1 40 . 5 1 1 A 20 20 ALA H H 19 8.133 8.781 -0.648 1
1 41 . 5 1 1 A 20 20 ALA HA H 19 4.170 4.057 0.113 1
1 45 . 5 1 1 A 20 20 ALA C C 19 179.857 179.578 0.279 1
1 46 . 5 1 1 A 20 20 ALA CA C 19 54.341 55.166 -0.825 1
1 47 . 5 1 1 A 20 20 ALA CB C 19 18.660 18.389 0.271 1
1 48 . 5 1 1 A 20 20 ALA N N 19 123.350 125.635 -2.285 1
1 49 . 5 1 1 A 21 21 GLU H H 20 8.140 8.149 -0.009 1
1 50 . 5 1 1 A 21 21 GLU HA H 20 4.128 4.067 0.061 1
1 55 . 5 1 1 A 21 21 GLU C C 20 177.675 178.555 -0.880 1
1 56 . 5 1 1 A 21 21 GLU CA C 20 58.520 59.444 -0.924 1
1 57 . 5 1 1 A 21 21 GLU CB C 20 29.765 29.542 0.223 1
1 59 . 5 1 1 A 21 21 GLU N N 20 119.063 119.394 -0.331 1
1 60 . 5 1 1 A 22 22 PHE H H 21 8.009 7.981 0.028 1
1 61 . 5 1 1 A 22 22 PHE HA H 21 4.123 4.229 -0.106 1
1 68 . 5 1 1 A 22 22 PHE C C 21 176.410 177.127 -0.717 1
1 69 . 5 1 1 A 22 22 PHE CA C 21 62.202 61.269 0.933 1
1 70 . 5 1 1 A 22 22 PHE CB C 21 39.223 39.113 0.110 1
1 75 . 5 1 1 A 22 22 PHE N N 21 121.211 120.986 0.225 1
1 76 . 5 1 1 A 23 23 ASP H H 22 8.261 8.436 -0.175 1
1 77 . 5 1 1 A 23 23 ASP HA H 22 4.041 4.276 -0.235 1
1 80 . 5 1 1 A 23 23 ASP C C 22 179.078 178.505 0.573 1
1 81 . 5 1 1 A 23 23 ASP CA C 22 57.048 57.193 -0.145 1
1 82 . 5 1 1 A 23 23 ASP CB C 22 40.154 40.100 0.054 1
1 83 . 5 1 1 A 23 23 ASP N N 22 116.876 118.788 -1.912 1
1 84 . 5 1 1 A 24 24 ALA H H 23 7.651 7.366 0.285 1
1 85 . 5 1 1 A 24 24 ALA HA H 23 3.785 3.796 -0.011 1
1 89 . 5 1 1 A 24 24 ALA C C 23 179.577 179.948 -0.371 1
1 90 . 5 1 1 A 24 24 ALA CA C 23 54.341 55.179 -0.838 1
1 91 . 5 1 1 A 24 24 ALA CB C 23 17.762 18.014 -0.252 1
1 92 . 5 1 1 A 24 24 ALA N N 23 121.873 122.563 -0.690 1
1 93 . 5 1 1 A 25 25 VAL H H 24 7.718 7.887 -0.169 1
1 94 . 5 1 1 A 25 25 VAL HA H 24 3.216 3.559 -0.343 1
1 102 . 5 1 1 A 25 25 VAL C C 24 177.805 178.375 -0.570 1
1 103 . 5 1 1 A 25 25 VAL CA C 24 66.789 66.853 -0.064 1
1 104 . 5 1 1 A 25 25 VAL CB C 24 31.277 31.228 0.049 1
1 107 . 5 1 1 A 25 25 VAL N N 24 117.890 119.044 -1.154 1
1 108 . 5 1 1 A 26 26 VAL H H 25 7.867 7.603 0.264 1
1 109 . 5 1 1 A 26 26 VAL HA H 25 3.274 3.543 -0.269 1
1 117 . 5 1 1 A 26 26 VAL C C 25 177.788 177.562 0.226 1
1 118 . 5 1 1 A 26 26 VAL CA C 25 67.282 66.265 1.017 1
1 119 . 5 1 1 A 26 26 VAL CB C 25 31.266 31.272 -0.006 1
1 122 . 5 1 1 A 26 26 VAL N N 25 118.170 120.213 -2.043 1
1 123 . 5 1 1 A 27 27 GLY H H 26 7.544 7.602 -0.058 1
1 124 . 5 1 1 A 27 27 GLY HA2 H 26 3.592 3.460 0.132 1
1 125 . 5 1 1 A 27 27 GLY HA3 H 26 3.721 3.589 0.132 1
1 126 . 5 1 1 A 27 27 GLY C C 26 176.717 176.177 0.540 1
1 127 . 5 1 1 A 27 27 GLY CA C 26 47.085 47.137 -0.052 1
1 128 . 5 1 1 A 27 27 GLY N N 26 105.795 107.722 -1.927 1
1 129 . 5 1 1 A 28 28 TYR H H 27 7.625 7.368 0.257 1
1 130 . 5 1 1 A 28 28 TYR HA H 27 4.546 4.628 -0.082 1
1 137 . 5 1 1 A 28 28 TYR C C 27 178.991 178.125 0.866 1
1 138 . 5 1 1 A 28 28 TYR CA C 27 58.845 59.803 -0.958 1
1 139 . 5 1 1 A 28 28 TYR CB C 27 37.602 37.568 0.034 1
1 144 . 5 1 1 A 28 28 TYR N N 27 119.933 121.490 -1.557 1
1 145 . 5 1 1 A 29 29 LEU H H 28 8.517 8.158 0.359 1
1 146 . 5 1 1 A 29 29 LEU HA H 28 3.728 3.840 -0.112 1
1 156 . 5 1 1 A 29 29 LEU CA C 28 58.281 58.089 0.192 1
1 157 . 5 1 1 A 29 29 LEU CB C 28 41.948 41.420 0.528 1
1 161 . 5 1 1 A 29 29 LEU N N 28 119.669 120.310 -0.641 1
1 162 . 5 1 1 A 30 30 GLU H H 29 8.072 8.035 0.037 1
1 163 . 5 1 1 A 30 30 GLU HA H 29 3.722 3.853 -0.131 1
1 168 . 5 1 1 A 30 30 GLU C C 29 177.731 179.381 -1.650 1
1 169 . 5 1 1 A 30 30 GLU CA C 29 59.763 59.980 -0.217 1
1 170 . 5 1 1 A 30 30 GLU CB C 29 28.844 29.344 -0.500 1
1 172 . 5 1 1 A 30 30 GLU N N 29 117.666 117.643 0.023 1
1 173 . 5 1 1 A 31 31 ASP H H 30 7.243 7.866 -0.623 1
1 174 . 5 1 1 A 31 31 ASP HA H 30 4.297 4.393 -0.096 1
1 177 . 5 1 1 A 31 31 ASP CA C 30 56.953 57.365 -0.412 1
1 178 . 5 1 1 A 31 31 ASP CB C 30 40.730 40.523 0.207 1
1 179 . 5 1 1 A 31 31 ASP N N 30 116.720 119.274 -2.554 1
1 180 . 5 1 1 A 32 32 ILE H H 31 7.940 7.404 0.536 1
1 181 . 5 1 1 A 32 32 ILE HA H 31 3.640 3.718 -0.078 1
1 191 . 5 1 1 A 32 32 ILE C C 31 177.980 178.123 -0.143 1
1 192 . 5 1 1 A 32 32 ILE CA C 31 64.692 64.088 0.604 1
1 193 . 5 1 1 A 32 32 ILE CB C 31 38.938 37.331 1.607 1
1 197 . 5 1 1 A 32 32 ILE N N 31 119.728 120.198 -0.470 1
1 198 . 5 1 1 A 33 33 ILE H H 32 7.984 7.882 0.102 1
1 199 . 5 1 1 A 33 33 ILE HA H 32 3.598 3.002 0.596 1
1 209 . 5 1 1 A 33 33 ILE C C 32 176.723 176.850 -0.127 1
1 210 . 5 1 1 A 33 33 ILE CA C 32 63.241 64.327 -1.086 1
1 211 . 5 1 1 A 33 33 ILE CB C 32 37.580 37.620 -0.040 1
1 215 . 5 1 1 A 33 33 ILE N N 32 113.919 120.476 -6.557 1
1 216 . 5 1 1 A 34 34 MET H H 33 7.288 7.667 -0.379 1
1 217 . 5 1 1 A 34 34 MET HA H 33 4.496 4.708 -0.212 1
1 225 . 5 1 1 A 34 34 MET C C 33 176.423 175.736 0.687 1
1 226 . 5 1 1 A 34 34 MET CA C 33 54.634 54.109 0.525 1
1 227 . 5 1 1 A 34 34 MET CB C 33 31.934 31.780 0.154 1
1 230 . 5 1 1 A 34 34 MET N N 33 115.130 116.974 -1.844 1
1 231 . 5 1 1 A 35 35 ASP H H 34 7.405 7.631 -0.226 1
1 232 . 5 1 1 A 35 35 ASP HA H 34 4.484 4.587 -0.103 1
1 235 . 5 1 1 A 35 35 ASP C C 34 177.139 176.886 0.253 1
1 236 . 5 1 1 A 35 35 ASP CA C 34 54.625 54.564 0.061 1
1 237 . 5 1 1 A 35 35 ASP CB C 34 43.554 42.810 0.744 1
1 238 . 5 1 1 A 35 35 ASP N N 34 121.814 122.485 -0.671 1
1 239 . 5 1 1 A 36 36 ASP H H 35 8.765 8.809 -0.044 1
1 240 . 5 1 1 A 36 36 ASP HA H 35 4.235 4.356 -0.121 1
1 243 . 5 1 1 A 36 36 ASP C C 35 178.320 178.456 -0.136 1
1 244 . 5 1 1 A 36 36 ASP CA C 35 57.832 57.976 -0.144 1
1 245 . 5 1 1 A 36 36 ASP CB C 35 40.914 40.387 0.527 1
1 246 . 5 1 1 A 36 36 ASP N N 35 125.883 125.358 0.525 1
1 247 . 5 1 1 A 37 37 GLU H H 36 8.905 8.087 0.818 1
1 248 . 5 1 1 A 37 37 GLU HA H 36 3.933 4.099 -0.166 1
1 253 . 5 1 1 A 37 37 GLU C C 36 179.304 179.121 0.183 1
1 254 . 5 1 1 A 37 37 GLU CA C 36 59.828 59.238 0.590 1
1 255 . 5 1 1 A 37 37 GLU CB C 36 29.380 29.316 0.064 1
1 257 . 5 1 1 A 37 37 GLU N N 36 119.077 120.505 -1.428 1
1 258 . 5 1 1 A 38 38 PHE H H 37 7.460 8.175 -0.715 1
1 259 . 5 1 1 A 38 38 PHE HA H 37 3.642 4.035 -0.393 1
1 267 . 5 1 1 A 38 38 PHE C C 37 176.483 177.919 -1.436 1
1 268 . 5 1 1 A 38 38 PHE CA C 37 61.411 61.047 0.364 1
1 269 . 5 1 1 A 38 38 PHE CB C 37 39.355 39.227 0.128 1
1 275 . 5 1 1 A 38 38 PHE N N 37 119.968 120.795 -0.827 1
1 276 . 5 1 1 A 39 39 GLN H H 38 7.968 7.964 0.004 1
1 277 . 5 1 1 A 39 39 GLN HA H 38 3.712 3.852 -0.140 1
1 284 . 5 1 1 A 39 39 GLN CA C 38 59.153 58.792 0.361 1
1 285 . 5 1 1 A 39 39 GLN CB C 38 28.213 28.322 -0.109 1
1 287 . 5 1 1 A 39 39 GLN N N 38 116.433 118.330 -1.897 1
1 289 . 5 1 1 A 40 40 LEU H H 39 7.930 7.568 0.362 1
1 290 . 5 1 1 A 40 40 LEU HA H 39 3.916 4.008 -0.092 1
1 300 . 5 1 1 A 40 40 LEU C C 39 177.731 178.096 -0.365 1
1 301 . 5 1 1 A 40 40 LEU CA C 39 57.915 57.989 -0.074 1
1 302 . 5 1 1 A 40 40 LEU CB C 39 41.989 41.800 0.189 1
1 306 . 5 1 1 A 40 40 LEU N N 39 119.505 121.633 -2.128 1
1 307 . 5 1 1 A 41 41 LEU H H 40 7.174 7.903 -0.729 1
1 308 . 5 1 1 A 41 41 LEU HA H 40 3.835 3.999 -0.164 1
1 318 . 5 1 1 A 41 41 LEU C C 40 179.738 178.329 1.409 1
1 319 . 5 1 1 A 41 41 LEU CA C 40 58.266 58.349 -0.083 1
1 320 . 5 1 1 A 41 41 LEU CB C 40 42.050 41.331 0.719 1
1 324 . 5 1 1 A 41 41 LEU N N 40 120.971 119.582 1.389 1
1 325 . 5 1 1 A 42 42 GLN H H 41 8.058 7.890 0.168 1
1 326 . 5 1 1 A 42 42 GLN HA H 41 3.556 3.748 -0.192 1
1 333 . 5 1 1 A 42 42 GLN C C 41 177.642 178.573 -0.931 1
1 334 . 5 1 1 A 42 42 GLN CA C 41 59.826 59.208 0.618 1
1 335 . 5 1 1 A 42 42 GLN CB C 41 28.762 27.768 0.994 1
1 337 . 5 1 1 A 42 42 GLN N N 41 117.899 117.764 0.135 1
1 339 . 5 1 1 A 43 43 ARG H H 42 8.179 7.963 0.216 1
1 340 . 5 1 1 A 43 43 ARG HA H 42 3.655 3.969 -0.314 1
1 347 . 5 1 1 A 43 43 ARG C C 42 178.051 178.667 -0.616 1
1 348 . 5 1 1 A 43 43 ARG CA C 42 59.766 58.739 1.027 1
1 349 . 5 1 1 A 43 43 ARG CB C 42 29.941 29.930 0.011 1
1 352 . 5 1 1 A 43 43 ARG N N 42 119.392 119.872 -0.480 1
1 353 . 5 1 1 A 44 44 ASN H H 43 8.525 8.176 0.349 1
1 354 . 5 1 1 A 44 44 ASN HA H 43 4.332 4.387 -0.055 1
1 359 . 5 1 1 A 44 44 ASN C C 43 178.150 178.404 -0.254 1
1 360 . 5 1 1 A 44 44 ASN CA C 43 55.841 56.416 -0.575 1
1 361 . 5 1 1 A 44 44 ASN CB C 43 37.632 38.650 -1.018 1
1 362 . 5 1 1 A 44 44 ASN N N 43 116.214 118.127 -1.913 1
1 364 . 5 1 1 A 45 45 PHE H H 44 7.586 8.101 -0.515 1
1 365 . 5 1 1 A 45 45 PHE HA H 44 4.132 4.263 -0.131 1
1 372 . 5 1 1 A 45 45 PHE C C 44 176.691 178.746 -2.055 1
1 373 . 5 1 1 A 45 45 PHE CA C 44 62.333 60.743 1.590 1
1 374 . 5 1 1 A 45 45 PHE CB C 44 39.449 38.239 1.210 1
1 379 . 5 1 1 A 45 45 PHE N N 44 121.501 119.194 2.307 1
1 380 . 5 1 1 A 46 46 MET H H 45 8.190 8.368 -0.178 1
1 381 . 5 1 1 A 46 46 MET HA H 45 4.060 4.209 -0.149 1
1 389 . 5 1 1 A 46 46 MET C C 45 179.754 178.142 1.612 1
1 390 . 5 1 1 A 46 46 MET CA C 45 57.742 57.912 -0.170 1
1 391 . 5 1 1 A 46 46 MET CB C 45 29.912 31.264 -1.352 1
1 394 . 5 1 1 A 46 46 MET N N 45 116.727 117.931 -1.204 1
1 395 . 5 1 1 A 47 47 ASP H H 46 8.579 8.191 0.388 1
1 396 . 5 1 1 A 47 47 ASP HA H 46 4.804 4.690 0.114 1
1 399 . 5 1 1 A 47 47 ASP C C 46 177.854 177.634 0.220 1
1 400 . 5 1 1 A 47 47 ASP CA C 46 57.277 57.269 0.008 1
1 401 . 5 1 1 A 47 47 ASP CB C 46 40.776 41.705 -0.929 1
1 402 . 5 1 1 A 47 47 ASP N N 46 117.798 120.724 -2.926 1
1 403 . 5 1 1 A 48 48 LYS H H 47 7.339 7.895 -0.556 1
1 404 . 5 1 1 A 48 48 LYS HA H 47 3.828 4.326 -0.498 1
1 413 . 5 1 1 A 48 48 LYS C C 47 178.812 178.588 0.224 1
1 414 . 5 1 1 A 48 48 LYS CA C 47 58.953 57.558 1.395 1
1 415 . 5 1 1 A 48 48 LYS CB C 47 32.796 33.466 -0.670 1
1 419 . 5 1 1 A 48 48 LYS N N 47 117.852 117.717 0.135 1
1 420 . 5 1 1 A 49 49 TYR H H 48 6.841 8.464 -1.623 1
1 421 . 5 1 1 A 49 49 TYR HA H 48 4.995 4.203 0.792 1
1 428 . 5 1 1 A 49 49 TYR C C 48 178.138 178.488 -0.350 1
1 429 . 5 1 1 A 49 49 TYR CA C 48 58.620 59.686 -1.066 1
1 430 . 5 1 1 A 49 49 TYR CB C 48 42.939 38.025 4.914 1
1 435 . 5 1 1 A 49 49 TYR N N 48 112.109 119.037 -6.928 1
1 436 . 5 1 1 A 50 50 TYR H H 49 8.491 8.114 0.377 1
1 437 . 5 1 1 A 50 50 TYR HA H 49 4.598 4.152 0.446 1
1 444 . 5 1 1 A 50 50 TYR C C 49 176.015 178.378 -2.363 1
1 445 . 5 1 1 A 50 50 TYR CA C 49 62.442 59.579 2.863 1
1 446 . 5 1 1 A 50 50 TYR CB C 49 36.588 37.067 -0.479 1
1 451 . 5 1 1 A 50 50 TYR N N 49 118.294 119.321 -1.027 1
1 452 . 5 1 1 A 51 51 LEU H H 50 7.512 7.603 -0.091 1
1 453 . 5 1 1 A 51 51 LEU HA H 50 3.878 3.429 0.449 1
1 463 . 5 1 1 A 51 51 LEU C C 50 178.625 178.765 -0.140 1
1 464 . 5 1 1 A 51 51 LEU CA C 50 55.994 57.359 -1.365 1
1 465 . 5 1 1 A 51 51 LEU CB C 50 40.743 41.137 -0.394 1
1 469 . 5 1 1 A 51 51 LEU N N 50 118.478 121.473 -2.995 1
1 470 . 5 1 1 A 52 52 GLU H H 51 8.042 7.755 0.287 1
1 471 . 5 1 1 A 52 52 GLU HA H 51 4.197 3.955 0.242 1
1 476 . 5 1 1 A 52 52 GLU C C 51 177.629 177.838 -0.209 1
1 477 . 5 1 1 A 52 52 GLU CA C 51 56.141 59.642 -3.501 1
1 478 . 5 1 1 A 52 52 GLU CB C 51 29.162 29.073 0.089 1
1 480 . 5 1 1 A 52 52 GLU N N 51 115.067 118.075 -3.008 1
1 481 . 5 1 1 A 53 53 PHE H H 52 7.465 7.979 -0.514 1
1 482 . 5 1 1 A 53 53 PHE HA H 52 4.431 4.717 -0.286 1
1 490 . 5 1 1 A 53 53 PHE C C 52 174.325 174.885 -0.560 1
1 491 . 5 1 1 A 53 53 PHE CA C 52 58.986 57.217 1.769 1
1 492 . 5 1 1 A 53 53 PHE CB C 52 40.183 37.800 2.383 1
1 498 . 5 1 1 A 53 53 PHE N N 52 116.768 119.194 -2.426 1
1 499 . 5 1 1 A 54 54 GLU H H 53 7.484 8.714 -1.230 1
1 500 . 5 1 1 A 54 54 GLU HA H 53 4.583 4.921 -0.338 1
1 505 . 5 1 1 A 54 54 GLU C C 53 175.722 175.524 0.198 1
1 506 . 5 1 1 A 54 54 GLU CA C 53 54.248 55.303 -1.055 1
1 507 . 5 1 1 A 54 54 GLU CB C 53 34.409 31.353 3.056 1
1 509 . 5 1 1 A 54 54 GLU N N 53 118.844 124.085 -5.241 1
1 510 . 5 1 1 A 55 55 ASP H H 54 9.008 8.640 0.368 1
1 511 . 5 1 1 A 55 55 ASP HA H 54 4.735 4.851 -0.116 1
1 514 . 5 1 1 A 55 55 ASP C C 54 175.421 175.817 -0.396 1
1 515 . 5 1 1 A 55 55 ASP CA C 54 52.888 53.559 -0.671 1
1 516 . 5 1 1 A 55 55 ASP CB C 54 38.894 40.736 -1.842 1
1 517 . 5 1 1 A 55 55 ASP N N 54 123.654 123.322 0.332 1
1 518 . 5 1 1 A 56 56 THR H H 55 7.819 7.880 -0.061 1
1 519 . 5 1 1 A 56 56 THR HA H 55 4.574 4.884 -0.310 1
1 524 . 5 1 1 A 56 56 THR C C 55 174.096 174.110 -0.014 1
1 525 . 5 1 1 A 56 56 THR CA C 55 59.172 59.501 -0.329 1
1 526 . 5 1 1 A 56 56 THR CB C 55 71.889 72.617 -0.728 1
1 528 . 5 1 1 A 56 56 THR N N 55 112.015 116.999 -4.984 1
1 529 . 5 1 1 A 57 57 GLU H H 56 8.527 8.851 -0.324 1
1 530 . 5 1 1 A 57 57 GLU HA H 56 4.217 4.471 -0.254 1
1 535 . 5 1 1 A 57 57 GLU C C 56 177.042 176.224 0.818 1
1 536 . 5 1 1 A 57 57 GLU CA C 56 56.869 56.648 0.221 1
1 537 . 5 1 1 A 57 57 GLU CB C 56 29.731 30.659 -0.928 1
1 539 . 5 1 1 A 57 57 GLU N N 56 117.531 118.881 -1.350 1
1 540 . 5 1 1 A 58 58 GLU H H 57 7.587 7.896 -0.309 1
1 541 . 5 1 1 A 58 58 GLU HA H 57 3.941 4.658 -0.717 1
1 546 . 5 1 1 A 58 58 GLU C C 57 176.849 176.156 0.693 1
1 547 . 5 1 1 A 58 58 GLU CA C 57 56.924 55.847 1.077 1
1 548 . 5 1 1 A 58 58 GLU CB C 57 30.251 30.807 -0.556 1
1 550 . 5 1 1 A 58 58 GLU N N 57 119.183 118.760 0.423 1
1 551 . 5 1 1 A 59 59 ASN H H 58 9.120 8.744 0.376 1
1 552 . 5 1 1 A 59 59 ASN HA H 58 4.922 5.215 -0.293 1
1 557 . 5 1 1 A 59 59 ASN C C 58 174.254 174.899 -0.645 1
1 558 . 5 1 1 A 59 59 ASN CA C 58 51.956 52.329 -0.373 1
1 559 . 5 1 1 A 59 59 ASN CB C 58 37.404 39.996 -2.592 1
1 560 . 5 1 1 A 59 59 ASN N N 58 126.767 123.773 2.994 1
1 562 . 5 1 1 A 60 60 LYS H H 59 5.892 8.891 -2.999 1
1 563 . 5 1 1 A 60 60 LYS HA H 59 3.798 4.812 -1.014 1
1 572 . 5 1 1 A 60 60 LYS C C 59 177.908 177.162 0.746 1
1 573 . 5 1 1 A 60 60 LYS CA C 59 56.623 54.798 1.825 1
1 574 . 5 1 1 A 60 60 LYS CB C 59 32.279 35.127 -2.848 1
1 578 . 5 1 1 A 60 60 LYS N N 59 121.527 120.184 1.343 1
1 579 . 5 1 1 A 61 61 LEU H H 60 8.473 8.776 -0.303 1
1 580 . 5 1 1 A 61 61 LEU HA H 60 3.891 4.281 -0.390 1
1 590 . 5 1 1 A 61 61 LEU C C 60 179.843 178.005 1.838 1
1 591 . 5 1 1 A 61 61 LEU CA C 60 58.301 56.968 1.333 1
1 592 . 5 1 1 A 61 61 LEU CB C 60 41.305 42.314 -1.009 1
1 596 . 5 1 1 A 61 61 LEU N N 60 125.639 124.958 0.681 1
1 597 . 5 1 1 A 62 62 ILE H H 61 7.698 7.739 -0.041 1
1 598 . 5 1 1 A 62 62 ILE HA H 61 3.952 3.848 0.104 1
1 608 . 5 1 1 A 62 62 ILE C C 61 175.392 177.185 -1.793 1
1 609 . 5 1 1 A 62 62 ILE CA C 61 61.743 63.226 -1.483 1
1 610 . 5 1 1 A 62 62 ILE CB C 61 39.108 37.683 1.425 1
1 614 . 5 1 1 A 62 62 ILE N N 61 114.111 118.825 -4.714 1
1 615 . 5 1 1 A 63 63 TYR H H 62 7.273 7.705 -0.432 1
1 616 . 5 1 1 A 63 63 TYR HA H 62 4.343 4.219 0.124 1
1 623 . 5 1 1 A 63 63 TYR C C 62 178.264 178.574 -0.310 1
1 624 . 5 1 1 A 63 63 TYR CA C 62 57.231 60.921 -3.690 1
1 625 . 5 1 1 A 63 63 TYR CB C 62 36.332 37.395 -1.063 1
1 630 . 5 1 1 A 63 63 TYR N N 62 117.689 121.303 -3.614 1
1 631 . 5 1 1 A 64 64 THR H H 63 7.747 7.949 -0.202 1
1 632 . 5 1 1 A 64 64 THR HA H 63 4.266 4.225 0.041 1
1 637 . 5 1 1 A 64 64 THR CA C 63 69.362 67.566 1.796 1
1 638 . 5 1 1 A 64 64 THR CB C 63 66.962 67.490 -0.528 1
1 640 . 5 1 1 A 64 64 THR N N 63 113.755 116.286 -2.531 1
1 641 . 5 1 1 A 65 65 PRO HA H 64 4.372 4.378 -0.006 1
1 648 . 5 1 1 A 65 65 PRO C C 64 179.913 179.379 0.534 1
1 649 . 5 1 1 A 65 65 PRO CA C 64 66.011 66.012 -0.001 1
1 650 . 5 1 1 A 65 65 PRO CB C 64 30.642 30.687 -0.045 1
1 653 . 5 1 1 A 66 66 ILE H H 65 7.377 7.342 0.035 1
1 654 . 5 1 1 A 66 66 ILE HA H 65 3.530 3.901 -0.371 1
1 664 . 5 1 1 A 66 66 ILE C C 65 177.543 178.258 -0.715 1
1 665 . 5 1 1 A 66 66 ILE CA C 65 66.647 64.209 2.438 1
1 666 . 5 1 1 A 66 66 ILE CB C 65 38.029 37.614 0.415 1
1 670 . 5 1 1 A 66 66 ILE N N 65 118.353 116.673 1.680 1
1 671 . 5 1 1 A 67 67 PHE H H 66 8.480 8.404 0.076 1
1 672 . 5 1 1 A 67 67 PHE HA H 66 4.115 4.389 -0.274 1
1 680 . 5 1 1 A 67 67 PHE C C 66 177.293 178.116 -0.823 1
1 681 . 5 1 1 A 67 67 PHE CA C 66 59.570 62.272 -2.702 1
1 682 . 5 1 1 A 67 67 PHE CB C 66 38.865 39.550 -0.685 1
1 688 . 5 1 1 A 67 67 PHE N N 66 122.420 120.778 1.642 1
1 689 . 5 1 1 A 68 68 ASN H H 67 8.595 8.162 0.433 1
1 690 . 5 1 1 A 68 68 ASN HA H 67 4.211 4.438 -0.227 1
1 695 . 5 1 1 A 68 68 ASN C C 67 178.697 178.120 0.577 1
1 696 . 5 1 1 A 68 68 ASN CA C 67 56.056 56.102 -0.046 1
1 697 . 5 1 1 A 68 68 ASN CB C 67 37.704 38.141 -0.437 1
1 698 . 5 1 1 A 68 68 ASN N N 67 115.573 117.522 -1.949 1
1 700 . 5 1 1 A 69 69 GLU H H 68 8.414 7.967 0.447 1
1 701 . 5 1 1 A 69 69 GLU HA H 68 4.102 4.181 -0.079 1
1 706 . 5 1 1 A 69 69 GLU C C 68 177.880 178.888 -1.008 1
1 707 . 5 1 1 A 69 69 GLU CA C 68 59.399 59.337 0.062 1
1 708 . 5 1 1 A 69 69 GLU CB C 68 29.855 29.347 0.508 1
1 710 . 5 1 1 A 69 69 GLU N N 68 123.510 119.866 3.644 1
1 711 . 5 1 1 A 70 70 TYR H H 69 8.659 8.050 0.609 1
1 712 . 5 1 1 A 70 70 TYR HA H 69 3.362 4.098 -0.736 1
1 719 . 5 1 1 A 70 70 TYR C C 69 178.143 176.942 1.201 1
1 720 . 5 1 1 A 70 70 TYR CA C 69 60.686 61.198 -0.512 1
1 721 . 5 1 1 A 70 70 TYR CB C 69 38.560 38.946 -0.386 1
1 726 . 5 1 1 A 70 70 TYR N N 69 122.130 121.074 1.056 1
1 727 . 5 1 1 A 71 71 ILE H H 70 8.031 7.728 0.303 1
1 728 . 5 1 1 A 71 71 ILE HA H 70 3.265 3.697 -0.432 1
1 738 . 5 1 1 A 71 71 ILE C C 70 178.056 178.010 0.046 1
1 739 . 5 1 1 A 71 71 ILE CA C 70 63.756 63.949 -0.193 1
1 740 . 5 1 1 A 71 71 ILE CB C 70 37.321 36.563 0.758 1
1 744 . 5 1 1 A 71 71 ILE N N 70 118.906 120.485 -1.579 1
1 745 . 5 1 1 A 72 72 SER H H 71 7.803 7.626 0.177 1
1 746 . 5 1 1 A 72 72 SER HA H 71 4.029 4.293 -0.264 1
1 749 . 5 1 1 A 72 72 SER CA C 71 61.380 61.132 0.248 1
1 750 . 5 1 1 A 72 72 SER CB C 71 63.288 63.021 0.267 1
1 751 . 5 1 1 A 72 72 SER N N 71 113.735 117.023 -3.288 1
1 752 . 5 1 1 A 73 73 LEU H H 72 7.952 8.009 -0.057 1
1 753 . 5 1 1 A 73 73 LEU HA H 72 4.418 4.142 0.276 1
1 763 . 5 1 1 A 73 73 LEU C C 72 177.767 178.180 -0.413 1
1 764 . 5 1 1 A 73 73 LEU CA C 72 56.543 57.420 -0.877 1
1 765 . 5 1 1 A 73 73 LEU CB C 72 44.517 41.734 2.783 1
1 769 . 5 1 1 A 73 73 LEU N N 72 119.411 122.541 -3.130 1
1 770 . 5 1 1 A 74 74 VAL H H 73 8.021 7.575 0.446 1
1 771 . 5 1 1 A 74 74 VAL HA H 73 3.532 3.313 0.219 1
1 779 . 5 1 1 A 74 74 VAL C C 73 177.126 177.842 -0.716 1
1 780 . 5 1 1 A 74 74 VAL CA C 73 66.250 66.384 -0.134 1
1 781 . 5 1 1 A 74 74 VAL CB C 73 31.212 31.090 0.122 1
1 784 . 5 1 1 A 74 74 VAL N N 73 118.747 119.224 -0.477 1
1 785 . 5 1 1 A 75 75 GLU H H 74 7.232 7.986 -0.754 1
1 786 . 5 1 1 A 75 75 GLU HA H 74 3.013 4.122 -1.109 1
1 791 . 5 1 1 A 75 75 GLU C C 74 178.804 179.514 -0.710 1
1 792 . 5 1 1 A 75 75 GLU CA C 74 60.536 59.887 0.649 1
1 793 . 5 1 1 A 75 75 GLU CB C 74 27.009 29.001 -1.992 1
1 795 . 5 1 1 A 75 75 GLU N N 74 118.660 119.654 -0.994 1
1 796 . 5 1 1 A 76 76 LYS H H 75 7.051 7.972 -0.921 1
1 797 . 5 1 1 A 76 76 LYS HA H 75 3.765 4.103 -0.338 1
1 806 . 5 1 1 A 76 76 LYS C C 75 177.765 177.970 -0.205 1
1 807 . 5 1 1 A 76 76 LYS CA C 75 58.357 58.370 -0.013 1
1 808 . 5 1 1 A 76 76 LYS CB C 75 31.939 32.229 -0.290 1
1 812 . 5 1 1 A 76 76 LYS N N 75 116.112 119.350 -3.238 1
1 813 . 5 1 1 A 77 77 TYR H H 76 7.067 7.926 -0.859 1
1 814 . 5 1 1 A 77 77 TYR HA H 76 4.036 4.186 -0.150 1
1 821 . 5 1 1 A 77 77 TYR C C 76 177.752 177.213 0.539 1
1 822 . 5 1 1 A 77 77 TYR CA C 76 61.820 61.207 0.613 1
1 823 . 5 1 1 A 77 77 TYR CB C 76 38.480 38.677 -0.197 1
1 828 . 5 1 1 A 77 77 TYR N N 76 118.434 121.908 -3.474 1
1 829 . 5 1 1 A 78 78 ILE H H 77 7.554 8.403 -0.849 1
1 830 . 5 1 1 A 78 78 ILE HA H 77 3.159 3.598 -0.439 1
1 840 . 5 1 1 A 78 78 ILE C C 77 177.341 177.852 -0.511 1
1 841 . 5 1 1 A 78 78 ILE CA C 77 65.177 65.176 0.001 1
1 842 . 5 1 1 A 78 78 ILE CB C 77 37.339 37.763 -0.424 1
1 846 . 5 1 1 A 78 78 ILE N N 77 117.672 121.453 -3.781 1
1 847 . 5 1 1 A 79 79 GLU H H 78 8.296 8.078 0.218 1
1 848 . 5 1 1 A 79 79 GLU HA H 78 3.557 3.772 -0.215 1
1 853 . 5 1 1 A 79 79 GLU C C 78 177.742 178.816 -1.074 1
1 854 . 5 1 1 A 79 79 GLU CA C 78 60.847 60.077 0.770 1
1 855 . 5 1 1 A 79 79 GLU CB C 78 29.594 29.210 0.384 1
1 857 . 5 1 1 A 79 79 GLU N N 78 118.701 120.863 -2.162 1
1 858 . 5 1 1 A 80 80 GLU H H 79 8.330 8.271 0.059 1
1 859 . 5 1 1 A 80 80 GLU HA H 79 3.774 4.003 -0.229 1
1 864 . 5 1 1 A 80 80 GLU C C 79 179.926 179.300 0.626 1
1 865 . 5 1 1 A 80 80 GLU CA C 79 59.581 58.949 0.632 1
1 866 . 5 1 1 A 80 80 GLU CB C 79 29.062 29.042 0.020 1
1 868 . 5 1 1 A 80 80 GLU N N 79 116.767 117.941 -1.174 1
1 869 . 5 1 1 A 81 81 GLN H H 80 7.634 7.674 -0.040 1
1 870 . 5 1 1 A 81 81 GLN HA H 80 3.605 3.856 -0.251 1
1 877 . 5 1 1 A 81 81 GLN C C 80 179.681 178.507 1.174 1
1 878 . 5 1 1 A 81 81 GLN CA C 80 57.765 58.441 -0.676 1
1 879 . 5 1 1 A 81 81 GLN CB C 80 28.079 28.145 -0.066 1
1 881 . 5 1 1 A 81 81 GLN N N 80 116.325 118.737 -2.412 1
1 883 . 5 1 1 A 82 82 LEU H H 81 8.156 7.495 0.661 1
1 884 . 5 1 1 A 82 82 LEU HA H 81 3.536 3.795 -0.259 1
1 894 . 5 1 1 A 82 82 LEU C C 81 178.945 179.347 -0.402 1
1 895 . 5 1 1 A 82 82 LEU CA C 81 57.761 56.833 0.928 1
1 896 . 5 1 1 A 82 82 LEU CB C 81 40.961 41.015 -0.054 1
1 900 . 5 1 1 A 82 82 LEU N N 81 121.546 120.446 1.100 1
1 901 . 5 1 1 A 83 83 LEU H H 82 8.326 7.959 0.367 1
1 902 . 5 1 1 A 83 83 LEU HA H 82 4.198 4.265 -0.067 1
1 912 . 5 1 1 A 83 83 LEU C C 82 178.631 179.051 -0.420 1
1 913 . 5 1 1 A 83 83 LEU CA C 82 57.016 57.106 -0.090 1
1 914 . 5 1 1 A 83 83 LEU CB C 82 42.182 40.792 1.390 1
1 918 . 5 1 1 A 83 83 LEU N N 82 120.426 119.068 1.358 1
1 919 . 5 1 1 A 84 84 GLN H H 83 6.992 7.686 -0.694 1
1 920 . 5 1 1 A 84 84 GLN HA H 83 3.877 3.991 -0.114 1
1 927 . 5 1 1 A 84 84 GLN C C 83 177.008 176.972 0.036 1
1 928 . 5 1 1 A 84 84 GLN CA C 83 57.543 58.359 -0.816 1
1 929 . 5 1 1 A 84 84 GLN CB C 83 28.688 28.400 0.288 1
1 931 . 5 1 1 A 84 84 GLN N N 83 114.001 117.276 -3.275 1
1 933 . 5 1 1 A 85 85 ARG H H 84 7.072 7.348 -0.276 1
1 934 . 5 1 1 A 85 85 ARG HA H 84 4.047 4.396 -0.349 1
1 942 . 5 1 1 A 85 85 ARG C C 84 175.999 175.558 0.441 1
1 943 . 5 1 1 A 85 85 ARG CA C 84 56.764 56.005 0.759 1
1 944 . 5 1 1 A 85 85 ARG CB C 84 32.044 32.493 -0.449 1
1 947 . 5 1 1 A 85 85 ARG N N 84 115.827 116.846 -1.019 1
1 949 . 5 1 1 A 86 86 ILE H H 85 8.238 7.547 0.691 1
1 950 . 5 1 1 A 86 86 ILE HA H 85 4.389 4.527 -0.138 1
1 960 . 5 1 1 A 86 86 ILE CA C 85 58.007 57.767 0.240 1
1 961 . 5 1 1 A 86 86 ILE CB C 85 39.604 38.774 0.830 1
1 965 . 5 1 1 A 86 86 ILE N N 85 119.285 120.010 -0.725 1
1 966 . 5 1 1 A 87 87 PRO HA H 86 4.392 4.491 -0.099 1
1 973 . 5 1 1 A 87 87 PRO C C 86 177.622 177.278 0.344 1
1 974 . 5 1 1 A 87 87 PRO CA C 86 64.665 64.518 0.147 1
1 975 . 5 1 1 A 87 87 PRO CB C 86 32.020 31.880 0.140 1
1 978 . 5 1 1 A 88 88 GLU H H 87 8.312 8.377 -0.065 1
1 979 . 5 1 1 A 88 88 GLU HA H 87 4.208 4.463 -0.255 1
1 984 . 5 1 1 A 88 88 GLU C C 87 175.554 175.863 -0.309 1
1 985 . 5 1 1 A 88 88 GLU CA C 87 56.045 56.242 -0.197 1
1 986 . 5 1 1 A 88 88 GLU CB C 87 28.654 29.965 -1.311 1
1 988 . 5 1 1 A 88 88 GLU N N 87 114.256 116.903 -2.647 1
1 989 . 5 1 1 A 89 89 PHE H H 88 7.946 7.461 0.485 1
1 990 . 5 1 1 A 89 89 PHE HA H 88 3.993 4.488 -0.495 1
1 998 . 5 1 1 A 89 89 PHE C C 88 173.460 175.069 -1.609 1
1 999 . 5 1 1 A 89 89 PHE CA C 88 60.119 59.267 0.852 1
1 1000 . 5 1 1 A 89 89 PHE CB C 88 39.994 39.793 0.201 1
1 1006 . 5 1 1 A 89 89 PHE N N 88 121.550 123.398 -1.848 1
1 1007 . 5 1 1 A 90 90 ASN H H 89 7.266 7.827 -0.561 1
1 1008 . 5 1 1 A 90 90 ASN HA H 89 4.454 5.028 -0.574 1
1 1013 . 5 1 1 A 90 90 ASN C C 89 173.921 174.962 -1.041 1
1 1014 . 5 1 1 A 90 90 ASN CA C 89 51.839 51.838 0.001 1
1 1015 . 5 1 1 A 90 90 ASN CB C 89 40.674 39.367 1.307 1
1 1016 . 5 1 1 A 90 90 ASN N N 89 125.344 124.412 0.932 1
1 1018 . 5 1 1 A 91 91 MET H H 90 8.968 8.893 0.075 1
1 1019 . 5 1 1 A 91 91 MET HA H 90 4.049 4.159 -0.110 1
1 1027 . 5 1 1 A 91 91 MET C C 90 177.475 178.156 -0.681 1
1 1028 . 5 1 1 A 91 91 MET CA C 90 57.758 59.063 -1.305 1
1 1029 . 5 1 1 A 91 91 MET CB C 90 32.250 32.345 -0.095 1
1 1032 . 5 1 1 A 91 91 MET N N 90 127.052 125.199 1.853 1
1 1033 . 5 1 1 A 92 92 ALA H H 91 8.292 8.210 0.082 1
1 1034 . 5 1 1 A 92 92 ALA HA H 91 4.059 4.024 0.035 1
1 1038 . 5 1 1 A 92 92 ALA C C 91 180.412 179.997 0.415 1
1 1039 . 5 1 1 A 92 92 ALA CA C 91 55.368 55.138 0.230 1
1 1040 . 5 1 1 A 92 92 ALA CB C 91 17.527 18.173 -0.646 1
1 1041 . 5 1 1 A 92 92 ALA N N 91 123.752 121.171 2.581 1
1 1042 . 5 1 1 A 93 93 ALA H H 92 7.931 8.011 -0.080 1
1 1043 . 5 1 1 A 93 93 ALA HA H 92 4.054 4.103 -0.049 1
1 1047 . 5 1 1 A 93 93 ALA C C 92 180.482 179.901 0.581 1
1 1048 . 5 1 1 A 93 93 ALA CA C 92 54.614 54.871 -0.257 1
1 1049 . 5 1 1 A 93 93 ALA CB C 92 18.098 18.217 -0.119 1
1 1050 . 5 1 1 A 93 93 ALA N N 92 121.158 120.446 0.712 1
1 1051 . 5 1 1 A 94 94 PHE H H 93 8.110 7.794 0.316 1
1 1052 . 5 1 1 A 94 94 PHE HA H 93 4.304 4.188 0.116 1
1 1060 . 5 1 1 A 94 94 PHE C C 93 177.350 177.583 -0.233 1
1 1061 . 5 1 1 A 94 94 PHE CA C 93 61.641 61.486 0.155 1
1 1062 . 5 1 1 A 94 94 PHE CB C 93 40.014 39.336 0.678 1
1 1068 . 5 1 1 A 94 94 PHE N N 93 119.807 119.877 -0.070 1
1 1069 . 5 1 1 A 95 95 THR H H 94 8.726 8.389 0.337 1
1 1070 . 5 1 1 A 95 95 THR HA H 94 3.569 3.912 -0.343 1
1 1075 . 5 1 1 A 95 95 THR C C 94 176.932 176.498 0.434 1
1 1076 . 5 1 1 A 95 95 THR CA C 94 66.833 65.576 1.257 1
1 1077 . 5 1 1 A 95 95 THR CB C 94 68.445 68.264 0.181 1
1 1079 . 5 1 1 A 95 95 THR N N 94 113.074 112.597 0.477 1
1 1080 . 5 1 1 A 96 96 THR H H 95 7.657 8.012 -0.355 1
1 1081 . 5 1 1 A 96 96 THR HA H 95 3.945 3.926 0.019 1
1 1086 . 5 1 1 A 96 96 THR C C 95 176.386 176.676 -0.290 1
1 1087 . 5 1 1 A 96 96 THR CA C 95 66.550 65.688 0.862 1
1 1088 . 5 1 1 A 96 96 THR CB C 95 68.583 69.012 -0.429 1
1 1090 . 5 1 1 A 96 96 THR N N 95 117.927 117.794 0.133 1
1 1091 . 5 1 1 A 97 97 THR H H 96 7.699 7.696 0.003 1
1 1092 . 5 1 1 A 97 97 THR HA H 96 3.905 4.222 -0.317 1
1 1097 . 5 1 1 A 97 97 THR C C 96 176.572 176.748 -0.176 1
1 1098 . 5 1 1 A 97 97 THR CA C 96 65.979 66.341 -0.362 1
1 1099 . 5 1 1 A 97 97 THR CB C 96 68.553 68.404 0.149 1
1 1101 . 5 1 1 A 97 97 THR N N 96 118.518 117.249 1.269 1
1 1102 . 5 1 1 A 98 98 LEU H H 97 8.304 8.037 0.267 1
1 1103 . 5 1 1 A 98 98 LEU HA H 97 3.725 3.830 -0.105 1
1 1113 . 5 1 1 A 98 98 LEU C C 97 178.490 178.330 0.160 1
1 1114 . 5 1 1 A 98 98 LEU CA C 97 58.517 58.105 0.412 1
1 1115 . 5 1 1 A 98 98 LEU CB C 97 41.697 41.015 0.682 1
1 1119 . 5 1 1 A 98 98 LEU N N 97 122.882 122.275 0.607 1
1 1120 . 5 1 1 A 99 99 GLN H H 98 7.639 8.191 -0.552 1
1 1121 . 5 1 1 A 99 99 GLN HA H 98 3.927 4.156 -0.229 1
1 1128 . 5 1 1 A 99 99 GLN C C 98 178.068 177.682 0.386 1
1 1129 . 5 1 1 A 99 99 GLN CA C 98 58.735 58.053 0.682 1
1 1130 . 5 1 1 A 99 99 GLN CB C 98 27.986 27.901 0.085 1
1 1132 . 5 1 1 A 99 99 GLN N N 98 114.302 116.497 -2.195 1
1 1134 . 5 1 1 A 100 100 HIS H H 99 7.575 7.499 0.076 1
1 1135 . 5 1 1 A 100 100 HIS HA H 99 4.524 4.338 0.186 1
1 1139 . 5 1 1 A 100 100 HIS C C 99 174.789 177.868 -3.079 1
1 1140 . 5 1 1 A 100 100 HIS CA C 99 56.154 59.676 -3.522 1
1 1141 . 5 1 1 A 100 100 HIS CB C 99 28.946 30.353 -1.407 1
1 1143 . 5 1 1 A 100 100 HIS N N 99 114.778 118.317 -3.539 1
1 1144 . 5 1 1 A 101 101 HIS H H 100 7.773 8.097 -0.324 1
1 1145 . 5 1 1 A 101 101 HIS HA H 100 4.704 4.367 0.337 1
1 1149 . 5 1 1 A 101 101 HIS C C 100 174.818 177.253 -2.435 1
1 1150 . 5 1 1 A 101 101 HIS CA C 100 54.830 58.933 -4.103 1
1 1151 . 5 1 1 A 101 101 HIS CB C 100 29.749 28.762 0.987 1
1 1153 . 5 1 1 A 101 101 HIS N N 100 117.397 117.146 0.251 1
1 1154 . 5 1 1 A 102 102 LYS H H 101 7.324 8.110 -0.786 1
1 1155 . 5 1 1 A 102 102 LYS HA H 101 3.611 4.108 -0.497 1
1 1164 . 5 1 1 A 102 102 LYS C C 101 176.823 178.001 -1.178 1
1 1165 . 5 1 1 A 102 102 LYS CA C 101 59.915 58.861 1.054 1
1 1166 . 5 1 1 A 102 102 LYS CB C 101 32.825 32.080 0.745 1
1 1170 . 5 1 1 A 102 102 LYS N N 101 120.533 122.049 -1.516 1
1 1171 . 5 1 1 A 103 103 ASP H H 102 8.361 7.724 0.637 1
1 1172 . 5 1 1 A 103 103 ASP HA H 102 4.421 4.538 -0.117 1
1 1175 . 5 1 1 A 103 103 ASP C C 102 176.793 176.410 0.383 1
1 1176 . 5 1 1 A 103 103 ASP CA C 102 55.500 56.144 -0.644 1
1 1177 . 5 1 1 A 103 103 ASP CB C 102 40.178 40.577 -0.399 1
1 1178 . 5 1 1 A 103 103 ASP N N 102 114.814 117.753 -2.939 1
1 1179 . 5 1 1 A 104 104 GLU H H 103 7.858 8.251 -0.393 1
1 1180 . 5 1 1 A 104 104 GLU HA H 103 4.339 4.682 -0.343 1
1 1183 . 5 1 1 A 104 104 GLU C C 103 175.777 176.627 -0.850 1
1 1184 . 5 1 1 A 104 104 GLU CA C 103 56.356 57.838 -1.482 1
1 1185 . 5 1 1 A 104 104 GLU CB C 103 31.293 32.631 -1.338 1
1 1186 . 5 1 1 A 104 104 GLU N N 103 116.826 118.785 -1.959 1
1 1187 . 5 1 1 A 105 105 VAL H H 104 7.201 7.893 -0.692 1
1 1188 . 5 1 1 A 105 105 VAL HA H 104 4.296 4.090 0.206 1
1 1196 . 5 1 1 A 105 105 VAL C C 104 174.482 176.199 -1.717 1
1 1197 . 5 1 1 A 105 105 VAL CA C 104 60.370 63.338 -2.968 1
1 1198 . 5 1 1 A 105 105 VAL CB C 104 34.341 32.124 2.217 1
1 1201 . 5 1 1 A 105 105 VAL N N 104 116.422 119.773 -3.351 1
1 1202 . 5 1 1 A 106 106 ALA H H 105 8.487 8.524 -0.037 1
1 1203 . 5 1 1 A 106 106 ALA HA H 105 4.172 4.428 -0.256 1
1 1207 . 5 1 1 A 106 106 ALA C C 105 179.030 178.914 0.116 1
1 1208 . 5 1 1 A 106 106 ALA CA C 105 52.966 52.694 0.272 1
1 1209 . 5 1 1 A 106 106 ALA CB C 105 19.371 19.597 -0.226 1
1 1210 . 5 1 1 A 106 106 ALA N N 105 128.313 127.720 0.593 1
1 1211 . 5 1 1 A 107 107 GLY H H 106 8.738 8.797 -0.059 1
1 1212 . 5 1 1 A 107 107 GLY HA2 H 106 3.773 3.868 -0.095 1
1 1213 . 5 1 1 A 107 107 GLY HA3 H 106 3.998 3.934 0.064 1
1 1214 . 5 1 1 A 107 107 GLY C C 106 174.958 175.337 -0.379 1
1 1215 . 5 1 1 A 107 107 GLY CA C 106 47.449 47.112 0.337 1
1 1216 . 5 1 1 A 107 107 GLY N N 106 110.612 110.920 -0.308 1
1 1217 . 5 1 1 A 108 108 ASP H H 107 8.535 7.856 0.679 1
1 1218 . 5 1 1 A 108 108 ASP HA H 107 4.333 4.349 -0.016 1
1 1221 . 5 1 1 A 108 108 ASP C C 107 179.133 178.992 0.141 1
1 1222 . 5 1 1 A 108 108 ASP CA C 107 56.721 56.244 0.477 1
1 1223 . 5 1 1 A 108 108 ASP CB C 107 39.336 40.687 -1.351 1
1 1224 . 5 1 1 A 108 108 ASP N N 107 117.474 122.279 -4.805 1
1 1225 . 5 1 1 A 109 109 ILE H H 108 7.459 7.902 -0.443 1
1 1226 . 5 1 1 A 109 109 ILE HA H 108 3.688 3.810 -0.122 1
1 1236 . 5 1 1 A 109 109 ILE C C 108 176.735 178.437 -1.702 1
1 1237 . 5 1 1 A 109 109 ILE CA C 108 63.474 65.407 -1.933 1
1 1238 . 5 1 1 A 109 109 ILE CB C 108 37.340 37.618 -0.278 1
1 1242 . 5 1 1 A 109 109 ILE N N 108 119.609 119.694 -0.085 1
1 1243 . 5 1 1 A 110 110 PHE H H 109 7.920 8.378 -0.458 1
1 1244 . 5 1 1 A 110 110 PHE HA H 109 3.759 4.078 -0.319 1
1 1252 . 5 1 1 A 110 110 PHE C C 109 177.132 177.386 -0.254 1
1 1253 . 5 1 1 A 110 110 PHE CA C 109 62.766 61.228 1.538 1
1 1254 . 5 1 1 A 110 110 PHE CB C 109 39.752 39.281 0.471 1
1 1260 . 5 1 1 A 110 110 PHE N N 109 120.906 120.455 0.451 1
1 1261 . 5 1 1 A 111 111 ASP H H 110 8.639 8.308 0.331 1
1 1262 . 5 1 1 A 111 111 ASP HA H 110 4.216 4.213 0.003 1
1 1265 . 5 1 1 A 111 111 ASP C C 110 178.900 178.415 0.485 1
1 1266 . 5 1 1 A 111 111 ASP CA C 110 57.105 57.235 -0.130 1
1 1267 . 5 1 1 A 111 111 ASP CB C 110 39.697 41.710 -2.013 1
1 1268 . 5 1 1 A 111 111 ASP N N 110 117.124 119.028 -1.904 1
1 1269 . 5 1 1 A 112 112 MET H H 111 7.331 7.542 -0.211 1
1 1270 . 5 1 1 A 112 112 MET HA H 111 4.081 4.120 -0.039 1
1 1278 . 5 1 1 A 112 112 MET C C 111 179.052 178.150 0.902 1
1 1279 . 5 1 1 A 112 112 MET CA C 111 58.202 58.116 0.086 1
1 1280 . 5 1 1 A 112 112 MET CB C 111 31.827 32.437 -0.610 1
1 1283 . 5 1 1 A 112 112 MET N N 111 118.061 119.442 -1.381 1
1 1284 . 5 1 1 A 113 113 LEU H H 112 8.001 8.060 -0.059 1
1 1285 . 5 1 1 A 113 113 LEU HA H 112 3.723 3.561 0.162 1
1 1295 . 5 1 1 A 113 113 LEU C C 112 179.747 178.610 1.137 1
1 1296 . 5 1 1 A 113 113 LEU CA C 112 57.371 57.392 -0.021 1
1 1297 . 5 1 1 A 113 113 LEU CB C 112 40.671 41.086 -0.415 1
1 1301 . 5 1 1 A 113 113 LEU N N 112 120.426 119.660 0.766 1
1 1302 . 5 1 1 A 114 114 LEU H H 113 7.744 7.637 0.107 1
1 1303 . 5 1 1 A 114 114 LEU HA H 113 4.007 3.492 0.515 1
1 1313 . 5 1 1 A 114 114 LEU C C 113 179.358 178.521 0.837 1
1 1314 . 5 1 1 A 114 114 LEU CA C 113 57.202 57.505 -0.303 1
1 1315 . 5 1 1 A 114 114 LEU CB C 113 41.727 41.577 0.150 1
1 1319 . 5 1 1 A 114 114 LEU N N 113 119.584 119.620 -0.036 1
1 1320 . 5 1 1 A 115 115 THR H H 114 7.353 7.582 -0.229 1
1 1321 . 5 1 1 A 115 115 THR HA H 114 4.071 4.112 -0.041 1
1 1327 . 5 1 1 A 115 115 THR C C 114 173.591 176.375 -2.784 1
1 1328 . 5 1 1 A 115 115 THR CA C 114 65.332 64.483 0.849 1
1 1329 . 5 1 1 A 115 115 THR CB C 114 70.319 68.649 1.670 1
1 1331 . 5 1 1 A 115 115 THR N N 114 107.535 112.309 -4.774 1
1 1332 . 5 1 1 A 116 116 PHE H H 115 6.979 7.852 -0.873 1
1 1333 . 5 1 1 A 116 116 PHE HA H 115 5.022 4.396 0.626 1
1 1341 . 5 1 1 A 116 116 PHE C C 115 176.488 176.032 0.456 1
1 1342 . 5 1 1 A 116 116 PHE CA C 115 55.911 61.050 -5.139 1
1 1343 . 5 1 1 A 116 116 PHE CB C 115 38.521 38.933 -0.412 1
1 1349 . 5 1 1 A 116 116 PHE N N 115 112.366 119.898 -7.532 1
1 1350 . 5 1 1 A 117 117 THR H H 116 7.564 8.104 -0.540 1
1 1351 . 5 1 1 A 117 117 THR HA H 116 4.626 4.887 -0.261 1
1 1356 . 5 1 1 A 117 117 THR C C 116 174.085 174.137 -0.052 1
1 1357 . 5 1 1 A 117 117 THR CA C 116 61.636 62.922 -1.286 1
1 1358 . 5 1 1 A 117 117 THR CB C 116 70.915 72.147 -1.232 1
1 1360 . 5 1 1 A 117 117 THR N N 116 105.498 112.894 -7.396 1
1 1361 . 5 1 1 A 118 118 ASP H H 117 8.270 7.772 0.498 1
1 1362 . 5 1 1 A 118 118 ASP HA H 117 4.955 4.690 0.265 1
1 1365 . 5 1 1 A 118 118 ASP C C 117 176.328 176.365 -0.037 1
1 1366 . 5 1 1 A 118 118 ASP CA C 117 53.417 53.459 -0.042 1
1 1367 . 5 1 1 A 118 118 ASP CB C 117 43.388 40.616 2.772 1
1 1368 . 5 1 1 A 118 118 ASP N N 117 124.409 121.519 2.890 1
1 1369 . 5 1 1 A 119 119 PHE H H 118 8.973 8.745 0.228 1
1 1370 . 5 1 1 A 119 119 PHE HA H 118 3.506 4.206 -0.700 1
1 1378 . 5 1 1 A 119 119 PHE CA C 118 61.490 61.357 0.133 1
1 1379 . 5 1 1 A 119 119 PHE CB C 118 39.246 39.512 -0.266 1
1 1385 . 5 1 1 A 119 119 PHE N N 118 126.688 126.445 0.243 1
1 1386 . 5 1 1 A 120 120 LEU H H 119 8.099 8.411 -0.312 1
1 1387 . 5 1 1 A 120 120 LEU HA H 119 3.842 3.911 -0.069 1
1 1397 . 5 1 1 A 120 120 LEU C C 119 179.601 179.430 0.171 1
1 1398 . 5 1 1 A 120 120 LEU CA C 119 58.174 57.727 0.447 1
1 1399 . 5 1 1 A 120 120 LEU CB C 119 40.315 41.051 -0.736 1
1 1403 . 5 1 1 A 120 120 LEU N N 119 117.930 119.962 -2.032 1
1 1404 . 5 1 1 A 121 121 ALA H H 120 7.729 7.946 -0.217 1
1 1405 . 5 1 1 A 121 121 ALA HA H 120 3.996 4.111 -0.115 1
1 1409 . 5 1 1 A 121 121 ALA C C 120 180.995 179.410 1.585 1
1 1410 . 5 1 1 A 121 121 ALA CA C 120 54.832 54.618 0.214 1
1 1411 . 5 1 1 A 121 121 ALA CB C 120 17.706 18.347 -0.641 1
1 1412 . 5 1 1 A 121 121 ALA N N 120 123.195 121.659 1.536 1
1 1413 . 5 1 1 A 122 122 PHE H H 121 7.943 7.896 0.047 1
1 1414 . 5 1 1 A 122 122 PHE HA H 121 3.887 3.836 0.051 1
1 1419 . 5 1 1 A 122 122 PHE C C 121 175.410 176.954 -1.544 1
1 1420 . 5 1 1 A 122 122 PHE CA C 121 61.075 60.710 0.365 1
1 1421 . 5 1 1 A 122 122 PHE CB C 121 38.115 38.833 -0.718 1
1 1424 . 5 1 1 A 122 122 PHE N N 121 121.798 120.496 1.302 1
1 1425 . 5 1 1 A 123 123 LYS H H 122 8.468 7.816 0.652 1
1 1426 . 5 1 1 A 123 123 LYS HA H 122 3.077 3.846 -0.769 1
1 1435 . 5 1 1 A 123 123 LYS C C 122 178.453 178.737 -0.284 1
1 1436 . 5 1 1 A 123 123 LYS CA C 122 59.855 59.935 -0.080 1
1 1437 . 5 1 1 A 123 123 LYS CB C 122 32.374 32.330 0.044 1
1 1441 . 5 1 1 A 123 123 LYS N N 122 120.614 118.436 2.178 1
1 1442 . 5 1 1 A 124 124 GLU H H 123 8.100 7.794 0.306 1
1 1443 . 5 1 1 A 124 124 GLU HA H 123 3.652 4.050 -0.398 1
1 1448 . 5 1 1 A 124 124 GLU C C 123 177.743 178.448 -0.705 1
1 1449 . 5 1 1 A 124 124 GLU CA C 123 59.406 59.461 -0.055 1
1 1450 . 5 1 1 A 124 124 GLU CB C 123 28.811 29.381 -0.570 1
1 1452 . 5 1 1 A 124 124 GLU N N 123 117.404 118.780 -1.376 1
1 1453 . 5 1 1 A 125 125 MET H H 124 7.537 7.558 -0.021 1
1 1454 . 5 1 1 A 125 125 MET HA H 124 3.860 3.931 -0.071 1
1 1462 . 5 1 1 A 125 125 MET C C 124 179.522 178.367 1.155 1
1 1463 . 5 1 1 A 125 125 MET CA C 124 58.832 58.469 0.363 1
1 1464 . 5 1 1 A 125 125 MET CB C 124 31.765 31.279 0.486 1
1 1467 . 5 1 1 A 125 125 MET N N 124 119.413 118.940 0.473 1
1 1468 . 5 1 1 A 126 126 PHE H H 125 7.148 7.468 -0.320 1
1 1469 . 5 1 1 A 126 126 PHE HA H 125 3.633 4.211 -0.578 1
1 1476 . 5 1 1 A 126 126 PHE C C 125 178.994 178.227 0.767 1
1 1477 . 5 1 1 A 126 126 PHE CA C 125 63.148 61.037 2.111 1
1 1478 . 5 1 1 A 126 126 PHE CB C 125 39.830 38.332 1.498 1
1 1483 . 5 1 1 A 126 126 PHE N N 125 120.013 118.518 1.495 1
1 1484 . 5 1 1 A 127 127 LEU H H 126 8.369 8.456 -0.087 1
1 1485 . 5 1 1 A 127 127 LEU HA H 126 3.972 4.030 -0.058 1
1 1495 . 5 1 1 A 127 127 LEU C C 126 180.621 179.016 1.605 1
1 1496 . 5 1 1 A 127 127 LEU CA C 126 57.944 57.899 0.045 1
1 1497 . 5 1 1 A 127 127 LEU CB C 126 40.543 41.217 -0.674 1
1 1501 . 5 1 1 A 127 127 LEU N N 126 119.692 119.829 -0.137 1
1 1502 . 5 1 1 A 128 128 ASP H H 127 8.578 8.185 0.393 1
1 1503 . 5 1 1 A 128 128 ASP HA H 127 4.308 4.332 -0.024 1
1 1506 . 5 1 1 A 128 128 ASP C C 127 178.254 178.210 0.044 1
1 1507 . 5 1 1 A 128 128 ASP CA C 127 56.964 57.254 -0.290 1
1 1508 . 5 1 1 A 128 128 ASP CB C 127 39.735 40.947 -1.212 1
1 1509 . 5 1 1 A 128 128 ASP N N 127 121.926 119.198 2.728 1
1 1510 . 5 1 1 A 129 129 TYR H H 128 7.710 8.242 -0.532 1
1 1511 . 5 1 1 A 129 129 TYR HA H 128 3.908 4.276 -0.368 1
1 1518 . 5 1 1 A 129 129 TYR C C 128 177.633 177.732 -0.099 1
1 1519 . 5 1 1 A 129 129 TYR CA C 128 61.796 61.405 0.391 1
1 1520 . 5 1 1 A 129 129 TYR CB C 128 39.372 38.781 0.591 1
1 1525 . 5 1 1 A 129 129 TYR N N 128 122.548 120.541 2.007 1
1 1526 . 5 1 1 A 130 130 ARG H H 129 8.622 8.389 0.233 1
1 1527 . 5 1 1 A 130 130 ARG HA H 129 3.722 3.933 -0.211 1
1 1535 . 5 1 1 A 130 130 ARG CA C 129 60.084 59.468 0.616 1
1 1536 . 5 1 1 A 130 130 ARG CB C 129 29.902 29.956 -0.054 1
1 1539 . 5 1 1 A 130 130 ARG N N 129 118.302 119.235 -0.933 1
1 1541 . 5 1 1 A 131 131 ALA H H 130 7.936 8.015 -0.079 1
1 1542 . 5 1 1 A 131 131 ALA HA H 130 3.997 4.006 -0.009 1
1 1546 . 5 1 1 A 131 131 ALA C C 130 180.456 179.950 0.506 1
1 1547 . 5 1 1 A 131 131 ALA CA C 130 55.133 54.994 0.139 1
1 1548 . 5 1 1 A 131 131 ALA CB C 130 17.750 18.277 -0.527 1
1 1549 . 5 1 1 A 131 131 ALA N N 130 119.788 121.832 -2.044 1
1 1550 . 5 1 1 A 132 132 GLU H H 131 7.622 7.700 -0.078 1
1 1551 . 5 1 1 A 132 132 GLU HA H 131 3.862 3.956 -0.094 1
1 1556 . 5 1 1 A 132 132 GLU C C 131 179.528 179.009 0.519 1
1 1557 . 5 1 1 A 132 132 GLU CA C 131 58.849 58.888 -0.039 1
1 1558 . 5 1 1 A 132 132 GLU CB C 131 28.930 29.070 -0.140 1
1 1560 . 5 1 1 A 132 132 GLU N N 131 118.428 118.060 0.368 1
1 1561 . 5 1 1 A 133 133 LYS H H 132 7.853 7.615 0.238 1
1 1562 . 5 1 1 A 133 133 LYS HA H 132 3.722 3.999 -0.277 1
1 1571 . 5 1 1 A 133 133 LYS C C 132 175.725 178.312 -2.587 1
1 1572 . 5 1 1 A 133 133 LYS CA C 132 57.544 58.872 -1.328 1
1 1573 . 5 1 1 A 133 133 LYS CB C 132 31.770 32.116 -0.346 1
1 1577 . 5 1 1 A 133 133 LYS N N 132 119.473 119.038 0.435 1
1 1578 . 5 1 1 A 134 134 GLU H H 133 8.151 7.806 0.345 1
1 1579 . 5 1 1 A 134 134 GLU HA H 133 4.161 4.201 -0.040 1
1 1584 . 5 1 1 A 134 134 GLU C C 133 177.453 176.714 0.739 1
1 1585 . 5 1 1 A 134 134 GLU CA C 133 57.222 57.352 -0.130 1
1 1586 . 5 1 1 A 134 134 GLU CB C 133 30.091 29.447 0.644 1
1 1588 . 5 1 1 A 134 134 GLU N N 133 116.525 117.149 -0.624 1
1 1589 . 5 1 1 A 135 135 GLY H H 134 7.702 7.607 0.095 1
1 1590 . 5 1 1 A 135 135 GLY HA2 H 134 3.896 4.103 -0.207 1
1 1591 . 5 1 1 A 135 135 GLY HA3 H 134 3.897 4.108 -0.211 1
1 1592 . 5 1 1 A 135 135 GLY C C 134 174.538 174.676 -0.138 1
1 1593 . 5 1 1 A 135 135 GLY CA C 134 45.975 45.790 0.185 1
1 1594 . 5 1 1 A 135 135 GLY N N 134 107.924 106.179 1.745 1
1 1595 . 5 1 1 A 136 136 ARG H H 135 8.045 7.801 0.244 1
1 1596 . 5 1 1 A 136 136 ARG HA H 135 4.323 4.061 0.262 1
1 1604 . 5 1 1 A 136 136 ARG C C 135 175.864 177.187 -1.323 1
1 1605 . 5 1 1 A 136 136 ARG CA C 135 56.016 57.849 -1.833 1
1 1606 . 5 1 1 A 136 136 ARG CB C 135 30.987 30.116 0.871 1
1 1609 . 5 1 1 A 136 136 ARG N N 135 119.708 120.033 -0.325 1
1 1 . 6 1 1 A 14 14 PHE CA C 13 58.199 56.316 1.883 1
1 2 . 6 1 1 A 14 14 PHE CB C 13 39.717 39.471 0.246 1
1 3 . 6 1 1 A 15 15 SER H H 14 8.299 8.560 -0.261 1
1 4 . 6 1 1 A 15 15 SER HA H 14 4.359 4.332 0.027 1
1 7 . 6 1 1 A 15 15 SER CA C 14 58.249 59.045 -0.796 1
1 8 . 6 1 1 A 15 15 SER CB C 14 63.936 65.471 -1.535 1
1 9 . 6 1 1 A 15 15 SER N N 14 117.379 123.299 -5.920 1
1 10 . 6 1 1 A 16 16 SER H H 15 8.255 8.133 0.122 1
1 11 . 6 1 1 A 16 16 SER HA H 15 3.729 4.202 -0.473 1
1 14 . 6 1 1 A 16 16 SER CA C 15 58.224 59.620 -1.396 1
1 15 . 6 1 1 A 16 16 SER CB C 15 63.886 63.032 0.854 1
1 16 . 6 1 1 A 16 16 SER N N 15 117.694 115.400 2.294 1
1 17 . 6 1 1 A 17 17 ALA H H 16 8.333 7.954 0.379 1
1 18 . 6 1 1 A 17 17 ALA HA H 16 4.252 4.185 0.067 1
1 22 . 6 1 1 A 17 17 ALA CA C 16 53.377 54.924 -1.547 1
1 23 . 6 1 1 A 17 17 ALA CB C 16 18.896 18.660 0.236 1
1 24 . 6 1 1 A 17 17 ALA N N 16 125.462 123.336 2.126 1
1 25 . 6 1 1 A 18 18 SER H H 17 8.219 7.696 0.523 1
1 26 . 6 1 1 A 18 18 SER HA H 17 4.332 4.382 -0.050 1
1 29 . 6 1 1 A 18 18 SER CA C 17 59.105 60.110 -1.005 1
1 30 . 6 1 1 A 18 18 SER CB C 17 63.592 64.012 -0.420 1
1 31 . 6 1 1 A 18 18 SER N N 17 114.821 114.878 -0.057 1
1 32 . 6 1 1 A 19 19 ASP H H 18 8.309 9.024 -0.715 1
1 33 . 6 1 1 A 19 19 ASP HA H 18 4.554 4.333 0.221 1
1 36 . 6 1 1 A 19 19 ASP C C 18 176.528 178.699 -2.171 1
1 37 . 6 1 1 A 19 19 ASP CA C 18 55.272 56.820 -1.548 1
1 38 . 6 1 1 A 19 19 ASP CB C 18 40.883 39.965 0.918 1
1 39 . 6 1 1 A 19 19 ASP N N 18 123.367 124.211 -0.844 1
1 40 . 6 1 1 A 20 20 ALA H H 19 8.133 8.270 -0.137 1
1 41 . 6 1 1 A 20 20 ALA HA H 19 4.170 4.035 0.135 1
1 45 . 6 1 1 A 20 20 ALA C C 19 179.857 178.994 0.863 1
1 46 . 6 1 1 A 20 20 ALA CA C 19 54.341 55.551 -1.210 1
1 47 . 6 1 1 A 20 20 ALA CB C 19 18.660 18.585 0.075 1
1 48 . 6 1 1 A 20 20 ALA N N 19 123.350 122.037 1.313 1
1 49 . 6 1 1 A 21 21 GLU H H 20 8.140 8.104 0.036 1
1 50 . 6 1 1 A 21 21 GLU HA H 20 4.128 4.100 0.028 1
1 55 . 6 1 1 A 21 21 GLU C C 20 177.675 178.562 -0.887 1
1 56 . 6 1 1 A 21 21 GLU CA C 20 58.520 59.470 -0.950 1
1 57 . 6 1 1 A 21 21 GLU CB C 20 29.765 29.543 0.222 1
1 59 . 6 1 1 A 21 21 GLU N N 20 119.063 118.702 0.361 1
1 60 . 6 1 1 A 22 22 PHE H H 21 8.009 8.388 -0.379 1
1 61 . 6 1 1 A 22 22 PHE HA H 21 4.123 4.217 -0.094 1
1 68 . 6 1 1 A 22 22 PHE C C 21 176.410 177.059 -0.649 1
1 69 . 6 1 1 A 22 22 PHE CA C 21 62.202 61.997 0.205 1
1 70 . 6 1 1 A 22 22 PHE CB C 21 39.223 39.114 0.109 1
1 75 . 6 1 1 A 22 22 PHE N N 21 121.211 121.036 0.175 1
1 76 . 6 1 1 A 23 23 ASP H H 22 8.261 8.298 -0.037 1
1 77 . 6 1 1 A 23 23 ASP HA H 22 4.041 4.334 -0.293 1
1 80 . 6 1 1 A 23 23 ASP C C 22 179.078 178.115 0.963 1
1 81 . 6 1 1 A 23 23 ASP CA C 22 57.048 57.908 -0.860 1
1 82 . 6 1 1 A 23 23 ASP CB C 22 40.154 42.075 -1.921 1
1 83 . 6 1 1 A 23 23 ASP N N 22 116.876 119.519 -2.643 1
1 84 . 6 1 1 A 24 24 ALA H H 23 7.651 7.559 0.092 1
1 85 . 6 1 1 A 24 24 ALA HA H 23 3.785 3.859 -0.074 1
1 89 . 6 1 1 A 24 24 ALA C C 23 179.577 179.676 -0.099 1
1 90 . 6 1 1 A 24 24 ALA CA C 23 54.341 55.151 -0.810 1
1 91 . 6 1 1 A 24 24 ALA CB C 23 17.762 18.292 -0.530 1
1 92 . 6 1 1 A 24 24 ALA N N 23 121.873 121.438 0.435 1
1 93 . 6 1 1 A 25 25 VAL H H 24 7.718 8.068 -0.350 1
1 94 . 6 1 1 A 25 25 VAL HA H 24 3.216 3.622 -0.406 1
1 102 . 6 1 1 A 25 25 VAL C C 24 177.805 178.119 -0.314 1
1 103 . 6 1 1 A 25 25 VAL CA C 24 66.789 66.827 -0.038 1
1 104 . 6 1 1 A 25 25 VAL CB C 24 31.277 31.309 -0.032 1
1 107 . 6 1 1 A 25 25 VAL N N 24 117.890 118.149 -0.259 1
1 108 . 6 1 1 A 26 26 VAL H H 25 7.867 7.623 0.244 1
1 109 . 6 1 1 A 26 26 VAL HA H 25 3.274 3.507 -0.233 1
1 117 . 6 1 1 A 26 26 VAL C C 25 177.788 177.626 0.162 1
1 118 . 6 1 1 A 26 26 VAL CA C 25 67.282 66.333 0.949 1
1 119 . 6 1 1 A 26 26 VAL CB C 25 31.266 31.376 -0.110 1
1 122 . 6 1 1 A 26 26 VAL N N 25 118.170 119.957 -1.787 1
1 123 . 6 1 1 A 27 27 GLY H H 26 7.544 7.581 -0.037 1
1 124 . 6 1 1 A 27 27 GLY HA2 H 26 3.592 3.479 0.113 1
1 125 . 6 1 1 A 27 27 GLY HA3 H 26 3.721 3.602 0.119 1
1 126 . 6 1 1 A 27 27 GLY C C 26 176.717 176.157 0.560 1
1 127 . 6 1 1 A 27 27 GLY CA C 26 47.085 47.149 -0.064 1
1 128 . 6 1 1 A 27 27 GLY N N 26 105.795 107.551 -1.756 1
1 129 . 6 1 1 A 28 28 TYR H H 27 7.625 7.246 0.379 1
1 130 . 6 1 1 A 28 28 TYR HA H 27 4.546 4.567 -0.021 1
1 137 . 6 1 1 A 28 28 TYR C C 27 178.991 178.403 0.588 1
1 138 . 6 1 1 A 28 28 TYR CA C 27 58.845 59.881 -1.036 1
1 139 . 6 1 1 A 28 28 TYR CB C 27 37.602 37.721 -0.119 1
1 144 . 6 1 1 A 28 28 TYR N N 27 119.933 121.476 -1.543 1
1 145 . 6 1 1 A 29 29 LEU H H 28 8.517 8.125 0.392 1
1 146 . 6 1 1 A 29 29 LEU HA H 28 3.728 3.796 -0.068 1
1 156 . 6 1 1 A 29 29 LEU CA C 28 58.281 57.783 0.498 1
1 157 . 6 1 1 A 29 29 LEU CB C 28 41.948 41.260 0.688 1
1 161 . 6 1 1 A 29 29 LEU N N 28 119.669 120.541 -0.872 1
1 162 . 6 1 1 A 30 30 GLU H H 29 8.072 8.155 -0.083 1
1 163 . 6 1 1 A 30 30 GLU HA H 29 3.722 3.845 -0.123 1
1 168 . 6 1 1 A 30 30 GLU C C 29 177.731 179.147 -1.416 1
1 169 . 6 1 1 A 30 30 GLU CA C 29 59.763 59.941 -0.178 1
1 170 . 6 1 1 A 30 30 GLU CB C 29 28.844 29.059 -0.215 1
1 172 . 6 1 1 A 30 30 GLU N N 29 117.666 118.136 -0.470 1
1 173 . 6 1 1 A 31 31 ASP H H 30 7.243 7.734 -0.491 1
1 174 . 6 1 1 A 31 31 ASP HA H 30 4.297 4.407 -0.110 1
1 177 . 6 1 1 A 31 31 ASP CA C 30 56.953 57.214 -0.261 1
1 178 . 6 1 1 A 31 31 ASP CB C 30 40.730 40.342 0.388 1
1 179 . 6 1 1 A 31 31 ASP N N 30 116.720 119.490 -2.770 1
1 180 . 6 1 1 A 32 32 ILE H H 31 7.940 7.565 0.375 1
1 181 . 6 1 1 A 32 32 ILE HA H 31 3.640 3.705 -0.065 1
1 191 . 6 1 1 A 32 32 ILE C C 31 177.980 178.115 -0.135 1
1 192 . 6 1 1 A 32 32 ILE CA C 31 64.692 64.024 0.668 1
1 193 . 6 1 1 A 32 32 ILE CB C 31 38.938 36.695 2.243 1
1 197 . 6 1 1 A 32 32 ILE N N 31 119.728 120.231 -0.503 1
1 198 . 6 1 1 A 33 33 ILE H H 32 7.984 7.768 0.216 1
1 199 . 6 1 1 A 33 33 ILE HA H 32 3.598 3.086 0.512 1
1 209 . 6 1 1 A 33 33 ILE C C 32 176.723 176.936 -0.213 1
1 210 . 6 1 1 A 33 33 ILE CA C 32 63.241 64.564 -1.323 1
1 211 . 6 1 1 A 33 33 ILE CB C 32 37.580 37.864 -0.284 1
1 215 . 6 1 1 A 33 33 ILE N N 32 113.919 120.693 -6.774 1
1 216 . 6 1 1 A 34 34 MET H H 33 7.288 7.647 -0.359 1
1 217 . 6 1 1 A 34 34 MET HA H 33 4.496 4.684 -0.188 1
1 225 . 6 1 1 A 34 34 MET C C 33 176.423 175.785 0.638 1
1 226 . 6 1 1 A 34 34 MET CA C 33 54.634 54.203 0.431 1
1 227 . 6 1 1 A 34 34 MET CB C 33 31.934 31.584 0.350 1
1 230 . 6 1 1 A 34 34 MET N N 33 115.130 116.686 -1.556 1
1 231 . 6 1 1 A 35 35 ASP H H 34 7.405 7.558 -0.153 1
1 232 . 6 1 1 A 35 35 ASP HA H 34 4.484 4.563 -0.079 1
1 235 . 6 1 1 A 35 35 ASP C C 34 177.139 176.768 0.371 1
1 236 . 6 1 1 A 35 35 ASP CA C 34 54.625 54.504 0.121 1
1 237 . 6 1 1 A 35 35 ASP CB C 34 43.554 42.785 0.769 1
1 238 . 6 1 1 A 35 35 ASP N N 34 121.814 122.494 -0.680 1
1 239 . 6 1 1 A 36 36 ASP H H 35 8.765 8.778 -0.013 1
1 240 . 6 1 1 A 36 36 ASP HA H 35 4.235 4.329 -0.094 1
1 243 . 6 1 1 A 36 36 ASP C C 35 178.320 178.087 0.233 1
1 244 . 6 1 1 A 36 36 ASP CA C 35 57.832 57.911 -0.079 1
1 245 . 6 1 1 A 36 36 ASP CB C 35 40.914 40.522 0.392 1
1 246 . 6 1 1 A 36 36 ASP N N 35 125.883 125.350 0.533 1
1 247 . 6 1 1 A 37 37 GLU H H 36 8.905 8.292 0.613 1
1 248 . 6 1 1 A 37 37 GLU HA H 36 3.933 4.123 -0.190 1
1 253 . 6 1 1 A 37 37 GLU C C 36 179.304 179.132 0.172 1
1 254 . 6 1 1 A 37 37 GLU CA C 36 59.828 58.904 0.924 1
1 255 . 6 1 1 A 37 37 GLU CB C 36 29.380 29.669 -0.289 1
1 257 . 6 1 1 A 37 37 GLU N N 36 119.077 119.805 -0.728 1
1 258 . 6 1 1 A 38 38 PHE H H 37 7.460 8.098 -0.638 1
1 259 . 6 1 1 A 38 38 PHE HA H 37 3.642 4.121 -0.479 1
1 267 . 6 1 1 A 38 38 PHE C C 37 176.483 177.837 -1.354 1
1 268 . 6 1 1 A 38 38 PHE CA C 37 61.411 61.217 0.194 1
1 269 . 6 1 1 A 38 38 PHE CB C 37 39.355 39.047 0.308 1
1 275 . 6 1 1 A 38 38 PHE N N 37 119.968 122.827 -2.859 1
1 276 . 6 1 1 A 39 39 GLN H H 38 7.968 7.998 -0.030 1
1 277 . 6 1 1 A 39 39 GLN HA H 38 3.712 3.818 -0.106 1
1 284 . 6 1 1 A 39 39 GLN CA C 38 59.153 58.831 0.322 1
1 285 . 6 1 1 A 39 39 GLN CB C 38 28.213 28.447 -0.234 1
1 287 . 6 1 1 A 39 39 GLN N N 38 116.433 118.483 -2.050 1
1 289 . 6 1 1 A 40 40 LEU H H 39 7.930 7.742 0.188 1
1 290 . 6 1 1 A 40 40 LEU HA H 39 3.916 3.996 -0.080 1
1 300 . 6 1 1 A 40 40 LEU C C 39 177.731 178.088 -0.357 1
1 301 . 6 1 1 A 40 40 LEU CA C 39 57.915 58.062 -0.147 1
1 302 . 6 1 1 A 40 40 LEU CB C 39 41.989 41.674 0.315 1
1 306 . 6 1 1 A 40 40 LEU N N 39 119.505 121.568 -2.063 1
1 307 . 6 1 1 A 41 41 LEU H H 40 7.174 7.808 -0.634 1
1 308 . 6 1 1 A 41 41 LEU HA H 40 3.835 3.967 -0.132 1
1 318 . 6 1 1 A 41 41 LEU C C 40 179.738 178.408 1.330 1
1 319 . 6 1 1 A 41 41 LEU CA C 40 58.266 58.300 -0.034 1
1 320 . 6 1 1 A 41 41 LEU CB C 40 42.050 41.660 0.390 1
1 324 . 6 1 1 A 41 41 LEU N N 40 120.971 119.700 1.271 1
1 325 . 6 1 1 A 42 42 GLN H H 41 8.058 7.979 0.079 1
1 326 . 6 1 1 A 42 42 GLN HA H 41 3.556 3.757 -0.201 1
1 333 . 6 1 1 A 42 42 GLN C C 41 177.642 178.503 -0.861 1
1 334 . 6 1 1 A 42 42 GLN CA C 41 59.826 59.203 0.623 1
1 335 . 6 1 1 A 42 42 GLN CB C 41 28.762 27.995 0.767 1
1 337 . 6 1 1 A 42 42 GLN N N 41 117.899 118.162 -0.263 1
1 339 . 6 1 1 A 43 43 ARG H H 42 8.179 7.799 0.380 1
1 340 . 6 1 1 A 43 43 ARG HA H 42 3.655 3.997 -0.342 1
1 347 . 6 1 1 A 43 43 ARG C C 42 178.051 178.417 -0.366 1
1 348 . 6 1 1 A 43 43 ARG CA C 42 59.766 58.626 1.140 1
1 349 . 6 1 1 A 43 43 ARG CB C 42 29.941 29.838 0.103 1
1 352 . 6 1 1 A 43 43 ARG N N 42 119.392 119.849 -0.457 1
1 353 . 6 1 1 A 44 44 ASN H H 43 8.525 8.143 0.382 1
1 354 . 6 1 1 A 44 44 ASN HA H 43 4.332 4.375 -0.043 1
1 359 . 6 1 1 A 44 44 ASN C C 43 178.150 177.685 0.465 1
1 360 . 6 1 1 A 44 44 ASN CA C 43 55.841 56.099 -0.258 1
1 361 . 6 1 1 A 44 44 ASN CB C 43 37.632 38.924 -1.292 1
1 362 . 6 1 1 A 44 44 ASN N N 43 116.214 117.658 -1.444 1
1 364 . 6 1 1 A 45 45 PHE H H 44 7.586 7.835 -0.249 1
1 365 . 6 1 1 A 45 45 PHE HA H 44 4.132 4.283 -0.151 1
1 372 . 6 1 1 A 45 45 PHE C C 44 176.691 178.874 -2.183 1
1 373 . 6 1 1 A 45 45 PHE CA C 44 62.333 60.643 1.690 1
1 374 . 6 1 1 A 45 45 PHE CB C 44 39.449 38.736 0.713 1
1 379 . 6 1 1 A 45 45 PHE N N 44 121.501 117.603 3.898 1
1 380 . 6 1 1 A 46 46 MET H H 45 8.190 8.057 0.133 1
1 381 . 6 1 1 A 46 46 MET HA H 45 4.060 4.324 -0.264 1
1 389 . 6 1 1 A 46 46 MET C C 45 179.754 178.370 1.384 1
1 390 . 6 1 1 A 46 46 MET CA C 45 57.742 57.615 0.127 1
1 391 . 6 1 1 A 46 46 MET CB C 45 29.912 32.318 -2.406 1
1 394 . 6 1 1 A 46 46 MET N N 45 116.727 119.369 -2.642 1
1 395 . 6 1 1 A 47 47 ASP H H 46 8.579 8.029 0.550 1
1 396 . 6 1 1 A 47 47 ASP HA H 46 4.804 4.519 0.285 1
1 399 . 6 1 1 A 47 47 ASP C C 46 177.854 178.132 -0.278 1
1 400 . 6 1 1 A 47 47 ASP CA C 46 57.277 57.385 -0.108 1
1 401 . 6 1 1 A 47 47 ASP CB C 46 40.776 40.507 0.269 1
1 402 . 6 1 1 A 47 47 ASP N N 46 117.798 121.296 -3.498 1
1 403 . 6 1 1 A 48 48 LYS H H 47 7.339 7.710 -0.371 1
1 404 . 6 1 1 A 48 48 LYS HA H 47 3.828 4.324 -0.496 1
1 413 . 6 1 1 A 48 48 LYS C C 47 178.812 178.407 0.405 1
1 414 . 6 1 1 A 48 48 LYS CA C 47 58.953 57.397 1.556 1
1 415 . 6 1 1 A 48 48 LYS CB C 47 32.796 33.233 -0.437 1
1 419 . 6 1 1 A 48 48 LYS N N 47 117.852 118.732 -0.880 1
1 420 . 6 1 1 A 49 49 TYR H H 48 6.841 8.539 -1.698 1
1 421 . 6 1 1 A 49 49 TYR HA H 48 4.995 4.212 0.783 1
1 428 . 6 1 1 A 49 49 TYR C C 48 178.138 178.520 -0.382 1
1 429 . 6 1 1 A 49 49 TYR CA C 48 58.620 59.863 -1.243 1
1 430 . 6 1 1 A 49 49 TYR CB C 48 42.939 38.151 4.788 1
1 435 . 6 1 1 A 49 49 TYR N N 48 112.109 119.265 -7.156 1
1 436 . 6 1 1 A 50 50 TYR H H 49 8.491 8.120 0.371 1
1 437 . 6 1 1 A 50 50 TYR HA H 49 4.598 3.938 0.660 1
1 444 . 6 1 1 A 50 50 TYR C C 49 176.015 177.728 -1.713 1
1 445 . 6 1 1 A 50 50 TYR CA C 49 62.442 59.259 3.183 1
1 446 . 6 1 1 A 50 50 TYR CB C 49 36.588 36.797 -0.209 1
1 451 . 6 1 1 A 50 50 TYR N N 49 118.294 119.208 -0.914 1
1 452 . 6 1 1 A 51 51 LEU H H 50 7.512 7.483 0.029 1
1 453 . 6 1 1 A 51 51 LEU HA H 50 3.878 3.508 0.370 1
1 463 . 6 1 1 A 51 51 LEU C C 50 178.625 178.581 0.044 1
1 464 . 6 1 1 A 51 51 LEU CA C 50 55.994 57.216 -1.222 1
1 465 . 6 1 1 A 51 51 LEU CB C 50 40.743 41.325 -0.582 1
1 469 . 6 1 1 A 51 51 LEU N N 50 118.478 121.818 -3.340 1
1 470 . 6 1 1 A 52 52 GLU H H 51 8.042 7.702 0.340 1
1 471 . 6 1 1 A 52 52 GLU HA H 51 4.197 3.915 0.282 1
1 476 . 6 1 1 A 52 52 GLU C C 51 177.629 177.528 0.101 1
1 477 . 6 1 1 A 52 52 GLU CA C 51 56.141 59.520 -3.379 1
1 478 . 6 1 1 A 52 52 GLU CB C 51 29.162 29.082 0.080 1
1 480 . 6 1 1 A 52 52 GLU N N 51 115.067 117.903 -2.836 1
1 481 . 6 1 1 A 53 53 PHE H H 52 7.465 7.828 -0.363 1
1 482 . 6 1 1 A 53 53 PHE HA H 52 4.431 4.526 -0.095 1
1 490 . 6 1 1 A 53 53 PHE C C 52 174.325 174.636 -0.311 1
1 491 . 6 1 1 A 53 53 PHE CA C 52 58.986 56.824 2.162 1
1 492 . 6 1 1 A 53 53 PHE CB C 52 40.183 37.187 2.996 1
1 498 . 6 1 1 A 53 53 PHE N N 52 116.768 118.097 -1.329 1
1 499 . 6 1 1 A 54 54 GLU H H 53 7.484 8.454 -0.970 1
1 500 . 6 1 1 A 54 54 GLU HA H 53 4.583 4.767 -0.184 1
1 505 . 6 1 1 A 54 54 GLU C C 53 175.722 175.907 -0.185 1
1 506 . 6 1 1 A 54 54 GLU CA C 53 54.248 55.882 -1.634 1
1 507 . 6 1 1 A 54 54 GLU CB C 53 34.409 31.285 3.124 1
1 509 . 6 1 1 A 54 54 GLU N N 53 118.844 124.301 -5.457 1
1 510 . 6 1 1 A 55 55 ASP H H 54 9.008 8.782 0.226 1
1 511 . 6 1 1 A 55 55 ASP HA H 54 4.735 4.932 -0.197 1
1 514 . 6 1 1 A 55 55 ASP C C 54 175.421 175.347 0.074 1
1 515 . 6 1 1 A 55 55 ASP CA C 54 52.888 53.542 -0.654 1
1 516 . 6 1 1 A 55 55 ASP CB C 54 38.894 40.331 -1.437 1
1 517 . 6 1 1 A 55 55 ASP N N 54 123.654 123.852 -0.198 1
1 518 . 6 1 1 A 56 56 THR H H 55 7.819 7.809 0.010 1
1 519 . 6 1 1 A 56 56 THR HA H 55 4.574 4.862 -0.288 1
1 524 . 6 1 1 A 56 56 THR C C 55 174.096 174.713 -0.617 1
1 525 . 6 1 1 A 56 56 THR CA C 55 59.172 59.221 -0.049 1
1 526 . 6 1 1 A 56 56 THR CB C 55 71.889 72.785 -0.896 1
1 528 . 6 1 1 A 56 56 THR N N 55 112.015 116.239 -4.224 1
1 529 . 6 1 1 A 57 57 GLU H H 56 8.527 8.575 -0.048 1
1 530 . 6 1 1 A 57 57 GLU HA H 56 4.217 4.273 -0.056 1
1 535 . 6 1 1 A 57 57 GLU C C 56 177.042 177.281 -0.239 1
1 536 . 6 1 1 A 57 57 GLU CA C 56 56.869 59.081 -2.212 1
1 537 . 6 1 1 A 57 57 GLU CB C 56 29.731 30.295 -0.564 1
1 539 . 6 1 1 A 57 57 GLU N N 56 117.531 120.847 -3.316 1
1 540 . 6 1 1 A 58 58 GLU H H 57 7.587 7.837 -0.250 1
1 541 . 6 1 1 A 58 58 GLU HA H 57 3.941 4.454 -0.513 1
1 546 . 6 1 1 A 58 58 GLU C C 57 176.849 175.655 1.194 1
1 547 . 6 1 1 A 58 58 GLU CA C 57 56.924 55.965 0.959 1
1 548 . 6 1 1 A 58 58 GLU CB C 57 30.251 30.534 -0.283 1
1 550 . 6 1 1 A 58 58 GLU N N 57 119.183 117.600 1.583 1
1 551 . 6 1 1 A 59 59 ASN H H 58 9.120 8.765 0.355 1
1 552 . 6 1 1 A 59 59 ASN HA H 58 4.922 5.580 -0.658 1
1 557 . 6 1 1 A 59 59 ASN C C 58 174.254 173.635 0.619 1
1 558 . 6 1 1 A 59 59 ASN CA C 58 51.956 50.733 1.223 1
1 559 . 6 1 1 A 59 59 ASN CB C 58 37.404 41.944 -4.540 1
1 560 . 6 1 1 A 59 59 ASN N N 58 126.767 117.769 8.998 1
1 562 . 6 1 1 A 60 60 LYS H H 59 5.892 8.288 -2.396 1
1 563 . 6 1 1 A 60 60 LYS HA H 59 3.798 4.916 -1.118 1
1 572 . 6 1 1 A 60 60 LYS C C 59 177.908 177.128 0.780 1
1 573 . 6 1 1 A 60 60 LYS CA C 59 56.623 54.471 2.152 1
1 574 . 6 1 1 A 60 60 LYS CB C 59 32.279 36.157 -3.878 1
1 578 . 6 1 1 A 60 60 LYS N N 59 121.527 117.726 3.801 1
1 579 . 6 1 1 A 61 61 LEU H H 60 8.473 8.685 -0.212 1
1 580 . 6 1 1 A 61 61 LEU HA H 60 3.891 4.327 -0.436 1
1 590 . 6 1 1 A 61 61 LEU C C 60 179.843 178.104 1.739 1
1 591 . 6 1 1 A 61 61 LEU CA C 60 58.301 56.967 1.334 1
1 592 . 6 1 1 A 61 61 LEU CB C 60 41.305 42.338 -1.033 1
1 596 . 6 1 1 A 61 61 LEU N N 60 125.639 124.900 0.739 1
1 597 . 6 1 1 A 62 62 ILE H H 61 7.698 7.938 -0.240 1
1 598 . 6 1 1 A 62 62 ILE HA H 61 3.952 3.941 0.011 1
1 608 . 6 1 1 A 62 62 ILE C C 61 175.392 177.224 -1.832 1
1 609 . 6 1 1 A 62 62 ILE CA C 61 61.743 63.385 -1.642 1
1 610 . 6 1 1 A 62 62 ILE CB C 61 39.108 37.748 1.360 1
1 614 . 6 1 1 A 62 62 ILE N N 61 114.111 118.985 -4.874 1
1 615 . 6 1 1 A 63 63 TYR H H 62 7.273 7.959 -0.686 1
1 616 . 6 1 1 A 63 63 TYR HA H 62 4.343 4.127 0.216 1
1 623 . 6 1 1 A 63 63 TYR C C 62 178.264 178.545 -0.281 1
1 624 . 6 1 1 A 63 63 TYR CA C 62 57.231 60.878 -3.647 1
1 625 . 6 1 1 A 63 63 TYR CB C 62 36.332 37.540 -1.208 1
1 630 . 6 1 1 A 63 63 TYR N N 62 117.689 121.369 -3.680 1
1 631 . 6 1 1 A 64 64 THR H H 63 7.747 8.011 -0.264 1
1 632 . 6 1 1 A 64 64 THR HA H 63 4.266 4.237 0.029 1
1 637 . 6 1 1 A 64 64 THR CA C 63 69.362 67.558 1.804 1
1 638 . 6 1 1 A 64 64 THR CB C 63 66.962 67.505 -0.543 1
1 640 . 6 1 1 A 64 64 THR N N 63 113.755 115.942 -2.187 1
1 641 . 6 1 1 A 65 65 PRO HA H 64 4.372 4.385 -0.013 1
1 648 . 6 1 1 A 65 65 PRO C C 64 179.913 179.400 0.513 1
1 649 . 6 1 1 A 65 65 PRO CA C 64 66.011 66.000 0.011 1
1 650 . 6 1 1 A 65 65 PRO CB C 64 30.642 30.616 0.026 1
1 653 . 6 1 1 A 66 66 ILE H H 65 7.377 7.223 0.154 1
1 654 . 6 1 1 A 66 66 ILE HA H 65 3.530 3.858 -0.328 1
1 664 . 6 1 1 A 66 66 ILE C C 65 177.543 178.378 -0.835 1
1 665 . 6 1 1 A 66 66 ILE CA C 65 66.647 64.187 2.460 1
1 666 . 6 1 1 A 66 66 ILE CB C 65 38.029 37.612 0.417 1
1 670 . 6 1 1 A 66 66 ILE N N 65 118.353 116.790 1.563 1
1 671 . 6 1 1 A 67 67 PHE H H 66 8.480 8.351 0.129 1
1 672 . 6 1 1 A 67 67 PHE HA H 66 4.115 4.306 -0.191 1
1 680 . 6 1 1 A 67 67 PHE C C 66 177.293 177.770 -0.477 1
1 681 . 6 1 1 A 67 67 PHE CA C 66 59.570 62.294 -2.724 1
1 682 . 6 1 1 A 67 67 PHE CB C 66 38.865 39.496 -0.631 1
1 688 . 6 1 1 A 67 67 PHE N N 66 122.420 120.411 2.009 1
1 689 . 6 1 1 A 68 68 ASN H H 67 8.595 8.155 0.440 1
1 690 . 6 1 1 A 68 68 ASN HA H 67 4.211 4.310 -0.099 1
1 695 . 6 1 1 A 68 68 ASN C C 67 178.697 178.146 0.551 1
1 696 . 6 1 1 A 68 68 ASN CA C 67 56.056 56.426 -0.370 1
1 697 . 6 1 1 A 68 68 ASN CB C 67 37.704 37.824 -0.120 1
1 698 . 6 1 1 A 68 68 ASN N N 67 115.573 117.404 -1.831 1
1 700 . 6 1 1 A 69 69 GLU H H 68 8.414 8.084 0.330 1
1 701 . 6 1 1 A 69 69 GLU HA H 68 4.102 4.163 -0.061 1
1 706 . 6 1 1 A 69 69 GLU C C 68 177.880 178.820 -0.940 1
1 707 . 6 1 1 A 69 69 GLU CA C 68 59.399 59.458 -0.059 1
1 708 . 6 1 1 A 69 69 GLU CB C 68 29.855 29.442 0.413 1
1 710 . 6 1 1 A 69 69 GLU N N 68 123.510 120.009 3.501 1
1 711 . 6 1 1 A 70 70 TYR H H 69 8.659 7.983 0.676 1
1 712 . 6 1 1 A 70 70 TYR HA H 69 3.362 4.114 -0.752 1
1 719 . 6 1 1 A 70 70 TYR C C 69 178.143 176.988 1.155 1
1 720 . 6 1 1 A 70 70 TYR CA C 69 60.686 61.032 -0.346 1
1 721 . 6 1 1 A 70 70 TYR CB C 69 38.560 38.896 -0.336 1
1 726 . 6 1 1 A 70 70 TYR N N 69 122.130 120.629 1.501 1
1 727 . 6 1 1 A 71 71 ILE H H 70 8.031 7.665 0.366 1
1 728 . 6 1 1 A 71 71 ILE HA H 70 3.265 3.699 -0.434 1
1 738 . 6 1 1 A 71 71 ILE C C 70 178.056 177.529 0.527 1
1 739 . 6 1 1 A 71 71 ILE CA C 70 63.756 63.970 -0.214 1
1 740 . 6 1 1 A 71 71 ILE CB C 70 37.321 36.487 0.834 1
1 744 . 6 1 1 A 71 71 ILE N N 70 118.906 120.122 -1.216 1
1 745 . 6 1 1 A 72 72 SER H H 71 7.803 7.801 0.002 1
1 746 . 6 1 1 A 72 72 SER HA H 71 4.029 4.357 -0.328 1
1 749 . 6 1 1 A 72 72 SER CA C 71 61.380 61.160 0.220 1
1 750 . 6 1 1 A 72 72 SER CB C 71 63.288 63.188 0.100 1
1 751 . 6 1 1 A 72 72 SER N N 71 113.735 116.791 -3.056 1
1 752 . 6 1 1 A 73 73 LEU H H 72 7.952 7.962 -0.010 1
1 753 . 6 1 1 A 73 73 LEU HA H 72 4.418 4.111 0.307 1
1 763 . 6 1 1 A 73 73 LEU C C 72 177.767 178.335 -0.568 1
1 764 . 6 1 1 A 73 73 LEU CA C 72 56.543 57.419 -0.876 1
1 765 . 6 1 1 A 73 73 LEU CB C 72 44.517 41.823 2.694 1
1 769 . 6 1 1 A 73 73 LEU N N 72 119.411 122.443 -3.032 1
1 770 . 6 1 1 A 74 74 VAL H H 73 8.021 7.557 0.464 1
1 771 . 6 1 1 A 74 74 VAL HA H 73 3.532 3.332 0.200 1
1 779 . 6 1 1 A 74 74 VAL C C 73 177.126 177.953 -0.827 1
1 780 . 6 1 1 A 74 74 VAL CA C 73 66.250 66.297 -0.047 1
1 781 . 6 1 1 A 74 74 VAL CB C 73 31.212 31.129 0.083 1
1 784 . 6 1 1 A 74 74 VAL N N 73 118.747 119.214 -0.467 1
1 785 . 6 1 1 A 75 75 GLU H H 74 7.232 8.003 -0.771 1
1 786 . 6 1 1 A 75 75 GLU HA H 74 3.013 4.123 -1.110 1
1 791 . 6 1 1 A 75 75 GLU C C 74 178.804 179.127 -0.323 1
1 792 . 6 1 1 A 75 75 GLU CA C 74 60.536 59.969 0.567 1
1 793 . 6 1 1 A 75 75 GLU CB C 74 27.009 29.049 -2.040 1
1 795 . 6 1 1 A 75 75 GLU N N 74 118.660 119.736 -1.076 1
1 796 . 6 1 1 A 76 76 LYS H H 75 7.051 7.385 -0.334 1
1 797 . 6 1 1 A 76 76 LYS HA H 75 3.765 4.013 -0.248 1
1 806 . 6 1 1 A 76 76 LYS C C 75 177.765 178.382 -0.617 1
1 807 . 6 1 1 A 76 76 LYS CA C 75 58.357 58.801 -0.444 1
1 808 . 6 1 1 A 76 76 LYS CB C 75 31.939 31.980 -0.041 1
1 812 . 6 1 1 A 76 76 LYS N N 75 116.112 119.883 -3.771 1
1 813 . 6 1 1 A 77 77 TYR H H 76 7.067 7.735 -0.668 1
1 814 . 6 1 1 A 77 77 TYR HA H 76 4.036 4.161 -0.125 1
1 821 . 6 1 1 A 77 77 TYR C C 76 177.752 177.048 0.704 1
1 822 . 6 1 1 A 77 77 TYR CA C 76 61.820 61.229 0.591 1
1 823 . 6 1 1 A 77 77 TYR CB C 76 38.480 38.612 -0.132 1
1 828 . 6 1 1 A 77 77 TYR N N 76 118.434 120.637 -2.203 1
1 829 . 6 1 1 A 78 78 ILE H H 77 7.554 8.180 -0.626 1
1 830 . 6 1 1 A 78 78 ILE HA H 77 3.159 3.497 -0.338 1
1 840 . 6 1 1 A 78 78 ILE C C 77 177.341 177.866 -0.525 1
1 841 . 6 1 1 A 78 78 ILE CA C 77 65.177 65.155 0.022 1
1 842 . 6 1 1 A 78 78 ILE CB C 77 37.339 37.907 -0.568 1
1 846 . 6 1 1 A 78 78 ILE N N 77 117.672 121.457 -3.785 1
1 847 . 6 1 1 A 79 79 GLU H H 78 8.296 7.971 0.325 1
1 848 . 6 1 1 A 79 79 GLU HA H 78 3.557 3.787 -0.230 1
1 853 . 6 1 1 A 79 79 GLU C C 78 177.742 178.643 -0.901 1
1 854 . 6 1 1 A 79 79 GLU CA C 78 60.847 59.831 1.016 1
1 855 . 6 1 1 A 79 79 GLU CB C 78 29.594 29.031 0.563 1
1 857 . 6 1 1 A 79 79 GLU N N 78 118.701 120.645 -1.944 1
1 858 . 6 1 1 A 80 80 GLU H H 79 8.330 8.187 0.143 1
1 859 . 6 1 1 A 80 80 GLU HA H 79 3.774 4.019 -0.245 1
1 864 . 6 1 1 A 80 80 GLU C C 79 179.926 179.182 0.744 1
1 865 . 6 1 1 A 80 80 GLU CA C 79 59.581 58.940 0.641 1
1 866 . 6 1 1 A 80 80 GLU CB C 79 29.062 29.135 -0.073 1
1 868 . 6 1 1 A 80 80 GLU N N 79 116.767 118.761 -1.994 1
1 869 . 6 1 1 A 81 81 GLN H H 80 7.634 7.701 -0.067 1
1 870 . 6 1 1 A 81 81 GLN HA H 80 3.605 3.866 -0.261 1
1 877 . 6 1 1 A 81 81 GLN C C 80 179.681 178.617 1.064 1
1 878 . 6 1 1 A 81 81 GLN CA C 80 57.765 58.499 -0.734 1
1 879 . 6 1 1 A 81 81 GLN CB C 80 28.079 28.067 0.012 1
1 881 . 6 1 1 A 81 81 GLN N N 80 116.325 118.694 -2.369 1
1 883 . 6 1 1 A 82 82 LEU H H 81 8.156 7.467 0.689 1
1 884 . 6 1 1 A 82 82 LEU HA H 81 3.536 3.782 -0.246 1
1 894 . 6 1 1 A 82 82 LEU C C 81 178.945 179.429 -0.484 1
1 895 . 6 1 1 A 82 82 LEU CA C 81 57.761 56.849 0.912 1
1 896 . 6 1 1 A 82 82 LEU CB C 81 40.961 40.897 0.064 1
1 900 . 6 1 1 A 82 82 LEU N N 81 121.546 120.146 1.400 1
1 901 . 6 1 1 A 83 83 LEU H H 82 8.326 8.137 0.189 1
1 902 . 6 1 1 A 83 83 LEU HA H 82 4.198 4.267 -0.069 1
1 912 . 6 1 1 A 83 83 LEU C C 82 178.631 179.361 -0.730 1
1 913 . 6 1 1 A 83 83 LEU CA C 82 57.016 57.144 -0.128 1
1 914 . 6 1 1 A 83 83 LEU CB C 82 42.182 40.705 1.477 1
1 918 . 6 1 1 A 83 83 LEU N N 82 120.426 119.056 1.370 1
1 919 . 6 1 1 A 84 84 GLN H H 83 6.992 7.770 -0.778 1
1 920 . 6 1 1 A 84 84 GLN HA H 83 3.877 3.989 -0.112 1
1 927 . 6 1 1 A 84 84 GLN C C 83 177.008 177.235 -0.227 1
1 928 . 6 1 1 A 84 84 GLN CA C 83 57.543 58.731 -1.188 1
1 929 . 6 1 1 A 84 84 GLN CB C 83 28.688 28.512 0.176 1
1 931 . 6 1 1 A 84 84 GLN N N 83 114.001 117.523 -3.522 1
1 933 . 6 1 1 A 85 85 ARG H H 84 7.072 7.391 -0.319 1
1 934 . 6 1 1 A 85 85 ARG HA H 84 4.047 4.367 -0.320 1
1 942 . 6 1 1 A 85 85 ARG C C 84 175.999 175.709 0.290 1
1 943 . 6 1 1 A 85 85 ARG CA C 84 56.764 56.292 0.472 1
1 944 . 6 1 1 A 85 85 ARG CB C 84 32.044 31.875 0.169 1
1 947 . 6 1 1 A 85 85 ARG N N 84 115.827 116.641 -0.814 1
1 949 . 6 1 1 A 86 86 ILE H H 85 8.238 7.845 0.393 1
1 950 . 6 1 1 A 86 86 ILE HA H 85 4.389 4.486 -0.097 1
1 960 . 6 1 1 A 86 86 ILE CA C 85 58.007 57.764 0.243 1
1 961 . 6 1 1 A 86 86 ILE CB C 85 39.604 38.892 0.712 1
1 965 . 6 1 1 A 86 86 ILE N N 85 119.285 120.276 -0.991 1
1 966 . 6 1 1 A 87 87 PRO HA H 86 4.392 4.547 -0.155 1
1 973 . 6 1 1 A 87 87 PRO C C 86 177.622 176.555 1.067 1
1 974 . 6 1 1 A 87 87 PRO CA C 86 64.665 64.252 0.413 1
1 975 . 6 1 1 A 87 87 PRO CB C 86 32.020 31.674 0.346 1
1 978 . 6 1 1 A 88 88 GLU H H 87 8.312 8.223 0.089 1
1 979 . 6 1 1 A 88 88 GLU HA H 87 4.208 4.644 -0.436 1
1 984 . 6 1 1 A 88 88 GLU C C 87 175.554 175.996 -0.442 1
1 985 . 6 1 1 A 88 88 GLU CA C 87 56.045 56.357 -0.312 1
1 986 . 6 1 1 A 88 88 GLU CB C 87 28.654 30.878 -2.224 1
1 988 . 6 1 1 A 88 88 GLU N N 87 114.256 116.684 -2.428 1
1 989 . 6 1 1 A 89 89 PHE H H 88 7.946 7.527 0.419 1
1 990 . 6 1 1 A 89 89 PHE HA H 88 3.993 4.383 -0.390 1
1 998 . 6 1 1 A 89 89 PHE C C 88 173.460 174.583 -1.123 1
1 999 . 6 1 1 A 89 89 PHE CA C 88 60.119 59.576 0.543 1
1 1000 . 6 1 1 A 89 89 PHE CB C 88 39.994 39.685 0.309 1
1 1006 . 6 1 1 A 89 89 PHE N N 88 121.550 123.457 -1.907 1
1 1007 . 6 1 1 A 90 90 ASN H H 89 7.266 7.881 -0.615 1
1 1008 . 6 1 1 A 90 90 ASN HA H 89 4.454 5.390 -0.936 1
1 1013 . 6 1 1 A 90 90 ASN C C 89 173.921 175.208 -1.287 1
1 1014 . 6 1 1 A 90 90 ASN CA C 89 51.839 51.471 0.368 1
1 1015 . 6 1 1 A 90 90 ASN CB C 89 40.674 39.366 1.308 1
1 1016 . 6 1 1 A 90 90 ASN N N 89 125.344 123.592 1.752 1
1 1018 . 6 1 1 A 91 91 MET H H 90 8.968 8.790 0.178 1
1 1019 . 6 1 1 A 91 91 MET HA H 90 4.049 4.230 -0.181 1
1 1027 . 6 1 1 A 91 91 MET C C 90 177.475 178.033 -0.558 1
1 1028 . 6 1 1 A 91 91 MET CA C 90 57.758 58.157 -0.399 1
1 1029 . 6 1 1 A 91 91 MET CB C 90 32.250 32.352 -0.102 1
1 1032 . 6 1 1 A 91 91 MET N N 90 127.052 122.838 4.214 1
1 1033 . 6 1 1 A 92 92 ALA H H 91 8.292 8.041 0.251 1
1 1034 . 6 1 1 A 92 92 ALA HA H 91 4.059 4.144 -0.085 1
1 1038 . 6 1 1 A 92 92 ALA C C 91 180.412 179.717 0.695 1
1 1039 . 6 1 1 A 92 92 ALA CA C 91 55.368 54.842 0.526 1
1 1040 . 6 1 1 A 92 92 ALA CB C 91 17.527 18.680 -1.153 1
1 1041 . 6 1 1 A 92 92 ALA N N 91 123.752 121.183 2.569 1
1 1042 . 6 1 1 A 93 93 ALA H H 92 7.931 7.962 -0.031 1
1 1043 . 6 1 1 A 93 93 ALA HA H 92 4.054 4.099 -0.045 1
1 1047 . 6 1 1 A 93 93 ALA C C 92 180.482 179.889 0.593 1
1 1048 . 6 1 1 A 93 93 ALA CA C 92 54.614 54.840 -0.226 1
1 1049 . 6 1 1 A 93 93 ALA CB C 92 18.098 18.165 -0.067 1
1 1050 . 6 1 1 A 93 93 ALA N N 92 121.158 120.006 1.152 1
1 1051 . 6 1 1 A 94 94 PHE H H 93 8.110 7.915 0.195 1
1 1052 . 6 1 1 A 94 94 PHE HA H 93 4.304 4.118 0.186 1
1 1060 . 6 1 1 A 94 94 PHE C C 93 177.350 177.239 0.111 1
1 1061 . 6 1 1 A 94 94 PHE CA C 93 61.641 61.445 0.196 1
1 1062 . 6 1 1 A 94 94 PHE CB C 93 40.014 39.471 0.543 1
1 1068 . 6 1 1 A 94 94 PHE N N 93 119.807 119.793 0.014 1
1 1069 . 6 1 1 A 95 95 THR H H 94 8.726 8.194 0.532 1
1 1070 . 6 1 1 A 95 95 THR HA H 94 3.569 4.125 -0.556 1
1 1075 . 6 1 1 A 95 95 THR C C 94 176.932 177.080 -0.148 1
1 1076 . 6 1 1 A 95 95 THR CA C 94 66.833 65.605 1.228 1
1 1077 . 6 1 1 A 95 95 THR CB C 94 68.445 68.259 0.186 1
1 1079 . 6 1 1 A 95 95 THR N N 94 113.074 112.171 0.903 1
1 1080 . 6 1 1 A 96 96 THR H H 95 7.657 7.843 -0.186 1
1 1081 . 6 1 1 A 96 96 THR HA H 95 3.945 4.012 -0.067 1
1 1086 . 6 1 1 A 96 96 THR C C 95 176.386 176.246 0.140 1
1 1087 . 6 1 1 A 96 96 THR CA C 95 66.550 66.122 0.428 1
1 1088 . 6 1 1 A 96 96 THR CB C 95 68.583 68.593 -0.010 1
1 1090 . 6 1 1 A 96 96 THR N N 95 117.927 116.532 1.395 1
1 1091 . 6 1 1 A 97 97 THR H H 96 7.699 7.746 -0.047 1
1 1092 . 6 1 1 A 97 97 THR HA H 96 3.905 4.168 -0.263 1
1 1097 . 6 1 1 A 97 97 THR C C 96 176.572 176.529 0.043 1
1 1098 . 6 1 1 A 97 97 THR CA C 96 65.979 66.326 -0.347 1
1 1099 . 6 1 1 A 97 97 THR CB C 96 68.553 68.359 0.194 1
1 1101 . 6 1 1 A 97 97 THR N N 96 118.518 116.969 1.549 1
1 1102 . 6 1 1 A 98 98 LEU H H 97 8.304 8.188 0.116 1
1 1103 . 6 1 1 A 98 98 LEU HA H 97 3.725 3.827 -0.102 1
1 1113 . 6 1 1 A 98 98 LEU C C 97 178.490 178.389 0.101 1
1 1114 . 6 1 1 A 98 98 LEU CA C 97 58.517 58.081 0.436 1
1 1115 . 6 1 1 A 98 98 LEU CB C 97 41.697 41.137 0.560 1
1 1119 . 6 1 1 A 98 98 LEU N N 97 122.882 122.220 0.662 1
1 1120 . 6 1 1 A 99 99 GLN H H 98 7.639 8.114 -0.475 1
1 1121 . 6 1 1 A 99 99 GLN HA H 98 3.927 4.167 -0.240 1
1 1128 . 6 1 1 A 99 99 GLN C C 98 178.068 177.484 0.584 1
1 1129 . 6 1 1 A 99 99 GLN CA C 98 58.735 58.082 0.653 1
1 1130 . 6 1 1 A 99 99 GLN CB C 98 27.986 28.220 -0.234 1
1 1132 . 6 1 1 A 99 99 GLN N N 98 114.302 116.262 -1.960 1
1 1134 . 6 1 1 A 100 100 HIS H H 99 7.575 7.210 0.365 1
1 1135 . 6 1 1 A 100 100 HIS HA H 99 4.524 4.416 0.108 1
1 1139 . 6 1 1 A 100 100 HIS C C 99 174.789 177.690 -2.901 1
1 1140 . 6 1 1 A 100 100 HIS CA C 99 56.154 59.843 -3.689 1
1 1141 . 6 1 1 A 100 100 HIS CB C 99 28.946 30.711 -1.765 1
1 1143 . 6 1 1 A 100 100 HIS N N 99 114.778 118.033 -3.255 1
1 1144 . 6 1 1 A 101 101 HIS H H 100 7.773 8.027 -0.254 1
1 1145 . 6 1 1 A 101 101 HIS HA H 100 4.704 4.367 0.337 1
1 1149 . 6 1 1 A 101 101 HIS C C 100 174.818 177.141 -2.323 1
1 1150 . 6 1 1 A 101 101 HIS CA C 100 54.830 58.556 -3.726 1
1 1151 . 6 1 1 A 101 101 HIS CB C 100 29.749 28.553 1.196 1
1 1153 . 6 1 1 A 101 101 HIS N N 100 117.397 117.241 0.156 1
1 1154 . 6 1 1 A 102 102 LYS H H 101 7.324 8.102 -0.778 1
1 1155 . 6 1 1 A 102 102 LYS HA H 101 3.611 4.064 -0.453 1
1 1164 . 6 1 1 A 102 102 LYS C C 101 176.823 178.105 -1.282 1
1 1165 . 6 1 1 A 102 102 LYS CA C 101 59.915 58.938 0.977 1
1 1166 . 6 1 1 A 102 102 LYS CB C 101 32.825 32.066 0.759 1
1 1170 . 6 1 1 A 102 102 LYS N N 101 120.533 122.151 -1.618 1
1 1171 . 6 1 1 A 103 103 ASP H H 102 8.361 7.721 0.640 1
1 1172 . 6 1 1 A 103 103 ASP HA H 102 4.421 4.419 0.002 1
1 1175 . 6 1 1 A 103 103 ASP C C 102 176.793 177.869 -1.076 1
1 1176 . 6 1 1 A 103 103 ASP CA C 102 55.500 56.289 -0.789 1
1 1177 . 6 1 1 A 103 103 ASP CB C 102 40.178 40.725 -0.547 1
1 1178 . 6 1 1 A 103 103 ASP N N 102 114.814 119.446 -4.632 1
1 1179 . 6 1 1 A 104 104 GLU H H 103 7.858 7.976 -0.118 1
1 1180 . 6 1 1 A 104 104 GLU HA H 103 4.339 4.348 -0.009 1
1 1183 . 6 1 1 A 104 104 GLU C C 103 175.777 176.858 -1.081 1
1 1184 . 6 1 1 A 104 104 GLU CA C 103 56.356 57.998 -1.642 1
1 1185 . 6 1 1 A 104 104 GLU CB C 103 31.293 30.669 0.624 1
1 1186 . 6 1 1 A 104 104 GLU N N 103 116.826 118.771 -1.945 1
1 1187 . 6 1 1 A 105 105 VAL H H 104 7.201 7.807 -0.606 1
1 1188 . 6 1 1 A 105 105 VAL HA H 104 4.296 4.129 0.167 1
1 1196 . 6 1 1 A 105 105 VAL C C 104 174.482 175.591 -1.109 1
1 1197 . 6 1 1 A 105 105 VAL CA C 104 60.370 62.635 -2.265 1
1 1198 . 6 1 1 A 105 105 VAL CB C 104 34.341 33.067 1.274 1
1 1201 . 6 1 1 A 105 105 VAL N N 104 116.422 119.771 -3.349 1
1 1202 . 6 1 1 A 106 106 ALA H H 105 8.487 8.457 0.030 1
1 1203 . 6 1 1 A 106 106 ALA HA H 105 4.172 4.417 -0.245 1
1 1207 . 6 1 1 A 106 106 ALA C C 105 179.030 178.859 0.171 1
1 1208 . 6 1 1 A 106 106 ALA CA C 105 52.966 52.484 0.482 1
1 1209 . 6 1 1 A 106 106 ALA CB C 105 19.371 19.472 -0.101 1
1 1210 . 6 1 1 A 106 106 ALA N N 105 128.313 128.709 -0.396 1
1 1211 . 6 1 1 A 107 107 GLY H H 106 8.738 8.797 -0.059 1
1 1212 . 6 1 1 A 107 107 GLY HA2 H 106 3.773 3.874 -0.101 1
1 1213 . 6 1 1 A 107 107 GLY HA3 H 106 3.998 3.936 0.062 1
1 1214 . 6 1 1 A 107 107 GLY C C 106 174.958 175.451 -0.493 1
1 1215 . 6 1 1 A 107 107 GLY CA C 106 47.449 47.195 0.254 1
1 1216 . 6 1 1 A 107 107 GLY N N 106 110.612 110.811 -0.199 1
1 1217 . 6 1 1 A 108 108 ASP H H 107 8.535 7.850 0.685 1
1 1218 . 6 1 1 A 108 108 ASP HA H 107 4.333 4.374 -0.041 1
1 1221 . 6 1 1 A 108 108 ASP C C 107 179.133 178.991 0.142 1
1 1222 . 6 1 1 A 108 108 ASP CA C 107 56.721 56.382 0.339 1
1 1223 . 6 1 1 A 108 108 ASP CB C 107 39.336 40.538 -1.202 1
1 1224 . 6 1 1 A 108 108 ASP N N 107 117.474 122.179 -4.705 1
1 1225 . 6 1 1 A 109 109 ILE H H 108 7.459 7.878 -0.419 1
1 1226 . 6 1 1 A 109 109 ILE HA H 108 3.688 3.822 -0.134 1
1 1236 . 6 1 1 A 109 109 ILE C C 108 176.735 178.497 -1.762 1
1 1237 . 6 1 1 A 109 109 ILE CA C 108 63.474 65.415 -1.941 1
1 1238 . 6 1 1 A 109 109 ILE CB C 108 37.340 37.623 -0.283 1
1 1242 . 6 1 1 A 109 109 ILE N N 108 119.609 119.710 -0.101 1
1 1243 . 6 1 1 A 110 110 PHE H H 109 7.920 8.339 -0.419 1
1 1244 . 6 1 1 A 110 110 PHE HA H 109 3.759 4.085 -0.326 1
1 1252 . 6 1 1 A 110 110 PHE C C 109 177.132 177.297 -0.165 1
1 1253 . 6 1 1 A 110 110 PHE CA C 109 62.766 61.229 1.537 1
1 1254 . 6 1 1 A 110 110 PHE CB C 109 39.752 39.316 0.436 1
1 1260 . 6 1 1 A 110 110 PHE N N 109 120.906 120.417 0.489 1
1 1261 . 6 1 1 A 111 111 ASP H H 110 8.639 8.274 0.365 1
1 1262 . 6 1 1 A 111 111 ASP HA H 110 4.216 4.242 -0.026 1
1 1265 . 6 1 1 A 111 111 ASP C C 110 178.900 178.340 0.560 1
1 1266 . 6 1 1 A 111 111 ASP CA C 110 57.105 57.337 -0.232 1
1 1267 . 6 1 1 A 111 111 ASP CB C 110 39.697 42.041 -2.344 1
1 1268 . 6 1 1 A 111 111 ASP N N 110 117.124 118.783 -1.659 1
1 1269 . 6 1 1 A 112 112 MET H H 111 7.331 7.604 -0.273 1
1 1270 . 6 1 1 A 112 112 MET HA H 111 4.081 4.148 -0.067 1
1 1278 . 6 1 1 A 112 112 MET C C 111 179.052 178.131 0.921 1
1 1279 . 6 1 1 A 112 112 MET CA C 111 58.202 57.985 0.217 1
1 1280 . 6 1 1 A 112 112 MET CB C 111 31.827 32.380 -0.553 1
1 1283 . 6 1 1 A 112 112 MET N N 111 118.061 119.389 -1.328 1
1 1284 . 6 1 1 A 113 113 LEU H H 112 8.001 8.001 0.000 1
1 1285 . 6 1 1 A 113 113 LEU HA H 112 3.723 3.597 0.126 1
1 1295 . 6 1 1 A 113 113 LEU C C 112 179.747 178.701 1.046 1
1 1296 . 6 1 1 A 113 113 LEU CA C 112 57.371 57.398 -0.027 1
1 1297 . 6 1 1 A 113 113 LEU CB C 112 40.671 41.000 -0.329 1
1 1301 . 6 1 1 A 113 113 LEU N N 112 120.426 119.681 0.745 1
1 1302 . 6 1 1 A 114 114 LEU H H 113 7.744 7.471 0.273 1
1 1303 . 6 1 1 A 114 114 LEU HA H 113 4.007 3.578 0.429 1
1 1313 . 6 1 1 A 114 114 LEU C C 113 179.358 178.612 0.746 1
1 1314 . 6 1 1 A 114 114 LEU CA C 113 57.202 57.391 -0.189 1
1 1315 . 6 1 1 A 114 114 LEU CB C 113 41.727 41.136 0.591 1
1 1319 . 6 1 1 A 114 114 LEU N N 113 119.584 118.348 1.236 1
1 1320 . 6 1 1 A 115 115 THR H H 114 7.353 7.639 -0.286 1
1 1321 . 6 1 1 A 115 115 THR HA H 114 4.071 4.022 0.049 1
1 1327 . 6 1 1 A 115 115 THR C C 114 173.591 176.364 -2.773 1
1 1328 . 6 1 1 A 115 115 THR CA C 114 65.332 64.659 0.673 1
1 1329 . 6 1 1 A 115 115 THR CB C 114 70.319 68.529 1.790 1
1 1331 . 6 1 1 A 115 115 THR N N 114 107.535 110.745 -3.210 1
1 1332 . 6 1 1 A 116 116 PHE H H 115 6.979 7.724 -0.745 1
1 1333 . 6 1 1 A 116 116 PHE HA H 115 5.022 4.413 0.609 1
1 1341 . 6 1 1 A 116 116 PHE C C 115 176.488 176.077 0.411 1
1 1342 . 6 1 1 A 116 116 PHE CA C 115 55.911 61.067 -5.156 1
1 1343 . 6 1 1 A 116 116 PHE CB C 115 38.521 39.025 -0.504 1
1 1349 . 6 1 1 A 116 116 PHE N N 115 112.366 120.038 -7.672 1
1 1350 . 6 1 1 A 117 117 THR H H 116 7.564 8.148 -0.584 1
1 1351 . 6 1 1 A 117 117 THR HA H 116 4.626 4.940 -0.314 1
1 1356 . 6 1 1 A 117 117 THR C C 116 174.085 173.879 0.206 1
1 1357 . 6 1 1 A 117 117 THR CA C 116 61.636 62.503 -0.867 1
1 1358 . 6 1 1 A 117 117 THR CB C 116 70.915 72.468 -1.553 1
1 1360 . 6 1 1 A 117 117 THR N N 116 105.498 112.696 -7.198 1
1 1361 . 6 1 1 A 118 118 ASP H H 117 8.270 7.892 0.378 1
1 1362 . 6 1 1 A 118 118 ASP HA H 117 4.955 4.992 -0.037 1
1 1365 . 6 1 1 A 118 118 ASP C C 117 176.328 176.232 0.096 1
1 1366 . 6 1 1 A 118 118 ASP CA C 117 53.417 53.310 0.107 1
1 1367 . 6 1 1 A 118 118 ASP CB C 117 43.388 38.864 4.524 1
1 1368 . 6 1 1 A 118 118 ASP N N 117 124.409 121.624 2.785 1
1 1369 . 6 1 1 A 119 119 PHE H H 118 8.973 8.855 0.118 1
1 1370 . 6 1 1 A 119 119 PHE HA H 118 3.506 4.273 -0.767 1
1 1378 . 6 1 1 A 119 119 PHE CA C 118 61.490 61.034 0.456 1
1 1379 . 6 1 1 A 119 119 PHE CB C 118 39.246 39.668 -0.422 1
1 1385 . 6 1 1 A 119 119 PHE N N 118 126.688 125.393 1.295 1
1 1386 . 6 1 1 A 120 120 LEU H H 119 8.099 8.236 -0.137 1
1 1387 . 6 1 1 A 120 120 LEU HA H 119 3.842 3.995 -0.153 1
1 1397 . 6 1 1 A 120 120 LEU C C 119 179.601 179.111 0.490 1
1 1398 . 6 1 1 A 120 120 LEU CA C 119 58.174 57.780 0.394 1
1 1399 . 6 1 1 A 120 120 LEU CB C 119 40.315 41.566 -1.251 1
1 1403 . 6 1 1 A 120 120 LEU N N 119 117.930 119.810 -1.880 1
1 1404 . 6 1 1 A 121 121 ALA H H 120 7.729 7.712 0.017 1
1 1405 . 6 1 1 A 121 121 ALA HA H 120 3.996 4.116 -0.120 1
1 1409 . 6 1 1 A 121 121 ALA C C 120 180.995 179.704 1.291 1
1 1410 . 6 1 1 A 121 121 ALA CA C 120 54.832 54.612 0.220 1
1 1411 . 6 1 1 A 121 121 ALA CB C 120 17.706 18.277 -0.571 1
1 1412 . 6 1 1 A 121 121 ALA N N 120 123.195 120.210 2.985 1
1 1413 . 6 1 1 A 122 122 PHE H H 121 7.943 7.845 0.098 1
1 1414 . 6 1 1 A 122 122 PHE HA H 121 3.887 3.771 0.116 1
1 1419 . 6 1 1 A 122 122 PHE C C 121 175.410 176.744 -1.334 1
1 1420 . 6 1 1 A 122 122 PHE CA C 121 61.075 60.657 0.418 1
1 1421 . 6 1 1 A 122 122 PHE CB C 121 38.115 38.872 -0.757 1
1 1424 . 6 1 1 A 122 122 PHE N N 121 121.798 120.095 1.703 1
1 1425 . 6 1 1 A 123 123 LYS H H 122 8.468 7.820 0.648 1
1 1426 . 6 1 1 A 123 123 LYS HA H 122 3.077 3.751 -0.674 1
1 1435 . 6 1 1 A 123 123 LYS C C 122 178.453 178.775 -0.322 1
1 1436 . 6 1 1 A 123 123 LYS CA C 122 59.855 59.800 0.055 1
1 1437 . 6 1 1 A 123 123 LYS CB C 122 32.374 31.972 0.402 1
1 1441 . 6 1 1 A 123 123 LYS N N 122 120.614 118.522 2.092 1
1 1442 . 6 1 1 A 124 124 GLU H H 123 8.100 7.854 0.246 1
1 1443 . 6 1 1 A 124 124 GLU HA H 123 3.652 4.019 -0.367 1
1 1448 . 6 1 1 A 124 124 GLU C C 123 177.743 178.531 -0.788 1
1 1449 . 6 1 1 A 124 124 GLU CA C 123 59.406 59.552 -0.146 1
1 1450 . 6 1 1 A 124 124 GLU CB C 123 28.811 29.015 -0.204 1
1 1452 . 6 1 1 A 124 124 GLU N N 123 117.404 119.141 -1.737 1
1 1453 . 6 1 1 A 125 125 MET H H 124 7.537 7.606 -0.069 1
1 1454 . 6 1 1 A 125 125 MET HA H 124 3.860 3.952 -0.092 1
1 1462 . 6 1 1 A 125 125 MET C C 124 179.522 178.254 1.268 1
1 1463 . 6 1 1 A 125 125 MET CA C 124 58.832 58.491 0.341 1
1 1464 . 6 1 1 A 125 125 MET CB C 124 31.765 31.476 0.289 1
1 1467 . 6 1 1 A 125 125 MET N N 124 119.413 118.897 0.516 1
1 1468 . 6 1 1 A 126 126 PHE H H 125 7.148 7.361 -0.213 1
1 1469 . 6 1 1 A 126 126 PHE HA H 125 3.633 4.262 -0.629 1
1 1476 . 6 1 1 A 126 126 PHE C C 125 178.994 178.219 0.775 1
1 1477 . 6 1 1 A 126 126 PHE CA C 125 63.148 60.597 2.551 1
1 1478 . 6 1 1 A 126 126 PHE CB C 125 39.830 38.084 1.746 1
1 1483 . 6 1 1 A 126 126 PHE N N 125 120.013 119.377 0.636 1
1 1484 . 6 1 1 A 127 127 LEU H H 126 8.369 8.236 0.133 1
1 1485 . 6 1 1 A 127 127 LEU HA H 126 3.972 4.001 -0.029 1
1 1495 . 6 1 1 A 127 127 LEU C C 126 180.621 178.579 2.042 1
1 1496 . 6 1 1 A 127 127 LEU CA C 126 57.944 57.896 0.048 1
1 1497 . 6 1 1 A 127 127 LEU CB C 126 40.543 41.175 -0.632 1
1 1501 . 6 1 1 A 127 127 LEU N N 126 119.692 119.718 -0.026 1
1 1502 . 6 1 1 A 128 128 ASP H H 127 8.578 8.173 0.405 1
1 1503 . 6 1 1 A 128 128 ASP HA H 127 4.308 4.296 0.012 1
1 1506 . 6 1 1 A 128 128 ASP C C 127 178.254 177.908 0.346 1
1 1507 . 6 1 1 A 128 128 ASP CA C 127 56.964 57.292 -0.328 1
1 1508 . 6 1 1 A 128 128 ASP CB C 127 39.735 41.432 -1.697 1
1 1509 . 6 1 1 A 128 128 ASP N N 127 121.926 119.274 2.652 1
1 1510 . 6 1 1 A 129 129 TYR H H 128 7.710 8.169 -0.459 1
1 1511 . 6 1 1 A 129 129 TYR HA H 128 3.908 4.166 -0.258 1
1 1518 . 6 1 1 A 129 129 TYR C C 128 177.633 177.732 -0.099 1
1 1519 . 6 1 1 A 129 129 TYR CA C 128 61.796 61.414 0.382 1
1 1520 . 6 1 1 A 129 129 TYR CB C 128 39.372 38.649 0.723 1
1 1525 . 6 1 1 A 129 129 TYR N N 128 122.548 120.352 2.196 1
1 1526 . 6 1 1 A 130 130 ARG H H 129 8.622 8.251 0.371 1
1 1527 . 6 1 1 A 130 130 ARG HA H 129 3.722 3.938 -0.216 1
1 1535 . 6 1 1 A 130 130 ARG CA C 129 60.084 59.501 0.583 1
1 1536 . 6 1 1 A 130 130 ARG CB C 129 29.902 30.014 -0.112 1
1 1539 . 6 1 1 A 130 130 ARG N N 129 118.302 119.133 -0.831 1
1 1541 . 6 1 1 A 131 131 ALA H H 130 7.936 8.006 -0.070 1
1 1542 . 6 1 1 A 131 131 ALA HA H 130 3.997 4.054 -0.057 1
1 1546 . 6 1 1 A 131 131 ALA C C 130 180.456 179.998 0.458 1
1 1547 . 6 1 1 A 131 131 ALA CA C 130 55.133 55.025 0.108 1
1 1548 . 6 1 1 A 131 131 ALA CB C 130 17.750 18.315 -0.565 1
1 1549 . 6 1 1 A 131 131 ALA N N 130 119.788 121.678 -1.890 1
1 1550 . 6 1 1 A 132 132 GLU H H 131 7.622 7.678 -0.056 1
1 1551 . 6 1 1 A 132 132 GLU HA H 131 3.862 3.970 -0.108 1
1 1556 . 6 1 1 A 132 132 GLU C C 131 179.528 179.111 0.417 1
1 1557 . 6 1 1 A 132 132 GLU CA C 131 58.849 58.730 0.119 1
1 1558 . 6 1 1 A 132 132 GLU CB C 131 28.930 29.105 -0.175 1
1 1560 . 6 1 1 A 132 132 GLU N N 131 118.428 117.929 0.499 1
1 1561 . 6 1 1 A 133 133 LYS H H 132 7.853 7.445 0.408 1
1 1562 . 6 1 1 A 133 133 LYS HA H 132 3.722 3.960 -0.238 1
1 1571 . 6 1 1 A 133 133 LYS C C 132 175.725 178.331 -2.606 1
1 1572 . 6 1 1 A 133 133 LYS CA C 132 57.544 58.934 -1.390 1
1 1573 . 6 1 1 A 133 133 LYS CB C 132 31.770 31.905 -0.135 1
1 1577 . 6 1 1 A 133 133 LYS N N 132 119.473 119.293 0.180 1
1 1578 . 6 1 1 A 134 134 GLU H H 133 8.151 7.640 0.511 1
1 1579 . 6 1 1 A 134 134 GLU HA H 133 4.161 4.300 -0.139 1
1 1584 . 6 1 1 A 134 134 GLU C C 133 177.453 177.411 0.042 1
1 1585 . 6 1 1 A 134 134 GLU CA C 133 57.222 56.253 0.969 1
1 1586 . 6 1 1 A 134 134 GLU CB C 133 30.091 30.232 -0.141 1
1 1588 . 6 1 1 A 134 134 GLU N N 133 116.525 117.190 -0.665 1
1 1589 . 6 1 1 A 135 135 GLY H H 134 7.702 7.756 -0.054 1
1 1590 . 6 1 1 A 135 135 GLY HA2 H 134 3.896 3.862 0.034 1
1 1591 . 6 1 1 A 135 135 GLY HA3 H 134 3.897 3.869 0.028 1
1 1592 . 6 1 1 A 135 135 GLY C C 134 174.538 174.252 0.286 1
1 1593 . 6 1 1 A 135 135 GLY CA C 134 45.975 46.519 -0.544 1
1 1594 . 6 1 1 A 135 135 GLY N N 134 107.924 109.166 -1.242 1
1 1595 . 6 1 1 A 136 136 ARG H H 135 8.045 8.418 -0.373 1
1 1596 . 6 1 1 A 136 136 ARG HA H 135 4.323 3.957 0.366 1
1 1604 . 6 1 1 A 136 136 ARG C C 135 175.864 176.347 -0.483 1
1 1605 . 6 1 1 A 136 136 ARG CA C 135 56.016 57.174 -1.158 1
1 1606 . 6 1 1 A 136 136 ARG CB C 135 30.987 28.055 2.932 1
1 1609 . 6 1 1 A 136 136 ARG N N 135 119.708 111.795 7.913 1
1 1 . 7 1 1 A 14 14 PHE CA C 13 58.199 59.184 -0.985 1
1 2 . 7 1 1 A 14 14 PHE CB C 13 39.717 37.903 1.814 1
1 3 . 7 1 1 A 15 15 SER H H 14 8.299 8.699 -0.400 1
1 4 . 7 1 1 A 15 15 SER HA H 14 4.359 4.744 -0.385 1
1 7 . 7 1 1 A 15 15 SER CA C 14 58.249 57.233 1.016 1
1 8 . 7 1 1 A 15 15 SER CB C 14 63.936 65.810 -1.874 1
1 9 . 7 1 1 A 15 15 SER N N 14 117.379 116.718 0.661 1
1 10 . 7 1 1 A 16 16 SER H H 15 8.255 8.841 -0.586 1
1 11 . 7 1 1 A 16 16 SER HA H 15 3.729 4.165 -0.436 1
1 14 . 7 1 1 A 16 16 SER CA C 15 58.224 60.933 -2.709 1
1 15 . 7 1 1 A 16 16 SER CB C 15 63.886 61.801 2.085 1
1 16 . 7 1 1 A 16 16 SER N N 15 117.694 114.626 3.068 1
1 17 . 7 1 1 A 17 17 ALA H H 16 8.333 8.512 -0.179 1
1 18 . 7 1 1 A 17 17 ALA HA H 16 4.252 4.235 0.017 1
1 22 . 7 1 1 A 17 17 ALA CA C 16 53.377 54.199 -0.822 1
1 23 . 7 1 1 A 17 17 ALA CB C 16 18.896 18.525 0.371 1
1 24 . 7 1 1 A 17 17 ALA N N 16 125.462 124.524 0.938 1
1 25 . 7 1 1 A 18 18 SER H H 17 8.219 7.931 0.288 1
1 26 . 7 1 1 A 18 18 SER HA H 17 4.332 4.640 -0.308 1
1 29 . 7 1 1 A 18 18 SER CA C 17 59.105 57.587 1.518 1
1 30 . 7 1 1 A 18 18 SER CB C 17 63.592 64.482 -0.890 1
1 31 . 7 1 1 A 18 18 SER N N 17 114.821 112.387 2.434 1
1 32 . 7 1 1 A 19 19 ASP H H 18 8.309 8.300 0.009 1
1 33 . 7 1 1 A 19 19 ASP HA H 18 4.554 5.000 -0.446 1
1 36 . 7 1 1 A 19 19 ASP C C 18 176.528 176.698 -0.170 1
1 37 . 7 1 1 A 19 19 ASP CA C 18 55.272 55.641 -0.369 1
1 38 . 7 1 1 A 19 19 ASP CB C 18 40.883 41.058 -0.175 1
1 39 . 7 1 1 A 19 19 ASP N N 18 123.367 121.391 1.976 1
1 40 . 7 1 1 A 20 20 ALA H H 19 8.133 8.598 -0.465 1
1 41 . 7 1 1 A 20 20 ALA HA H 19 4.170 4.074 0.096 1
1 45 . 7 1 1 A 20 20 ALA C C 19 179.857 178.957 0.900 1
1 46 . 7 1 1 A 20 20 ALA CA C 19 54.341 55.532 -1.191 1
1 47 . 7 1 1 A 20 20 ALA CB C 19 18.660 18.582 0.078 1
1 48 . 7 1 1 A 20 20 ALA N N 19 123.350 122.893 0.457 1
1 49 . 7 1 1 A 21 21 GLU H H 20 8.140 8.073 0.067 1
1 50 . 7 1 1 A 21 21 GLU HA H 20 4.128 4.055 0.073 1
1 55 . 7 1 1 A 21 21 GLU C C 20 177.675 178.707 -1.032 1
1 56 . 7 1 1 A 21 21 GLU CA C 20 58.520 59.412 -0.892 1
1 57 . 7 1 1 A 21 21 GLU CB C 20 29.765 29.615 0.150 1
1 59 . 7 1 1 A 21 21 GLU N N 20 119.063 118.859 0.204 1
1 60 . 7 1 1 A 22 22 PHE H H 21 8.009 8.141 -0.132 1
1 61 . 7 1 1 A 22 22 PHE HA H 21 4.123 4.293 -0.170 1
1 68 . 7 1 1 A 22 22 PHE C C 21 176.410 177.409 -0.999 1
1 69 . 7 1 1 A 22 22 PHE CA C 21 62.202 61.215 0.987 1
1 70 . 7 1 1 A 22 22 PHE CB C 21 39.223 38.933 0.290 1
1 75 . 7 1 1 A 22 22 PHE N N 21 121.211 121.014 0.197 1
1 76 . 7 1 1 A 23 23 ASP H H 22 8.261 8.512 -0.251 1
1 77 . 7 1 1 A 23 23 ASP HA H 22 4.041 4.401 -0.360 1
1 80 . 7 1 1 A 23 23 ASP C C 22 179.078 178.171 0.907 1
1 81 . 7 1 1 A 23 23 ASP CA C 22 57.048 57.899 -0.851 1
1 82 . 7 1 1 A 23 23 ASP CB C 22 40.154 42.261 -2.107 1
1 83 . 7 1 1 A 23 23 ASP N N 22 116.876 119.433 -2.557 1
1 84 . 7 1 1 A 24 24 ALA H H 23 7.651 7.519 0.132 1
1 85 . 7 1 1 A 24 24 ALA HA H 23 3.785 3.893 -0.108 1
1 89 . 7 1 1 A 24 24 ALA C C 23 179.577 179.683 -0.106 1
1 90 . 7 1 1 A 24 24 ALA CA C 23 54.341 55.054 -0.713 1
1 91 . 7 1 1 A 24 24 ALA CB C 23 17.762 18.261 -0.499 1
1 92 . 7 1 1 A 24 24 ALA N N 23 121.873 121.191 0.682 1
1 93 . 7 1 1 A 25 25 VAL H H 24 7.718 7.760 -0.042 1
1 94 . 7 1 1 A 25 25 VAL HA H 24 3.216 3.588 -0.372 1
1 102 . 7 1 1 A 25 25 VAL C C 24 177.805 178.363 -0.558 1
1 103 . 7 1 1 A 25 25 VAL CA C 24 66.789 66.750 0.039 1
1 104 . 7 1 1 A 25 25 VAL CB C 24 31.277 31.129 0.148 1
1 107 . 7 1 1 A 25 25 VAL N N 24 117.890 118.456 -0.566 1
1 108 . 7 1 1 A 26 26 VAL H H 25 7.867 7.725 0.142 1
1 109 . 7 1 1 A 26 26 VAL HA H 25 3.274 3.511 -0.237 1
1 117 . 7 1 1 A 26 26 VAL C C 25 177.788 177.759 0.029 1
1 118 . 7 1 1 A 26 26 VAL CA C 25 67.282 66.418 0.864 1
1 119 . 7 1 1 A 26 26 VAL CB C 25 31.266 31.430 -0.164 1
1 122 . 7 1 1 A 26 26 VAL N N 25 118.170 120.135 -1.965 1
1 123 . 7 1 1 A 27 27 GLY H H 26 7.544 7.605 -0.061 1
1 124 . 7 1 1 A 27 27 GLY HA2 H 26 3.592 3.516 0.076 1
1 125 . 7 1 1 A 27 27 GLY HA3 H 26 3.721 3.635 0.086 1
1 126 . 7 1 1 A 27 27 GLY C C 26 176.717 176.434 0.283 1
1 127 . 7 1 1 A 27 27 GLY CA C 26 47.085 47.170 -0.085 1
1 128 . 7 1 1 A 27 27 GLY N N 26 105.795 107.500 -1.705 1
1 129 . 7 1 1 A 28 28 TYR H H 27 7.625 7.357 0.268 1
1 130 . 7 1 1 A 28 28 TYR HA H 27 4.546 4.618 -0.072 1
1 137 . 7 1 1 A 28 28 TYR C C 27 178.991 178.157 0.834 1
1 138 . 7 1 1 A 28 28 TYR CA C 27 58.845 59.766 -0.921 1
1 139 . 7 1 1 A 28 28 TYR CB C 27 37.602 37.552 0.050 1
1 144 . 7 1 1 A 28 28 TYR N N 27 119.933 121.569 -1.636 1
1 145 . 7 1 1 A 29 29 LEU H H 28 8.517 8.217 0.300 1
1 146 . 7 1 1 A 29 29 LEU HA H 28 3.728 3.806 -0.078 1
1 156 . 7 1 1 A 29 29 LEU CA C 28 58.281 57.864 0.417 1
1 157 . 7 1 1 A 29 29 LEU CB C 28 41.948 41.404 0.544 1
1 161 . 7 1 1 A 29 29 LEU N N 28 119.669 120.327 -0.658 1
1 162 . 7 1 1 A 30 30 GLU H H 29 8.072 7.983 0.089 1
1 163 . 7 1 1 A 30 30 GLU HA H 29 3.722 3.858 -0.136 1
1 168 . 7 1 1 A 30 30 GLU C C 29 177.731 179.360 -1.629 1
1 169 . 7 1 1 A 30 30 GLU CA C 29 59.763 59.991 -0.228 1
1 170 . 7 1 1 A 30 30 GLU CB C 29 28.844 29.361 -0.517 1
1 172 . 7 1 1 A 30 30 GLU N N 29 117.666 117.956 -0.290 1
1 173 . 7 1 1 A 31 31 ASP H H 30 7.243 7.832 -0.589 1
1 174 . 7 1 1 A 31 31 ASP HA H 30 4.297 4.387 -0.090 1
1 177 . 7 1 1 A 31 31 ASP CA C 30 56.953 57.355 -0.402 1
1 178 . 7 1 1 A 31 31 ASP CB C 30 40.730 40.745 -0.015 1
1 179 . 7 1 1 A 31 31 ASP N N 30 116.720 119.204 -2.484 1
1 180 . 7 1 1 A 32 32 ILE H H 31 7.940 7.487 0.453 1
1 181 . 7 1 1 A 32 32 ILE HA H 31 3.640 3.696 -0.056 1
1 191 . 7 1 1 A 32 32 ILE C C 31 177.980 178.149 -0.169 1
1 192 . 7 1 1 A 32 32 ILE CA C 31 64.692 64.076 0.616 1
1 193 . 7 1 1 A 32 32 ILE CB C 31 38.938 36.931 2.007 1
1 197 . 7 1 1 A 32 32 ILE N N 31 119.728 120.211 -0.483 1
1 198 . 7 1 1 A 33 33 ILE H H 32 7.984 7.840 0.144 1
1 199 . 7 1 1 A 33 33 ILE HA H 32 3.598 3.391 0.207 1
1 209 . 7 1 1 A 33 33 ILE C C 32 176.723 177.113 -0.390 1
1 210 . 7 1 1 A 33 33 ILE CA C 32 63.241 64.526 -1.285 1
1 211 . 7 1 1 A 33 33 ILE CB C 32 37.580 37.746 -0.166 1
1 215 . 7 1 1 A 33 33 ILE N N 32 113.919 120.758 -6.839 1
1 216 . 7 1 1 A 34 34 MET H H 33 7.288 7.587 -0.299 1
1 217 . 7 1 1 A 34 34 MET HA H 33 4.496 4.701 -0.205 1
1 225 . 7 1 1 A 34 34 MET C C 33 176.423 175.742 0.681 1
1 226 . 7 1 1 A 34 34 MET CA C 33 54.634 54.294 0.340 1
1 227 . 7 1 1 A 34 34 MET CB C 33 31.934 32.356 -0.422 1
1 230 . 7 1 1 A 34 34 MET N N 33 115.130 116.864 -1.734 1
1 231 . 7 1 1 A 35 35 ASP H H 34 7.405 7.518 -0.113 1
1 232 . 7 1 1 A 35 35 ASP HA H 34 4.484 4.434 0.050 1
1 235 . 7 1 1 A 35 35 ASP C C 34 177.139 176.734 0.405 1
1 236 . 7 1 1 A 35 35 ASP CA C 34 54.625 54.919 -0.294 1
1 237 . 7 1 1 A 35 35 ASP CB C 34 43.554 42.679 0.875 1
1 238 . 7 1 1 A 35 35 ASP N N 34 121.814 121.752 0.062 1
1 239 . 7 1 1 A 36 36 ASP H H 35 8.765 9.252 -0.487 1
1 240 . 7 1 1 A 36 36 ASP HA H 35 4.235 4.264 -0.029 1
1 243 . 7 1 1 A 36 36 ASP C C 35 178.320 178.060 0.260 1
1 244 . 7 1 1 A 36 36 ASP CA C 35 57.832 58.535 -0.703 1
1 245 . 7 1 1 A 36 36 ASP CB C 35 40.914 41.318 -0.404 1
1 246 . 7 1 1 A 36 36 ASP N N 35 125.883 128.717 -2.834 1
1 247 . 7 1 1 A 37 37 GLU H H 36 8.905 8.322 0.583 1
1 248 . 7 1 1 A 37 37 GLU HA H 36 3.933 4.107 -0.174 1
1 253 . 7 1 1 A 37 37 GLU C C 36 179.304 179.054 0.250 1
1 254 . 7 1 1 A 37 37 GLU CA C 36 59.828 58.749 1.079 1
1 255 . 7 1 1 A 37 37 GLU CB C 36 29.380 29.724 -0.344 1
1 257 . 7 1 1 A 37 37 GLU N N 36 119.077 119.234 -0.157 1
1 258 . 7 1 1 A 38 38 PHE H H 37 7.460 8.224 -0.764 1
1 259 . 7 1 1 A 38 38 PHE HA H 37 3.642 4.064 -0.422 1
1 267 . 7 1 1 A 38 38 PHE C C 37 176.483 177.925 -1.442 1
1 268 . 7 1 1 A 38 38 PHE CA C 37 61.411 61.248 0.163 1
1 269 . 7 1 1 A 38 38 PHE CB C 37 39.355 39.260 0.095 1
1 275 . 7 1 1 A 38 38 PHE N N 37 119.968 122.583 -2.615 1
1 276 . 7 1 1 A 39 39 GLN H H 38 7.968 8.090 -0.122 1
1 277 . 7 1 1 A 39 39 GLN HA H 38 3.712 3.791 -0.079 1
1 284 . 7 1 1 A 39 39 GLN CA C 38 59.153 58.876 0.277 1
1 285 . 7 1 1 A 39 39 GLN CB C 38 28.213 28.467 -0.254 1
1 287 . 7 1 1 A 39 39 GLN N N 38 116.433 118.385 -1.952 1
1 289 . 7 1 1 A 40 40 LEU H H 39 7.930 7.861 0.069 1
1 290 . 7 1 1 A 40 40 LEU HA H 39 3.916 4.045 -0.129 1
1 300 . 7 1 1 A 40 40 LEU C C 39 177.731 178.423 -0.692 1
1 301 . 7 1 1 A 40 40 LEU CA C 39 57.915 58.094 -0.179 1
1 302 . 7 1 1 A 40 40 LEU CB C 39 41.989 41.660 0.329 1
1 306 . 7 1 1 A 40 40 LEU N N 39 119.505 122.099 -2.594 1
1 307 . 7 1 1 A 41 41 LEU H H 40 7.174 7.972 -0.798 1
1 308 . 7 1 1 A 41 41 LEU HA H 40 3.835 4.144 -0.309 1
1 318 . 7 1 1 A 41 41 LEU C C 40 179.738 178.303 1.435 1
1 319 . 7 1 1 A 41 41 LEU CA C 40 58.266 57.565 0.701 1
1 320 . 7 1 1 A 41 41 LEU CB C 40 42.050 41.335 0.715 1
1 324 . 7 1 1 A 41 41 LEU N N 40 120.971 119.817 1.154 1
1 325 . 7 1 1 A 42 42 GLN H H 41 8.058 8.044 0.014 1
1 326 . 7 1 1 A 42 42 GLN HA H 41 3.556 3.755 -0.199 1
1 333 . 7 1 1 A 42 42 GLN C C 41 177.642 178.461 -0.819 1
1 334 . 7 1 1 A 42 42 GLN CA C 41 59.826 59.169 0.657 1
1 335 . 7 1 1 A 42 42 GLN CB C 41 28.762 27.915 0.847 1
1 337 . 7 1 1 A 42 42 GLN N N 41 117.899 118.806 -0.907 1
1 339 . 7 1 1 A 43 43 ARG H H 42 8.179 7.572 0.607 1
1 340 . 7 1 1 A 43 43 ARG HA H 42 3.655 4.050 -0.395 1
1 347 . 7 1 1 A 43 43 ARG C C 42 178.051 178.992 -0.941 1
1 348 . 7 1 1 A 43 43 ARG CA C 42 59.766 58.765 1.001 1
1 349 . 7 1 1 A 43 43 ARG CB C 42 29.941 29.628 0.313 1
1 352 . 7 1 1 A 43 43 ARG N N 42 119.392 119.171 0.221 1
1 353 . 7 1 1 A 44 44 ASN H H 43 8.525 7.799 0.726 1
1 354 . 7 1 1 A 44 44 ASN HA H 43 4.332 4.377 -0.045 1
1 359 . 7 1 1 A 44 44 ASN C C 43 178.150 178.529 -0.379 1
1 360 . 7 1 1 A 44 44 ASN CA C 43 55.841 56.373 -0.532 1
1 361 . 7 1 1 A 44 44 ASN CB C 43 37.632 38.255 -0.623 1
1 362 . 7 1 1 A 44 44 ASN N N 43 116.214 118.128 -1.914 1
1 364 . 7 1 1 A 45 45 PHE H H 44 7.586 7.873 -0.287 1
1 365 . 7 1 1 A 45 45 PHE HA H 44 4.132 4.341 -0.209 1
1 372 . 7 1 1 A 45 45 PHE C C 44 176.691 178.944 -2.253 1
1 373 . 7 1 1 A 45 45 PHE CA C 44 62.333 60.822 1.511 1
1 374 . 7 1 1 A 45 45 PHE CB C 44 39.449 38.659 0.790 1
1 379 . 7 1 1 A 45 45 PHE N N 44 121.501 119.152 2.349 1
1 380 . 7 1 1 A 46 46 MET H H 45 8.190 8.151 0.039 1
1 381 . 7 1 1 A 46 46 MET HA H 45 4.060 4.213 -0.153 1
1 389 . 7 1 1 A 46 46 MET C C 45 179.754 178.106 1.648 1
1 390 . 7 1 1 A 46 46 MET CA C 45 57.742 57.980 -0.238 1
1 391 . 7 1 1 A 46 46 MET CB C 45 29.912 31.328 -1.416 1
1 394 . 7 1 1 A 46 46 MET N N 45 116.727 117.849 -1.122 1
1 395 . 7 1 1 A 47 47 ASP H H 46 8.579 8.277 0.302 1
1 396 . 7 1 1 A 47 47 ASP HA H 46 4.804 4.652 0.152 1
1 399 . 7 1 1 A 47 47 ASP C C 46 177.854 177.631 0.223 1
1 400 . 7 1 1 A 47 47 ASP CA C 46 57.277 57.256 0.021 1
1 401 . 7 1 1 A 47 47 ASP CB C 46 40.776 41.601 -0.825 1
1 402 . 7 1 1 A 47 47 ASP N N 46 117.798 120.667 -2.869 1
1 403 . 7 1 1 A 48 48 LYS H H 47 7.339 7.922 -0.583 1
1 404 . 7 1 1 A 48 48 LYS HA H 47 3.828 4.331 -0.503 1
1 413 . 7 1 1 A 48 48 LYS C C 47 178.812 178.483 0.329 1
1 414 . 7 1 1 A 48 48 LYS CA C 47 58.953 57.541 1.412 1
1 415 . 7 1 1 A 48 48 LYS CB C 47 32.796 33.455 -0.659 1
1 419 . 7 1 1 A 48 48 LYS N N 47 117.852 117.519 0.333 1
1 420 . 7 1 1 A 49 49 TYR H H 48 6.841 8.425 -1.584 1
1 421 . 7 1 1 A 49 49 TYR HA H 48 4.995 4.170 0.825 1
1 428 . 7 1 1 A 49 49 TYR C C 48 178.138 178.495 -0.357 1
1 429 . 7 1 1 A 49 49 TYR CA C 48 58.620 59.636 -1.016 1
1 430 . 7 1 1 A 49 49 TYR CB C 48 42.939 37.994 4.945 1
1 435 . 7 1 1 A 49 49 TYR N N 48 112.109 119.024 -6.915 1
1 436 . 7 1 1 A 50 50 TYR H H 49 8.491 7.996 0.495 1
1 437 . 7 1 1 A 50 50 TYR HA H 49 4.598 4.063 0.535 1
1 444 . 7 1 1 A 50 50 TYR C C 49 176.015 177.441 -1.426 1
1 445 . 7 1 1 A 50 50 TYR CA C 49 62.442 59.378 3.064 1
1 446 . 7 1 1 A 50 50 TYR CB C 49 36.588 36.778 -0.190 1
1 451 . 7 1 1 A 50 50 TYR N N 49 118.294 119.466 -1.172 1
1 452 . 7 1 1 A 51 51 LEU H H 50 7.512 7.584 -0.072 1
1 453 . 7 1 1 A 51 51 LEU HA H 50 3.878 3.540 0.338 1
1 463 . 7 1 1 A 51 51 LEU C C 50 178.625 178.717 -0.092 1
1 464 . 7 1 1 A 51 51 LEU CA C 50 55.994 57.245 -1.251 1
1 465 . 7 1 1 A 51 51 LEU CB C 50 40.743 41.613 -0.870 1
1 469 . 7 1 1 A 51 51 LEU N N 50 118.478 121.696 -3.218 1
1 470 . 7 1 1 A 52 52 GLU H H 51 8.042 7.911 0.131 1
1 471 . 7 1 1 A 52 52 GLU HA H 51 4.197 3.969 0.228 1
1 476 . 7 1 1 A 52 52 GLU C C 51 177.629 177.727 -0.098 1
1 477 . 7 1 1 A 52 52 GLU CA C 51 56.141 59.566 -3.425 1
1 478 . 7 1 1 A 52 52 GLU CB C 51 29.162 29.243 -0.081 1
1 480 . 7 1 1 A 52 52 GLU N N 51 115.067 117.492 -2.425 1
1 481 . 7 1 1 A 53 53 PHE H H 52 7.465 7.849 -0.384 1
1 482 . 7 1 1 A 53 53 PHE HA H 52 4.431 4.562 -0.131 1
1 490 . 7 1 1 A 53 53 PHE C C 52 174.325 175.062 -0.737 1
1 491 . 7 1 1 A 53 53 PHE CA C 52 58.986 57.041 1.945 1
1 492 . 7 1 1 A 53 53 PHE CB C 52 40.183 37.499 2.684 1
1 498 . 7 1 1 A 53 53 PHE N N 52 116.768 118.925 -2.157 1
1 499 . 7 1 1 A 54 54 GLU H H 53 7.484 8.734 -1.250 1
1 500 . 7 1 1 A 54 54 GLU HA H 53 4.583 4.914 -0.331 1
1 505 . 7 1 1 A 54 54 GLU C C 53 175.722 175.519 0.203 1
1 506 . 7 1 1 A 54 54 GLU CA C 53 54.248 54.764 -0.516 1
1 507 . 7 1 1 A 54 54 GLU CB C 53 34.409 32.011 2.398 1
1 509 . 7 1 1 A 54 54 GLU N N 53 118.844 123.579 -4.735 1
1 510 . 7 1 1 A 55 55 ASP H H 54 9.008 8.624 0.384 1
1 511 . 7 1 1 A 55 55 ASP HA H 54 4.735 4.810 -0.075 1
1 514 . 7 1 1 A 55 55 ASP C C 54 175.421 175.794 -0.373 1
1 515 . 7 1 1 A 55 55 ASP CA C 54 52.888 53.733 -0.845 1
1 516 . 7 1 1 A 55 55 ASP CB C 54 38.894 40.370 -1.476 1
1 517 . 7 1 1 A 55 55 ASP N N 54 123.654 123.120 0.534 1
1 518 . 7 1 1 A 56 56 THR H H 55 7.819 8.075 -0.256 1
1 519 . 7 1 1 A 56 56 THR HA H 55 4.574 4.986 -0.412 1
1 524 . 7 1 1 A 56 56 THR C C 55 174.096 173.953 0.143 1
1 525 . 7 1 1 A 56 56 THR CA C 55 59.172 59.416 -0.244 1
1 526 . 7 1 1 A 56 56 THR CB C 55 71.889 72.180 -0.291 1
1 528 . 7 1 1 A 56 56 THR N N 55 112.015 117.171 -5.156 1
1 529 . 7 1 1 A 57 57 GLU H H 56 8.527 8.763 -0.236 1
1 530 . 7 1 1 A 57 57 GLU HA H 56 4.217 4.577 -0.360 1
1 535 . 7 1 1 A 57 57 GLU C C 56 177.042 176.283 0.759 1
1 536 . 7 1 1 A 57 57 GLU CA C 56 56.869 56.231 0.638 1
1 537 . 7 1 1 A 57 57 GLU CB C 56 29.731 30.477 -0.746 1
1 539 . 7 1 1 A 57 57 GLU N N 56 117.531 118.799 -1.268 1
1 540 . 7 1 1 A 58 58 GLU H H 57 7.587 7.720 -0.133 1
1 541 . 7 1 1 A 58 58 GLU HA H 57 3.941 4.490 -0.549 1
1 546 . 7 1 1 A 58 58 GLU C C 57 176.849 175.941 0.908 1
1 547 . 7 1 1 A 58 58 GLU CA C 57 56.924 56.195 0.729 1
1 548 . 7 1 1 A 58 58 GLU CB C 57 30.251 30.580 -0.329 1
1 550 . 7 1 1 A 58 58 GLU N N 57 119.183 121.919 -2.736 1
1 551 . 7 1 1 A 59 59 ASN H H 58 9.120 8.725 0.395 1
1 552 . 7 1 1 A 59 59 ASN HA H 58 4.922 5.033 -0.111 1
1 557 . 7 1 1 A 59 59 ASN C C 58 174.254 174.366 -0.112 1
1 558 . 7 1 1 A 59 59 ASN CA C 58 51.956 52.364 -0.408 1
1 559 . 7 1 1 A 59 59 ASN CB C 58 37.404 39.445 -2.041 1
1 560 . 7 1 1 A 59 59 ASN N N 58 126.767 125.513 1.254 1
1 562 . 7 1 1 A 60 60 LYS H H 59 5.892 8.981 -3.089 1
1 563 . 7 1 1 A 60 60 LYS HA H 59 3.798 4.571 -0.773 1
1 572 . 7 1 1 A 60 60 LYS C C 59 177.908 177.851 0.057 1
1 573 . 7 1 1 A 60 60 LYS CA C 59 56.623 55.096 1.527 1
1 574 . 7 1 1 A 60 60 LYS CB C 59 32.279 34.187 -1.908 1
1 578 . 7 1 1 A 60 60 LYS N N 59 121.527 126.962 -5.435 1
1 579 . 7 1 1 A 61 61 LEU H H 60 8.473 8.794 -0.321 1
1 580 . 7 1 1 A 61 61 LEU HA H 60 3.891 4.228 -0.337 1
1 590 . 7 1 1 A 61 61 LEU C C 60 179.843 178.640 1.203 1
1 591 . 7 1 1 A 61 61 LEU CA C 60 58.301 56.459 1.842 1
1 592 . 7 1 1 A 61 61 LEU CB C 60 41.305 41.711 -0.406 1
1 596 . 7 1 1 A 61 61 LEU N N 60 125.639 122.925 2.714 1
1 597 . 7 1 1 A 62 62 ILE H H 61 7.698 7.883 -0.185 1
1 598 . 7 1 1 A 62 62 ILE HA H 61 3.952 3.910 0.042 1
1 608 . 7 1 1 A 62 62 ILE C C 61 175.392 177.112 -1.720 1
1 609 . 7 1 1 A 62 62 ILE CA C 61 61.743 63.512 -1.769 1
1 610 . 7 1 1 A 62 62 ILE CB C 61 39.108 37.822 1.286 1
1 614 . 7 1 1 A 62 62 ILE N N 61 114.111 119.753 -5.642 1
1 615 . 7 1 1 A 63 63 TYR H H 62 7.273 7.972 -0.699 1
1 616 . 7 1 1 A 63 63 TYR HA H 62 4.343 4.204 0.139 1
1 623 . 7 1 1 A 63 63 TYR C C 62 178.264 178.459 -0.195 1
1 624 . 7 1 1 A 63 63 TYR CA C 62 57.231 61.063 -3.832 1
1 625 . 7 1 1 A 63 63 TYR CB C 62 36.332 37.672 -1.340 1
1 630 . 7 1 1 A 63 63 TYR N N 62 117.689 121.471 -3.782 1
1 631 . 7 1 1 A 64 64 THR H H 63 7.747 8.009 -0.262 1
1 632 . 7 1 1 A 64 64 THR HA H 63 4.266 4.218 0.048 1
1 637 . 7 1 1 A 64 64 THR CA C 63 69.362 67.616 1.746 1
1 638 . 7 1 1 A 64 64 THR CB C 63 66.962 67.239 -0.277 1
1 640 . 7 1 1 A 64 64 THR N N 63 113.755 116.094 -2.339 1
1 641 . 7 1 1 A 65 65 PRO HA H 64 4.372 4.388 -0.016 1
1 648 . 7 1 1 A 65 65 PRO C C 64 179.913 179.348 0.565 1
1 649 . 7 1 1 A 65 65 PRO CA C 64 66.011 66.038 -0.027 1
1 650 . 7 1 1 A 65 65 PRO CB C 64 30.642 30.745 -0.103 1
1 653 . 7 1 1 A 66 66 ILE H H 65 7.377 7.269 0.108 1
1 654 . 7 1 1 A 66 66 ILE HA H 65 3.530 3.908 -0.378 1
1 664 . 7 1 1 A 66 66 ILE C C 65 177.543 178.476 -0.933 1
1 665 . 7 1 1 A 66 66 ILE CA C 65 66.647 64.259 2.388 1
1 666 . 7 1 1 A 66 66 ILE CB C 65 38.029 37.684 0.345 1
1 670 . 7 1 1 A 66 66 ILE N N 65 118.353 116.768 1.585 1
1 671 . 7 1 1 A 67 67 PHE H H 66 8.480 8.563 -0.083 1
1 672 . 7 1 1 A 67 67 PHE HA H 66 4.115 4.348 -0.233 1
1 680 . 7 1 1 A 67 67 PHE C C 66 177.293 177.878 -0.585 1
1 681 . 7 1 1 A 67 67 PHE CA C 66 59.570 62.441 -2.871 1
1 682 . 7 1 1 A 67 67 PHE CB C 66 38.865 39.413 -0.548 1
1 688 . 7 1 1 A 67 67 PHE N N 66 122.420 120.489 1.931 1
1 689 . 7 1 1 A 68 68 ASN H H 67 8.595 8.386 0.209 1
1 690 . 7 1 1 A 68 68 ASN HA H 67 4.211 4.430 -0.219 1
1 695 . 7 1 1 A 68 68 ASN C C 67 178.697 178.169 0.528 1
1 696 . 7 1 1 A 68 68 ASN CA C 67 56.056 56.124 -0.068 1
1 697 . 7 1 1 A 68 68 ASN CB C 67 37.704 38.189 -0.485 1
1 698 . 7 1 1 A 68 68 ASN N N 67 115.573 117.737 -2.164 1
1 700 . 7 1 1 A 69 69 GLU H H 68 8.414 8.147 0.267 1
1 701 . 7 1 1 A 69 69 GLU HA H 68 4.102 4.196 -0.094 1
1 706 . 7 1 1 A 69 69 GLU C C 68 177.880 178.791 -0.911 1
1 707 . 7 1 1 A 69 69 GLU CA C 68 59.399 59.407 -0.008 1
1 708 . 7 1 1 A 69 69 GLU CB C 68 29.855 29.488 0.367 1
1 710 . 7 1 1 A 69 69 GLU N N 68 123.510 119.979 3.531 1
1 711 . 7 1 1 A 70 70 TYR H H 69 8.659 8.053 0.606 1
1 712 . 7 1 1 A 70 70 TYR HA H 69 3.362 4.099 -0.737 1
1 719 . 7 1 1 A 70 70 TYR C C 69 178.143 177.003 1.140 1
1 720 . 7 1 1 A 70 70 TYR CA C 69 60.686 60.985 -0.299 1
1 721 . 7 1 1 A 70 70 TYR CB C 69 38.560 38.806 -0.246 1
1 726 . 7 1 1 A 70 70 TYR N N 69 122.130 120.697 1.433 1
1 727 . 7 1 1 A 71 71 ILE H H 70 8.031 7.689 0.342 1
1 728 . 7 1 1 A 71 71 ILE HA H 70 3.265 3.691 -0.426 1
1 738 . 7 1 1 A 71 71 ILE C C 70 178.056 177.281 0.775 1
1 739 . 7 1 1 A 71 71 ILE CA C 70 63.756 63.948 -0.192 1
1 740 . 7 1 1 A 71 71 ILE CB C 70 37.321 36.718 0.603 1
1 744 . 7 1 1 A 71 71 ILE N N 70 118.906 120.119 -1.213 1
1 745 . 7 1 1 A 72 72 SER H H 71 7.803 7.829 -0.026 1
1 746 . 7 1 1 A 72 72 SER HA H 71 4.029 4.381 -0.352 1
1 749 . 7 1 1 A 72 72 SER CA C 71 61.380 60.938 0.442 1
1 750 . 7 1 1 A 72 72 SER CB C 71 63.288 63.303 -0.015 1
1 751 . 7 1 1 A 72 72 SER N N 71 113.735 116.511 -2.776 1
1 752 . 7 1 1 A 73 73 LEU H H 72 7.952 8.027 -0.075 1
1 753 . 7 1 1 A 73 73 LEU HA H 72 4.418 4.123 0.295 1
1 763 . 7 1 1 A 73 73 LEU C C 72 177.767 178.300 -0.533 1
1 764 . 7 1 1 A 73 73 LEU CA C 72 56.543 57.434 -0.891 1
1 765 . 7 1 1 A 73 73 LEU CB C 72 44.517 41.723 2.794 1
1 769 . 7 1 1 A 73 73 LEU N N 72 119.411 122.506 -3.095 1
1 770 . 7 1 1 A 74 74 VAL H H 73 8.021 7.547 0.474 1
1 771 . 7 1 1 A 74 74 VAL HA H 73 3.532 3.356 0.176 1
1 779 . 7 1 1 A 74 74 VAL C C 73 177.126 177.958 -0.832 1
1 780 . 7 1 1 A 74 74 VAL CA C 73 66.250 66.337 -0.087 1
1 781 . 7 1 1 A 74 74 VAL CB C 73 31.212 31.173 0.039 1
1 784 . 7 1 1 A 74 74 VAL N N 73 118.747 119.218 -0.471 1
1 785 . 7 1 1 A 75 75 GLU H H 74 7.232 8.016 -0.784 1
1 786 . 7 1 1 A 75 75 GLU HA H 74 3.013 4.114 -1.101 1
1 791 . 7 1 1 A 75 75 GLU C C 74 178.804 178.945 -0.141 1
1 792 . 7 1 1 A 75 75 GLU CA C 74 60.536 59.737 0.799 1
1 793 . 7 1 1 A 75 75 GLU CB C 74 27.009 29.031 -2.022 1
1 795 . 7 1 1 A 75 75 GLU N N 74 118.660 119.947 -1.287 1
1 796 . 7 1 1 A 76 76 LYS H H 75 7.051 7.842 -0.791 1
1 797 . 7 1 1 A 76 76 LYS HA H 75 3.765 3.994 -0.229 1
1 806 . 7 1 1 A 76 76 LYS C C 75 177.765 178.532 -0.767 1
1 807 . 7 1 1 A 76 76 LYS CA C 75 58.357 58.913 -0.556 1
1 808 . 7 1 1 A 76 76 LYS CB C 75 31.939 31.900 0.039 1
1 812 . 7 1 1 A 76 76 LYS N N 75 116.112 119.565 -3.453 1
1 813 . 7 1 1 A 77 77 TYR H H 76 7.067 7.700 -0.633 1
1 814 . 7 1 1 A 77 77 TYR HA H 76 4.036 4.206 -0.170 1
1 821 . 7 1 1 A 77 77 TYR C C 76 177.752 177.247 0.505 1
1 822 . 7 1 1 A 77 77 TYR CA C 76 61.820 61.243 0.577 1
1 823 . 7 1 1 A 77 77 TYR CB C 76 38.480 38.688 -0.208 1
1 828 . 7 1 1 A 77 77 TYR N N 76 118.434 120.615 -2.181 1
1 829 . 7 1 1 A 78 78 ILE H H 77 7.554 8.394 -0.840 1
1 830 . 7 1 1 A 78 78 ILE HA H 77 3.159 3.528 -0.369 1
1 840 . 7 1 1 A 78 78 ILE C C 77 177.341 177.998 -0.657 1
1 841 . 7 1 1 A 78 78 ILE CA C 77 65.177 65.318 -0.141 1
1 842 . 7 1 1 A 78 78 ILE CB C 77 37.339 37.755 -0.416 1
1 846 . 7 1 1 A 78 78 ILE N N 77 117.672 121.513 -3.841 1
1 847 . 7 1 1 A 79 79 GLU H H 78 8.296 7.904 0.392 1
1 848 . 7 1 1 A 79 79 GLU HA H 78 3.557 3.710 -0.153 1
1 853 . 7 1 1 A 79 79 GLU C C 78 177.742 178.768 -1.026 1
1 854 . 7 1 1 A 79 79 GLU CA C 78 60.847 60.037 0.810 1
1 855 . 7 1 1 A 79 79 GLU CB C 78 29.594 29.174 0.420 1
1 857 . 7 1 1 A 79 79 GLU N N 78 118.701 120.690 -1.989 1
1 858 . 7 1 1 A 80 80 GLU H H 79 8.330 8.235 0.095 1
1 859 . 7 1 1 A 80 80 GLU HA H 79 3.774 3.959 -0.185 1
1 864 . 7 1 1 A 80 80 GLU C C 79 179.926 179.221 0.705 1
1 865 . 7 1 1 A 80 80 GLU CA C 79 59.581 58.999 0.582 1
1 866 . 7 1 1 A 80 80 GLU CB C 79 29.062 29.049 0.013 1
1 868 . 7 1 1 A 80 80 GLU N N 79 116.767 117.964 -1.197 1
1 869 . 7 1 1 A 81 81 GLN H H 80 7.634 7.676 -0.042 1
1 870 . 7 1 1 A 81 81 GLN HA H 80 3.605 3.848 -0.243 1
1 877 . 7 1 1 A 81 81 GLN C C 80 179.681 178.574 1.107 1
1 878 . 7 1 1 A 81 81 GLN CA C 80 57.765 58.476 -0.711 1
1 879 . 7 1 1 A 81 81 GLN CB C 80 28.079 27.972 0.107 1
1 881 . 7 1 1 A 81 81 GLN N N 80 116.325 118.671 -2.346 1
1 883 . 7 1 1 A 82 82 LEU H H 81 8.156 7.438 0.718 1
1 884 . 7 1 1 A 82 82 LEU HA H 81 3.536 3.731 -0.195 1
1 894 . 7 1 1 A 82 82 LEU C C 81 178.945 179.207 -0.262 1
1 895 . 7 1 1 A 82 82 LEU CA C 81 57.761 56.859 0.902 1
1 896 . 7 1 1 A 82 82 LEU CB C 81 40.961 40.887 0.074 1
1 900 . 7 1 1 A 82 82 LEU N N 81 121.546 120.145 1.401 1
1 901 . 7 1 1 A 83 83 LEU H H 82 8.326 8.021 0.305 1
1 902 . 7 1 1 A 83 83 LEU HA H 82 4.198 4.206 -0.008 1
1 912 . 7 1 1 A 83 83 LEU C C 82 178.631 179.070 -0.439 1
1 913 . 7 1 1 A 83 83 LEU CA C 82 57.016 56.999 0.017 1
1 914 . 7 1 1 A 83 83 LEU CB C 82 42.182 40.642 1.540 1
1 918 . 7 1 1 A 83 83 LEU N N 82 120.426 118.602 1.824 1
1 919 . 7 1 1 A 84 84 GLN H H 83 6.992 7.741 -0.749 1
1 920 . 7 1 1 A 84 84 GLN HA H 83 3.877 3.969 -0.092 1
1 927 . 7 1 1 A 84 84 GLN C C 83 177.008 176.734 0.274 1
1 928 . 7 1 1 A 84 84 GLN CA C 83 57.543 58.782 -1.239 1
1 929 . 7 1 1 A 84 84 GLN CB C 83 28.688 28.311 0.377 1
1 931 . 7 1 1 A 84 84 GLN N N 83 114.001 117.592 -3.591 1
1 933 . 7 1 1 A 85 85 ARG H H 84 7.072 7.579 -0.507 1
1 934 . 7 1 1 A 85 85 ARG HA H 84 4.047 4.426 -0.379 1
1 942 . 7 1 1 A 85 85 ARG C C 84 175.999 175.521 0.478 1
1 943 . 7 1 1 A 85 85 ARG CA C 84 56.764 56.676 0.088 1
1 944 . 7 1 1 A 85 85 ARG CB C 84 32.044 31.995 0.049 1
1 947 . 7 1 1 A 85 85 ARG N N 84 115.827 118.836 -3.009 1
1 949 . 7 1 1 A 86 86 ILE H H 85 8.238 7.361 0.877 1
1 950 . 7 1 1 A 86 86 ILE HA H 85 4.389 4.466 -0.077 1
1 960 . 7 1 1 A 86 86 ILE CA C 85 58.007 57.726 0.281 1
1 961 . 7 1 1 A 86 86 ILE CB C 85 39.604 38.732 0.872 1
1 965 . 7 1 1 A 86 86 ILE N N 85 119.285 118.706 0.579 1
1 966 . 7 1 1 A 87 87 PRO HA H 86 4.392 4.593 -0.201 1
1 973 . 7 1 1 A 87 87 PRO C C 86 177.622 176.259 1.363 1
1 974 . 7 1 1 A 87 87 PRO CA C 86 64.665 64.222 0.443 1
1 975 . 7 1 1 A 87 87 PRO CB C 86 32.020 31.700 0.320 1
1 978 . 7 1 1 A 88 88 GLU H H 87 8.312 8.213 0.099 1
1 979 . 7 1 1 A 88 88 GLU HA H 87 4.208 4.589 -0.381 1
1 984 . 7 1 1 A 88 88 GLU C C 87 175.554 175.690 -0.136 1
1 985 . 7 1 1 A 88 88 GLU CA C 87 56.045 56.190 -0.145 1
1 986 . 7 1 1 A 88 88 GLU CB C 87 28.654 30.689 -2.035 1
1 988 . 7 1 1 A 88 88 GLU N N 87 114.256 116.846 -2.590 1
1 989 . 7 1 1 A 89 89 PHE H H 88 7.946 7.393 0.553 1
1 990 . 7 1 1 A 89 89 PHE HA H 88 3.993 4.324 -0.331 1
1 998 . 7 1 1 A 89 89 PHE C C 88 173.460 174.645 -1.185 1
1 999 . 7 1 1 A 89 89 PHE CA C 88 60.119 59.556 0.563 1
1 1000 . 7 1 1 A 89 89 PHE CB C 88 39.994 39.625 0.369 1
1 1006 . 7 1 1 A 89 89 PHE N N 88 121.550 123.453 -1.903 1
1 1007 . 7 1 1 A 90 90 ASN H H 89 7.266 7.807 -0.541 1
1 1008 . 7 1 1 A 90 90 ASN HA H 89 4.454 5.066 -0.612 1
1 1013 . 7 1 1 A 90 90 ASN C C 89 173.921 175.071 -1.150 1
1 1014 . 7 1 1 A 90 90 ASN CA C 89 51.839 51.539 0.300 1
1 1015 . 7 1 1 A 90 90 ASN CB C 89 40.674 39.539 1.135 1
1 1016 . 7 1 1 A 90 90 ASN N N 89 125.344 124.652 0.692 1
1 1018 . 7 1 1 A 91 91 MET H H 90 8.968 8.651 0.317 1
1 1019 . 7 1 1 A 91 91 MET HA H 90 4.049 4.224 -0.175 1
1 1027 . 7 1 1 A 91 91 MET C C 90 177.475 177.956 -0.481 1
1 1028 . 7 1 1 A 91 91 MET CA C 90 57.758 57.786 -0.028 1
1 1029 . 7 1 1 A 91 91 MET CB C 90 32.250 32.471 -0.221 1
1 1032 . 7 1 1 A 91 91 MET N N 90 127.052 124.755 2.297 1
1 1033 . 7 1 1 A 92 92 ALA H H 91 8.292 8.101 0.191 1
1 1034 . 7 1 1 A 92 92 ALA HA H 91 4.059 4.134 -0.075 1
1 1038 . 7 1 1 A 92 92 ALA C C 91 180.412 179.663 0.749 1
1 1039 . 7 1 1 A 92 92 ALA CA C 91 55.368 54.885 0.483 1
1 1040 . 7 1 1 A 92 92 ALA CB C 91 17.527 18.474 -0.947 1
1 1041 . 7 1 1 A 92 92 ALA N N 91 123.752 121.301 2.451 1
1 1042 . 7 1 1 A 93 93 ALA H H 92 7.931 8.016 -0.085 1
1 1043 . 7 1 1 A 93 93 ALA HA H 92 4.054 4.101 -0.047 1
1 1047 . 7 1 1 A 93 93 ALA C C 92 180.482 179.772 0.710 1
1 1048 . 7 1 1 A 93 93 ALA CA C 92 54.614 54.871 -0.257 1
1 1049 . 7 1 1 A 93 93 ALA CB C 92 18.098 18.313 -0.215 1
1 1050 . 7 1 1 A 93 93 ALA N N 92 121.158 120.208 0.950 1
1 1051 . 7 1 1 A 94 94 PHE H H 93 8.110 7.887 0.223 1
1 1052 . 7 1 1 A 94 94 PHE HA H 93 4.304 4.140 0.164 1
1 1060 . 7 1 1 A 94 94 PHE C C 93 177.350 177.140 0.210 1
1 1061 . 7 1 1 A 94 94 PHE CA C 93 61.641 61.434 0.207 1
1 1062 . 7 1 1 A 94 94 PHE CB C 93 40.014 39.233 0.781 1
1 1068 . 7 1 1 A 94 94 PHE N N 93 119.807 120.254 -0.447 1
1 1069 . 7 1 1 A 95 95 THR H H 94 8.726 8.241 0.485 1
1 1070 . 7 1 1 A 95 95 THR HA H 94 3.569 3.883 -0.314 1
1 1075 . 7 1 1 A 95 95 THR C C 94 176.932 176.824 0.108 1
1 1076 . 7 1 1 A 95 95 THR CA C 94 66.833 65.538 1.295 1
1 1077 . 7 1 1 A 95 95 THR CB C 94 68.445 68.294 0.151 1
1 1079 . 7 1 1 A 95 95 THR N N 94 113.074 112.155 0.919 1
1 1080 . 7 1 1 A 96 96 THR H H 95 7.657 7.777 -0.120 1
1 1081 . 7 1 1 A 96 96 THR HA H 95 3.945 4.026 -0.081 1
1 1086 . 7 1 1 A 96 96 THR C C 95 176.386 176.393 -0.007 1
1 1087 . 7 1 1 A 96 96 THR CA C 95 66.550 65.943 0.607 1
1 1088 . 7 1 1 A 96 96 THR CB C 95 68.583 68.695 -0.112 1
1 1090 . 7 1 1 A 96 96 THR N N 95 117.927 117.120 0.807 1
1 1091 . 7 1 1 A 97 97 THR H H 96 7.699 7.779 -0.080 1
1 1092 . 7 1 1 A 97 97 THR HA H 96 3.905 4.154 -0.249 1
1 1097 . 7 1 1 A 97 97 THR C C 96 176.572 175.974 0.598 1
1 1098 . 7 1 1 A 97 97 THR CA C 96 65.979 66.591 -0.612 1
1 1099 . 7 1 1 A 97 97 THR CB C 96 68.553 68.267 0.286 1
1 1101 . 7 1 1 A 97 97 THR N N 96 118.518 116.904 1.614 1
1 1102 . 7 1 1 A 98 98 LEU H H 97 8.304 8.107 0.197 1
1 1103 . 7 1 1 A 98 98 LEU HA H 97 3.725 3.727 -0.002 1
1 1113 . 7 1 1 A 98 98 LEU C C 97 178.490 178.443 0.047 1
1 1114 . 7 1 1 A 98 98 LEU CA C 97 58.517 57.877 0.640 1
1 1115 . 7 1 1 A 98 98 LEU CB C 97 41.697 40.992 0.705 1
1 1119 . 7 1 1 A 98 98 LEU N N 97 122.882 121.813 1.069 1
1 1120 . 7 1 1 A 99 99 GLN H H 98 7.639 7.887 -0.248 1
1 1121 . 7 1 1 A 99 99 GLN HA H 98 3.927 4.103 -0.176 1
1 1128 . 7 1 1 A 99 99 GLN C C 98 178.068 178.111 -0.043 1
1 1129 . 7 1 1 A 99 99 GLN CA C 98 58.735 59.142 -0.407 1
1 1130 . 7 1 1 A 99 99 GLN CB C 98 27.986 28.371 -0.385 1
1 1132 . 7 1 1 A 99 99 GLN N N 98 114.302 118.440 -4.138 1
1 1134 . 7 1 1 A 100 100 HIS H H 99 7.575 7.874 -0.299 1
1 1135 . 7 1 1 A 100 100 HIS HA H 99 4.524 4.580 -0.056 1
1 1139 . 7 1 1 A 100 100 HIS C C 99 174.789 177.379 -2.590 1
1 1140 . 7 1 1 A 100 100 HIS CA C 99 56.154 57.369 -1.215 1
1 1141 . 7 1 1 A 100 100 HIS CB C 99 28.946 30.312 -1.366 1
1 1143 . 7 1 1 A 100 100 HIS N N 99 114.778 116.895 -2.117 1
1 1144 . 7 1 1 A 101 101 HIS H H 100 7.773 7.704 0.069 1
1 1145 . 7 1 1 A 101 101 HIS HA H 100 4.704 4.001 0.703 1
1 1149 . 7 1 1 A 101 101 HIS C C 100 174.818 176.902 -2.084 1
1 1150 . 7 1 1 A 101 101 HIS CA C 100 54.830 58.075 -3.245 1
1 1151 . 7 1 1 A 101 101 HIS CB C 100 29.749 30.106 -0.357 1
1 1153 . 7 1 1 A 101 101 HIS N N 100 117.397 120.193 -2.796 1
1 1154 . 7 1 1 A 102 102 LYS H H 101 7.324 8.095 -0.771 1
1 1155 . 7 1 1 A 102 102 LYS HA H 101 3.611 4.089 -0.478 1
1 1164 . 7 1 1 A 102 102 LYS C C 101 176.823 178.966 -2.143 1
1 1165 . 7 1 1 A 102 102 LYS CA C 101 59.915 58.870 1.045 1
1 1166 . 7 1 1 A 102 102 LYS CB C 101 32.825 32.128 0.697 1
1 1170 . 7 1 1 A 102 102 LYS N N 101 120.533 118.840 1.693 1
1 1171 . 7 1 1 A 103 103 ASP H H 102 8.361 7.748 0.613 1
1 1172 . 7 1 1 A 103 103 ASP HA H 102 4.421 4.478 -0.057 1
1 1175 . 7 1 1 A 103 103 ASP C C 102 176.793 177.701 -0.908 1
1 1176 . 7 1 1 A 103 103 ASP CA C 102 55.500 56.431 -0.931 1
1 1177 . 7 1 1 A 103 103 ASP CB C 102 40.178 41.064 -0.886 1
1 1178 . 7 1 1 A 103 103 ASP N N 102 114.814 119.239 -4.425 1
1 1179 . 7 1 1 A 104 104 GLU H H 103 7.858 8.007 -0.149 1
1 1180 . 7 1 1 A 104 104 GLU HA H 103 4.339 4.428 -0.089 1
1 1183 . 7 1 1 A 104 104 GLU C C 103 175.777 176.561 -0.784 1
1 1184 . 7 1 1 A 104 104 GLU CA C 103 56.356 57.901 -1.545 1
1 1185 . 7 1 1 A 104 104 GLU CB C 103 31.293 31.207 0.086 1
1 1186 . 7 1 1 A 104 104 GLU N N 103 116.826 118.422 -1.596 1
1 1187 . 7 1 1 A 105 105 VAL H H 104 7.201 7.351 -0.150 1
1 1188 . 7 1 1 A 105 105 VAL HA H 104 4.296 4.092 0.204 1
1 1196 . 7 1 1 A 105 105 VAL C C 104 174.482 175.811 -1.329 1
1 1197 . 7 1 1 A 105 105 VAL CA C 104 60.370 62.757 -2.387 1
1 1198 . 7 1 1 A 105 105 VAL CB C 104 34.341 33.323 1.018 1
1 1201 . 7 1 1 A 105 105 VAL N N 104 116.422 119.864 -3.442 1
1 1202 . 7 1 1 A 106 106 ALA H H 105 8.487 8.572 -0.085 1
1 1203 . 7 1 1 A 106 106 ALA HA H 105 4.172 4.351 -0.179 1
1 1207 . 7 1 1 A 106 106 ALA C C 105 179.030 179.285 -0.255 1
1 1208 . 7 1 1 A 106 106 ALA CA C 105 52.966 52.720 0.246 1
1 1209 . 7 1 1 A 106 106 ALA CB C 105 19.371 19.607 -0.236 1
1 1210 . 7 1 1 A 106 106 ALA N N 105 128.313 129.391 -1.078 1
1 1211 . 7 1 1 A 107 107 GLY H H 106 8.738 8.813 -0.075 1
1 1212 . 7 1 1 A 107 107 GLY HA2 H 106 3.773 3.874 -0.101 1
1 1213 . 7 1 1 A 107 107 GLY HA3 H 106 3.998 3.945 0.053 1
1 1214 . 7 1 1 A 107 107 GLY C C 106 174.958 175.505 -0.547 1
1 1215 . 7 1 1 A 107 107 GLY CA C 106 47.449 47.130 0.319 1
1 1216 . 7 1 1 A 107 107 GLY N N 106 110.612 111.017 -0.405 1
1 1217 . 7 1 1 A 108 108 ASP H H 107 8.535 8.288 0.247 1
1 1218 . 7 1 1 A 108 108 ASP HA H 107 4.333 4.375 -0.042 1
1 1221 . 7 1 1 A 108 108 ASP C C 107 179.133 179.041 0.092 1
1 1222 . 7 1 1 A 108 108 ASP CA C 107 56.721 57.061 -0.340 1
1 1223 . 7 1 1 A 108 108 ASP CB C 107 39.336 41.337 -2.001 1
1 1224 . 7 1 1 A 108 108 ASP N N 107 117.474 121.507 -4.033 1
1 1225 . 7 1 1 A 109 109 ILE H H 108 7.459 7.893 -0.434 1
1 1226 . 7 1 1 A 109 109 ILE HA H 108 3.688 3.676 0.012 1
1 1236 . 7 1 1 A 109 109 ILE C C 108 176.735 178.201 -1.466 1
1 1237 . 7 1 1 A 109 109 ILE CA C 108 63.474 65.628 -2.154 1
1 1238 . 7 1 1 A 109 109 ILE CB C 108 37.340 37.871 -0.531 1
1 1242 . 7 1 1 A 109 109 ILE N N 108 119.609 119.773 -0.164 1
1 1243 . 7 1 1 A 110 110 PHE H H 109 7.920 8.357 -0.437 1
1 1244 . 7 1 1 A 110 110 PHE HA H 109 3.759 4.066 -0.307 1
1 1252 . 7 1 1 A 110 110 PHE C C 109 177.132 177.368 -0.236 1
1 1253 . 7 1 1 A 110 110 PHE CA C 109 62.766 61.221 1.545 1
1 1254 . 7 1 1 A 110 110 PHE CB C 109 39.752 39.298 0.454 1
1 1260 . 7 1 1 A 110 110 PHE N N 109 120.906 120.398 0.508 1
1 1261 . 7 1 1 A 111 111 ASP H H 110 8.639 8.313 0.326 1
1 1262 . 7 1 1 A 111 111 ASP HA H 110 4.216 4.187 0.029 1
1 1265 . 7 1 1 A 111 111 ASP C C 110 178.900 178.360 0.540 1
1 1266 . 7 1 1 A 111 111 ASP CA C 110 57.105 57.257 -0.152 1
1 1267 . 7 1 1 A 111 111 ASP CB C 110 39.697 41.711 -2.014 1
1 1268 . 7 1 1 A 111 111 ASP N N 110 117.124 118.731 -1.607 1
1 1269 . 7 1 1 A 112 112 MET H H 111 7.331 7.534 -0.203 1
1 1270 . 7 1 1 A 112 112 MET HA H 111 4.081 4.112 -0.031 1
1 1278 . 7 1 1 A 112 112 MET C C 111 179.052 178.147 0.905 1
1 1279 . 7 1 1 A 112 112 MET CA C 111 58.202 58.112 0.090 1
1 1280 . 7 1 1 A 112 112 MET CB C 111 31.827 32.436 -0.609 1
1 1283 . 7 1 1 A 112 112 MET N N 111 118.061 119.420 -1.359 1
1 1284 . 7 1 1 A 113 113 LEU H H 112 8.001 8.014 -0.013 1
1 1285 . 7 1 1 A 113 113 LEU HA H 112 3.723 3.527 0.196 1
1 1295 . 7 1 1 A 113 113 LEU C C 112 179.747 178.499 1.248 1
1 1296 . 7 1 1 A 113 113 LEU CA C 112 57.371 57.328 0.043 1
1 1297 . 7 1 1 A 113 113 LEU CB C 112 40.671 40.932 -0.261 1
1 1301 . 7 1 1 A 113 113 LEU N N 112 120.426 119.628 0.798 1
1 1302 . 7 1 1 A 114 114 LEU H H 113 7.744 7.618 0.126 1
1 1303 . 7 1 1 A 114 114 LEU HA H 113 4.007 3.467 0.540 1
1 1313 . 7 1 1 A 114 114 LEU C C 113 179.358 178.511 0.847 1
1 1314 . 7 1 1 A 114 114 LEU CA C 113 57.202 57.474 -0.272 1
1 1315 . 7 1 1 A 114 114 LEU CB C 113 41.727 41.577 0.150 1
1 1319 . 7 1 1 A 114 114 LEU N N 113 119.584 119.571 0.013 1
1 1320 . 7 1 1 A 115 115 THR H H 114 7.353 7.585 -0.232 1
1 1321 . 7 1 1 A 115 115 THR HA H 114 4.071 4.067 0.004 1
1 1327 . 7 1 1 A 115 115 THR C C 114 173.591 176.475 -2.884 1
1 1328 . 7 1 1 A 115 115 THR CA C 114 65.332 64.391 0.941 1
1 1329 . 7 1 1 A 115 115 THR CB C 114 70.319 68.689 1.630 1
1 1331 . 7 1 1 A 115 115 THR N N 114 107.535 112.304 -4.769 1
1 1332 . 7 1 1 A 116 116 PHE H H 115 6.979 7.730 -0.751 1
1 1333 . 7 1 1 A 116 116 PHE HA H 115 5.022 4.235 0.787 1
1 1341 . 7 1 1 A 116 116 PHE C C 115 176.488 176.485 0.003 1
1 1342 . 7 1 1 A 116 116 PHE CA C 115 55.911 60.907 -4.996 1
1 1343 . 7 1 1 A 116 116 PHE CB C 115 38.521 39.123 -0.602 1
1 1349 . 7 1 1 A 116 116 PHE N N 115 112.366 120.053 -7.687 1
1 1350 . 7 1 1 A 117 117 THR H H 116 7.564 7.378 0.186 1
1 1351 . 7 1 1 A 117 117 THR HA H 116 4.626 4.864 -0.238 1
1 1356 . 7 1 1 A 117 117 THR C C 116 174.085 174.371 -0.286 1
1 1357 . 7 1 1 A 117 117 THR CA C 116 61.636 62.037 -0.401 1
1 1358 . 7 1 1 A 117 117 THR CB C 116 70.915 70.782 0.133 1
1 1360 . 7 1 1 A 117 117 THR N N 116 105.498 106.185 -0.687 1
1 1361 . 7 1 1 A 118 118 ASP H H 117 8.270 7.727 0.543 1
1 1362 . 7 1 1 A 118 118 ASP HA H 117 4.955 4.706 0.249 1
1 1365 . 7 1 1 A 118 118 ASP C C 117 176.328 176.423 -0.095 1
1 1366 . 7 1 1 A 118 118 ASP CA C 117 53.417 53.436 -0.019 1
1 1367 . 7 1 1 A 118 118 ASP CB C 117 43.388 40.196 3.192 1
1 1368 . 7 1 1 A 118 118 ASP N N 117 124.409 122.034 2.375 1
1 1369 . 7 1 1 A 119 119 PHE H H 118 8.973 8.892 0.081 1
1 1370 . 7 1 1 A 119 119 PHE HA H 118 3.506 4.313 -0.807 1
1 1378 . 7 1 1 A 119 119 PHE CA C 118 61.490 61.187 0.303 1
1 1379 . 7 1 1 A 119 119 PHE CB C 118 39.246 39.528 -0.282 1
1 1385 . 7 1 1 A 119 119 PHE N N 118 126.688 126.444 0.244 1
1 1386 . 7 1 1 A 120 120 LEU H H 119 8.099 8.374 -0.275 1
1 1387 . 7 1 1 A 120 120 LEU HA H 119 3.842 3.977 -0.135 1
1 1397 . 7 1 1 A 120 120 LEU C C 119 179.601 179.545 0.056 1
1 1398 . 7 1 1 A 120 120 LEU CA C 119 58.174 57.963 0.211 1
1 1399 . 7 1 1 A 120 120 LEU CB C 119 40.315 41.272 -0.957 1
1 1403 . 7 1 1 A 120 120 LEU N N 119 117.930 119.940 -2.010 1
1 1404 . 7 1 1 A 121 121 ALA H H 120 7.729 7.896 -0.167 1
1 1405 . 7 1 1 A 121 121 ALA HA H 120 3.996 4.112 -0.116 1
1 1409 . 7 1 1 A 121 121 ALA C C 120 180.995 179.601 1.394 1
1 1410 . 7 1 1 A 121 121 ALA CA C 120 54.832 54.735 0.097 1
1 1411 . 7 1 1 A 121 121 ALA CB C 120 17.706 18.315 -0.609 1
1 1412 . 7 1 1 A 121 121 ALA N N 120 123.195 121.304 1.891 1
1 1413 . 7 1 1 A 122 122 PHE H H 121 7.943 7.856 0.087 1
1 1414 . 7 1 1 A 122 122 PHE HA H 121 3.887 3.848 0.039 1
1 1419 . 7 1 1 A 122 122 PHE C C 121 175.410 176.831 -1.421 1
1 1420 . 7 1 1 A 122 122 PHE CA C 121 61.075 60.728 0.347 1
1 1421 . 7 1 1 A 122 122 PHE CB C 121 38.115 38.786 -0.671 1
1 1424 . 7 1 1 A 122 122 PHE N N 121 121.798 120.436 1.362 1
1 1425 . 7 1 1 A 123 123 LYS H H 122 8.468 7.998 0.470 1
1 1426 . 7 1 1 A 123 123 LYS HA H 122 3.077 3.998 -0.921 1
1 1435 . 7 1 1 A 123 123 LYS C C 122 178.453 178.952 -0.499 1
1 1436 . 7 1 1 A 123 123 LYS CA C 122 59.855 60.041 -0.186 1
1 1437 . 7 1 1 A 123 123 LYS CB C 122 32.374 32.259 0.115 1
1 1441 . 7 1 1 A 123 123 LYS N N 122 120.614 118.559 2.055 1
1 1442 . 7 1 1 A 124 124 GLU H H 123 8.100 7.866 0.234 1
1 1443 . 7 1 1 A 124 124 GLU HA H 123 3.652 4.042 -0.390 1
1 1448 . 7 1 1 A 124 124 GLU C C 123 177.743 178.462 -0.719 1
1 1449 . 7 1 1 A 124 124 GLU CA C 123 59.406 59.583 -0.177 1
1 1450 . 7 1 1 A 124 124 GLU CB C 123 28.811 29.204 -0.393 1
1 1452 . 7 1 1 A 124 124 GLU N N 123 117.404 119.160 -1.756 1
1 1453 . 7 1 1 A 125 125 MET H H 124 7.537 7.661 -0.124 1
1 1454 . 7 1 1 A 125 125 MET HA H 124 3.860 3.956 -0.096 1
1 1462 . 7 1 1 A 125 125 MET C C 124 179.522 178.376 1.146 1
1 1463 . 7 1 1 A 125 125 MET CA C 124 58.832 58.460 0.372 1
1 1464 . 7 1 1 A 125 125 MET CB C 124 31.765 31.498 0.267 1
1 1467 . 7 1 1 A 125 125 MET N N 124 119.413 118.993 0.420 1
1 1468 . 7 1 1 A 126 126 PHE H H 125 7.148 7.480 -0.332 1
1 1469 . 7 1 1 A 126 126 PHE HA H 125 3.633 4.260 -0.627 1
1 1476 . 7 1 1 A 126 126 PHE C C 125 178.994 178.257 0.737 1
1 1477 . 7 1 1 A 126 126 PHE CA C 125 63.148 61.216 1.932 1
1 1478 . 7 1 1 A 126 126 PHE CB C 125 39.830 38.363 1.467 1
1 1483 . 7 1 1 A 126 126 PHE N N 125 120.013 118.876 1.137 1
1 1484 . 7 1 1 A 127 127 LEU H H 126 8.369 8.596 -0.227 1
1 1485 . 7 1 1 A 127 127 LEU HA H 126 3.972 4.060 -0.088 1
1 1495 . 7 1 1 A 127 127 LEU C C 126 180.621 179.004 1.617 1
1 1496 . 7 1 1 A 127 127 LEU CA C 126 57.944 57.873 0.071 1
1 1497 . 7 1 1 A 127 127 LEU CB C 126 40.543 41.115 -0.572 1
1 1501 . 7 1 1 A 127 127 LEU N N 126 119.692 119.793 -0.101 1
1 1502 . 7 1 1 A 128 128 ASP H H 127 8.578 8.034 0.544 1
1 1503 . 7 1 1 A 128 128 ASP HA H 127 4.308 4.314 -0.006 1
1 1506 . 7 1 1 A 128 128 ASP C C 127 178.254 177.908 0.346 1
1 1507 . 7 1 1 A 128 128 ASP CA C 127 56.964 57.427 -0.463 1
1 1508 . 7 1 1 A 128 128 ASP CB C 127 39.735 41.350 -1.615 1
1 1509 . 7 1 1 A 128 128 ASP N N 127 121.926 119.292 2.634 1
1 1510 . 7 1 1 A 129 129 TYR H H 128 7.710 8.122 -0.412 1
1 1511 . 7 1 1 A 129 129 TYR HA H 128 3.908 4.016 -0.108 1
1 1518 . 7 1 1 A 129 129 TYR C C 128 177.633 177.558 0.075 1
1 1519 . 7 1 1 A 129 129 TYR CA C 128 61.796 61.163 0.633 1
1 1520 . 7 1 1 A 129 129 TYR CB C 128 39.372 38.422 0.950 1
1 1525 . 7 1 1 A 129 129 TYR N N 128 122.548 120.237 2.311 1
1 1526 . 7 1 1 A 130 130 ARG H H 129 8.622 8.580 0.042 1
1 1527 . 7 1 1 A 130 130 ARG HA H 129 3.722 4.002 -0.280 1
1 1535 . 7 1 1 A 130 130 ARG CA C 129 60.084 59.777 0.307 1
1 1536 . 7 1 1 A 130 130 ARG CB C 129 29.902 29.970 -0.068 1
1 1539 . 7 1 1 A 130 130 ARG N N 129 118.302 119.380 -1.078 1
1 1541 . 7 1 1 A 131 131 ALA H H 130 7.936 8.140 -0.204 1
1 1542 . 7 1 1 A 131 131 ALA HA H 130 3.997 4.021 -0.024 1
1 1546 . 7 1 1 A 131 131 ALA C C 130 180.456 179.427 1.029 1
1 1547 . 7 1 1 A 131 131 ALA CA C 130 55.133 54.972 0.161 1
1 1548 . 7 1 1 A 131 131 ALA CB C 130 17.750 18.255 -0.505 1
1 1549 . 7 1 1 A 131 131 ALA N N 130 119.788 121.149 -1.361 1
1 1550 . 7 1 1 A 132 132 GLU H H 131 7.622 7.659 -0.037 1
1 1551 . 7 1 1 A 132 132 GLU HA H 131 3.862 4.006 -0.144 1
1 1556 . 7 1 1 A 132 132 GLU C C 131 179.528 179.068 0.460 1
1 1557 . 7 1 1 A 132 132 GLU CA C 131 58.849 58.743 0.106 1
1 1558 . 7 1 1 A 132 132 GLU CB C 131 28.930 29.372 -0.442 1
1 1560 . 7 1 1 A 132 132 GLU N N 131 118.428 118.912 -0.484 1
1 1561 . 7 1 1 A 133 133 LYS H H 132 7.853 7.487 0.366 1
1 1562 . 7 1 1 A 133 133 LYS HA H 132 3.722 3.993 -0.271 1
1 1571 . 7 1 1 A 133 133 LYS C C 132 175.725 179.321 -3.596 1
1 1572 . 7 1 1 A 133 133 LYS CA C 132 57.544 58.920 -1.376 1
1 1573 . 7 1 1 A 133 133 LYS CB C 132 31.770 31.818 -0.048 1
1 1577 . 7 1 1 A 133 133 LYS N N 132 119.473 119.031 0.442 1
1 1578 . 7 1 1 A 134 134 GLU H H 133 8.151 7.654 0.497 1
1 1579 . 7 1 1 A 134 134 GLU HA H 133 4.161 4.179 -0.018 1
1 1584 . 7 1 1 A 134 134 GLU C C 133 177.453 176.861 0.592 1
1 1585 . 7 1 1 A 134 134 GLU CA C 133 57.222 56.616 0.606 1
1 1586 . 7 1 1 A 134 134 GLU CB C 133 30.091 29.701 0.390 1
1 1588 . 7 1 1 A 134 134 GLU N N 133 116.525 117.411 -0.886 1
1 1589 . 7 1 1 A 135 135 GLY H H 134 7.702 7.935 -0.233 1
1 1590 . 7 1 1 A 135 135 GLY HA2 H 134 3.896 3.948 -0.052 1
1 1591 . 7 1 1 A 135 135 GLY HA3 H 134 3.897 3.958 -0.061 1
1 1592 . 7 1 1 A 135 135 GLY C C 134 174.538 174.268 0.270 1
1 1593 . 7 1 1 A 135 135 GLY CA C 134 45.975 45.025 0.950 1
1 1594 . 7 1 1 A 135 135 GLY N N 134 107.924 107.690 0.234 1
1 1595 . 7 1 1 A 136 136 ARG H H 135 8.045 7.823 0.222 1
1 1596 . 7 1 1 A 136 136 ARG HA H 135 4.323 4.463 -0.140 1
1 1604 . 7 1 1 A 136 136 ARG C C 135 175.864 176.247 -0.383 1
1 1605 . 7 1 1 A 136 136 ARG CA C 135 56.016 55.370 0.646 1
1 1606 . 7 1 1 A 136 136 ARG CB C 135 30.987 31.967 -0.980 1
1 1609 . 7 1 1 A 136 136 ARG N N 135 119.708 119.456 0.252 1
1 1 . 8 1 1 A 14 14 PHE CA C 13 58.199 57.939 0.260 1
1 2 . 8 1 1 A 14 14 PHE CB C 13 39.717 39.103 0.614 1
1 3 . 8 1 1 A 15 15 SER H H 14 8.299 7.647 0.652 1
1 4 . 8 1 1 A 15 15 SER HA H 14 4.359 4.507 -0.148 1
1 7 . 8 1 1 A 15 15 SER CA C 14 58.249 59.620 -1.371 1
1 8 . 8 1 1 A 15 15 SER CB C 14 63.936 63.115 0.821 1
1 9 . 8 1 1 A 15 15 SER N N 14 117.379 116.766 0.613 1
1 10 . 8 1 1 A 16 16 SER H H 15 8.255 9.149 -0.894 1
1 11 . 8 1 1 A 16 16 SER HA H 15 3.729 4.376 -0.647 1
1 14 . 8 1 1 A 16 16 SER CA C 15 58.224 60.659 -2.435 1
1 15 . 8 1 1 A 16 16 SER CB C 15 63.886 63.412 0.474 1
1 16 . 8 1 1 A 16 16 SER N N 15 117.694 122.088 -4.394 1
1 17 . 8 1 1 A 17 17 ALA H H 16 8.333 8.142 0.191 1
1 18 . 8 1 1 A 17 17 ALA HA H 16 4.252 4.075 0.177 1
1 22 . 8 1 1 A 17 17 ALA CA C 16 53.377 55.177 -1.800 1
1 23 . 8 1 1 A 17 17 ALA CB C 16 18.896 18.453 0.443 1
1 24 . 8 1 1 A 17 17 ALA N N 16 125.462 123.895 1.567 1
1 25 . 8 1 1 A 18 18 SER H H 17 8.219 7.981 0.238 1
1 26 . 8 1 1 A 18 18 SER HA H 17 4.332 4.555 -0.223 1
1 29 . 8 1 1 A 18 18 SER CA C 17 59.105 58.297 0.808 1
1 30 . 8 1 1 A 18 18 SER CB C 17 63.592 63.737 -0.145 1
1 31 . 8 1 1 A 18 18 SER N N 17 114.821 110.438 4.383 1
1 32 . 8 1 1 A 19 19 ASP H H 18 8.309 7.698 0.611 1
1 33 . 8 1 1 A 19 19 ASP HA H 18 4.554 4.814 -0.260 1
1 36 . 8 1 1 A 19 19 ASP C C 18 176.528 176.904 -0.376 1
1 37 . 8 1 1 A 19 19 ASP CA C 18 55.272 52.962 2.310 1
1 38 . 8 1 1 A 19 19 ASP CB C 18 40.883 43.391 -2.508 1
1 39 . 8 1 1 A 19 19 ASP N N 18 123.367 123.660 -0.293 1
1 40 . 8 1 1 A 20 20 ALA H H 19 8.133 8.947 -0.814 1
1 41 . 8 1 1 A 20 20 ALA HA H 19 4.170 4.139 0.031 1
1 45 . 8 1 1 A 20 20 ALA C C 19 179.857 179.543 0.314 1
1 46 . 8 1 1 A 20 20 ALA CA C 19 54.341 55.187 -0.846 1
1 47 . 8 1 1 A 20 20 ALA CB C 19 18.660 18.442 0.218 1
1 48 . 8 1 1 A 20 20 ALA N N 19 123.350 126.947 -3.597 1
1 49 . 8 1 1 A 21 21 GLU H H 20 8.140 8.133 0.007 1
1 50 . 8 1 1 A 21 21 GLU HA H 20 4.128 4.099 0.029 1
1 55 . 8 1 1 A 21 21 GLU C C 20 177.675 178.607 -0.932 1
1 56 . 8 1 1 A 21 21 GLU CA C 20 58.520 59.536 -1.016 1
1 57 . 8 1 1 A 21 21 GLU CB C 20 29.765 29.537 0.228 1
1 59 . 8 1 1 A 21 21 GLU N N 20 119.063 119.435 -0.372 1
1 60 . 8 1 1 A 22 22 PHE H H 21 8.009 7.977 0.032 1
1 61 . 8 1 1 A 22 22 PHE HA H 21 4.123 4.367 -0.244 1
1 68 . 8 1 1 A 22 22 PHE C C 21 176.410 177.001 -0.591 1
1 69 . 8 1 1 A 22 22 PHE CA C 21 62.202 61.384 0.818 1
1 70 . 8 1 1 A 22 22 PHE CB C 21 39.223 39.235 -0.012 1
1 75 . 8 1 1 A 22 22 PHE N N 21 121.211 120.851 0.360 1
1 76 . 8 1 1 A 23 23 ASP H H 22 8.261 8.561 -0.300 1
1 77 . 8 1 1 A 23 23 ASP HA H 22 4.041 4.358 -0.317 1
1 80 . 8 1 1 A 23 23 ASP C C 22 179.078 178.589 0.489 1
1 81 . 8 1 1 A 23 23 ASP CA C 22 57.048 57.294 -0.246 1
1 82 . 8 1 1 A 23 23 ASP CB C 22 40.154 40.177 -0.023 1
1 83 . 8 1 1 A 23 23 ASP N N 22 116.876 118.556 -1.680 1
1 84 . 8 1 1 A 24 24 ALA H H 23 7.651 7.574 0.077 1
1 85 . 8 1 1 A 24 24 ALA HA H 23 3.785 3.835 -0.050 1
1 89 . 8 1 1 A 24 24 ALA C C 23 179.577 179.896 -0.319 1
1 90 . 8 1 1 A 24 24 ALA CA C 23 54.341 55.199 -0.858 1
1 91 . 8 1 1 A 24 24 ALA CB C 23 17.762 18.098 -0.336 1
1 92 . 8 1 1 A 24 24 ALA N N 23 121.873 122.543 -0.670 1
1 93 . 8 1 1 A 25 25 VAL H H 24 7.718 7.839 -0.121 1
1 94 . 8 1 1 A 25 25 VAL HA H 24 3.216 3.539 -0.323 1
1 102 . 8 1 1 A 25 25 VAL C C 24 177.805 178.328 -0.523 1
1 103 . 8 1 1 A 25 25 VAL CA C 24 66.789 66.778 0.011 1
1 104 . 8 1 1 A 25 25 VAL CB C 24 31.277 31.236 0.041 1
1 107 . 8 1 1 A 25 25 VAL N N 24 117.890 118.625 -0.735 1
1 108 . 8 1 1 A 26 26 VAL H H 25 7.867 7.667 0.200 1
1 109 . 8 1 1 A 26 26 VAL HA H 25 3.274 3.492 -0.218 1
1 117 . 8 1 1 A 26 26 VAL C C 25 177.788 177.796 -0.008 1
1 118 . 8 1 1 A 26 26 VAL CA C 25 67.282 66.314 0.968 1
1 119 . 8 1 1 A 26 26 VAL CB C 25 31.266 31.325 -0.059 1
1 122 . 8 1 1 A 26 26 VAL N N 25 118.170 120.058 -1.888 1
1 123 . 8 1 1 A 27 27 GLY H H 26 7.544 7.572 -0.028 1
1 124 . 8 1 1 A 27 27 GLY HA2 H 26 3.592 3.471 0.121 1
1 125 . 8 1 1 A 27 27 GLY HA3 H 26 3.721 3.607 0.114 1
1 126 . 8 1 1 A 27 27 GLY C C 26 176.717 176.602 0.115 1
1 127 . 8 1 1 A 27 27 GLY CA C 26 47.085 47.208 -0.123 1
1 128 . 8 1 1 A 27 27 GLY N N 26 105.795 107.628 -1.833 1
1 129 . 8 1 1 A 28 28 TYR H H 27 7.625 7.412 0.213 1
1 130 . 8 1 1 A 28 28 TYR HA H 27 4.546 4.584 -0.038 1
1 137 . 8 1 1 A 28 28 TYR C C 27 178.991 178.177 0.814 1
1 138 . 8 1 1 A 28 28 TYR CA C 27 58.845 59.920 -1.075 1
1 139 . 8 1 1 A 28 28 TYR CB C 27 37.602 37.185 0.417 1
1 144 . 8 1 1 A 28 28 TYR N N 27 119.933 121.907 -1.974 1
1 145 . 8 1 1 A 29 29 LEU H H 28 8.517 8.143 0.374 1
1 146 . 8 1 1 A 29 29 LEU HA H 28 3.728 3.822 -0.094 1
1 156 . 8 1 1 A 29 29 LEU CA C 28 58.281 58.115 0.166 1
1 157 . 8 1 1 A 29 29 LEU CB C 28 41.948 41.302 0.646 1
1 161 . 8 1 1 A 29 29 LEU N N 28 119.669 120.819 -1.150 1
1 162 . 8 1 1 A 30 30 GLU H H 29 8.072 7.913 0.159 1
1 163 . 8 1 1 A 30 30 GLU HA H 29 3.722 3.932 -0.210 1
1 168 . 8 1 1 A 30 30 GLU C C 29 177.731 178.866 -1.135 1
1 169 . 8 1 1 A 30 30 GLU CA C 29 59.763 59.884 -0.121 1
1 170 . 8 1 1 A 30 30 GLU CB C 29 28.844 29.354 -0.510 1
1 172 . 8 1 1 A 30 30 GLU N N 29 117.666 117.505 0.161 1
1 173 . 8 1 1 A 31 31 ASP H H 30 7.243 7.932 -0.689 1
1 174 . 8 1 1 A 31 31 ASP HA H 30 4.297 4.404 -0.107 1
1 177 . 8 1 1 A 31 31 ASP CA C 30 56.953 57.637 -0.684 1
1 178 . 8 1 1 A 31 31 ASP CB C 30 40.730 41.691 -0.961 1
1 179 . 8 1 1 A 31 31 ASP N N 30 116.720 119.145 -2.425 1
1 180 . 8 1 1 A 32 32 ILE H H 31 7.940 7.435 0.505 1
1 181 . 8 1 1 A 32 32 ILE HA H 31 3.640 3.618 0.022 1
1 191 . 8 1 1 A 32 32 ILE C C 31 177.980 178.227 -0.247 1
1 192 . 8 1 1 A 32 32 ILE CA C 31 64.692 64.458 0.234 1
1 193 . 8 1 1 A 32 32 ILE CB C 31 38.938 37.160 1.778 1
1 197 . 8 1 1 A 32 32 ILE N N 31 119.728 119.457 0.271 1
1 198 . 8 1 1 A 33 33 ILE H H 32 7.984 7.685 0.299 1
1 199 . 8 1 1 A 33 33 ILE HA H 32 3.598 3.268 0.330 1
1 209 . 8 1 1 A 33 33 ILE C C 32 176.723 177.043 -0.320 1
1 210 . 8 1 1 A 33 33 ILE CA C 32 63.241 64.627 -1.386 1
1 211 . 8 1 1 A 33 33 ILE CB C 32 37.580 37.919 -0.339 1
1 215 . 8 1 1 A 33 33 ILE N N 32 113.919 120.833 -6.914 1
1 216 . 8 1 1 A 34 34 MET H H 33 7.288 7.689 -0.401 1
1 217 . 8 1 1 A 34 34 MET HA H 33 4.496 4.646 -0.150 1
1 225 . 8 1 1 A 34 34 MET C C 33 176.423 175.643 0.780 1
1 226 . 8 1 1 A 34 34 MET CA C 33 54.634 54.484 0.150 1
1 227 . 8 1 1 A 34 34 MET CB C 33 31.934 31.417 0.517 1
1 230 . 8 1 1 A 34 34 MET N N 33 115.130 116.789 -1.659 1
1 231 . 8 1 1 A 35 35 ASP H H 34 7.405 7.439 -0.034 1
1 232 . 8 1 1 A 35 35 ASP HA H 34 4.484 4.464 0.020 1
1 235 . 8 1 1 A 35 35 ASP C C 34 177.139 176.675 0.464 1
1 236 . 8 1 1 A 35 35 ASP CA C 34 54.625 54.919 -0.294 1
1 237 . 8 1 1 A 35 35 ASP CB C 34 43.554 42.608 0.946 1
1 238 . 8 1 1 A 35 35 ASP N N 34 121.814 121.962 -0.148 1
1 239 . 8 1 1 A 36 36 ASP H H 35 8.765 9.229 -0.464 1
1 240 . 8 1 1 A 36 36 ASP HA H 35 4.235 4.253 -0.018 1
1 243 . 8 1 1 A 36 36 ASP C C 35 178.320 177.863 0.457 1
1 244 . 8 1 1 A 36 36 ASP CA C 35 57.832 58.435 -0.603 1
1 245 . 8 1 1 A 36 36 ASP CB C 35 40.914 41.196 -0.282 1
1 246 . 8 1 1 A 36 36 ASP N N 35 125.883 128.446 -2.563 1
1 247 . 8 1 1 A 37 37 GLU H H 36 8.905 8.308 0.597 1
1 248 . 8 1 1 A 37 37 GLU HA H 36 3.933 4.122 -0.189 1
1 253 . 8 1 1 A 37 37 GLU C C 36 179.304 179.020 0.284 1
1 254 . 8 1 1 A 37 37 GLU CA C 36 59.828 59.236 0.592 1
1 255 . 8 1 1 A 37 37 GLU CB C 36 29.380 29.241 0.139 1
1 257 . 8 1 1 A 37 37 GLU N N 36 119.077 119.116 -0.039 1
1 258 . 8 1 1 A 38 38 PHE H H 37 7.460 8.403 -0.943 1
1 259 . 8 1 1 A 38 38 PHE HA H 37 3.642 4.055 -0.413 1
1 267 . 8 1 1 A 38 38 PHE C C 37 176.483 178.015 -1.532 1
1 268 . 8 1 1 A 38 38 PHE CA C 37 61.411 61.272 0.139 1
1 269 . 8 1 1 A 38 38 PHE CB C 37 39.355 39.120 0.235 1
1 275 . 8 1 1 A 38 38 PHE N N 37 119.968 120.760 -0.792 1
1 276 . 8 1 1 A 39 39 GLN H H 38 7.968 8.177 -0.209 1
1 277 . 8 1 1 A 39 39 GLN HA H 38 3.712 3.936 -0.224 1
1 284 . 8 1 1 A 39 39 GLN CA C 38 59.153 58.820 0.333 1
1 285 . 8 1 1 A 39 39 GLN CB C 38 28.213 28.446 -0.233 1
1 287 . 8 1 1 A 39 39 GLN N N 38 116.433 118.350 -1.917 1
1 289 . 8 1 1 A 40 40 LEU H H 39 7.930 7.561 0.369 1
1 290 . 8 1 1 A 40 40 LEU HA H 39 3.916 4.029 -0.113 1
1 300 . 8 1 1 A 40 40 LEU C C 39 177.731 178.271 -0.540 1
1 301 . 8 1 1 A 40 40 LEU CA C 39 57.915 57.941 -0.026 1
1 302 . 8 1 1 A 40 40 LEU CB C 39 41.989 41.618 0.371 1
1 306 . 8 1 1 A 40 40 LEU N N 39 119.505 121.455 -1.950 1
1 307 . 8 1 1 A 41 41 LEU H H 40 7.174 7.777 -0.603 1
1 308 . 8 1 1 A 41 41 LEU HA H 40 3.835 4.113 -0.278 1
1 318 . 8 1 1 A 41 41 LEU C C 40 179.738 178.084 1.654 1
1 319 . 8 1 1 A 41 41 LEU CA C 40 58.266 57.817 0.449 1
1 320 . 8 1 1 A 41 41 LEU CB C 40 42.050 41.648 0.402 1
1 324 . 8 1 1 A 41 41 LEU N N 40 120.971 119.909 1.062 1
1 325 . 8 1 1 A 42 42 GLN H H 41 8.058 8.085 -0.027 1
1 326 . 8 1 1 A 42 42 GLN HA H 41 3.556 3.729 -0.173 1
1 333 . 8 1 1 A 42 42 GLN C C 41 177.642 178.685 -1.043 1
1 334 . 8 1 1 A 42 42 GLN CA C 41 59.826 59.028 0.798 1
1 335 . 8 1 1 A 42 42 GLN CB C 41 28.762 27.857 0.905 1
1 337 . 8 1 1 A 42 42 GLN N N 41 117.899 118.623 -0.724 1
1 339 . 8 1 1 A 43 43 ARG H H 42 8.179 7.982 0.197 1
1 340 . 8 1 1 A 43 43 ARG HA H 42 3.655 4.093 -0.438 1
1 347 . 8 1 1 A 43 43 ARG C C 42 178.051 178.800 -0.749 1
1 348 . 8 1 1 A 43 43 ARG CA C 42 59.766 59.071 0.695 1
1 349 . 8 1 1 A 43 43 ARG CB C 42 29.941 29.847 0.094 1
1 352 . 8 1 1 A 43 43 ARG N N 42 119.392 118.963 0.429 1
1 353 . 8 1 1 A 44 44 ASN H H 43 8.525 7.920 0.605 1
1 354 . 8 1 1 A 44 44 ASN HA H 43 4.332 4.438 -0.106 1
1 359 . 8 1 1 A 44 44 ASN C C 43 178.150 177.848 0.302 1
1 360 . 8 1 1 A 44 44 ASN CA C 43 55.841 56.281 -0.440 1
1 361 . 8 1 1 A 44 44 ASN CB C 43 37.632 39.369 -1.737 1
1 362 . 8 1 1 A 44 44 ASN N N 43 116.214 117.662 -1.448 1
1 364 . 8 1 1 A 45 45 PHE H H 44 7.586 8.001 -0.415 1
1 365 . 8 1 1 A 45 45 PHE HA H 44 4.132 4.285 -0.153 1
1 372 . 8 1 1 A 45 45 PHE C C 44 176.691 178.474 -1.783 1
1 373 . 8 1 1 A 45 45 PHE CA C 44 62.333 60.614 1.719 1
1 374 . 8 1 1 A 45 45 PHE CB C 44 39.449 38.574 0.875 1
1 379 . 8 1 1 A 45 45 PHE N N 44 121.501 117.795 3.706 1
1 380 . 8 1 1 A 46 46 MET H H 45 8.190 8.374 -0.184 1
1 381 . 8 1 1 A 46 46 MET HA H 45 4.060 4.240 -0.180 1
1 389 . 8 1 1 A 46 46 MET C C 45 179.754 178.168 1.586 1
1 390 . 8 1 1 A 46 46 MET CA C 45 57.742 58.005 -0.263 1
1 391 . 8 1 1 A 46 46 MET CB C 45 29.912 31.448 -1.536 1
1 394 . 8 1 1 A 46 46 MET N N 45 116.727 117.559 -0.832 1
1 395 . 8 1 1 A 47 47 ASP H H 46 8.579 8.272 0.307 1
1 396 . 8 1 1 A 47 47 ASP HA H 46 4.804 4.694 0.110 1
1 399 . 8 1 1 A 47 47 ASP C C 46 177.854 178.447 -0.593 1
1 400 . 8 1 1 A 47 47 ASP CA C 46 57.277 57.381 -0.104 1
1 401 . 8 1 1 A 47 47 ASP CB C 46 40.776 41.525 -0.749 1
1 402 . 8 1 1 A 47 47 ASP N N 46 117.798 120.849 -3.051 1
1 403 . 8 1 1 A 48 48 LYS H H 47 7.339 7.836 -0.497 1
1 404 . 8 1 1 A 48 48 LYS HA H 47 3.828 4.158 -0.330 1
1 413 . 8 1 1 A 48 48 LYS C C 47 178.812 178.677 0.135 1
1 414 . 8 1 1 A 48 48 LYS CA C 47 58.953 58.439 0.514 1
1 415 . 8 1 1 A 48 48 LYS CB C 47 32.796 32.812 -0.016 1
1 419 . 8 1 1 A 48 48 LYS N N 47 117.852 119.666 -1.814 1
1 420 . 8 1 1 A 49 49 TYR H H 48 6.841 8.822 -1.981 1
1 421 . 8 1 1 A 49 49 TYR HA H 48 4.995 4.259 0.736 1
1 428 . 8 1 1 A 49 49 TYR C C 48 178.138 178.507 -0.369 1
1 429 . 8 1 1 A 49 49 TYR CA C 48 58.620 59.768 -1.148 1
1 430 . 8 1 1 A 49 49 TYR CB C 48 42.939 38.107 4.832 1
1 435 . 8 1 1 A 49 49 TYR N N 48 112.109 119.713 -7.604 1
1 436 . 8 1 1 A 50 50 TYR H H 49 8.491 7.979 0.512 1
1 437 . 8 1 1 A 50 50 TYR HA H 49 4.598 4.154 0.444 1
1 444 . 8 1 1 A 50 50 TYR C C 49 176.015 178.165 -2.150 1
1 445 . 8 1 1 A 50 50 TYR CA C 49 62.442 59.636 2.806 1
1 446 . 8 1 1 A 50 50 TYR CB C 49 36.588 36.987 -0.399 1
1 451 . 8 1 1 A 50 50 TYR N N 49 118.294 119.765 -1.471 1
1 452 . 8 1 1 A 51 51 LEU H H 50 7.512 7.731 -0.219 1
1 453 . 8 1 1 A 51 51 LEU HA H 50 3.878 3.460 0.418 1
1 463 . 8 1 1 A 51 51 LEU C C 50 178.625 178.472 0.153 1
1 464 . 8 1 1 A 51 51 LEU CA C 50 55.994 57.472 -1.478 1
1 465 . 8 1 1 A 51 51 LEU CB C 50 40.743 41.329 -0.586 1
1 469 . 8 1 1 A 51 51 LEU N N 50 118.478 121.257 -2.779 1
1 470 . 8 1 1 A 52 52 GLU H H 51 8.042 7.779 0.263 1
1 471 . 8 1 1 A 52 52 GLU HA H 51 4.197 3.929 0.268 1
1 476 . 8 1 1 A 52 52 GLU C C 51 177.629 177.723 -0.094 1
1 477 . 8 1 1 A 52 52 GLU CA C 51 56.141 59.534 -3.393 1
1 478 . 8 1 1 A 52 52 GLU CB C 51 29.162 29.067 0.095 1
1 480 . 8 1 1 A 52 52 GLU N N 51 115.067 117.258 -2.191 1
1 481 . 8 1 1 A 53 53 PHE H H 52 7.465 7.888 -0.423 1
1 482 . 8 1 1 A 53 53 PHE HA H 52 4.431 4.615 -0.184 1
1 490 . 8 1 1 A 53 53 PHE C C 52 174.325 174.597 -0.272 1
1 491 . 8 1 1 A 53 53 PHE CA C 52 58.986 57.206 1.780 1
1 492 . 8 1 1 A 53 53 PHE CB C 52 40.183 37.599 2.584 1
1 498 . 8 1 1 A 53 53 PHE N N 52 116.768 118.978 -2.210 1
1 499 . 8 1 1 A 54 54 GLU H H 53 7.484 8.698 -1.214 1
1 500 . 8 1 1 A 54 54 GLU HA H 53 4.583 4.664 -0.081 1
1 505 . 8 1 1 A 54 54 GLU C C 53 175.722 177.362 -1.640 1
1 506 . 8 1 1 A 54 54 GLU CA C 53 54.248 55.215 -0.967 1
1 507 . 8 1 1 A 54 54 GLU CB C 53 34.409 30.278 4.131 1
1 509 . 8 1 1 A 54 54 GLU N N 53 118.844 123.639 -4.795 1
1 510 . 8 1 1 A 55 55 ASP H H 54 9.008 8.872 0.136 1
1 511 . 8 1 1 A 55 55 ASP HA H 54 4.735 4.640 0.095 1
1 514 . 8 1 1 A 55 55 ASP C C 54 175.421 176.608 -1.187 1
1 515 . 8 1 1 A 55 55 ASP CA C 54 52.888 54.622 -1.734 1
1 516 . 8 1 1 A 55 55 ASP CB C 54 38.894 39.979 -1.085 1
1 517 . 8 1 1 A 55 55 ASP N N 54 123.654 120.496 3.158 1
1 518 . 8 1 1 A 56 56 THR H H 55 7.819 7.609 0.210 1
1 519 . 8 1 1 A 56 56 THR HA H 55 4.574 4.214 0.360 1
1 524 . 8 1 1 A 56 56 THR C C 55 174.096 174.975 -0.879 1
1 525 . 8 1 1 A 56 56 THR CA C 55 59.172 62.260 -3.088 1
1 526 . 8 1 1 A 56 56 THR CB C 55 71.889 69.920 1.969 1
1 528 . 8 1 1 A 56 56 THR N N 55 112.015 113.078 -1.063 1
1 529 . 8 1 1 A 57 57 GLU H H 56 8.527 8.891 -0.364 1
1 530 . 8 1 1 A 57 57 GLU HA H 56 4.217 4.432 -0.215 1
1 535 . 8 1 1 A 57 57 GLU C C 56 177.042 177.151 -0.109 1
1 536 . 8 1 1 A 57 57 GLU CA C 56 56.869 57.496 -0.627 1
1 537 . 8 1 1 A 57 57 GLU CB C 56 29.731 29.931 -0.200 1
1 539 . 8 1 1 A 57 57 GLU N N 56 117.531 123.450 -5.919 1
1 540 . 8 1 1 A 58 58 GLU H H 57 7.587 7.976 -0.389 1
1 541 . 8 1 1 A 58 58 GLU HA H 57 3.941 4.466 -0.525 1
1 546 . 8 1 1 A 58 58 GLU C C 57 176.849 175.976 0.873 1
1 547 . 8 1 1 A 58 58 GLU CA C 57 56.924 56.394 0.530 1
1 548 . 8 1 1 A 58 58 GLU CB C 57 30.251 30.600 -0.349 1
1 550 . 8 1 1 A 58 58 GLU N N 57 119.183 119.991 -0.808 1
1 551 . 8 1 1 A 59 59 ASN H H 58 9.120 8.717 0.403 1
1 552 . 8 1 1 A 59 59 ASN HA H 58 4.922 5.816 -0.894 1
1 557 . 8 1 1 A 59 59 ASN C C 58 174.254 174.391 -0.137 1
1 558 . 8 1 1 A 59 59 ASN CA C 58 51.956 51.612 0.344 1
1 559 . 8 1 1 A 59 59 ASN CB C 58 37.404 41.582 -4.178 1
1 560 . 8 1 1 A 59 59 ASN N N 58 126.767 117.974 8.793 1
1 562 . 8 1 1 A 60 60 LYS H H 59 5.892 8.937 -3.045 1
1 563 . 8 1 1 A 60 60 LYS HA H 59 3.798 4.831 -1.033 1
1 572 . 8 1 1 A 60 60 LYS C C 59 177.908 176.906 1.002 1
1 573 . 8 1 1 A 60 60 LYS CA C 59 56.623 54.828 1.795 1
1 574 . 8 1 1 A 60 60 LYS CB C 59 32.279 35.253 -2.974 1
1 578 . 8 1 1 A 60 60 LYS N N 59 121.527 121.600 -0.073 1
1 579 . 8 1 1 A 61 61 LEU H H 60 8.473 8.786 -0.313 1
1 580 . 8 1 1 A 61 61 LEU HA H 60 3.891 4.195 -0.304 1
1 590 . 8 1 1 A 61 61 LEU C C 60 179.843 178.741 1.102 1
1 591 . 8 1 1 A 61 61 LEU CA C 60 58.301 56.485 1.816 1
1 592 . 8 1 1 A 61 61 LEU CB C 60 41.305 41.501 -0.196 1
1 596 . 8 1 1 A 61 61 LEU N N 60 125.639 123.814 1.825 1
1 597 . 8 1 1 A 62 62 ILE H H 61 7.698 7.727 -0.029 1
1 598 . 8 1 1 A 62 62 ILE HA H 61 3.952 3.847 0.105 1
1 608 . 8 1 1 A 62 62 ILE C C 61 175.392 177.111 -1.719 1
1 609 . 8 1 1 A 62 62 ILE CA C 61 61.743 63.085 -1.342 1
1 610 . 8 1 1 A 62 62 ILE CB C 61 39.108 37.610 1.498 1
1 614 . 8 1 1 A 62 62 ILE N N 61 114.111 119.608 -5.497 1
1 615 . 8 1 1 A 63 63 TYR H H 62 7.273 7.606 -0.333 1
1 616 . 8 1 1 A 63 63 TYR HA H 62 4.343 4.225 0.118 1
1 623 . 8 1 1 A 63 63 TYR C C 62 178.264 178.679 -0.415 1
1 624 . 8 1 1 A 63 63 TYR CA C 62 57.231 60.927 -3.696 1
1 625 . 8 1 1 A 63 63 TYR CB C 62 36.332 37.513 -1.181 1
1 630 . 8 1 1 A 63 63 TYR N N 62 117.689 121.359 -3.670 1
1 631 . 8 1 1 A 64 64 THR H H 63 7.747 7.951 -0.204 1
1 632 . 8 1 1 A 64 64 THR HA H 63 4.266 4.237 0.029 1
1 637 . 8 1 1 A 64 64 THR CA C 63 69.362 67.547 1.815 1
1 638 . 8 1 1 A 64 64 THR CB C 63 66.962 67.931 -0.969 1
1 640 . 8 1 1 A 64 64 THR N N 63 113.755 116.076 -2.321 1
1 641 . 8 1 1 A 65 65 PRO HA H 64 4.372 4.391 -0.019 1
1 648 . 8 1 1 A 65 65 PRO C C 64 179.913 179.410 0.503 1
1 649 . 8 1 1 A 65 65 PRO CA C 64 66.011 66.172 -0.161 1
1 650 . 8 1 1 A 65 65 PRO CB C 64 30.642 30.703 -0.061 1
1 653 . 8 1 1 A 66 66 ILE H H 65 7.377 7.259 0.118 1
1 654 . 8 1 1 A 66 66 ILE HA H 65 3.530 3.899 -0.369 1
1 664 . 8 1 1 A 66 66 ILE C C 65 177.543 178.480 -0.937 1
1 665 . 8 1 1 A 66 66 ILE CA C 65 66.647 64.256 2.391 1
1 666 . 8 1 1 A 66 66 ILE CB C 65 38.029 37.726 0.303 1
1 670 . 8 1 1 A 66 66 ILE N N 65 118.353 116.745 1.608 1
1 671 . 8 1 1 A 67 67 PHE H H 66 8.480 8.368 0.112 1
1 672 . 8 1 1 A 67 67 PHE HA H 66 4.115 4.294 -0.179 1
1 680 . 8 1 1 A 67 67 PHE C C 66 177.293 177.824 -0.531 1
1 681 . 8 1 1 A 67 67 PHE CA C 66 59.570 62.405 -2.835 1
1 682 . 8 1 1 A 67 67 PHE CB C 66 38.865 39.361 -0.496 1
1 688 . 8 1 1 A 67 67 PHE N N 66 122.420 120.427 1.993 1
1 689 . 8 1 1 A 68 68 ASN H H 67 8.595 8.353 0.242 1
1 690 . 8 1 1 A 68 68 ASN HA H 67 4.211 4.361 -0.150 1
1 695 . 8 1 1 A 68 68 ASN C C 67 178.697 178.167 0.530 1
1 696 . 8 1 1 A 68 68 ASN CA C 67 56.056 56.141 -0.085 1
1 697 . 8 1 1 A 68 68 ASN CB C 67 37.704 38.095 -0.391 1
1 698 . 8 1 1 A 68 68 ASN N N 67 115.573 117.710 -2.137 1
1 700 . 8 1 1 A 69 69 GLU H H 68 8.414 8.002 0.412 1
1 701 . 8 1 1 A 69 69 GLU HA H 68 4.102 4.201 -0.099 1
1 706 . 8 1 1 A 69 69 GLU C C 68 177.880 178.855 -0.975 1
1 707 . 8 1 1 A 69 69 GLU CA C 68 59.399 59.348 0.051 1
1 708 . 8 1 1 A 69 69 GLU CB C 68 29.855 29.323 0.532 1
1 710 . 8 1 1 A 69 69 GLU N N 68 123.510 119.847 3.663 1
1 711 . 8 1 1 A 70 70 TYR H H 69 8.659 8.141 0.518 1
1 712 . 8 1 1 A 70 70 TYR HA H 69 3.362 4.170 -0.808 1
1 719 . 8 1 1 A 70 70 TYR C C 69 178.143 177.014 1.129 1
1 720 . 8 1 1 A 70 70 TYR CA C 69 60.686 61.227 -0.541 1
1 721 . 8 1 1 A 70 70 TYR CB C 69 38.560 38.773 -0.213 1
1 726 . 8 1 1 A 70 70 TYR N N 69 122.130 120.868 1.262 1
1 727 . 8 1 1 A 71 71 ILE H H 70 8.031 7.814 0.217 1
1 728 . 8 1 1 A 71 71 ILE HA H 70 3.265 3.672 -0.407 1
1 738 . 8 1 1 A 71 71 ILE C C 70 178.056 177.312 0.744 1
1 739 . 8 1 1 A 71 71 ILE CA C 70 63.756 63.918 -0.162 1
1 740 . 8 1 1 A 71 71 ILE CB C 70 37.321 36.617 0.704 1
1 744 . 8 1 1 A 71 71 ILE N N 70 118.906 120.409 -1.503 1
1 745 . 8 1 1 A 72 72 SER H H 71 7.803 7.727 0.076 1
1 746 . 8 1 1 A 72 72 SER HA H 71 4.029 4.381 -0.352 1
1 749 . 8 1 1 A 72 72 SER CA C 71 61.380 61.022 0.358 1
1 750 . 8 1 1 A 72 72 SER CB C 71 63.288 63.282 0.006 1
1 751 . 8 1 1 A 72 72 SER N N 71 113.735 116.793 -3.058 1
1 752 . 8 1 1 A 73 73 LEU H H 72 7.952 7.954 -0.002 1
1 753 . 8 1 1 A 73 73 LEU HA H 72 4.418 4.162 0.256 1
1 763 . 8 1 1 A 73 73 LEU C C 72 177.767 178.333 -0.566 1
1 764 . 8 1 1 A 73 73 LEU CA C 72 56.543 57.453 -0.910 1
1 765 . 8 1 1 A 73 73 LEU CB C 72 44.517 41.934 2.583 1
1 769 . 8 1 1 A 73 73 LEU N N 72 119.411 122.486 -3.075 1
1 770 . 8 1 1 A 74 74 VAL H H 73 8.021 7.622 0.399 1
1 771 . 8 1 1 A 74 74 VAL HA H 73 3.532 3.338 0.194 1
1 779 . 8 1 1 A 74 74 VAL C C 73 177.126 177.987 -0.861 1
1 780 . 8 1 1 A 74 74 VAL CA C 73 66.250 66.331 -0.081 1
1 781 . 8 1 1 A 74 74 VAL CB C 73 31.212 31.100 0.112 1
1 784 . 8 1 1 A 74 74 VAL N N 73 118.747 119.248 -0.501 1
1 785 . 8 1 1 A 75 75 GLU H H 74 7.232 7.955 -0.723 1
1 786 . 8 1 1 A 75 75 GLU HA H 74 3.013 4.100 -1.087 1
1 791 . 8 1 1 A 75 75 GLU C C 74 178.804 179.055 -0.251 1
1 792 . 8 1 1 A 75 75 GLU CA C 74 60.536 59.822 0.714 1
1 793 . 8 1 1 A 75 75 GLU CB C 74 27.009 28.951 -1.942 1
1 795 . 8 1 1 A 75 75 GLU N N 74 118.660 119.846 -1.186 1
1 796 . 8 1 1 A 76 76 LYS H H 75 7.051 7.838 -0.787 1
1 797 . 8 1 1 A 76 76 LYS HA H 75 3.765 3.989 -0.224 1
1 806 . 8 1 1 A 76 76 LYS C C 75 177.765 178.649 -0.884 1
1 807 . 8 1 1 A 76 76 LYS CA C 75 58.357 58.935 -0.578 1
1 808 . 8 1 1 A 76 76 LYS CB C 75 31.939 31.896 0.043 1
1 812 . 8 1 1 A 76 76 LYS N N 75 116.112 119.577 -3.465 1
1 813 . 8 1 1 A 77 77 TYR H H 76 7.067 7.796 -0.729 1
1 814 . 8 1 1 A 77 77 TYR HA H 76 4.036 4.200 -0.164 1
1 821 . 8 1 1 A 77 77 TYR C C 76 177.752 177.189 0.563 1
1 822 . 8 1 1 A 77 77 TYR CA C 76 61.820 61.309 0.511 1
1 823 . 8 1 1 A 77 77 TYR CB C 76 38.480 38.548 -0.068 1
1 828 . 8 1 1 A 77 77 TYR N N 76 118.434 120.816 -2.382 1
1 829 . 8 1 1 A 78 78 ILE H H 77 7.554 8.412 -0.858 1
1 830 . 8 1 1 A 78 78 ILE HA H 77 3.159 3.580 -0.421 1
1 840 . 8 1 1 A 78 78 ILE C C 77 177.341 177.944 -0.603 1
1 841 . 8 1 1 A 78 78 ILE CA C 77 65.177 65.373 -0.196 1
1 842 . 8 1 1 A 78 78 ILE CB C 77 37.339 38.011 -0.672 1
1 846 . 8 1 1 A 78 78 ILE N N 77 117.672 121.218 -3.546 1
1 847 . 8 1 1 A 79 79 GLU H H 78 8.296 7.873 0.423 1
1 848 . 8 1 1 A 79 79 GLU HA H 78 3.557 3.783 -0.226 1
1 853 . 8 1 1 A 79 79 GLU C C 78 177.742 178.932 -1.190 1
1 854 . 8 1 1 A 79 79 GLU CA C 78 60.847 59.934 0.913 1
1 855 . 8 1 1 A 79 79 GLU CB C 78 29.594 29.110 0.484 1
1 857 . 8 1 1 A 79 79 GLU N N 78 118.701 121.145 -2.444 1
1 858 . 8 1 1 A 80 80 GLU H H 79 8.330 8.190 0.140 1
1 859 . 8 1 1 A 80 80 GLU HA H 79 3.774 3.994 -0.220 1
1 864 . 8 1 1 A 80 80 GLU C C 79 179.926 179.272 0.654 1
1 865 . 8 1 1 A 80 80 GLU CA C 79 59.581 59.055 0.526 1
1 866 . 8 1 1 A 80 80 GLU CB C 79 29.062 29.293 -0.231 1
1 868 . 8 1 1 A 80 80 GLU N N 79 116.767 117.988 -1.221 1
1 869 . 8 1 1 A 81 81 GLN H H 80 7.634 7.553 0.081 1
1 870 . 8 1 1 A 81 81 GLN HA H 80 3.605 3.821 -0.216 1
1 877 . 8 1 1 A 81 81 GLN C C 80 179.681 178.709 0.972 1
1 878 . 8 1 1 A 81 81 GLN CA C 80 57.765 58.522 -0.757 1
1 879 . 8 1 1 A 81 81 GLN CB C 80 28.079 27.934 0.145 1
1 881 . 8 1 1 A 81 81 GLN N N 80 116.325 118.865 -2.540 1
1 883 . 8 1 1 A 82 82 LEU H H 81 8.156 7.479 0.677 1
1 884 . 8 1 1 A 82 82 LEU HA H 81 3.536 3.804 -0.268 1
1 894 . 8 1 1 A 82 82 LEU C C 81 178.945 179.439 -0.494 1
1 895 . 8 1 1 A 82 82 LEU CA C 81 57.761 56.802 0.959 1
1 896 . 8 1 1 A 82 82 LEU CB C 81 40.961 41.052 -0.091 1
1 900 . 8 1 1 A 82 82 LEU N N 81 121.546 120.138 1.408 1
1 901 . 8 1 1 A 83 83 LEU H H 82 8.326 7.966 0.360 1
1 902 . 8 1 1 A 83 83 LEU HA H 82 4.198 4.204 -0.006 1
1 912 . 8 1 1 A 83 83 LEU C C 82 178.631 179.059 -0.428 1
1 913 . 8 1 1 A 83 83 LEU CA C 82 57.016 57.106 -0.090 1
1 914 . 8 1 1 A 83 83 LEU CB C 82 42.182 40.810 1.372 1
1 918 . 8 1 1 A 83 83 LEU N N 82 120.426 118.876 1.550 1
1 919 . 8 1 1 A 84 84 GLN H H 83 6.992 7.675 -0.683 1
1 920 . 8 1 1 A 84 84 GLN HA H 83 3.877 3.983 -0.106 1
1 927 . 8 1 1 A 84 84 GLN C C 83 177.008 176.996 0.012 1
1 928 . 8 1 1 A 84 84 GLN CA C 83 57.543 58.419 -0.876 1
1 929 . 8 1 1 A 84 84 GLN CB C 83 28.688 28.404 0.284 1
1 931 . 8 1 1 A 84 84 GLN N N 83 114.001 117.262 -3.261 1
1 933 . 8 1 1 A 85 85 ARG H H 84 7.072 7.387 -0.315 1
1 934 . 8 1 1 A 85 85 ARG HA H 84 4.047 4.382 -0.335 1
1 942 . 8 1 1 A 85 85 ARG C C 84 175.999 175.161 0.838 1
1 943 . 8 1 1 A 85 85 ARG CA C 84 56.764 55.764 1.000 1
1 944 . 8 1 1 A 85 85 ARG CB C 84 32.044 32.174 -0.130 1
1 947 . 8 1 1 A 85 85 ARG N N 84 115.827 116.667 -0.840 1
1 949 . 8 1 1 A 86 86 ILE H H 85 8.238 7.377 0.861 1
1 950 . 8 1 1 A 86 86 ILE HA H 85 4.389 4.598 -0.209 1
1 960 . 8 1 1 A 86 86 ILE CA C 85 58.007 57.935 0.072 1
1 961 . 8 1 1 A 86 86 ILE CB C 85 39.604 39.102 0.502 1
1 965 . 8 1 1 A 86 86 ILE N N 85 119.285 118.961 0.324 1
1 966 . 8 1 1 A 87 87 PRO HA H 86 4.392 4.537 -0.145 1
1 973 . 8 1 1 A 87 87 PRO C C 86 177.622 176.498 1.124 1
1 974 . 8 1 1 A 87 87 PRO CA C 86 64.665 64.253 0.412 1
1 975 . 8 1 1 A 87 87 PRO CB C 86 32.020 31.657 0.363 1
1 978 . 8 1 1 A 88 88 GLU H H 87 8.312 8.201 0.111 1
1 979 . 8 1 1 A 88 88 GLU HA H 87 4.208 4.570 -0.362 1
1 984 . 8 1 1 A 88 88 GLU C C 87 175.554 175.857 -0.303 1
1 985 . 8 1 1 A 88 88 GLU CA C 87 56.045 56.279 -0.234 1
1 986 . 8 1 1 A 88 88 GLU CB C 87 28.654 30.611 -1.957 1
1 988 . 8 1 1 A 88 88 GLU N N 87 114.256 116.759 -2.503 1
1 989 . 8 1 1 A 89 89 PHE H H 88 7.946 7.465 0.481 1
1 990 . 8 1 1 A 89 89 PHE HA H 88 3.993 4.362 -0.369 1
1 998 . 8 1 1 A 89 89 PHE C C 88 173.460 175.227 -1.767 1
1 999 . 8 1 1 A 89 89 PHE CA C 88 60.119 59.573 0.546 1
1 1000 . 8 1 1 A 89 89 PHE CB C 88 39.994 39.657 0.337 1
1 1006 . 8 1 1 A 89 89 PHE N N 88 121.550 123.600 -2.050 1
1 1007 . 8 1 1 A 90 90 ASN H H 89 7.266 7.849 -0.583 1
1 1008 . 8 1 1 A 90 90 ASN HA H 89 4.454 4.989 -0.535 1
1 1013 . 8 1 1 A 90 90 ASN C C 89 173.921 175.024 -1.103 1
1 1014 . 8 1 1 A 90 90 ASN CA C 89 51.839 51.433 0.406 1
1 1015 . 8 1 1 A 90 90 ASN CB C 89 40.674 38.789 1.885 1
1 1016 . 8 1 1 A 90 90 ASN N N 89 125.344 124.475 0.869 1
1 1018 . 8 1 1 A 91 91 MET H H 90 8.968 8.613 0.355 1
1 1019 . 8 1 1 A 91 91 MET HA H 90 4.049 4.172 -0.123 1
1 1027 . 8 1 1 A 91 91 MET C C 90 177.475 178.006 -0.531 1
1 1028 . 8 1 1 A 91 91 MET CA C 90 57.758 57.922 -0.164 1
1 1029 . 8 1 1 A 91 91 MET CB C 90 32.250 32.567 -0.317 1
1 1032 . 8 1 1 A 91 91 MET N N 90 127.052 124.932 2.120 1
1 1033 . 8 1 1 A 92 92 ALA H H 91 8.292 8.259 0.033 1
1 1034 . 8 1 1 A 92 92 ALA HA H 91 4.059 4.145 -0.086 1
1 1038 . 8 1 1 A 92 92 ALA C C 91 180.412 179.829 0.583 1
1 1039 . 8 1 1 A 92 92 ALA CA C 91 55.368 54.997 0.371 1
1 1040 . 8 1 1 A 92 92 ALA CB C 91 17.527 18.419 -0.892 1
1 1041 . 8 1 1 A 92 92 ALA N N 91 123.752 121.035 2.717 1
1 1042 . 8 1 1 A 93 93 ALA H H 92 7.931 8.028 -0.097 1
1 1043 . 8 1 1 A 93 93 ALA HA H 92 4.054 4.092 -0.038 1
1 1047 . 8 1 1 A 93 93 ALA C C 92 180.482 179.924 0.558 1
1 1048 . 8 1 1 A 93 93 ALA CA C 92 54.614 54.840 -0.226 1
1 1049 . 8 1 1 A 93 93 ALA CB C 92 18.098 18.164 -0.066 1
1 1050 . 8 1 1 A 93 93 ALA N N 92 121.158 120.128 1.030 1
1 1051 . 8 1 1 A 94 94 PHE H H 93 8.110 7.765 0.345 1
1 1052 . 8 1 1 A 94 94 PHE HA H 93 4.304 4.125 0.179 1
1 1060 . 8 1 1 A 94 94 PHE C C 93 177.350 177.710 -0.360 1
1 1061 . 8 1 1 A 94 94 PHE CA C 93 61.641 61.474 0.167 1
1 1062 . 8 1 1 A 94 94 PHE CB C 93 40.014 39.460 0.554 1
1 1068 . 8 1 1 A 94 94 PHE N N 93 119.807 119.838 -0.031 1
1 1069 . 8 1 1 A 95 95 THR H H 94 8.726 8.270 0.456 1
1 1070 . 8 1 1 A 95 95 THR HA H 94 3.569 3.978 -0.409 1
1 1075 . 8 1 1 A 95 95 THR C C 94 176.932 176.865 0.067 1
1 1076 . 8 1 1 A 95 95 THR CA C 94 66.833 65.561 1.272 1
1 1077 . 8 1 1 A 95 95 THR CB C 94 68.445 68.315 0.130 1
1 1079 . 8 1 1 A 95 95 THR N N 94 113.074 112.725 0.349 1
1 1080 . 8 1 1 A 96 96 THR H H 95 7.657 7.860 -0.203 1
1 1081 . 8 1 1 A 96 96 THR HA H 95 3.945 4.057 -0.112 1
1 1086 . 8 1 1 A 96 96 THR C C 95 176.386 176.542 -0.156 1
1 1087 . 8 1 1 A 96 96 THR CA C 95 66.550 66.101 0.449 1
1 1088 . 8 1 1 A 96 96 THR CB C 95 68.583 68.491 0.092 1
1 1090 . 8 1 1 A 96 96 THR N N 95 117.927 117.143 0.784 1
1 1091 . 8 1 1 A 97 97 THR H H 96 7.699 7.722 -0.023 1
1 1092 . 8 1 1 A 97 97 THR HA H 96 3.905 4.063 -0.158 1
1 1097 . 8 1 1 A 97 97 THR C C 96 176.572 176.561 0.011 1
1 1098 . 8 1 1 A 97 97 THR CA C 96 65.979 66.382 -0.403 1
1 1099 . 8 1 1 A 97 97 THR CB C 96 68.553 68.349 0.204 1
1 1101 . 8 1 1 A 97 97 THR N N 96 118.518 118.115 0.403 1
1 1102 . 8 1 1 A 98 98 LEU H H 97 8.304 8.168 0.136 1
1 1103 . 8 1 1 A 98 98 LEU HA H 97 3.725 3.773 -0.048 1
1 1113 . 8 1 1 A 98 98 LEU C C 97 178.490 178.715 -0.225 1
1 1114 . 8 1 1 A 98 98 LEU CA C 97 58.517 57.953 0.564 1
1 1115 . 8 1 1 A 98 98 LEU CB C 97 41.697 40.917 0.780 1
1 1119 . 8 1 1 A 98 98 LEU N N 97 122.882 121.963 0.919 1
1 1120 . 8 1 1 A 99 99 GLN H H 98 7.639 7.899 -0.260 1
1 1121 . 8 1 1 A 99 99 GLN HA H 98 3.927 4.061 -0.134 1
1 1128 . 8 1 1 A 99 99 GLN C C 98 178.068 177.346 0.722 1
1 1129 . 8 1 1 A 99 99 GLN CA C 98 58.735 58.443 0.292 1
1 1130 . 8 1 1 A 99 99 GLN CB C 98 27.986 28.583 -0.597 1
1 1132 . 8 1 1 A 99 99 GLN N N 98 114.302 118.118 -3.816 1
1 1134 . 8 1 1 A 100 100 HIS H H 99 7.575 7.500 0.075 1
1 1135 . 8 1 1 A 100 100 HIS HA H 99 4.524 4.474 0.050 1
1 1139 . 8 1 1 A 100 100 HIS C C 99 174.789 177.291 -2.502 1
1 1140 . 8 1 1 A 100 100 HIS CA C 99 56.154 58.112 -1.958 1
1 1141 . 8 1 1 A 100 100 HIS CB C 99 28.946 31.104 -2.158 1
1 1143 . 8 1 1 A 100 100 HIS N N 99 114.778 116.929 -2.151 1
1 1144 . 8 1 1 A 101 101 HIS H H 100 7.773 8.278 -0.505 1
1 1145 . 8 1 1 A 101 101 HIS HA H 100 4.704 4.371 0.333 1
1 1149 . 8 1 1 A 101 101 HIS C C 100 174.818 177.249 -2.431 1
1 1150 . 8 1 1 A 101 101 HIS CA C 100 54.830 59.066 -4.236 1
1 1151 . 8 1 1 A 101 101 HIS CB C 100 29.749 28.718 1.031 1
1 1153 . 8 1 1 A 101 101 HIS N N 100 117.397 117.597 -0.200 1
1 1154 . 8 1 1 A 102 102 LYS H H 101 7.324 8.096 -0.772 1
1 1155 . 8 1 1 A 102 102 LYS HA H 101 3.611 4.110 -0.499 1
1 1164 . 8 1 1 A 102 102 LYS C C 101 176.823 178.466 -1.643 1
1 1165 . 8 1 1 A 102 102 LYS CA C 101 59.915 59.182 0.733 1
1 1166 . 8 1 1 A 102 102 LYS CB C 101 32.825 32.261 0.564 1
1 1170 . 8 1 1 A 102 102 LYS N N 101 120.533 120.271 0.262 1
1 1171 . 8 1 1 A 103 103 ASP H H 102 8.361 7.759 0.602 1
1 1172 . 8 1 1 A 103 103 ASP HA H 102 4.421 4.420 0.001 1
1 1175 . 8 1 1 A 103 103 ASP C C 102 176.793 177.566 -0.773 1
1 1176 . 8 1 1 A 103 103 ASP CA C 102 55.500 56.294 -0.794 1
1 1177 . 8 1 1 A 103 103 ASP CB C 102 40.178 40.823 -0.645 1
1 1178 . 8 1 1 A 103 103 ASP N N 102 114.814 119.744 -4.930 1
1 1179 . 8 1 1 A 104 104 GLU H H 103 7.858 7.678 0.180 1
1 1180 . 8 1 1 A 104 104 GLU HA H 103 4.339 4.340 -0.001 1
1 1183 . 8 1 1 A 104 104 GLU C C 103 175.777 176.657 -0.880 1
1 1184 . 8 1 1 A 104 104 GLU CA C 103 56.356 58.369 -2.013 1
1 1185 . 8 1 1 A 104 104 GLU CB C 103 31.293 30.777 0.516 1
1 1186 . 8 1 1 A 104 104 GLU N N 103 116.826 116.795 0.031 1
1 1187 . 8 1 1 A 105 105 VAL H H 104 7.201 7.682 -0.481 1
1 1188 . 8 1 1 A 105 105 VAL HA H 104 4.296 4.232 0.064 1
1 1196 . 8 1 1 A 105 105 VAL C C 104 174.482 175.519 -1.037 1
1 1197 . 8 1 1 A 105 105 VAL CA C 104 60.370 61.515 -1.145 1
1 1198 . 8 1 1 A 105 105 VAL CB C 104 34.341 33.457 0.884 1
1 1201 . 8 1 1 A 105 105 VAL N N 104 116.422 117.069 -0.647 1
1 1202 . 8 1 1 A 106 106 ALA H H 105 8.487 8.621 -0.134 1
1 1203 . 8 1 1 A 106 106 ALA HA H 105 4.172 4.436 -0.264 1
1 1207 . 8 1 1 A 106 106 ALA C C 105 179.030 178.384 0.646 1
1 1208 . 8 1 1 A 106 106 ALA CA C 105 52.966 51.573 1.393 1
1 1209 . 8 1 1 A 106 106 ALA CB C 105 19.371 18.832 0.539 1
1 1210 . 8 1 1 A 106 106 ALA N N 105 128.313 125.289 3.024 1
1 1211 . 8 1 1 A 107 107 GLY H H 106 8.738 8.736 0.002 1
1 1212 . 8 1 1 A 107 107 GLY HA2 H 106 3.773 3.871 -0.098 1
1 1213 . 8 1 1 A 107 107 GLY HA3 H 106 3.998 3.936 0.062 1
1 1214 . 8 1 1 A 107 107 GLY C C 106 174.958 175.346 -0.388 1
1 1215 . 8 1 1 A 107 107 GLY CA C 106 47.449 47.235 0.214 1
1 1216 . 8 1 1 A 107 107 GLY N N 106 110.612 110.514 0.098 1
1 1217 . 8 1 1 A 108 108 ASP H H 107 8.535 7.856 0.679 1
1 1218 . 8 1 1 A 108 108 ASP HA H 107 4.333 4.359 -0.026 1
1 1221 . 8 1 1 A 108 108 ASP C C 107 179.133 179.050 0.083 1
1 1222 . 8 1 1 A 108 108 ASP CA C 107 56.721 56.264 0.457 1
1 1223 . 8 1 1 A 108 108 ASP CB C 107 39.336 40.666 -1.330 1
1 1224 . 8 1 1 A 108 108 ASP N N 107 117.474 122.314 -4.840 1
1 1225 . 8 1 1 A 109 109 ILE H H 108 7.459 7.933 -0.474 1
1 1226 . 8 1 1 A 109 109 ILE HA H 108 3.688 3.765 -0.077 1
1 1236 . 8 1 1 A 109 109 ILE C C 108 176.735 178.334 -1.599 1
1 1237 . 8 1 1 A 109 109 ILE CA C 108 63.474 65.490 -2.016 1
1 1238 . 8 1 1 A 109 109 ILE CB C 108 37.340 37.780 -0.440 1
1 1242 . 8 1 1 A 109 109 ILE N N 108 119.609 119.487 0.122 1
1 1243 . 8 1 1 A 110 110 PHE H H 109 7.920 8.298 -0.378 1
1 1244 . 8 1 1 A 110 110 PHE HA H 109 3.759 4.077 -0.318 1
1 1252 . 8 1 1 A 110 110 PHE C C 109 177.132 177.325 -0.193 1
1 1253 . 8 1 1 A 110 110 PHE CA C 109 62.766 61.233 1.533 1
1 1254 . 8 1 1 A 110 110 PHE CB C 109 39.752 39.328 0.424 1
1 1260 . 8 1 1 A 110 110 PHE N N 109 120.906 120.427 0.479 1
1 1261 . 8 1 1 A 111 111 ASP H H 110 8.639 8.303 0.336 1
1 1262 . 8 1 1 A 111 111 ASP HA H 110 4.216 4.190 0.026 1
1 1265 . 8 1 1 A 111 111 ASP C C 110 178.900 178.332 0.568 1
1 1266 . 8 1 1 A 111 111 ASP CA C 110 57.105 57.273 -0.168 1
1 1267 . 8 1 1 A 111 111 ASP CB C 110 39.697 42.004 -2.307 1
1 1268 . 8 1 1 A 111 111 ASP N N 110 117.124 118.737 -1.613 1
1 1269 . 8 1 1 A 112 112 MET H H 111 7.331 7.540 -0.209 1
1 1270 . 8 1 1 A 112 112 MET HA H 111 4.081 4.144 -0.063 1
1 1278 . 8 1 1 A 112 112 MET C C 111 179.052 178.152 0.900 1
1 1279 . 8 1 1 A 112 112 MET CA C 111 58.202 58.103 0.099 1
1 1280 . 8 1 1 A 112 112 MET CB C 111 31.827 32.446 -0.619 1
1 1283 . 8 1 1 A 112 112 MET N N 111 118.061 119.411 -1.350 1
1 1284 . 8 1 1 A 113 113 LEU H H 112 8.001 8.052 -0.051 1
1 1285 . 8 1 1 A 113 113 LEU HA H 112 3.723 3.596 0.127 1
1 1295 . 8 1 1 A 113 113 LEU C C 112 179.747 178.511 1.236 1
1 1296 . 8 1 1 A 113 113 LEU CA C 112 57.371 57.382 -0.011 1
1 1297 . 8 1 1 A 113 113 LEU CB C 112 40.671 41.071 -0.400 1
1 1301 . 8 1 1 A 113 113 LEU N N 112 120.426 119.678 0.748 1
1 1302 . 8 1 1 A 114 114 LEU H H 113 7.744 7.701 0.043 1
1 1303 . 8 1 1 A 114 114 LEU HA H 113 4.007 3.481 0.526 1
1 1313 . 8 1 1 A 114 114 LEU C C 113 179.358 178.503 0.855 1
1 1314 . 8 1 1 A 114 114 LEU CA C 113 57.202 57.459 -0.257 1
1 1315 . 8 1 1 A 114 114 LEU CB C 113 41.727 41.560 0.167 1
1 1319 . 8 1 1 A 114 114 LEU N N 113 119.584 119.588 -0.004 1
1 1320 . 8 1 1 A 115 115 THR H H 114 7.353 7.557 -0.204 1
1 1321 . 8 1 1 A 115 115 THR HA H 114 4.071 4.048 0.023 1
1 1327 . 8 1 1 A 115 115 THR C C 114 173.591 176.420 -2.829 1
1 1328 . 8 1 1 A 115 115 THR CA C 114 65.332 64.525 0.807 1
1 1329 . 8 1 1 A 115 115 THR CB C 114 70.319 68.492 1.827 1
1 1331 . 8 1 1 A 115 115 THR N N 114 107.535 112.288 -4.753 1
1 1332 . 8 1 1 A 116 116 PHE H H 115 6.979 7.625 -0.646 1
1 1333 . 8 1 1 A 116 116 PHE HA H 115 5.022 4.320 0.702 1
1 1341 . 8 1 1 A 116 116 PHE C C 115 176.488 176.534 -0.046 1
1 1342 . 8 1 1 A 116 116 PHE CA C 115 55.911 60.948 -5.037 1
1 1343 . 8 1 1 A 116 116 PHE CB C 115 38.521 39.138 -0.617 1
1 1349 . 8 1 1 A 116 116 PHE N N 115 112.366 120.221 -7.855 1
1 1350 . 8 1 1 A 117 117 THR H H 116 7.564 7.505 0.059 1
1 1351 . 8 1 1 A 117 117 THR HA H 116 4.626 4.853 -0.227 1
1 1356 . 8 1 1 A 117 117 THR C C 116 174.085 174.257 -0.172 1
1 1357 . 8 1 1 A 117 117 THR CA C 116 61.636 61.894 -0.258 1
1 1358 . 8 1 1 A 117 117 THR CB C 116 70.915 70.873 0.042 1
1 1360 . 8 1 1 A 117 117 THR N N 116 105.498 106.083 -0.585 1
1 1361 . 8 1 1 A 118 118 ASP H H 117 8.270 7.508 0.762 1
1 1362 . 8 1 1 A 118 118 ASP HA H 117 4.955 5.009 -0.054 1
1 1365 . 8 1 1 A 118 118 ASP C C 117 176.328 176.245 0.083 1
1 1366 . 8 1 1 A 118 118 ASP CA C 117 53.417 53.472 -0.055 1
1 1367 . 8 1 1 A 118 118 ASP CB C 117 43.388 38.857 4.531 1
1 1368 . 8 1 1 A 118 118 ASP N N 117 124.409 123.885 0.524 1
1 1369 . 8 1 1 A 119 119 PHE H H 118 8.973 8.788 0.185 1
1 1370 . 8 1 1 A 119 119 PHE HA H 118 3.506 4.227 -0.721 1
1 1378 . 8 1 1 A 119 119 PHE CA C 118 61.490 61.039 0.451 1
1 1379 . 8 1 1 A 119 119 PHE CB C 118 39.246 39.531 -0.285 1
1 1385 . 8 1 1 A 119 119 PHE N N 118 126.688 125.435 1.253 1
1 1386 . 8 1 1 A 120 120 LEU H H 119 8.099 8.257 -0.158 1
1 1387 . 8 1 1 A 120 120 LEU HA H 119 3.842 3.952 -0.110 1
1 1397 . 8 1 1 A 120 120 LEU C C 119 179.601 179.375 0.226 1
1 1398 . 8 1 1 A 120 120 LEU CA C 119 58.174 57.923 0.251 1
1 1399 . 8 1 1 A 120 120 LEU CB C 119 40.315 41.304 -0.989 1
1 1403 . 8 1 1 A 120 120 LEU N N 119 117.930 119.807 -1.877 1
1 1404 . 8 1 1 A 121 121 ALA H H 120 7.729 7.606 0.123 1
1 1405 . 8 1 1 A 121 121 ALA HA H 120 3.996 4.111 -0.115 1
1 1409 . 8 1 1 A 121 121 ALA C C 120 180.995 179.545 1.450 1
1 1410 . 8 1 1 A 121 121 ALA CA C 120 54.832 54.608 0.224 1
1 1411 . 8 1 1 A 121 121 ALA CB C 120 17.706 18.391 -0.685 1
1 1412 . 8 1 1 A 121 121 ALA N N 120 123.195 121.009 2.186 1
1 1413 . 8 1 1 A 122 122 PHE H H 121 7.943 7.763 0.180 1
1 1414 . 8 1 1 A 122 122 PHE HA H 121 3.887 3.803 0.084 1
1 1419 . 8 1 1 A 122 122 PHE C C 121 175.410 176.757 -1.347 1
1 1420 . 8 1 1 A 122 122 PHE CA C 121 61.075 60.655 0.420 1
1 1421 . 8 1 1 A 122 122 PHE CB C 121 38.115 38.663 -0.548 1
1 1424 . 8 1 1 A 122 122 PHE N N 121 121.798 120.176 1.622 1
1 1425 . 8 1 1 A 123 123 LYS H H 122 8.468 7.815 0.653 1
1 1426 . 8 1 1 A 123 123 LYS HA H 122 3.077 3.738 -0.661 1
1 1435 . 8 1 1 A 123 123 LYS C C 122 178.453 178.964 -0.511 1
1 1436 . 8 1 1 A 123 123 LYS CA C 122 59.855 59.905 -0.050 1
1 1437 . 8 1 1 A 123 123 LYS CB C 122 32.374 32.194 0.180 1
1 1441 . 8 1 1 A 123 123 LYS N N 122 120.614 118.432 2.182 1
1 1442 . 8 1 1 A 124 124 GLU H H 123 8.100 7.783 0.317 1
1 1443 . 8 1 1 A 124 124 GLU HA H 123 3.652 4.021 -0.369 1
1 1448 . 8 1 1 A 124 124 GLU C C 123 177.743 178.579 -0.836 1
1 1449 . 8 1 1 A 124 124 GLU CA C 123 59.406 59.448 -0.042 1
1 1450 . 8 1 1 A 124 124 GLU CB C 123 28.811 29.343 -0.532 1
1 1452 . 8 1 1 A 124 124 GLU N N 123 117.404 118.995 -1.591 1
1 1453 . 8 1 1 A 125 125 MET H H 124 7.537 7.511 0.026 1
1 1454 . 8 1 1 A 125 125 MET HA H 124 3.860 3.974 -0.114 1
1 1462 . 8 1 1 A 125 125 MET C C 124 179.522 178.290 1.232 1
1 1463 . 8 1 1 A 125 125 MET CA C 124 58.832 58.291 0.541 1
1 1464 . 8 1 1 A 125 125 MET CB C 124 31.765 31.397 0.368 1
1 1467 . 8 1 1 A 125 125 MET N N 124 119.413 119.131 0.282 1
1 1468 . 8 1 1 A 126 126 PHE H H 125 7.148 7.416 -0.268 1
1 1469 . 8 1 1 A 126 126 PHE HA H 125 3.633 4.245 -0.612 1
1 1476 . 8 1 1 A 126 126 PHE C C 125 178.994 178.191 0.803 1
1 1477 . 8 1 1 A 126 126 PHE CA C 125 63.148 61.223 1.925 1
1 1478 . 8 1 1 A 126 126 PHE CB C 125 39.830 38.365 1.465 1
1 1483 . 8 1 1 A 126 126 PHE N N 125 120.013 118.884 1.129 1
1 1484 . 8 1 1 A 127 127 LEU H H 126 8.369 8.498 -0.129 1
1 1485 . 8 1 1 A 127 127 LEU HA H 126 3.972 4.031 -0.059 1
1 1495 . 8 1 1 A 127 127 LEU C C 126 180.621 178.945 1.676 1
1 1496 . 8 1 1 A 127 127 LEU CA C 126 57.944 58.315 -0.371 1
1 1497 . 8 1 1 A 127 127 LEU CB C 126 40.543 41.818 -1.275 1
1 1501 . 8 1 1 A 127 127 LEU N N 126 119.692 119.892 -0.200 1
1 1502 . 8 1 1 A 128 128 ASP H H 127 8.578 8.138 0.440 1
1 1503 . 8 1 1 A 128 128 ASP HA H 127 4.308 4.378 -0.070 1
1 1506 . 8 1 1 A 128 128 ASP C C 127 178.254 178.003 0.251 1
1 1507 . 8 1 1 A 128 128 ASP CA C 127 56.964 57.227 -0.263 1
1 1508 . 8 1 1 A 128 128 ASP CB C 127 39.735 40.800 -1.065 1
1 1509 . 8 1 1 A 128 128 ASP N N 127 121.926 119.228 2.698 1
1 1510 . 8 1 1 A 129 129 TYR H H 128 7.710 8.325 -0.615 1
1 1511 . 8 1 1 A 129 129 TYR HA H 128 3.908 4.036 -0.128 1
1 1518 . 8 1 1 A 129 129 TYR C C 128 177.633 177.383 0.250 1
1 1519 . 8 1 1 A 129 129 TYR CA C 128 61.796 61.537 0.259 1
1 1520 . 8 1 1 A 129 129 TYR CB C 128 39.372 38.991 0.381 1
1 1525 . 8 1 1 A 129 129 TYR N N 128 122.548 120.517 2.031 1
1 1526 . 8 1 1 A 130 130 ARG H H 129 8.622 8.406 0.216 1
1 1527 . 8 1 1 A 130 130 ARG HA H 129 3.722 3.862 -0.140 1
1 1535 . 8 1 1 A 130 130 ARG CA C 129 60.084 59.642 0.442 1
1 1536 . 8 1 1 A 130 130 ARG CB C 129 29.902 29.930 -0.028 1
1 1539 . 8 1 1 A 130 130 ARG N N 129 118.302 119.424 -1.122 1
1 1541 . 8 1 1 A 131 131 ALA H H 130 7.936 8.018 -0.082 1
1 1542 . 8 1 1 A 131 131 ALA HA H 130 3.997 4.031 -0.034 1
1 1546 . 8 1 1 A 131 131 ALA C C 130 180.456 179.678 0.778 1
1 1547 . 8 1 1 A 131 131 ALA CA C 130 55.133 54.874 0.259 1
1 1548 . 8 1 1 A 131 131 ALA CB C 130 17.750 18.126 -0.376 1
1 1549 . 8 1 1 A 131 131 ALA N N 130 119.788 121.391 -1.603 1
1 1550 . 8 1 1 A 132 132 GLU H H 131 7.622 7.430 0.192 1
1 1551 . 8 1 1 A 132 132 GLU HA H 131 3.862 4.022 -0.160 1
1 1556 . 8 1 1 A 132 132 GLU C C 131 179.528 179.422 0.106 1
1 1557 . 8 1 1 A 132 132 GLU CA C 131 58.849 58.921 -0.072 1
1 1558 . 8 1 1 A 132 132 GLU CB C 131 28.930 29.070 -0.140 1
1 1560 . 8 1 1 A 132 132 GLU N N 131 118.428 117.958 0.470 1
1 1561 . 8 1 1 A 133 133 LYS H H 132 7.853 7.361 0.492 1
1 1562 . 8 1 1 A 133 133 LYS HA H 132 3.722 3.925 -0.203 1
1 1571 . 8 1 1 A 133 133 LYS C C 132 175.725 177.801 -2.076 1
1 1572 . 8 1 1 A 133 133 LYS CA C 132 57.544 58.726 -1.182 1
1 1573 . 8 1 1 A 133 133 LYS CB C 132 31.770 31.922 -0.152 1
1 1577 . 8 1 1 A 133 133 LYS N N 132 119.473 119.848 -0.375 1
1 1578 . 8 1 1 A 134 134 GLU H H 133 8.151 7.543 0.608 1
1 1579 . 8 1 1 A 134 134 GLU HA H 133 4.161 4.525 -0.364 1
1 1584 . 8 1 1 A 134 134 GLU C C 133 177.453 176.517 0.936 1
1 1585 . 8 1 1 A 134 134 GLU CA C 133 57.222 56.367 0.855 1
1 1586 . 8 1 1 A 134 134 GLU CB C 133 30.091 30.736 -0.645 1
1 1588 . 8 1 1 A 134 134 GLU N N 133 116.525 115.811 0.714 1
1 1589 . 8 1 1 A 135 135 GLY H H 134 7.702 7.771 -0.069 1
1 1590 . 8 1 1 A 135 135 GLY HA2 H 134 3.896 4.088 -0.192 1
1 1591 . 8 1 1 A 135 135 GLY HA3 H 134 3.897 4.091 -0.194 1
1 1592 . 8 1 1 A 135 135 GLY C C 134 174.538 173.423 1.115 1
1 1593 . 8 1 1 A 135 135 GLY CA C 134 45.975 45.907 0.068 1
1 1594 . 8 1 1 A 135 135 GLY N N 134 107.924 107.167 0.757 1
1 1595 . 8 1 1 A 136 136 ARG H H 135 8.045 8.062 -0.017 1
1 1596 . 8 1 1 A 136 136 ARG HA H 135 4.323 4.507 -0.184 1
1 1604 . 8 1 1 A 136 136 ARG C C 135 175.864 175.945 -0.081 1
1 1605 . 8 1 1 A 136 136 ARG CA C 135 56.016 55.730 0.286 1
1 1606 . 8 1 1 A 136 136 ARG CB C 135 30.987 32.275 -1.288 1
1 1609 . 8 1 1 A 136 136 ARG N N 135 119.708 120.813 -1.105 1
1 1 . 9 1 1 A 14 14 PHE CA C 13 58.199 60.528 -2.329 1
1 2 . 9 1 1 A 14 14 PHE CB C 13 39.717 38.747 0.970 1
1 3 . 9 1 1 A 15 15 SER H H 14 8.299 7.895 0.404 1
1 4 . 9 1 1 A 15 15 SER HA H 14 4.359 4.407 -0.048 1
1 7 . 9 1 1 A 15 15 SER CA C 14 58.249 58.032 0.217 1
1 8 . 9 1 1 A 15 15 SER CB C 14 63.936 63.477 0.459 1
1 9 . 9 1 1 A 15 15 SER N N 14 117.379 114.572 2.807 1
1 10 . 9 1 1 A 16 16 SER H H 15 8.255 8.665 -0.410 1
1 11 . 9 1 1 A 16 16 SER HA H 15 3.729 4.846 -1.117 1
1 14 . 9 1 1 A 16 16 SER CA C 15 58.224 58.052 0.172 1
1 15 . 9 1 1 A 16 16 SER CB C 15 63.886 65.312 -1.426 1
1 16 . 9 1 1 A 16 16 SER N N 15 117.694 116.296 1.398 1
1 17 . 9 1 1 A 17 17 ALA H H 16 8.333 8.266 0.067 1
1 18 . 9 1 1 A 17 17 ALA HA H 16 4.252 4.283 -0.031 1
1 22 . 9 1 1 A 17 17 ALA CA C 16 53.377 53.876 -0.499 1
1 23 . 9 1 1 A 17 17 ALA CB C 16 18.896 18.398 0.498 1
1 24 . 9 1 1 A 17 17 ALA N N 16 125.462 124.351 1.111 1
1 25 . 9 1 1 A 18 18 SER H H 17 8.219 8.328 -0.109 1
1 26 . 9 1 1 A 18 18 SER HA H 17 4.332 4.659 -0.327 1
1 29 . 9 1 1 A 18 18 SER CA C 17 59.105 57.352 1.753 1
1 30 . 9 1 1 A 18 18 SER CB C 17 63.592 63.840 -0.248 1
1 31 . 9 1 1 A 18 18 SER N N 17 114.821 112.776 2.045 1
1 32 . 9 1 1 A 19 19 ASP H H 18 8.309 8.429 -0.120 1
1 33 . 9 1 1 A 19 19 ASP HA H 18 4.554 4.983 -0.429 1
1 36 . 9 1 1 A 19 19 ASP C C 18 176.528 176.781 -0.253 1
1 37 . 9 1 1 A 19 19 ASP CA C 18 55.272 54.376 0.896 1
1 38 . 9 1 1 A 19 19 ASP CB C 18 40.883 42.712 -1.829 1
1 39 . 9 1 1 A 19 19 ASP N N 18 123.367 121.068 2.299 1
1 40 . 9 1 1 A 20 20 ALA H H 19 8.133 8.603 -0.470 1
1 41 . 9 1 1 A 20 20 ALA HA H 19 4.170 4.129 0.041 1
1 45 . 9 1 1 A 20 20 ALA C C 19 179.857 178.992 0.865 1
1 46 . 9 1 1 A 20 20 ALA CA C 19 54.341 55.549 -1.208 1
1 47 . 9 1 1 A 20 20 ALA CB C 19 18.660 18.623 0.037 1
1 48 . 9 1 1 A 20 20 ALA N N 19 123.350 123.014 0.336 1
1 49 . 9 1 1 A 21 21 GLU H H 20 8.140 7.952 0.188 1
1 50 . 9 1 1 A 21 21 GLU HA H 20 4.128 4.138 -0.010 1
1 55 . 9 1 1 A 21 21 GLU C C 20 177.675 178.755 -1.080 1
1 56 . 9 1 1 A 21 21 GLU CA C 20 58.520 59.329 -0.809 1
1 57 . 9 1 1 A 21 21 GLU CB C 20 29.765 29.375 0.390 1
1 59 . 9 1 1 A 21 21 GLU N N 20 119.063 119.201 -0.138 1
1 60 . 9 1 1 A 22 22 PHE H H 21 8.009 8.061 -0.052 1
1 61 . 9 1 1 A 22 22 PHE HA H 21 4.123 4.390 -0.267 1
1 68 . 9 1 1 A 22 22 PHE C C 21 176.410 177.185 -0.775 1
1 69 . 9 1 1 A 22 22 PHE CA C 21 62.202 61.247 0.955 1
1 70 . 9 1 1 A 22 22 PHE CB C 21 39.223 39.067 0.156 1
1 75 . 9 1 1 A 22 22 PHE N N 21 121.211 121.097 0.114 1
1 76 . 9 1 1 A 23 23 ASP H H 22 8.261 8.184 0.077 1
1 77 . 9 1 1 A 23 23 ASP HA H 22 4.041 4.296 -0.255 1
1 80 . 9 1 1 A 23 23 ASP C C 22 179.078 178.724 0.354 1
1 81 . 9 1 1 A 23 23 ASP CA C 22 57.048 57.242 -0.194 1
1 82 . 9 1 1 A 23 23 ASP CB C 22 40.154 40.076 0.078 1
1 83 . 9 1 1 A 23 23 ASP N N 22 116.876 118.595 -1.719 1
1 84 . 9 1 1 A 24 24 ALA H H 23 7.651 7.532 0.119 1
1 85 . 9 1 1 A 24 24 ALA HA H 23 3.785 3.811 -0.026 1
1 89 . 9 1 1 A 24 24 ALA C C 23 179.577 179.739 -0.162 1
1 90 . 9 1 1 A 24 24 ALA CA C 23 54.341 55.248 -0.907 1
1 91 . 9 1 1 A 24 24 ALA CB C 23 17.762 17.955 -0.193 1
1 92 . 9 1 1 A 24 24 ALA N N 23 121.873 121.693 0.180 1
1 93 . 9 1 1 A 25 25 VAL H H 24 7.718 7.817 -0.099 1
1 94 . 9 1 1 A 25 25 VAL HA H 24 3.216 3.501 -0.285 1
1 102 . 9 1 1 A 25 25 VAL C C 24 177.805 178.211 -0.406 1
1 103 . 9 1 1 A 25 25 VAL CA C 24 66.789 66.704 0.085 1
1 104 . 9 1 1 A 25 25 VAL CB C 24 31.277 31.243 0.034 1
1 107 . 9 1 1 A 25 25 VAL N N 24 117.890 118.580 -0.690 1
1 108 . 9 1 1 A 26 26 VAL H H 25 7.867 7.667 0.200 1
1 109 . 9 1 1 A 26 26 VAL HA H 25 3.274 3.522 -0.248 1
1 117 . 9 1 1 A 26 26 VAL C C 25 177.788 177.814 -0.026 1
1 118 . 9 1 1 A 26 26 VAL CA C 25 67.282 66.232 1.050 1
1 119 . 9 1 1 A 26 26 VAL CB C 25 31.266 31.334 -0.068 1
1 122 . 9 1 1 A 26 26 VAL N N 25 118.170 119.790 -1.620 1
1 123 . 9 1 1 A 27 27 GLY H H 26 7.544 7.718 -0.174 1
1 124 . 9 1 1 A 27 27 GLY HA2 H 26 3.592 3.459 0.133 1
1 125 . 9 1 1 A 27 27 GLY HA3 H 26 3.721 3.577 0.144 1
1 126 . 9 1 1 A 27 27 GLY C C 26 176.717 176.526 0.191 1
1 127 . 9 1 1 A 27 27 GLY CA C 26 47.085 47.180 -0.095 1
1 128 . 9 1 1 A 27 27 GLY N N 26 105.795 107.357 -1.562 1
1 129 . 9 1 1 A 28 28 TYR H H 27 7.625 7.376 0.249 1
1 130 . 9 1 1 A 28 28 TYR HA H 27 4.546 4.563 -0.017 1
1 137 . 9 1 1 A 28 28 TYR C C 27 178.991 178.126 0.865 1
1 138 . 9 1 1 A 28 28 TYR CA C 27 58.845 59.650 -0.805 1
1 139 . 9 1 1 A 28 28 TYR CB C 27 37.602 37.553 0.049 1
1 144 . 9 1 1 A 28 28 TYR N N 27 119.933 121.727 -1.794 1
1 145 . 9 1 1 A 29 29 LEU H H 28 8.517 8.331 0.186 1
1 146 . 9 1 1 A 29 29 LEU HA H 28 3.728 3.787 -0.059 1
1 156 . 9 1 1 A 29 29 LEU CA C 28 58.281 57.998 0.283 1
1 157 . 9 1 1 A 29 29 LEU CB C 28 41.948 41.363 0.585 1
1 161 . 9 1 1 A 29 29 LEU N N 28 119.669 120.228 -0.559 1
1 162 . 9 1 1 A 30 30 GLU H H 29 8.072 7.995 0.077 1
1 163 . 9 1 1 A 30 30 GLU HA H 29 3.722 3.866 -0.144 1
1 168 . 9 1 1 A 30 30 GLU C C 29 177.731 178.685 -0.954 1
1 169 . 9 1 1 A 30 30 GLU CA C 29 59.763 59.925 -0.162 1
1 170 . 9 1 1 A 30 30 GLU CB C 29 28.844 29.335 -0.491 1
1 172 . 9 1 1 A 30 30 GLU N N 29 117.666 117.822 -0.156 1
1 173 . 9 1 1 A 31 31 ASP H H 30 7.243 8.021 -0.778 1
1 174 . 9 1 1 A 31 31 ASP HA H 30 4.297 4.361 -0.064 1
1 177 . 9 1 1 A 31 31 ASP CA C 30 56.953 57.215 -0.262 1
1 178 . 9 1 1 A 31 31 ASP CB C 30 40.730 42.249 -1.519 1
1 179 . 9 1 1 A 31 31 ASP N N 30 116.720 119.306 -2.586 1
1 180 . 9 1 1 A 32 32 ILE H H 31 7.940 7.406 0.534 1
1 181 . 9 1 1 A 32 32 ILE HA H 31 3.640 3.693 -0.053 1
1 191 . 9 1 1 A 32 32 ILE C C 31 177.980 178.166 -0.186 1
1 192 . 9 1 1 A 32 32 ILE CA C 31 64.692 64.058 0.634 1
1 193 . 9 1 1 A 32 32 ILE CB C 31 38.938 37.229 1.709 1
1 197 . 9 1 1 A 32 32 ILE N N 31 119.728 117.663 2.065 1
1 198 . 9 1 1 A 33 33 ILE H H 32 7.984 7.888 0.096 1
1 199 . 9 1 1 A 33 33 ILE HA H 32 3.598 3.155 0.443 1
1 209 . 9 1 1 A 33 33 ILE C C 32 176.723 176.944 -0.221 1
1 210 . 9 1 1 A 33 33 ILE CA C 32 63.241 64.600 -1.359 1
1 211 . 9 1 1 A 33 33 ILE CB C 32 37.580 37.763 -0.183 1
1 215 . 9 1 1 A 33 33 ILE N N 32 113.919 120.511 -6.592 1
1 216 . 9 1 1 A 34 34 MET H H 33 7.288 7.858 -0.570 1
1 217 . 9 1 1 A 34 34 MET HA H 33 4.496 4.659 -0.163 1
1 225 . 9 1 1 A 34 34 MET C C 33 176.423 175.791 0.632 1
1 226 . 9 1 1 A 34 34 MET CA C 33 54.634 54.241 0.393 1
1 227 . 9 1 1 A 34 34 MET CB C 33 31.934 31.456 0.478 1
1 230 . 9 1 1 A 34 34 MET N N 33 115.130 116.840 -1.710 1
1 231 . 9 1 1 A 35 35 ASP H H 34 7.405 7.637 -0.232 1
1 232 . 9 1 1 A 35 35 ASP HA H 34 4.484 4.590 -0.106 1
1 235 . 9 1 1 A 35 35 ASP C C 34 177.139 176.740 0.399 1
1 236 . 9 1 1 A 35 35 ASP CA C 34 54.625 54.541 0.084 1
1 237 . 9 1 1 A 35 35 ASP CB C 34 43.554 42.582 0.972 1
1 238 . 9 1 1 A 35 35 ASP N N 34 121.814 122.455 -0.641 1
1 239 . 9 1 1 A 36 36 ASP H H 35 8.765 8.803 -0.038 1
1 240 . 9 1 1 A 36 36 ASP HA H 35 4.235 4.316 -0.081 1
1 243 . 9 1 1 A 36 36 ASP C C 35 178.320 178.438 -0.118 1
1 244 . 9 1 1 A 36 36 ASP CA C 35 57.832 58.018 -0.186 1
1 245 . 9 1 1 A 36 36 ASP CB C 35 40.914 40.390 0.524 1
1 246 . 9 1 1 A 36 36 ASP N N 35 125.883 125.294 0.589 1
1 247 . 9 1 1 A 37 37 GLU H H 36 8.905 7.965 0.940 1
1 248 . 9 1 1 A 37 37 GLU HA H 36 3.933 4.038 -0.105 1
1 253 . 9 1 1 A 37 37 GLU C C 36 179.304 179.162 0.142 1
1 254 . 9 1 1 A 37 37 GLU CA C 36 59.828 59.213 0.615 1
1 255 . 9 1 1 A 37 37 GLU CB C 36 29.380 29.272 0.108 1
1 257 . 9 1 1 A 37 37 GLU N N 36 119.077 120.317 -1.240 1
1 258 . 9 1 1 A 38 38 PHE H H 37 7.460 8.265 -0.805 1
1 259 . 9 1 1 A 38 38 PHE HA H 37 3.642 4.055 -0.413 1
1 267 . 9 1 1 A 38 38 PHE C C 37 176.483 178.126 -1.643 1
1 268 . 9 1 1 A 38 38 PHE CA C 37 61.411 61.202 0.209 1
1 269 . 9 1 1 A 38 38 PHE CB C 37 39.355 39.083 0.272 1
1 275 . 9 1 1 A 38 38 PHE N N 37 119.968 120.727 -0.759 1
1 276 . 9 1 1 A 39 39 GLN H H 38 7.968 7.968 0.000 1
1 277 . 9 1 1 A 39 39 GLN HA H 38 3.712 3.863 -0.151 1
1 284 . 9 1 1 A 39 39 GLN CA C 38 59.153 58.693 0.460 1
1 285 . 9 1 1 A 39 39 GLN CB C 38 28.213 28.412 -0.199 1
1 287 . 9 1 1 A 39 39 GLN N N 38 116.433 118.406 -1.973 1
1 289 . 9 1 1 A 40 40 LEU H H 39 7.930 7.466 0.464 1
1 290 . 9 1 1 A 40 40 LEU HA H 39 3.916 4.019 -0.103 1
1 300 . 9 1 1 A 40 40 LEU C C 39 177.731 178.065 -0.334 1
1 301 . 9 1 1 A 40 40 LEU CA C 39 57.915 57.908 0.007 1
1 302 . 9 1 1 A 40 40 LEU CB C 39 41.989 41.457 0.532 1
1 306 . 9 1 1 A 40 40 LEU N N 39 119.505 121.540 -2.035 1
1 307 . 9 1 1 A 41 41 LEU H H 40 7.174 7.706 -0.532 1
1 308 . 9 1 1 A 41 41 LEU HA H 40 3.835 3.947 -0.112 1
1 318 . 9 1 1 A 41 41 LEU C C 40 179.738 178.229 1.509 1
1 319 . 9 1 1 A 41 41 LEU CA C 40 58.266 58.241 0.025 1
1 320 . 9 1 1 A 41 41 LEU CB C 40 42.050 41.516 0.534 1
1 324 . 9 1 1 A 41 41 LEU N N 40 120.971 119.789 1.182 1
1 325 . 9 1 1 A 42 42 GLN H H 41 8.058 7.678 0.380 1
1 326 . 9 1 1 A 42 42 GLN HA H 41 3.556 3.708 -0.152 1
1 333 . 9 1 1 A 42 42 GLN C C 41 177.642 178.467 -0.825 1
1 334 . 9 1 1 A 42 42 GLN CA C 41 59.826 59.239 0.587 1
1 335 . 9 1 1 A 42 42 GLN CB C 41 28.762 27.938 0.824 1
1 337 . 9 1 1 A 42 42 GLN N N 41 117.899 117.693 0.206 1
1 339 . 9 1 1 A 43 43 ARG H H 42 8.179 7.744 0.435 1
1 340 . 9 1 1 A 43 43 ARG HA H 42 3.655 3.878 -0.223 1
1 347 . 9 1 1 A 43 43 ARG C C 42 178.051 178.270 -0.219 1
1 348 . 9 1 1 A 43 43 ARG CA C 42 59.766 58.840 0.926 1
1 349 . 9 1 1 A 43 43 ARG CB C 42 29.941 29.696 0.245 1
1 352 . 9 1 1 A 43 43 ARG N N 42 119.392 119.720 -0.328 1
1 353 . 9 1 1 A 44 44 ASN H H 43 8.525 8.260 0.265 1
1 354 . 9 1 1 A 44 44 ASN HA H 43 4.332 4.400 -0.068 1
1 359 . 9 1 1 A 44 44 ASN C C 43 178.150 177.788 0.362 1
1 360 . 9 1 1 A 44 44 ASN CA C 43 55.841 56.220 -0.379 1
1 361 . 9 1 1 A 44 44 ASN CB C 43 37.632 39.498 -1.866 1
1 362 . 9 1 1 A 44 44 ASN N N 43 116.214 117.478 -1.264 1
1 364 . 9 1 1 A 45 45 PHE H H 44 7.586 7.943 -0.357 1
1 365 . 9 1 1 A 45 45 PHE HA H 44 4.132 4.238 -0.106 1
1 372 . 9 1 1 A 45 45 PHE C C 44 176.691 178.394 -1.703 1
1 373 . 9 1 1 A 45 45 PHE CA C 44 62.333 60.587 1.746 1
1 374 . 9 1 1 A 45 45 PHE CB C 44 39.449 38.401 1.048 1
1 379 . 9 1 1 A 45 45 PHE N N 44 121.501 117.823 3.678 1
1 380 . 9 1 1 A 46 46 MET H H 45 8.190 8.264 -0.074 1
1 381 . 9 1 1 A 46 46 MET HA H 45 4.060 4.238 -0.178 1
1 389 . 9 1 1 A 46 46 MET C C 45 179.754 178.108 1.646 1
1 390 . 9 1 1 A 46 46 MET CA C 45 57.742 57.830 -0.088 1
1 391 . 9 1 1 A 46 46 MET CB C 45 29.912 31.219 -1.307 1
1 394 . 9 1 1 A 46 46 MET N N 45 116.727 117.576 -0.849 1
1 395 . 9 1 1 A 47 47 ASP H H 46 8.579 8.194 0.385 1
1 396 . 9 1 1 A 47 47 ASP HA H 46 4.804 4.659 0.145 1
1 399 . 9 1 1 A 47 47 ASP C C 46 177.854 177.720 0.134 1
1 400 . 9 1 1 A 47 47 ASP CA C 46 57.277 57.246 0.031 1
1 401 . 9 1 1 A 47 47 ASP CB C 46 40.776 41.609 -0.833 1
1 402 . 9 1 1 A 47 47 ASP N N 46 117.798 120.753 -2.955 1
1 403 . 9 1 1 A 48 48 LYS H H 47 7.339 7.777 -0.438 1
1 404 . 9 1 1 A 48 48 LYS HA H 47 3.828 4.325 -0.497 1
1 413 . 9 1 1 A 48 48 LYS C C 47 178.812 178.686 0.126 1
1 414 . 9 1 1 A 48 48 LYS CA C 47 58.953 57.893 1.060 1
1 415 . 9 1 1 A 48 48 LYS CB C 47 32.796 33.568 -0.772 1
1 419 . 9 1 1 A 48 48 LYS N N 47 117.852 117.818 0.034 1
1 420 . 9 1 1 A 49 49 TYR H H 48 6.841 8.662 -1.821 1
1 421 . 9 1 1 A 49 49 TYR HA H 48 4.995 4.212 0.783 1
1 428 . 9 1 1 A 49 49 TYR C C 48 178.138 178.458 -0.320 1
1 429 . 9 1 1 A 49 49 TYR CA C 48 58.620 59.744 -1.124 1
1 430 . 9 1 1 A 49 49 TYR CB C 48 42.939 38.118 4.821 1
1 435 . 9 1 1 A 49 49 TYR N N 48 112.109 119.088 -6.979 1
1 436 . 9 1 1 A 50 50 TYR H H 49 8.491 7.973 0.518 1
1 437 . 9 1 1 A 50 50 TYR HA H 49 4.598 4.287 0.311 1
1 444 . 9 1 1 A 50 50 TYR C C 49 176.015 177.990 -1.975 1
1 445 . 9 1 1 A 50 50 TYR CA C 49 62.442 59.726 2.716 1
1 446 . 9 1 1 A 50 50 TYR CB C 49 36.588 37.136 -0.548 1
1 451 . 9 1 1 A 50 50 TYR N N 49 118.294 119.749 -1.455 1
1 452 . 9 1 1 A 51 51 LEU H H 50 7.512 7.691 -0.179 1
1 453 . 9 1 1 A 51 51 LEU HA H 50 3.878 3.491 0.387 1
1 463 . 9 1 1 A 51 51 LEU C C 50 178.625 178.761 -0.136 1
1 464 . 9 1 1 A 51 51 LEU CA C 50 55.994 57.207 -1.213 1
1 465 . 9 1 1 A 51 51 LEU CB C 50 40.743 41.292 -0.549 1
1 469 . 9 1 1 A 51 51 LEU N N 50 118.478 121.249 -2.771 1
1 470 . 9 1 1 A 52 52 GLU H H 51 8.042 7.948 0.094 1
1 471 . 9 1 1 A 52 52 GLU HA H 51 4.197 3.986 0.211 1
1 476 . 9 1 1 A 52 52 GLU C C 51 177.629 177.465 0.164 1
1 477 . 9 1 1 A 52 52 GLU CA C 51 56.141 59.148 -3.007 1
1 478 . 9 1 1 A 52 52 GLU CB C 51 29.162 29.428 -0.266 1
1 480 . 9 1 1 A 52 52 GLU N N 51 115.067 117.815 -2.748 1
1 481 . 9 1 1 A 53 53 PHE H H 52 7.465 7.937 -0.472 1
1 482 . 9 1 1 A 53 53 PHE HA H 52 4.431 4.591 -0.160 1
1 490 . 9 1 1 A 53 53 PHE C C 52 174.325 174.683 -0.358 1
1 491 . 9 1 1 A 53 53 PHE CA C 52 58.986 56.997 1.989 1
1 492 . 9 1 1 A 53 53 PHE CB C 52 40.183 37.429 2.754 1
1 498 . 9 1 1 A 53 53 PHE N N 52 116.768 118.721 -1.953 1
1 499 . 9 1 1 A 54 54 GLU H H 53 7.484 8.594 -1.110 1
1 500 . 9 1 1 A 54 54 GLU HA H 53 4.583 4.586 -0.003 1
1 505 . 9 1 1 A 54 54 GLU C C 53 175.722 177.563 -1.841 1
1 506 . 9 1 1 A 54 54 GLU CA C 53 54.248 55.785 -1.537 1
1 507 . 9 1 1 A 54 54 GLU CB C 53 34.409 30.526 3.883 1
1 509 . 9 1 1 A 54 54 GLU N N 53 118.844 123.702 -4.858 1
1 510 . 9 1 1 A 55 55 ASP H H 54 9.008 8.814 0.194 1
1 511 . 9 1 1 A 55 55 ASP HA H 54 4.735 4.655 0.080 1
1 514 . 9 1 1 A 55 55 ASP C C 54 175.421 176.667 -1.246 1
1 515 . 9 1 1 A 55 55 ASP CA C 54 52.888 54.308 -1.420 1
1 516 . 9 1 1 A 55 55 ASP CB C 54 38.894 40.083 -1.189 1
1 517 . 9 1 1 A 55 55 ASP N N 54 123.654 120.610 3.044 1
1 518 . 9 1 1 A 56 56 THR H H 55 7.819 7.595 0.224 1
1 519 . 9 1 1 A 56 56 THR HA H 55 4.574 4.216 0.358 1
1 524 . 9 1 1 A 56 56 THR C C 55 174.096 175.139 -1.043 1
1 525 . 9 1 1 A 56 56 THR CA C 55 59.172 61.716 -2.544 1
1 526 . 9 1 1 A 56 56 THR CB C 55 71.889 70.122 1.767 1
1 528 . 9 1 1 A 56 56 THR N N 55 112.015 112.973 -0.958 1
1 529 . 9 1 1 A 57 57 GLU H H 56 8.527 8.751 -0.224 1
1 530 . 9 1 1 A 57 57 GLU HA H 56 4.217 4.233 -0.016 1
1 535 . 9 1 1 A 57 57 GLU C C 56 177.042 176.814 0.228 1
1 536 . 9 1 1 A 57 57 GLU CA C 56 56.869 58.277 -1.408 1
1 537 . 9 1 1 A 57 57 GLU CB C 56 29.731 30.285 -0.554 1
1 539 . 9 1 1 A 57 57 GLU N N 56 117.531 122.010 -4.479 1
1 540 . 9 1 1 A 58 58 GLU H H 57 7.587 7.769 -0.182 1
1 541 . 9 1 1 A 58 58 GLU HA H 57 3.941 4.233 -0.292 1
1 546 . 9 1 1 A 58 58 GLU C C 57 176.849 176.154 0.695 1
1 547 . 9 1 1 A 58 58 GLU CA C 57 56.924 56.615 0.309 1
1 548 . 9 1 1 A 58 58 GLU CB C 57 30.251 30.050 0.201 1
1 550 . 9 1 1 A 58 58 GLU N N 57 119.183 120.869 -1.686 1
1 551 . 9 1 1 A 59 59 ASN H H 58 9.120 8.493 0.627 1
1 552 . 9 1 1 A 59 59 ASN HA H 58 4.922 5.325 -0.403 1
1 557 . 9 1 1 A 59 59 ASN C C 58 174.254 174.304 -0.050 1
1 558 . 9 1 1 A 59 59 ASN CA C 58 51.956 52.192 -0.236 1
1 559 . 9 1 1 A 59 59 ASN CB C 58 37.404 40.802 -3.398 1
1 560 . 9 1 1 A 59 59 ASN N N 58 126.767 123.607 3.160 1
1 562 . 9 1 1 A 60 60 LYS H H 59 5.892 8.486 -2.594 1
1 563 . 9 1 1 A 60 60 LYS HA H 59 3.798 4.898 -1.100 1
1 572 . 9 1 1 A 60 60 LYS C C 59 177.908 176.982 0.926 1
1 573 . 9 1 1 A 60 60 LYS CA C 59 56.623 54.608 2.015 1
1 574 . 9 1 1 A 60 60 LYS CB C 59 32.279 35.848 -3.569 1
1 578 . 9 1 1 A 60 60 LYS N N 59 121.527 120.173 1.354 1
1 579 . 9 1 1 A 61 61 LEU H H 60 8.473 8.953 -0.480 1
1 580 . 9 1 1 A 61 61 LEU HA H 60 3.891 4.217 -0.326 1
1 590 . 9 1 1 A 61 61 LEU C C 60 179.843 178.861 0.982 1
1 591 . 9 1 1 A 61 61 LEU CA C 60 58.301 56.586 1.715 1
1 592 . 9 1 1 A 61 61 LEU CB C 60 41.305 41.758 -0.453 1
1 596 . 9 1 1 A 61 61 LEU N N 60 125.639 123.443 2.196 1
1 597 . 9 1 1 A 62 62 ILE H H 61 7.698 7.876 -0.178 1
1 598 . 9 1 1 A 62 62 ILE HA H 61 3.952 3.881 0.071 1
1 608 . 9 1 1 A 62 62 ILE C C 61 175.392 177.238 -1.846 1
1 609 . 9 1 1 A 62 62 ILE CA C 61 61.743 63.546 -1.803 1
1 610 . 9 1 1 A 62 62 ILE CB C 61 39.108 37.812 1.296 1
1 614 . 9 1 1 A 62 62 ILE N N 61 114.111 119.765 -5.654 1
1 615 . 9 1 1 A 63 63 TYR H H 62 7.273 8.072 -0.799 1
1 616 . 9 1 1 A 63 63 TYR HA H 62 4.343 4.382 -0.039 1
1 623 . 9 1 1 A 63 63 TYR C C 62 178.264 178.427 -0.163 1
1 624 . 9 1 1 A 63 63 TYR CA C 62 57.231 60.923 -3.692 1
1 625 . 9 1 1 A 63 63 TYR CB C 62 36.332 37.289 -0.957 1
1 630 . 9 1 1 A 63 63 TYR N N 62 117.689 121.135 -3.446 1
1 631 . 9 1 1 A 64 64 THR H H 63 7.747 8.202 -0.455 1
1 632 . 9 1 1 A 64 64 THR HA H 63 4.266 4.204 0.062 1
1 637 . 9 1 1 A 64 64 THR CA C 63 69.362 67.542 1.820 1
1 638 . 9 1 1 A 64 64 THR CB C 63 66.962 67.906 -0.944 1
1 640 . 9 1 1 A 64 64 THR N N 63 113.755 116.294 -2.539 1
1 641 . 9 1 1 A 65 65 PRO HA H 64 4.372 4.388 -0.016 1
1 648 . 9 1 1 A 65 65 PRO C C 64 179.913 179.393 0.520 1
1 649 . 9 1 1 A 65 65 PRO CA C 64 66.011 65.927 0.084 1
1 650 . 9 1 1 A 65 65 PRO CB C 64 30.642 30.647 -0.005 1
1 653 . 9 1 1 A 66 66 ILE H H 65 7.377 7.186 0.191 1
1 654 . 9 1 1 A 66 66 ILE HA H 65 3.530 3.860 -0.330 1
1 664 . 9 1 1 A 66 66 ILE C C 65 177.543 178.456 -0.913 1
1 665 . 9 1 1 A 66 66 ILE CA C 65 66.647 64.172 2.475 1
1 666 . 9 1 1 A 66 66 ILE CB C 65 38.029 37.514 0.515 1
1 670 . 9 1 1 A 66 66 ILE N N 65 118.353 116.839 1.514 1
1 671 . 9 1 1 A 67 67 PHE H H 66 8.480 8.392 0.088 1
1 672 . 9 1 1 A 67 67 PHE HA H 66 4.115 4.395 -0.280 1
1 680 . 9 1 1 A 67 67 PHE C C 66 177.293 177.881 -0.588 1
1 681 . 9 1 1 A 67 67 PHE CA C 66 59.570 62.235 -2.665 1
1 682 . 9 1 1 A 67 67 PHE CB C 66 38.865 39.659 -0.794 1
1 688 . 9 1 1 A 67 67 PHE N N 66 122.420 120.472 1.948 1
1 689 . 9 1 1 A 68 68 ASN H H 67 8.595 8.345 0.250 1
1 690 . 9 1 1 A 68 68 ASN HA H 67 4.211 4.436 -0.225 1
1 695 . 9 1 1 A 68 68 ASN C C 67 178.697 178.030 0.667 1
1 696 . 9 1 1 A 68 68 ASN CA C 67 56.056 56.268 -0.212 1
1 697 . 9 1 1 A 68 68 ASN CB C 67 37.704 38.149 -0.445 1
1 698 . 9 1 1 A 68 68 ASN N N 67 115.573 117.572 -1.999 1
1 700 . 9 1 1 A 69 69 GLU H H 68 8.414 7.993 0.421 1
1 701 . 9 1 1 A 69 69 GLU HA H 68 4.102 4.202 -0.100 1
1 706 . 9 1 1 A 69 69 GLU C C 68 177.880 178.874 -0.994 1
1 707 . 9 1 1 A 69 69 GLU CA C 68 59.399 59.352 0.047 1
1 708 . 9 1 1 A 69 69 GLU CB C 68 29.855 29.369 0.486 1
1 710 . 9 1 1 A 69 69 GLU N N 68 123.510 119.997 3.513 1
1 711 . 9 1 1 A 70 70 TYR H H 69 8.659 8.091 0.568 1
1 712 . 9 1 1 A 70 70 TYR HA H 69 3.362 4.143 -0.781 1
1 719 . 9 1 1 A 70 70 TYR C C 69 178.143 177.053 1.090 1
1 720 . 9 1 1 A 70 70 TYR CA C 69 60.686 61.111 -0.425 1
1 721 . 9 1 1 A 70 70 TYR CB C 69 38.560 38.955 -0.395 1
1 726 . 9 1 1 A 70 70 TYR N N 69 122.130 121.021 1.109 1
1 727 . 9 1 1 A 71 71 ILE H H 70 8.031 7.848 0.183 1
1 728 . 9 1 1 A 71 71 ILE HA H 70 3.265 3.744 -0.479 1
1 738 . 9 1 1 A 71 71 ILE C C 70 178.056 177.708 0.348 1
1 739 . 9 1 1 A 71 71 ILE CA C 70 63.756 64.022 -0.266 1
1 740 . 9 1 1 A 71 71 ILE CB C 70 37.321 36.734 0.587 1
1 744 . 9 1 1 A 71 71 ILE N N 70 118.906 120.166 -1.260 1
1 745 . 9 1 1 A 72 72 SER H H 71 7.803 7.781 0.022 1
1 746 . 9 1 1 A 72 72 SER HA H 71 4.029 4.401 -0.372 1
1 749 . 9 1 1 A 72 72 SER CA C 71 61.380 60.945 0.435 1
1 750 . 9 1 1 A 72 72 SER CB C 71 63.288 63.553 -0.265 1
1 751 . 9 1 1 A 72 72 SER N N 71 113.735 118.694 -4.959 1
1 752 . 9 1 1 A 73 73 LEU H H 72 7.952 8.062 -0.110 1
1 753 . 9 1 1 A 73 73 LEU HA H 72 4.418 4.154 0.264 1
1 763 . 9 1 1 A 73 73 LEU C C 72 177.767 178.314 -0.547 1
1 764 . 9 1 1 A 73 73 LEU CA C 72 56.543 57.457 -0.914 1
1 765 . 9 1 1 A 73 73 LEU CB C 72 44.517 41.886 2.631 1
1 769 . 9 1 1 A 73 73 LEU N N 72 119.411 122.605 -3.194 1
1 770 . 9 1 1 A 74 74 VAL H H 73 8.021 7.627 0.394 1
1 771 . 9 1 1 A 74 74 VAL HA H 73 3.532 3.313 0.219 1
1 779 . 9 1 1 A 74 74 VAL C C 73 177.126 177.975 -0.849 1
1 780 . 9 1 1 A 74 74 VAL CA C 73 66.250 66.309 -0.059 1
1 781 . 9 1 1 A 74 74 VAL CB C 73 31.212 31.102 0.110 1
1 784 . 9 1 1 A 74 74 VAL N N 73 118.747 119.227 -0.480 1
1 785 . 9 1 1 A 75 75 GLU H H 74 7.232 7.931 -0.699 1
1 786 . 9 1 1 A 75 75 GLU HA H 74 3.013 4.210 -1.197 1
1 791 . 9 1 1 A 75 75 GLU C C 74 178.804 179.121 -0.317 1
1 792 . 9 1 1 A 75 75 GLU CA C 74 60.536 60.087 0.449 1
1 793 . 9 1 1 A 75 75 GLU CB C 74 27.009 29.203 -2.194 1
1 795 . 9 1 1 A 75 75 GLU N N 74 118.660 119.820 -1.160 1
1 796 . 9 1 1 A 76 76 LYS H H 75 7.051 7.377 -0.326 1
1 797 . 9 1 1 A 76 76 LYS HA H 75 3.765 4.036 -0.271 1
1 806 . 9 1 1 A 76 76 LYS C C 75 177.765 178.367 -0.602 1
1 807 . 9 1 1 A 76 76 LYS CA C 75 58.357 58.835 -0.478 1
1 808 . 9 1 1 A 76 76 LYS CB C 75 31.939 31.988 -0.049 1
1 812 . 9 1 1 A 76 76 LYS N N 75 116.112 119.869 -3.757 1
1 813 . 9 1 1 A 77 77 TYR H H 76 7.067 7.614 -0.547 1
1 814 . 9 1 1 A 77 77 TYR HA H 76 4.036 4.201 -0.165 1
1 821 . 9 1 1 A 77 77 TYR C C 76 177.752 177.050 0.702 1
1 822 . 9 1 1 A 77 77 TYR CA C 76 61.820 61.243 0.577 1
1 823 . 9 1 1 A 77 77 TYR CB C 76 38.480 38.678 -0.198 1
1 828 . 9 1 1 A 77 77 TYR N N 76 118.434 120.574 -2.140 1
1 829 . 9 1 1 A 78 78 ILE H H 77 7.554 8.350 -0.796 1
1 830 . 9 1 1 A 78 78 ILE HA H 77 3.159 3.579 -0.420 1
1 840 . 9 1 1 A 78 78 ILE C C 77 177.341 177.926 -0.585 1
1 841 . 9 1 1 A 78 78 ILE CA C 77 65.177 65.331 -0.154 1
1 842 . 9 1 1 A 78 78 ILE CB C 77 37.339 38.024 -0.685 1
1 846 . 9 1 1 A 78 78 ILE N N 77 117.672 121.608 -3.936 1
1 847 . 9 1 1 A 79 79 GLU H H 78 8.296 7.990 0.306 1
1 848 . 9 1 1 A 79 79 GLU HA H 78 3.557 3.853 -0.296 1
1 853 . 9 1 1 A 79 79 GLU C C 78 177.742 178.907 -1.165 1
1 854 . 9 1 1 A 79 79 GLU CA C 78 60.847 59.998 0.849 1
1 855 . 9 1 1 A 79 79 GLU CB C 78 29.594 29.108 0.486 1
1 857 . 9 1 1 A 79 79 GLU N N 78 118.701 121.049 -2.348 1
1 858 . 9 1 1 A 80 80 GLU H H 79 8.330 8.096 0.234 1
1 859 . 9 1 1 A 80 80 GLU HA H 79 3.774 4.026 -0.252 1
1 864 . 9 1 1 A 80 80 GLU C C 79 179.926 179.100 0.826 1
1 865 . 9 1 1 A 80 80 GLU CA C 79 59.581 59.017 0.564 1
1 866 . 9 1 1 A 80 80 GLU CB C 79 29.062 29.437 -0.375 1
1 868 . 9 1 1 A 80 80 GLU N N 79 116.767 118.538 -1.771 1
1 869 . 9 1 1 A 81 81 GLN H H 80 7.634 7.786 -0.152 1
1 870 . 9 1 1 A 81 81 GLN HA H 80 3.605 3.834 -0.229 1
1 877 . 9 1 1 A 81 81 GLN C C 80 179.681 178.652 1.029 1
1 878 . 9 1 1 A 81 81 GLN CA C 80 57.765 58.525 -0.760 1
1 879 . 9 1 1 A 81 81 GLN CB C 80 28.079 27.849 0.230 1
1 881 . 9 1 1 A 81 81 GLN N N 80 116.325 118.692 -2.367 1
1 883 . 9 1 1 A 82 82 LEU H H 81 8.156 7.496 0.660 1
1 884 . 9 1 1 A 82 82 LEU HA H 81 3.536 3.782 -0.246 1
1 894 . 9 1 1 A 82 82 LEU C C 81 178.945 179.571 -0.626 1
1 895 . 9 1 1 A 82 82 LEU CA C 81 57.761 56.851 0.910 1
1 896 . 9 1 1 A 82 82 LEU CB C 81 40.961 40.827 0.134 1
1 900 . 9 1 1 A 82 82 LEU N N 81 121.546 119.932 1.614 1
1 901 . 9 1 1 A 83 83 LEU H H 82 8.326 8.042 0.284 1
1 902 . 9 1 1 A 83 83 LEU HA H 82 4.198 4.218 -0.020 1
1 912 . 9 1 1 A 83 83 LEU C C 82 178.631 179.234 -0.603 1
1 913 . 9 1 1 A 83 83 LEU CA C 82 57.016 57.098 -0.082 1
1 914 . 9 1 1 A 83 83 LEU CB C 82 42.182 40.687 1.495 1
1 918 . 9 1 1 A 83 83 LEU N N 82 120.426 119.741 0.685 1
1 919 . 9 1 1 A 84 84 GLN H H 83 6.992 7.755 -0.763 1
1 920 . 9 1 1 A 84 84 GLN HA H 83 3.877 4.019 -0.142 1
1 927 . 9 1 1 A 84 84 GLN C C 83 177.008 176.980 0.028 1
1 928 . 9 1 1 A 84 84 GLN CA C 83 57.543 58.820 -1.277 1
1 929 . 9 1 1 A 84 84 GLN CB C 83 28.688 28.597 0.091 1
1 931 . 9 1 1 A 84 84 GLN N N 83 114.001 117.341 -3.340 1
1 933 . 9 1 1 A 85 85 ARG H H 84 7.072 7.389 -0.317 1
1 934 . 9 1 1 A 85 85 ARG HA H 84 4.047 4.380 -0.333 1
1 942 . 9 1 1 A 85 85 ARG C C 84 175.999 175.690 0.309 1
1 943 . 9 1 1 A 85 85 ARG CA C 84 56.764 55.996 0.768 1
1 944 . 9 1 1 A 85 85 ARG CB C 84 32.044 32.526 -0.482 1
1 947 . 9 1 1 A 85 85 ARG N N 84 115.827 116.409 -0.582 1
1 949 . 9 1 1 A 86 86 ILE H H 85 8.238 7.803 0.435 1
1 950 . 9 1 1 A 86 86 ILE HA H 85 4.389 4.553 -0.164 1
1 960 . 9 1 1 A 86 86 ILE CA C 85 58.007 57.851 0.156 1
1 961 . 9 1 1 A 86 86 ILE CB C 85 39.604 38.599 1.005 1
1 965 . 9 1 1 A 86 86 ILE N N 85 119.285 120.182 -0.897 1
1 966 . 9 1 1 A 87 87 PRO HA H 86 4.392 4.482 -0.090 1
1 973 . 9 1 1 A 87 87 PRO C C 86 177.622 176.562 1.060 1
1 974 . 9 1 1 A 87 87 PRO CA C 86 64.665 64.310 0.355 1
1 975 . 9 1 1 A 87 87 PRO CB C 86 32.020 31.726 0.294 1
1 978 . 9 1 1 A 88 88 GLU H H 87 8.312 8.215 0.097 1
1 979 . 9 1 1 A 88 88 GLU HA H 87 4.208 4.560 -0.352 1
1 984 . 9 1 1 A 88 88 GLU C C 87 175.554 175.759 -0.205 1
1 985 . 9 1 1 A 88 88 GLU CA C 87 56.045 56.262 -0.217 1
1 986 . 9 1 1 A 88 88 GLU CB C 87 28.654 30.368 -1.714 1
1 988 . 9 1 1 A 88 88 GLU N N 87 114.256 116.689 -2.433 1
1 989 . 9 1 1 A 89 89 PHE H H 88 7.946 7.813 0.133 1
1 990 . 9 1 1 A 89 89 PHE HA H 88 3.993 4.614 -0.621 1
1 998 . 9 1 1 A 89 89 PHE C C 88 173.460 174.985 -1.525 1
1 999 . 9 1 1 A 89 89 PHE CA C 88 60.119 58.921 1.198 1
1 1000 . 9 1 1 A 89 89 PHE CB C 88 39.994 40.034 -0.040 1
1 1006 . 9 1 1 A 89 89 PHE N N 88 121.550 123.120 -1.570 1
1 1007 . 9 1 1 A 90 90 ASN H H 89 7.266 7.922 -0.656 1
1 1008 . 9 1 1 A 90 90 ASN HA H 89 4.454 5.084 -0.630 1
1 1013 . 9 1 1 A 90 90 ASN C C 89 173.921 175.100 -1.179 1
1 1014 . 9 1 1 A 90 90 ASN CA C 89 51.839 52.044 -0.205 1
1 1015 . 9 1 1 A 90 90 ASN CB C 89 40.674 40.273 0.401 1
1 1016 . 9 1 1 A 90 90 ASN N N 89 125.344 124.799 0.545 1
1 1018 . 9 1 1 A 91 91 MET H H 90 8.968 8.964 0.004 1
1 1019 . 9 1 1 A 91 91 MET HA H 90 4.049 4.447 -0.398 1
1 1027 . 9 1 1 A 91 91 MET C C 90 177.475 178.401 -0.926 1
1 1028 . 9 1 1 A 91 91 MET CA C 90 57.758 58.736 -0.978 1
1 1029 . 9 1 1 A 91 91 MET CB C 90 32.250 31.631 0.619 1
1 1032 . 9 1 1 A 91 91 MET N N 90 127.052 124.510 2.542 1
1 1033 . 9 1 1 A 92 92 ALA H H 91 8.292 8.137 0.155 1
1 1034 . 9 1 1 A 92 92 ALA HA H 91 4.059 4.116 -0.057 1
1 1038 . 9 1 1 A 92 92 ALA C C 91 180.412 179.724 0.688 1
1 1039 . 9 1 1 A 92 92 ALA CA C 91 55.368 55.050 0.318 1
1 1040 . 9 1 1 A 92 92 ALA CB C 91 17.527 18.418 -0.891 1
1 1041 . 9 1 1 A 92 92 ALA N N 91 123.752 121.962 1.790 1
1 1042 . 9 1 1 A 93 93 ALA H H 92 7.931 7.830 0.101 1
1 1043 . 9 1 1 A 93 93 ALA HA H 92 4.054 4.088 -0.034 1
1 1047 . 9 1 1 A 93 93 ALA C C 92 180.482 179.874 0.608 1
1 1048 . 9 1 1 A 93 93 ALA CA C 92 54.614 54.985 -0.371 1
1 1049 . 9 1 1 A 93 93 ALA CB C 92 18.098 18.351 -0.253 1
1 1050 . 9 1 1 A 93 93 ALA N N 92 121.158 119.873 1.285 1
1 1051 . 9 1 1 A 94 94 PHE H H 93 8.110 7.887 0.223 1
1 1052 . 9 1 1 A 94 94 PHE HA H 93 4.304 4.113 0.191 1
1 1060 . 9 1 1 A 94 94 PHE C C 93 177.350 177.249 0.101 1
1 1061 . 9 1 1 A 94 94 PHE CA C 93 61.641 61.408 0.233 1
1 1062 . 9 1 1 A 94 94 PHE CB C 93 40.014 38.931 1.083 1
1 1068 . 9 1 1 A 94 94 PHE N N 93 119.807 120.064 -0.257 1
1 1069 . 9 1 1 A 95 95 THR H H 94 8.726 8.331 0.395 1
1 1070 . 9 1 1 A 95 95 THR HA H 94 3.569 3.974 -0.405 1
1 1075 . 9 1 1 A 95 95 THR C C 94 176.932 176.993 -0.061 1
1 1076 . 9 1 1 A 95 95 THR CA C 94 66.833 65.583 1.250 1
1 1077 . 9 1 1 A 95 95 THR CB C 94 68.445 68.238 0.207 1
1 1079 . 9 1 1 A 95 95 THR N N 94 113.074 112.129 0.945 1
1 1080 . 9 1 1 A 96 96 THR H H 95 7.657 7.780 -0.123 1
1 1081 . 9 1 1 A 96 96 THR HA H 95 3.945 4.056 -0.111 1
1 1086 . 9 1 1 A 96 96 THR C C 95 176.386 176.462 -0.076 1
1 1087 . 9 1 1 A 96 96 THR CA C 95 66.550 66.162 0.388 1
1 1088 . 9 1 1 A 96 96 THR CB C 95 68.583 68.812 -0.229 1
1 1090 . 9 1 1 A 96 96 THR N N 95 117.927 116.431 1.496 1
1 1091 . 9 1 1 A 97 97 THR H H 96 7.699 7.773 -0.074 1
1 1092 . 9 1 1 A 97 97 THR HA H 96 3.905 4.052 -0.147 1
1 1097 . 9 1 1 A 97 97 THR C C 96 176.572 176.539 0.033 1
1 1098 . 9 1 1 A 97 97 THR CA C 96 65.979 66.655 -0.676 1
1 1099 . 9 1 1 A 97 97 THR CB C 96 68.553 68.266 0.287 1
1 1101 . 9 1 1 A 97 97 THR N N 96 118.518 116.492 2.026 1
1 1102 . 9 1 1 A 98 98 LEU H H 97 8.304 8.145 0.159 1
1 1103 . 9 1 1 A 98 98 LEU HA H 97 3.725 3.836 -0.111 1
1 1113 . 9 1 1 A 98 98 LEU C C 97 178.490 178.633 -0.143 1
1 1114 . 9 1 1 A 98 98 LEU CA C 97 58.517 58.078 0.439 1
1 1115 . 9 1 1 A 98 98 LEU CB C 97 41.697 41.109 0.588 1
1 1119 . 9 1 1 A 98 98 LEU N N 97 122.882 122.208 0.674 1
1 1120 . 9 1 1 A 99 99 GLN H H 98 7.639 7.927 -0.288 1
1 1121 . 9 1 1 A 99 99 GLN HA H 98 3.927 4.088 -0.161 1
1 1128 . 9 1 1 A 99 99 GLN C C 98 178.068 178.730 -0.662 1
1 1129 . 9 1 1 A 99 99 GLN CA C 98 58.735 59.233 -0.498 1
1 1130 . 9 1 1 A 99 99 GLN CB C 98 27.986 28.299 -0.313 1
1 1132 . 9 1 1 A 99 99 GLN N N 98 114.302 118.329 -4.027 1
1 1134 . 9 1 1 A 100 100 HIS H H 99 7.575 7.810 -0.235 1
1 1135 . 9 1 1 A 100 100 HIS HA H 99 4.524 4.426 0.098 1
1 1139 . 9 1 1 A 100 100 HIS C C 99 174.789 178.125 -3.336 1
1 1140 . 9 1 1 A 100 100 HIS CA C 99 56.154 60.042 -3.888 1
1 1141 . 9 1 1 A 100 100 HIS CB C 99 28.946 30.660 -1.714 1
1 1143 . 9 1 1 A 100 100 HIS N N 99 114.778 119.427 -4.649 1
1 1144 . 9 1 1 A 101 101 HIS H H 100 7.773 8.164 -0.391 1
1 1145 . 9 1 1 A 101 101 HIS HA H 100 4.704 4.390 0.314 1
1 1149 . 9 1 1 A 101 101 HIS C C 100 174.818 177.260 -2.442 1
1 1150 . 9 1 1 A 101 101 HIS CA C 100 54.830 58.862 -4.032 1
1 1151 . 9 1 1 A 101 101 HIS CB C 100 29.749 28.748 1.001 1
1 1153 . 9 1 1 A 101 101 HIS N N 100 117.397 117.435 -0.038 1
1 1154 . 9 1 1 A 102 102 LYS H H 101 7.324 8.183 -0.859 1
1 1155 . 9 1 1 A 102 102 LYS HA H 101 3.611 4.152 -0.541 1
1 1164 . 9 1 1 A 102 102 LYS C C 101 176.823 177.997 -1.174 1
1 1165 . 9 1 1 A 102 102 LYS CA C 101 59.915 58.886 1.029 1
1 1166 . 9 1 1 A 102 102 LYS CB C 101 32.825 32.229 0.596 1
1 1170 . 9 1 1 A 102 102 LYS N N 101 120.533 122.277 -1.744 1
1 1171 . 9 1 1 A 103 103 ASP H H 102 8.361 7.671 0.690 1
1 1172 . 9 1 1 A 103 103 ASP HA H 102 4.421 4.430 -0.009 1
1 1175 . 9 1 1 A 103 103 ASP C C 102 176.793 177.415 -0.622 1
1 1176 . 9 1 1 A 103 103 ASP CA C 102 55.500 56.373 -0.873 1
1 1177 . 9 1 1 A 103 103 ASP CB C 102 40.178 40.729 -0.551 1
1 1178 . 9 1 1 A 103 103 ASP N N 102 114.814 119.430 -4.616 1
1 1179 . 9 1 1 A 104 104 GLU H H 103 7.858 7.564 0.294 1
1 1180 . 9 1 1 A 104 104 GLU HA H 103 4.339 4.453 -0.114 1
1 1183 . 9 1 1 A 104 104 GLU C C 103 175.777 176.889 -1.112 1
1 1184 . 9 1 1 A 104 104 GLU CA C 103 56.356 57.965 -1.609 1
1 1185 . 9 1 1 A 104 104 GLU CB C 103 31.293 30.935 0.358 1
1 1186 . 9 1 1 A 104 104 GLU N N 103 116.826 116.864 -0.038 1
1 1187 . 9 1 1 A 105 105 VAL H H 104 7.201 7.826 -0.625 1
1 1188 . 9 1 1 A 105 105 VAL HA H 104 4.296 4.124 0.172 1
1 1196 . 9 1 1 A 105 105 VAL C C 104 174.482 175.652 -1.170 1
1 1197 . 9 1 1 A 105 105 VAL CA C 104 60.370 62.625 -2.255 1
1 1198 . 9 1 1 A 105 105 VAL CB C 104 34.341 32.784 1.557 1
1 1201 . 9 1 1 A 105 105 VAL N N 104 116.422 119.923 -3.501 1
1 1202 . 9 1 1 A 106 106 ALA H H 105 8.487 8.449 0.038 1
1 1203 . 9 1 1 A 106 106 ALA HA H 105 4.172 4.437 -0.265 1
1 1207 . 9 1 1 A 106 106 ALA C C 105 179.030 178.903 0.127 1
1 1208 . 9 1 1 A 106 106 ALA CA C 105 52.966 52.600 0.366 1
1 1209 . 9 1 1 A 106 106 ALA CB C 105 19.371 19.497 -0.126 1
1 1210 . 9 1 1 A 106 106 ALA N N 105 128.313 128.725 -0.412 1
1 1211 . 9 1 1 A 107 107 GLY H H 106 8.738 8.797 -0.059 1
1 1212 . 9 1 1 A 107 107 GLY HA2 H 106 3.773 3.871 -0.098 1
1 1213 . 9 1 1 A 107 107 GLY HA3 H 106 3.998 3.936 0.062 1
1 1214 . 9 1 1 A 107 107 GLY C C 106 174.958 175.545 -0.587 1
1 1215 . 9 1 1 A 107 107 GLY CA C 106 47.449 47.149 0.300 1
1 1216 . 9 1 1 A 107 107 GLY N N 106 110.612 110.969 -0.357 1
1 1217 . 9 1 1 A 108 108 ASP H H 107 8.535 8.337 0.198 1
1 1218 . 9 1 1 A 108 108 ASP HA H 107 4.333 4.355 -0.022 1
1 1221 . 9 1 1 A 108 108 ASP C C 107 179.133 179.070 0.063 1
1 1222 . 9 1 1 A 108 108 ASP CA C 107 56.721 57.079 -0.358 1
1 1223 . 9 1 1 A 108 108 ASP CB C 107 39.336 41.144 -1.808 1
1 1224 . 9 1 1 A 108 108 ASP N N 107 117.474 121.421 -3.947 1
1 1225 . 9 1 1 A 109 109 ILE H H 108 7.459 7.929 -0.470 1
1 1226 . 9 1 1 A 109 109 ILE HA H 108 3.688 3.703 -0.015 1
1 1236 . 9 1 1 A 109 109 ILE C C 108 176.735 178.196 -1.461 1
1 1237 . 9 1 1 A 109 109 ILE CA C 108 63.474 65.592 -2.118 1
1 1238 . 9 1 1 A 109 109 ILE CB C 108 37.340 37.821 -0.481 1
1 1242 . 9 1 1 A 109 109 ILE N N 108 119.609 119.580 0.029 1
1 1243 . 9 1 1 A 110 110 PHE H H 109 7.920 8.341 -0.421 1
1 1244 . 9 1 1 A 110 110 PHE HA H 109 3.759 4.092 -0.333 1
1 1252 . 9 1 1 A 110 110 PHE C C 109 177.132 177.386 -0.254 1
1 1253 . 9 1 1 A 110 110 PHE CA C 109 62.766 61.240 1.526 1
1 1254 . 9 1 1 A 110 110 PHE CB C 109 39.752 39.300 0.452 1
1 1260 . 9 1 1 A 110 110 PHE N N 109 120.906 120.371 0.535 1
1 1261 . 9 1 1 A 111 111 ASP H H 110 8.639 8.230 0.409 1
1 1262 . 9 1 1 A 111 111 ASP HA H 110 4.216 4.228 -0.012 1
1 1265 . 9 1 1 A 111 111 ASP C C 110 178.900 178.415 0.485 1
1 1266 . 9 1 1 A 111 111 ASP CA C 110 57.105 57.313 -0.208 1
1 1267 . 9 1 1 A 111 111 ASP CB C 110 39.697 42.025 -2.328 1
1 1268 . 9 1 1 A 111 111 ASP N N 110 117.124 118.776 -1.652 1
1 1269 . 9 1 1 A 112 112 MET H H 111 7.331 7.578 -0.247 1
1 1270 . 9 1 1 A 112 112 MET HA H 111 4.081 4.174 -0.093 1
1 1278 . 9 1 1 A 112 112 MET C C 111 179.052 178.193 0.859 1
1 1279 . 9 1 1 A 112 112 MET CA C 111 58.202 58.119 0.083 1
1 1280 . 9 1 1 A 112 112 MET CB C 111 31.827 32.470 -0.643 1
1 1283 . 9 1 1 A 112 112 MET N N 111 118.061 119.449 -1.388 1
1 1284 . 9 1 1 A 113 113 LEU H H 112 8.001 8.105 -0.104 1
1 1285 . 9 1 1 A 113 113 LEU HA H 112 3.723 3.668 0.055 1
1 1295 . 9 1 1 A 113 113 LEU C C 112 179.747 178.683 1.064 1
1 1296 . 9 1 1 A 113 113 LEU CA C 112 57.371 57.498 -0.127 1
1 1297 . 9 1 1 A 113 113 LEU CB C 112 40.671 41.142 -0.471 1
1 1301 . 9 1 1 A 113 113 LEU N N 112 120.426 119.732 0.694 1
1 1302 . 9 1 1 A 114 114 LEU H H 113 7.744 7.485 0.259 1
1 1303 . 9 1 1 A 114 114 LEU HA H 113 4.007 3.586 0.421 1
1 1313 . 9 1 1 A 114 114 LEU C C 113 179.358 178.877 0.481 1
1 1314 . 9 1 1 A 114 114 LEU CA C 113 57.202 57.420 -0.218 1
1 1315 . 9 1 1 A 114 114 LEU CB C 113 41.727 41.124 0.603 1
1 1319 . 9 1 1 A 114 114 LEU N N 113 119.584 118.562 1.022 1
1 1320 . 9 1 1 A 115 115 THR H H 114 7.353 7.691 -0.338 1
1 1321 . 9 1 1 A 115 115 THR HA H 114 4.071 4.038 0.033 1
1 1327 . 9 1 1 A 115 115 THR C C 114 173.591 176.702 -3.111 1
1 1328 . 9 1 1 A 115 115 THR CA C 114 65.332 64.733 0.599 1
1 1329 . 9 1 1 A 115 115 THR CB C 114 70.319 68.444 1.875 1
1 1331 . 9 1 1 A 115 115 THR N N 114 107.535 111.052 -3.517 1
1 1332 . 9 1 1 A 116 116 PHE H H 115 6.979 7.691 -0.712 1
1 1333 . 9 1 1 A 116 116 PHE HA H 115 5.022 4.267 0.755 1
1 1341 . 9 1 1 A 116 116 PHE C C 115 176.488 176.576 -0.088 1
1 1342 . 9 1 1 A 116 116 PHE CA C 115 55.911 60.901 -4.990 1
1 1343 . 9 1 1 A 116 116 PHE CB C 115 38.521 39.255 -0.734 1
1 1349 . 9 1 1 A 116 116 PHE N N 115 112.366 119.925 -7.559 1
1 1350 . 9 1 1 A 117 117 THR H H 116 7.564 7.595 -0.031 1
1 1351 . 9 1 1 A 117 117 THR HA H 116 4.626 4.810 -0.184 1
1 1356 . 9 1 1 A 117 117 THR C C 116 174.085 174.402 -0.317 1
1 1357 . 9 1 1 A 117 117 THR CA C 116 61.636 61.837 -0.201 1
1 1358 . 9 1 1 A 117 117 THR CB C 116 70.915 70.849 0.066 1
1 1360 . 9 1 1 A 117 117 THR N N 116 105.498 105.487 0.011 1
1 1361 . 9 1 1 A 118 118 ASP H H 117 8.270 7.867 0.403 1
1 1362 . 9 1 1 A 118 118 ASP HA H 117 4.955 5.006 -0.051 1
1 1365 . 9 1 1 A 118 118 ASP C C 117 176.328 176.098 0.230 1
1 1366 . 9 1 1 A 118 118 ASP CA C 117 53.417 53.039 0.378 1
1 1367 . 9 1 1 A 118 118 ASP CB C 117 43.388 38.591 4.797 1
1 1368 . 9 1 1 A 118 118 ASP N N 117 124.409 123.751 0.658 1
1 1369 . 9 1 1 A 119 119 PHE H H 118 8.973 8.783 0.190 1
1 1370 . 9 1 1 A 119 119 PHE HA H 118 3.506 4.262 -0.756 1
1 1378 . 9 1 1 A 119 119 PHE CA C 118 61.490 61.150 0.340 1
1 1379 . 9 1 1 A 119 119 PHE CB C 118 39.246 39.548 -0.302 1
1 1385 . 9 1 1 A 119 119 PHE N N 118 126.688 124.632 2.056 1
1 1386 . 9 1 1 A 120 120 LEU H H 119 8.099 8.317 -0.218 1
1 1387 . 9 1 1 A 120 120 LEU HA H 119 3.842 3.976 -0.134 1
1 1397 . 9 1 1 A 120 120 LEU C C 119 179.601 179.377 0.224 1
1 1398 . 9 1 1 A 120 120 LEU CA C 119 58.174 57.864 0.310 1
1 1399 . 9 1 1 A 120 120 LEU CB C 119 40.315 41.503 -1.188 1
1 1403 . 9 1 1 A 120 120 LEU N N 119 117.930 119.872 -1.942 1
1 1404 . 9 1 1 A 121 121 ALA H H 120 7.729 7.707 0.022 1
1 1405 . 9 1 1 A 121 121 ALA HA H 120 3.996 4.138 -0.142 1
1 1409 . 9 1 1 A 121 121 ALA C C 120 180.995 179.595 1.400 1
1 1410 . 9 1 1 A 121 121 ALA CA C 120 54.832 54.644 0.188 1
1 1411 . 9 1 1 A 121 121 ALA CB C 120 17.706 18.291 -0.585 1
1 1412 . 9 1 1 A 121 121 ALA N N 120 123.195 120.441 2.754 1
1 1413 . 9 1 1 A 122 122 PHE H H 121 7.943 7.931 0.012 1
1 1414 . 9 1 1 A 122 122 PHE HA H 121 3.887 3.874 0.013 1
1 1419 . 9 1 1 A 122 122 PHE C C 121 175.410 176.825 -1.415 1
1 1420 . 9 1 1 A 122 122 PHE CA C 121 61.075 60.745 0.330 1
1 1421 . 9 1 1 A 122 122 PHE CB C 121 38.115 38.802 -0.687 1
1 1424 . 9 1 1 A 122 122 PHE N N 121 121.798 120.190 1.608 1
1 1425 . 9 1 1 A 123 123 LYS H H 122 8.468 7.941 0.527 1
1 1426 . 9 1 1 A 123 123 LYS HA H 122 3.077 3.859 -0.782 1
1 1435 . 9 1 1 A 123 123 LYS C C 122 178.453 178.832 -0.379 1
1 1436 . 9 1 1 A 123 123 LYS CA C 122 59.855 60.022 -0.167 1
1 1437 . 9 1 1 A 123 123 LYS CB C 122 32.374 32.451 -0.077 1
1 1441 . 9 1 1 A 123 123 LYS N N 122 120.614 118.448 2.166 1
1 1442 . 9 1 1 A 124 124 GLU H H 123 8.100 7.815 0.285 1
1 1443 . 9 1 1 A 124 124 GLU HA H 123 3.652 4.037 -0.385 1
1 1448 . 9 1 1 A 124 124 GLU C C 123 177.743 178.555 -0.812 1
1 1449 . 9 1 1 A 124 124 GLU CA C 123 59.406 59.554 -0.148 1
1 1450 . 9 1 1 A 124 124 GLU CB C 123 28.811 29.212 -0.401 1
1 1452 . 9 1 1 A 124 124 GLU N N 123 117.404 118.805 -1.401 1
1 1453 . 9 1 1 A 125 125 MET H H 124 7.537 7.605 -0.068 1
1 1454 . 9 1 1 A 125 125 MET HA H 124 3.860 3.948 -0.088 1
1 1462 . 9 1 1 A 125 125 MET C C 124 179.522 178.333 1.189 1
1 1463 . 9 1 1 A 125 125 MET CA C 124 58.832 58.501 0.331 1
1 1464 . 9 1 1 A 125 125 MET CB C 124 31.765 31.262 0.503 1
1 1467 . 9 1 1 A 125 125 MET N N 124 119.413 118.965 0.448 1
1 1468 . 9 1 1 A 126 126 PHE H H 125 7.148 7.468 -0.320 1
1 1469 . 9 1 1 A 126 126 PHE HA H 125 3.633 4.219 -0.586 1
1 1476 . 9 1 1 A 126 126 PHE C C 125 178.994 178.320 0.674 1
1 1477 . 9 1 1 A 126 126 PHE CA C 125 63.148 60.605 2.543 1
1 1478 . 9 1 1 A 126 126 PHE CB C 125 39.830 38.379 1.451 1
1 1483 . 9 1 1 A 126 126 PHE N N 125 120.013 118.975 1.038 1
1 1484 . 9 1 1 A 127 127 LEU H H 126 8.369 8.199 0.170 1
1 1485 . 9 1 1 A 127 127 LEU HA H 126 3.972 4.069 -0.097 1
1 1495 . 9 1 1 A 127 127 LEU C C 126 180.621 179.218 1.403 1
1 1496 . 9 1 1 A 127 127 LEU CA C 126 57.944 57.599 0.345 1
1 1497 . 9 1 1 A 127 127 LEU CB C 126 40.543 41.045 -0.502 1
1 1501 . 9 1 1 A 127 127 LEU N N 126 119.692 119.522 0.170 1
1 1502 . 9 1 1 A 128 128 ASP H H 127 8.578 7.966 0.612 1
1 1503 . 9 1 1 A 128 128 ASP HA H 127 4.308 4.352 -0.044 1
1 1506 . 9 1 1 A 128 128 ASP C C 127 178.254 178.192 0.062 1
1 1507 . 9 1 1 A 128 128 ASP CA C 127 56.964 57.144 -0.180 1
1 1508 . 9 1 1 A 128 128 ASP CB C 127 39.735 40.771 -1.036 1
1 1509 . 9 1 1 A 128 128 ASP N N 127 121.926 119.945 1.981 1
1 1510 . 9 1 1 A 129 129 TYR H H 128 7.710 8.055 -0.345 1
1 1511 . 9 1 1 A 129 129 TYR HA H 128 3.908 3.994 -0.086 1
1 1518 . 9 1 1 A 129 129 TYR C C 128 177.633 177.512 0.121 1
1 1519 . 9 1 1 A 129 129 TYR CA C 128 61.796 61.161 0.635 1
1 1520 . 9 1 1 A 129 129 TYR CB C 128 39.372 38.369 1.003 1
1 1525 . 9 1 1 A 129 129 TYR N N 128 122.548 120.353 2.195 1
1 1526 . 9 1 1 A 130 130 ARG H H 129 8.622 8.453 0.169 1
1 1527 . 9 1 1 A 130 130 ARG HA H 129 3.722 3.977 -0.255 1
1 1535 . 9 1 1 A 130 130 ARG CA C 129 60.084 59.705 0.379 1
1 1536 . 9 1 1 A 130 130 ARG CB C 129 29.902 29.923 -0.021 1
1 1539 . 9 1 1 A 130 130 ARG N N 129 118.302 119.347 -1.045 1
1 1541 . 9 1 1 A 131 131 ALA H H 130 7.936 7.929 0.007 1
1 1542 . 9 1 1 A 131 131 ALA HA H 130 3.997 4.036 -0.039 1
1 1546 . 9 1 1 A 131 131 ALA C C 130 180.456 180.410 0.046 1
1 1547 . 9 1 1 A 131 131 ALA CA C 130 55.133 54.837 0.296 1
1 1548 . 9 1 1 A 131 131 ALA CB C 130 17.750 18.145 -0.395 1
1 1549 . 9 1 1 A 131 131 ALA N N 130 119.788 121.106 -1.318 1
1 1550 . 9 1 1 A 132 132 GLU H H 131 7.622 7.572 0.050 1
1 1551 . 9 1 1 A 132 132 GLU HA H 131 3.862 4.033 -0.171 1
1 1556 . 9 1 1 A 132 132 GLU C C 131 179.528 178.176 1.352 1
1 1557 . 9 1 1 A 132 132 GLU CA C 131 58.849 58.478 0.371 1
1 1558 . 9 1 1 A 132 132 GLU CB C 131 28.930 29.372 -0.442 1
1 1560 . 9 1 1 A 132 132 GLU N N 131 118.428 118.445 -0.017 1
1 1561 . 9 1 1 A 133 133 LYS H H 132 7.853 7.600 0.253 1
1 1562 . 9 1 1 A 133 133 LYS HA H 132 3.722 4.096 -0.374 1
1 1571 . 9 1 1 A 133 133 LYS C C 132 175.725 178.112 -2.387 1
1 1572 . 9 1 1 A 133 133 LYS CA C 132 57.544 58.110 -0.566 1
1 1573 . 9 1 1 A 133 133 LYS CB C 132 31.770 31.979 -0.209 1
1 1577 . 9 1 1 A 133 133 LYS N N 132 119.473 117.840 1.633 1
1 1578 . 9 1 1 A 134 134 GLU H H 133 8.151 8.515 -0.364 1
1 1579 . 9 1 1 A 134 134 GLU HA H 133 4.161 4.151 0.010 1
1 1584 . 9 1 1 A 134 134 GLU C C 133 177.453 177.921 -0.468 1
1 1585 . 9 1 1 A 134 134 GLU CA C 133 57.222 58.203 -0.981 1
1 1586 . 9 1 1 A 134 134 GLU CB C 133 30.091 28.827 1.264 1
1 1588 . 9 1 1 A 134 134 GLU N N 133 116.525 117.434 -0.909 1
1 1589 . 9 1 1 A 135 135 GLY H H 134 7.702 7.517 0.185 1
1 1590 . 9 1 1 A 135 135 GLY HA2 H 134 3.896 3.953 -0.057 1
1 1591 . 9 1 1 A 135 135 GLY HA3 H 134 3.897 3.960 -0.063 1
1 1592 . 9 1 1 A 135 135 GLY C C 134 174.538 173.461 1.077 1
1 1593 . 9 1 1 A 135 135 GLY CA C 134 45.975 45.311 0.664 1
1 1594 . 9 1 1 A 135 135 GLY N N 134 107.924 107.484 0.440 1
1 1595 . 9 1 1 A 136 136 ARG H H 135 8.045 7.691 0.354 1
1 1596 . 9 1 1 A 136 136 ARG HA H 135 4.323 3.938 0.385 1
1 1604 . 9 1 1 A 136 136 ARG C C 135 175.864 176.142 -0.278 1
1 1605 . 9 1 1 A 136 136 ARG CA C 135 56.016 56.929 -0.913 1
1 1606 . 9 1 1 A 136 136 ARG CB C 135 30.987 29.163 1.824 1
1 1609 . 9 1 1 A 136 136 ARG N N 135 119.708 116.884 2.824 1
1 1 . 10 1 1 A 14 14 PHE CA C 13 58.199 59.027 -0.828 1
1 2 . 10 1 1 A 14 14 PHE CB C 13 39.717 41.097 -1.380 1
1 3 . 10 1 1 A 15 15 SER H H 14 8.299 8.005 0.294 1
1 4 . 10 1 1 A 15 15 SER HA H 14 4.359 4.852 -0.493 1
1 7 . 10 1 1 A 15 15 SER CA C 14 58.249 57.471 0.778 1
1 8 . 10 1 1 A 15 15 SER CB C 14 63.936 67.289 -3.353 1
1 9 . 10 1 1 A 15 15 SER N N 14 117.379 113.150 4.229 1
1 10 . 10 1 1 A 16 16 SER H H 15 8.255 8.648 -0.393 1
1 11 . 10 1 1 A 16 16 SER HA H 15 3.729 4.696 -0.967 1
1 14 . 10 1 1 A 16 16 SER CA C 15 58.224 58.358 -0.134 1
1 15 . 10 1 1 A 16 16 SER CB C 15 63.886 63.389 0.497 1
1 16 . 10 1 1 A 16 16 SER N N 15 117.694 117.001 0.693 1
1 17 . 10 1 1 A 17 17 ALA H H 16 8.333 8.148 0.185 1
1 18 . 10 1 1 A 17 17 ALA HA H 16 4.252 4.232 0.020 1
1 22 . 10 1 1 A 17 17 ALA CA C 16 53.377 53.868 -0.491 1
1 23 . 10 1 1 A 17 17 ALA CB C 16 18.896 18.406 0.490 1
1 24 . 10 1 1 A 17 17 ALA N N 16 125.462 125.181 0.281 1
1 25 . 10 1 1 A 18 18 SER H H 17 8.219 8.008 0.211 1
1 26 . 10 1 1 A 18 18 SER HA H 17 4.332 4.572 -0.240 1
1 29 . 10 1 1 A 18 18 SER CA C 17 59.105 57.168 1.937 1
1 30 . 10 1 1 A 18 18 SER CB C 17 63.592 64.338 -0.746 1
1 31 . 10 1 1 A 18 18 SER N N 17 114.821 109.571 5.250 1
1 32 . 10 1 1 A 19 19 ASP H H 18 8.309 8.539 -0.230 1
1 33 . 10 1 1 A 19 19 ASP HA H 18 4.554 4.967 -0.413 1
1 36 . 10 1 1 A 19 19 ASP C C 18 176.528 176.956 -0.428 1
1 37 . 10 1 1 A 19 19 ASP CA C 18 55.272 55.185 0.087 1
1 38 . 10 1 1 A 19 19 ASP CB C 18 40.883 41.529 -0.646 1
1 39 . 10 1 1 A 19 19 ASP N N 18 123.367 120.661 2.706 1
1 40 . 10 1 1 A 20 20 ALA H H 19 8.133 8.560 -0.427 1
1 41 . 10 1 1 A 20 20 ALA HA H 19 4.170 4.105 0.065 1
1 45 . 10 1 1 A 20 20 ALA C C 19 179.857 179.033 0.824 1
1 46 . 10 1 1 A 20 20 ALA CA C 19 54.341 55.532 -1.191 1
1 47 . 10 1 1 A 20 20 ALA CB C 19 18.660 18.576 0.084 1
1 48 . 10 1 1 A 20 20 ALA N N 19 123.350 122.999 0.351 1
1 49 . 10 1 1 A 21 21 GLU H H 20 8.140 7.946 0.194 1
1 50 . 10 1 1 A 21 21 GLU HA H 20 4.128 4.081 0.047 1
1 55 . 10 1 1 A 21 21 GLU C C 20 177.675 178.665 -0.990 1
1 56 . 10 1 1 A 21 21 GLU CA C 20 58.520 59.322 -0.802 1
1 57 . 10 1 1 A 21 21 GLU CB C 20 29.765 29.429 0.336 1
1 59 . 10 1 1 A 21 21 GLU N N 20 119.063 119.333 -0.270 1
1 60 . 10 1 1 A 22 22 PHE H H 21 8.009 8.031 -0.022 1
1 61 . 10 1 1 A 22 22 PHE HA H 21 4.123 4.336 -0.213 1
1 68 . 10 1 1 A 22 22 PHE C C 21 176.410 176.967 -0.557 1
1 69 . 10 1 1 A 22 22 PHE CA C 21 62.202 61.272 0.930 1
1 70 . 10 1 1 A 22 22 PHE CB C 21 39.223 39.044 0.179 1
1 75 . 10 1 1 A 22 22 PHE N N 21 121.211 120.999 0.212 1
1 76 . 10 1 1 A 23 23 ASP H H 22 8.261 8.247 0.014 1
1 77 . 10 1 1 A 23 23 ASP HA H 22 4.041 4.433 -0.392 1
1 80 . 10 1 1 A 23 23 ASP C C 22 179.078 178.524 0.554 1
1 81 . 10 1 1 A 23 23 ASP CA C 22 57.048 57.344 -0.296 1
1 82 . 10 1 1 A 23 23 ASP CB C 22 40.154 40.291 -0.137 1
1 83 . 10 1 1 A 23 23 ASP N N 22 116.876 118.554 -1.678 1
1 84 . 10 1 1 A 24 24 ALA H H 23 7.651 7.434 0.217 1
1 85 . 10 1 1 A 24 24 ALA HA H 23 3.785 3.901 -0.116 1
1 89 . 10 1 1 A 24 24 ALA C C 23 179.577 179.915 -0.338 1
1 90 . 10 1 1 A 24 24 ALA CA C 23 54.341 55.140 -0.799 1
1 91 . 10 1 1 A 24 24 ALA CB C 23 17.762 18.240 -0.478 1
1 92 . 10 1 1 A 24 24 ALA N N 23 121.873 122.526 -0.653 1
1 93 . 10 1 1 A 25 25 VAL H H 24 7.718 7.934 -0.216 1
1 94 . 10 1 1 A 25 25 VAL HA H 24 3.216 3.549 -0.333 1
1 102 . 10 1 1 A 25 25 VAL C C 24 177.805 177.942 -0.137 1
1 103 . 10 1 1 A 25 25 VAL CA C 24 66.789 66.900 -0.111 1
1 104 . 10 1 1 A 25 25 VAL CB C 24 31.277 31.360 -0.083 1
1 107 . 10 1 1 A 25 25 VAL N N 24 117.890 118.418 -0.528 1
1 108 . 10 1 1 A 26 26 VAL H H 25 7.867 7.808 0.059 1
1 109 . 10 1 1 A 26 26 VAL HA H 25 3.274 3.565 -0.291 1
1 117 . 10 1 1 A 26 26 VAL C C 25 177.788 177.880 -0.092 1
1 118 . 10 1 1 A 26 26 VAL CA C 25 67.282 66.158 1.124 1
1 119 . 10 1 1 A 26 26 VAL CB C 25 31.266 31.417 -0.151 1
1 122 . 10 1 1 A 26 26 VAL N N 25 118.170 119.387 -1.217 1
1 123 . 10 1 1 A 27 27 GLY H H 26 7.544 7.652 -0.108 1
1 124 . 10 1 1 A 27 27 GLY HA2 H 26 3.592 3.530 0.062 1
1 125 . 10 1 1 A 27 27 GLY HA3 H 26 3.721 3.641 0.080 1
1 126 . 10 1 1 A 27 27 GLY C C 26 176.717 176.393 0.324 1
1 127 . 10 1 1 A 27 27 GLY CA C 26 47.085 47.188 -0.103 1
1 128 . 10 1 1 A 27 27 GLY N N 26 105.795 107.707 -1.912 1
1 129 . 10 1 1 A 28 28 TYR H H 27 7.625 7.376 0.249 1
1 130 . 10 1 1 A 28 28 TYR HA H 27 4.546 4.547 -0.001 1
1 137 . 10 1 1 A 28 28 TYR C C 27 178.991 178.129 0.862 1
1 138 . 10 1 1 A 28 28 TYR CA C 27 58.845 59.704 -0.859 1
1 139 . 10 1 1 A 28 28 TYR CB C 27 37.602 37.810 -0.208 1
1 144 . 10 1 1 A 28 28 TYR N N 27 119.933 121.580 -1.647 1
1 145 . 10 1 1 A 29 29 LEU H H 28 8.517 8.457 0.060 1
1 146 . 10 1 1 A 29 29 LEU HA H 28 3.728 3.833 -0.105 1
1 156 . 10 1 1 A 29 29 LEU CA C 28 58.281 58.093 0.188 1
1 157 . 10 1 1 A 29 29 LEU CB C 28 41.948 41.466 0.482 1
1 161 . 10 1 1 A 29 29 LEU N N 28 119.669 120.251 -0.582 1
1 162 . 10 1 1 A 30 30 GLU H H 29 8.072 8.012 0.060 1
1 163 . 10 1 1 A 30 30 GLU HA H 29 3.722 3.873 -0.151 1
1 168 . 10 1 1 A 30 30 GLU C C 29 177.731 178.720 -0.989 1
1 169 . 10 1 1 A 30 30 GLU CA C 29 59.763 59.928 -0.165 1
1 170 . 10 1 1 A 30 30 GLU CB C 29 28.844 29.229 -0.385 1
1 172 . 10 1 1 A 30 30 GLU N N 29 117.666 117.593 0.073 1
1 173 . 10 1 1 A 31 31 ASP H H 30 7.243 7.888 -0.645 1
1 174 . 10 1 1 A 31 31 ASP HA H 30 4.297 4.398 -0.101 1
1 177 . 10 1 1 A 31 31 ASP CA C 30 56.953 57.013 -0.060 1
1 178 . 10 1 1 A 31 31 ASP CB C 30 40.730 41.657 -0.927 1
1 179 . 10 1 1 A 31 31 ASP N N 30 116.720 119.084 -2.364 1
1 180 . 10 1 1 A 32 32 ILE H H 31 7.940 7.512 0.428 1
1 181 . 10 1 1 A 32 32 ILE HA H 31 3.640 3.714 -0.074 1
1 191 . 10 1 1 A 32 32 ILE C C 31 177.980 178.128 -0.148 1
1 192 . 10 1 1 A 32 32 ILE CA C 31 64.692 64.086 0.606 1
1 193 . 10 1 1 A 32 32 ILE CB C 31 38.938 37.212 1.726 1
1 197 . 10 1 1 A 32 32 ILE N N 31 119.728 118.011 1.717 1
1 198 . 10 1 1 A 33 33 ILE H H 32 7.984 8.024 -0.040 1
1 199 . 10 1 1 A 33 33 ILE HA H 32 3.598 2.908 0.690 1
1 209 . 10 1 1 A 33 33 ILE C C 32 176.723 177.178 -0.455 1
1 210 . 10 1 1 A 33 33 ILE CA C 32 63.241 64.453 -1.212 1
1 211 . 10 1 1 A 33 33 ILE CB C 32 37.580 37.544 0.036 1
1 215 . 10 1 1 A 33 33 ILE N N 32 113.919 120.782 -6.863 1
1 216 . 10 1 1 A 34 34 MET H H 33 7.288 7.718 -0.430 1
1 217 . 10 1 1 A 34 34 MET HA H 33 4.496 4.524 -0.028 1
1 225 . 10 1 1 A 34 34 MET C C 33 176.423 176.131 0.292 1
1 226 . 10 1 1 A 34 34 MET CA C 33 54.634 55.611 -0.977 1
1 227 . 10 1 1 A 34 34 MET CB C 33 31.934 32.523 -0.589 1
1 230 . 10 1 1 A 34 34 MET N N 33 115.130 117.254 -2.124 1
1 231 . 10 1 1 A 35 35 ASP H H 34 7.405 7.524 -0.119 1
1 232 . 10 1 1 A 35 35 ASP HA H 34 4.484 4.490 -0.006 1
1 235 . 10 1 1 A 35 35 ASP C C 34 177.139 176.671 0.468 1
1 236 . 10 1 1 A 35 35 ASP CA C 34 54.625 54.858 -0.233 1
1 237 . 10 1 1 A 35 35 ASP CB C 34 43.554 42.556 0.998 1
1 238 . 10 1 1 A 35 35 ASP N N 34 121.814 121.938 -0.124 1
1 239 . 10 1 1 A 36 36 ASP H H 35 8.765 9.186 -0.421 1
1 240 . 10 1 1 A 36 36 ASP HA H 35 4.235 4.233 0.002 1
1 243 . 10 1 1 A 36 36 ASP C C 35 178.320 177.912 0.408 1
1 244 . 10 1 1 A 36 36 ASP CA C 35 57.832 58.500 -0.668 1
1 245 . 10 1 1 A 36 36 ASP CB C 35 40.914 41.197 -0.283 1
1 246 . 10 1 1 A 36 36 ASP N N 35 125.883 128.404 -2.521 1
1 247 . 10 1 1 A 37 37 GLU H H 36 8.905 8.096 0.809 1
1 248 . 10 1 1 A 37 37 GLU HA H 36 3.933 4.019 -0.086 1
1 253 . 10 1 1 A 37 37 GLU C C 36 179.304 179.016 0.288 1
1 254 . 10 1 1 A 37 37 GLU CA C 36 59.828 59.263 0.565 1
1 255 . 10 1 1 A 37 37 GLU CB C 36 29.380 29.302 0.078 1
1 257 . 10 1 1 A 37 37 GLU N N 36 119.077 118.970 0.107 1
1 258 . 10 1 1 A 38 38 PHE H H 37 7.460 8.063 -0.603 1
1 259 . 10 1 1 A 38 38 PHE HA H 37 3.642 3.981 -0.339 1
1 267 . 10 1 1 A 38 38 PHE C C 37 176.483 177.864 -1.381 1
1 268 . 10 1 1 A 38 38 PHE CA C 37 61.411 60.925 0.486 1
1 269 . 10 1 1 A 38 38 PHE CB C 37 39.355 39.108 0.247 1
1 275 . 10 1 1 A 38 38 PHE N N 37 119.968 120.754 -0.786 1
1 276 . 10 1 1 A 39 39 GLN H H 38 7.968 8.132 -0.164 1
1 277 . 10 1 1 A 39 39 GLN HA H 38 3.712 3.797 -0.085 1
1 284 . 10 1 1 A 39 39 GLN CA C 38 59.153 58.609 0.544 1
1 285 . 10 1 1 A 39 39 GLN CB C 38 28.213 28.139 0.074 1
1 287 . 10 1 1 A 39 39 GLN N N 38 116.433 118.290 -1.857 1
1 289 . 10 1 1 A 40 40 LEU H H 39 7.930 7.507 0.423 1
1 290 . 10 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 10 1 1 A 40 40 LEU C C 39 177.731 178.051 -0.320 1
1 301 . 10 1 1 A 40 40 LEU CA C 39 57.915 57.905 0.010 1
1 302 . 10 1 1 A 40 40 LEU CB C 39 41.989 41.481 0.508 1
1 306 . 10 1 1 A 40 40 LEU N N 39 119.505 121.427 -1.922 1
1 307 . 10 1 1 A 41 41 LEU H H 40 7.174 7.739 -0.565 1
1 308 . 10 1 1 A 41 41 LEU HA H 40 3.835 3.981 -0.146 1
1 318 . 10 1 1 A 41 41 LEU C C 40 179.738 178.207 1.531 1
1 319 . 10 1 1 A 41 41 LEU CA C 40 58.266 58.263 0.003 1
1 320 . 10 1 1 A 41 41 LEU CB C 40 42.050 41.475 0.575 1
1 324 . 10 1 1 A 41 41 LEU N N 40 120.971 119.792 1.179 1
1 325 . 10 1 1 A 42 42 GLN H H 41 8.058 7.819 0.239 1
1 326 . 10 1 1 A 42 42 GLN HA H 41 3.556 3.731 -0.175 1
1 333 . 10 1 1 A 42 42 GLN C C 41 177.642 178.576 -0.934 1
1 334 . 10 1 1 A 42 42 GLN CA C 41 59.826 59.219 0.607 1
1 335 . 10 1 1 A 42 42 GLN CB C 41 28.762 28.061 0.701 1
1 337 . 10 1 1 A 42 42 GLN N N 41 117.899 117.731 0.168 1
1 339 . 10 1 1 A 43 43 ARG H H 42 8.179 7.680 0.499 1
1 340 . 10 1 1 A 43 43 ARG HA H 42 3.655 4.007 -0.352 1
1 347 . 10 1 1 A 43 43 ARG C C 42 178.051 178.809 -0.758 1
1 348 . 10 1 1 A 43 43 ARG CA C 42 59.766 59.107 0.659 1
1 349 . 10 1 1 A 43 43 ARG CB C 42 29.941 29.788 0.153 1
1 352 . 10 1 1 A 43 43 ARG N N 42 119.392 118.877 0.515 1
1 353 . 10 1 1 A 44 44 ASN H H 43 8.525 8.163 0.362 1
1 354 . 10 1 1 A 44 44 ASN HA H 43 4.332 4.377 -0.045 1
1 359 . 10 1 1 A 44 44 ASN C C 43 178.150 177.770 0.380 1
1 360 . 10 1 1 A 44 44 ASN CA C 43 55.841 56.196 -0.355 1
1 361 . 10 1 1 A 44 44 ASN CB C 43 37.632 39.355 -1.723 1
1 362 . 10 1 1 A 44 44 ASN N N 43 116.214 117.677 -1.463 1
1 364 . 10 1 1 A 45 45 PHE H H 44 7.586 7.875 -0.289 1
1 365 . 10 1 1 A 45 45 PHE HA H 44 4.132 4.284 -0.152 1
1 372 . 10 1 1 A 45 45 PHE C C 44 176.691 178.792 -2.101 1
1 373 . 10 1 1 A 45 45 PHE CA C 44 62.333 60.577 1.756 1
1 374 . 10 1 1 A 45 45 PHE CB C 44 39.449 38.760 0.689 1
1 379 . 10 1 1 A 45 45 PHE N N 44 121.501 117.365 4.136 1
1 380 . 10 1 1 A 46 46 MET H H 45 8.190 8.410 -0.220 1
1 381 . 10 1 1 A 46 46 MET HA H 45 4.060 4.386 -0.326 1
1 389 . 10 1 1 A 46 46 MET C C 45 179.754 178.082 1.672 1
1 390 . 10 1 1 A 46 46 MET CA C 45 57.742 57.798 -0.056 1
1 391 . 10 1 1 A 46 46 MET CB C 45 29.912 32.115 -2.203 1
1 394 . 10 1 1 A 46 46 MET N N 45 116.727 119.283 -2.556 1
1 395 . 10 1 1 A 47 47 ASP H H 46 8.579 8.204 0.375 1
1 396 . 10 1 1 A 47 47 ASP HA H 46 4.804 4.632 0.172 1
1 399 . 10 1 1 A 47 47 ASP C C 46 177.854 178.402 -0.548 1
1 400 . 10 1 1 A 47 47 ASP CA C 46 57.277 57.244 0.033 1
1 401 . 10 1 1 A 47 47 ASP CB C 46 40.776 41.578 -0.802 1
1 402 . 10 1 1 A 47 47 ASP N N 46 117.798 120.671 -2.873 1
1 403 . 10 1 1 A 48 48 LYS H H 47 7.339 7.957 -0.618 1
1 404 . 10 1 1 A 48 48 LYS HA H 47 3.828 4.228 -0.400 1
1 413 . 10 1 1 A 48 48 LYS C C 47 178.812 178.673 0.139 1
1 414 . 10 1 1 A 48 48 LYS CA C 47 58.953 58.471 0.482 1
1 415 . 10 1 1 A 48 48 LYS CB C 47 32.796 32.972 -0.176 1
1 419 . 10 1 1 A 48 48 LYS N N 47 117.852 119.723 -1.871 1
1 420 . 10 1 1 A 49 49 TYR H H 48 6.841 8.747 -1.906 1
1 421 . 10 1 1 A 49 49 TYR HA H 48 4.995 4.261 0.734 1
1 428 . 10 1 1 A 49 49 TYR C C 48 178.138 178.395 -0.257 1
1 429 . 10 1 1 A 49 49 TYR CA C 48 58.620 59.793 -1.173 1
1 430 . 10 1 1 A 49 49 TYR CB C 48 42.939 38.256 4.683 1
1 435 . 10 1 1 A 49 49 TYR N N 48 112.109 119.869 -7.760 1
1 436 . 10 1 1 A 50 50 TYR H H 49 8.491 7.981 0.510 1
1 437 . 10 1 1 A 50 50 TYR HA H 49 4.598 4.052 0.546 1
1 444 . 10 1 1 A 50 50 TYR C C 49 176.015 177.658 -1.643 1
1 445 . 10 1 1 A 50 50 TYR CA C 49 62.442 59.538 2.904 1
1 446 . 10 1 1 A 50 50 TYR CB C 49 36.588 36.890 -0.302 1
1 451 . 10 1 1 A 50 50 TYR N N 49 118.294 119.633 -1.339 1
1 452 . 10 1 1 A 51 51 LEU H H 50 7.512 7.698 -0.186 1
1 453 . 10 1 1 A 51 51 LEU HA H 50 3.878 3.522 0.356 1
1 463 . 10 1 1 A 51 51 LEU C C 50 178.625 178.418 0.207 1
1 464 . 10 1 1 A 51 51 LEU CA C 50 55.994 57.157 -1.163 1
1 465 . 10 1 1 A 51 51 LEU CB C 50 40.743 41.262 -0.519 1
1 469 . 10 1 1 A 51 51 LEU N N 50 118.478 121.577 -3.099 1
1 470 . 10 1 1 A 52 52 GLU H H 51 8.042 7.910 0.132 1
1 471 . 10 1 1 A 52 52 GLU HA H 51 4.197 3.921 0.276 1
1 476 . 10 1 1 A 52 52 GLU C C 51 177.629 177.627 0.002 1
1 477 . 10 1 1 A 52 52 GLU CA C 51 56.141 59.542 -3.401 1
1 478 . 10 1 1 A 52 52 GLU CB C 51 29.162 29.215 -0.053 1
1 480 . 10 1 1 A 52 52 GLU N N 51 115.067 118.367 -3.300 1
1 481 . 10 1 1 A 53 53 PHE H H 52 7.465 7.988 -0.523 1
1 482 . 10 1 1 A 53 53 PHE HA H 52 4.431 4.785 -0.354 1
1 490 . 10 1 1 A 53 53 PHE C C 52 174.325 174.704 -0.379 1
1 491 . 10 1 1 A 53 53 PHE CA C 52 58.986 57.042 1.944 1
1 492 . 10 1 1 A 53 53 PHE CB C 52 40.183 37.217 2.966 1
1 498 . 10 1 1 A 53 53 PHE N N 52 116.768 118.118 -1.350 1
1 499 . 10 1 1 A 54 54 GLU H H 53 7.484 8.620 -1.136 1
1 500 . 10 1 1 A 54 54 GLU HA H 53 4.583 4.911 -0.328 1
1 505 . 10 1 1 A 54 54 GLU C C 53 175.722 175.776 -0.054 1
1 506 . 10 1 1 A 54 54 GLU CA C 53 54.248 55.284 -1.036 1
1 507 . 10 1 1 A 54 54 GLU CB C 53 34.409 31.311 3.098 1
1 509 . 10 1 1 A 54 54 GLU N N 53 118.844 123.443 -4.599 1
1 510 . 10 1 1 A 55 55 ASP H H 54 9.008 8.599 0.409 1
1 511 . 10 1 1 A 55 55 ASP HA H 54 4.735 4.829 -0.094 1
1 514 . 10 1 1 A 55 55 ASP C C 54 175.421 175.984 -0.563 1
1 515 . 10 1 1 A 55 55 ASP CA C 54 52.888 53.782 -0.894 1
1 516 . 10 1 1 A 55 55 ASP CB C 54 38.894 40.663 -1.769 1
1 517 . 10 1 1 A 55 55 ASP N N 54 123.654 123.406 0.248 1
1 518 . 10 1 1 A 56 56 THR H H 55 7.819 8.092 -0.273 1
1 519 . 10 1 1 A 56 56 THR HA H 55 4.574 4.967 -0.393 1
1 524 . 10 1 1 A 56 56 THR C C 55 174.096 174.155 -0.059 1
1 525 . 10 1 1 A 56 56 THR CA C 55 59.172 59.837 -0.665 1
1 526 . 10 1 1 A 56 56 THR CB C 55 71.889 72.046 -0.157 1
1 528 . 10 1 1 A 56 56 THR N N 55 112.015 117.843 -5.828 1
1 529 . 10 1 1 A 57 57 GLU H H 56 8.527 8.688 -0.161 1
1 530 . 10 1 1 A 57 57 GLU HA H 56 4.217 4.499 -0.282 1
1 535 . 10 1 1 A 57 57 GLU C C 56 177.042 175.953 1.089 1
1 536 . 10 1 1 A 57 57 GLU CA C 56 56.869 56.535 0.334 1
1 537 . 10 1 1 A 57 57 GLU CB C 56 29.731 30.909 -1.178 1
1 539 . 10 1 1 A 57 57 GLU N N 56 117.531 118.770 -1.239 1
1 540 . 10 1 1 A 58 58 GLU H H 57 7.587 8.017 -0.430 1
1 541 . 10 1 1 A 58 58 GLU HA H 57 3.941 4.889 -0.948 1
1 546 . 10 1 1 A 58 58 GLU C C 57 176.849 175.417 1.432 1
1 547 . 10 1 1 A 58 58 GLU CA C 57 56.924 54.841 2.083 1
1 548 . 10 1 1 A 58 58 GLU CB C 57 30.251 32.478 -2.227 1
1 550 . 10 1 1 A 58 58 GLU N N 57 119.183 120.168 -0.985 1
1 551 . 10 1 1 A 59 59 ASN H H 58 9.120 8.915 0.205 1
1 552 . 10 1 1 A 59 59 ASN HA H 58 4.922 5.380 -0.458 1
1 557 . 10 1 1 A 59 59 ASN C C 58 174.254 174.715 -0.461 1
1 558 . 10 1 1 A 59 59 ASN CA C 58 51.956 52.632 -0.676 1
1 559 . 10 1 1 A 59 59 ASN CB C 58 37.404 40.624 -3.220 1
1 560 . 10 1 1 A 59 59 ASN N N 58 126.767 120.831 5.936 1
1 562 . 10 1 1 A 60 60 LYS H H 59 5.892 9.186 -3.294 1
1 563 . 10 1 1 A 60 60 LYS HA H 59 3.798 4.546 -0.748 1
1 572 . 10 1 1 A 60 60 LYS C C 59 177.908 177.958 -0.050 1
1 573 . 10 1 1 A 60 60 LYS CA C 59 56.623 54.548 2.075 1
1 574 . 10 1 1 A 60 60 LYS CB C 59 32.279 34.304 -2.025 1
1 578 . 10 1 1 A 60 60 LYS N N 59 121.527 122.409 -0.882 1
1 579 . 10 1 1 A 61 61 LEU H H 60 8.473 8.789 -0.316 1
1 580 . 10 1 1 A 61 61 LEU HA H 60 3.891 4.292 -0.401 1
1 590 . 10 1 1 A 61 61 LEU C C 60 179.843 177.972 1.871 1
1 591 . 10 1 1 A 61 61 LEU CA C 60 58.301 56.911 1.390 1
1 592 . 10 1 1 A 61 61 LEU CB C 60 41.305 42.307 -1.002 1
1 596 . 10 1 1 A 61 61 LEU N N 60 125.639 124.763 0.876 1
1 597 . 10 1 1 A 62 62 ILE H H 61 7.698 7.640 0.058 1
1 598 . 10 1 1 A 62 62 ILE HA H 61 3.952 3.838 0.114 1
1 608 . 10 1 1 A 62 62 ILE C C 61 175.392 177.185 -1.793 1
1 609 . 10 1 1 A 62 62 ILE CA C 61 61.743 63.383 -1.640 1
1 610 . 10 1 1 A 62 62 ILE CB C 61 39.108 37.712 1.396 1
1 614 . 10 1 1 A 62 62 ILE N N 61 114.111 118.783 -4.672 1
1 615 . 10 1 1 A 63 63 TYR H H 62 7.273 7.532 -0.259 1
1 616 . 10 1 1 A 63 63 TYR HA H 62 4.343 4.187 0.156 1
1 623 . 10 1 1 A 63 63 TYR C C 62 178.264 178.586 -0.322 1
1 624 . 10 1 1 A 63 63 TYR CA C 62 57.231 60.783 -3.552 1
1 625 . 10 1 1 A 63 63 TYR CB C 62 36.332 37.395 -1.063 1
1 630 . 10 1 1 A 63 63 TYR N N 62 117.689 121.274 -3.585 1
1 631 . 10 1 1 A 64 64 THR H H 63 7.747 8.048 -0.301 1
1 632 . 10 1 1 A 64 64 THR HA H 63 4.266 4.240 0.026 1
1 637 . 10 1 1 A 64 64 THR CA C 63 69.362 67.567 1.795 1
1 638 . 10 1 1 A 64 64 THR CB C 63 66.962 67.581 -0.619 1
1 640 . 10 1 1 A 64 64 THR N N 63 113.755 116.049 -2.294 1
1 641 . 10 1 1 A 65 65 PRO HA H 64 4.372 4.382 -0.010 1
1 648 . 10 1 1 A 65 65 PRO C C 64 179.913 179.385 0.528 1
1 649 . 10 1 1 A 65 65 PRO CA C 64 66.011 66.135 -0.124 1
1 650 . 10 1 1 A 65 65 PRO CB C 64 30.642 30.676 -0.034 1
1 653 . 10 1 1 A 66 66 ILE H H 65 7.377 7.348 0.029 1
1 654 . 10 1 1 A 66 66 ILE HA H 65 3.530 3.912 -0.382 1
1 664 . 10 1 1 A 66 66 ILE C C 65 177.543 178.201 -0.658 1
1 665 . 10 1 1 A 66 66 ILE CA C 65 66.647 64.252 2.395 1
1 666 . 10 1 1 A 66 66 ILE CB C 65 38.029 37.730 0.299 1
1 670 . 10 1 1 A 66 66 ILE N N 65 118.353 116.691 1.662 1
1 671 . 10 1 1 A 67 67 PHE H H 66 8.480 8.490 -0.010 1
1 672 . 10 1 1 A 67 67 PHE HA H 66 4.115 4.346 -0.231 1
1 680 . 10 1 1 A 67 67 PHE C C 66 177.293 178.317 -1.024 1
1 681 . 10 1 1 A 67 67 PHE CA C 66 59.570 61.774 -2.204 1
1 682 . 10 1 1 A 67 67 PHE CB C 66 38.865 39.479 -0.614 1
1 688 . 10 1 1 A 67 67 PHE N N 66 122.420 120.244 2.176 1
1 689 . 10 1 1 A 68 68 ASN H H 67 8.595 8.065 0.530 1
1 690 . 10 1 1 A 68 68 ASN HA H 67 4.211 4.433 -0.222 1
1 695 . 10 1 1 A 68 68 ASN C C 67 178.697 178.286 0.411 1
1 696 . 10 1 1 A 68 68 ASN CA C 67 56.056 56.288 -0.232 1
1 697 . 10 1 1 A 68 68 ASN CB C 67 37.704 37.891 -0.187 1
1 698 . 10 1 1 A 68 68 ASN N N 67 115.573 117.098 -1.525 1
1 700 . 10 1 1 A 69 69 GLU H H 68 8.414 7.974 0.440 1
1 701 . 10 1 1 A 69 69 GLU HA H 68 4.102 4.191 -0.089 1
1 706 . 10 1 1 A 69 69 GLU C C 68 177.880 178.842 -0.962 1
1 707 . 10 1 1 A 69 69 GLU CA C 68 59.399 59.310 0.089 1
1 708 . 10 1 1 A 69 69 GLU CB C 68 29.855 29.281 0.574 1
1 710 . 10 1 1 A 69 69 GLU N N 68 123.510 119.976 3.534 1
1 711 . 10 1 1 A 70 70 TYR H H 69 8.659 8.028 0.631 1
1 712 . 10 1 1 A 70 70 TYR HA H 69 3.362 4.109 -0.747 1
1 719 . 10 1 1 A 70 70 TYR C C 69 178.143 176.961 1.182 1
1 720 . 10 1 1 A 70 70 TYR CA C 69 60.686 61.155 -0.469 1
1 721 . 10 1 1 A 70 70 TYR CB C 69 38.560 38.772 -0.212 1
1 726 . 10 1 1 A 70 70 TYR N N 69 122.130 120.873 1.257 1
1 727 . 10 1 1 A 71 71 ILE H H 70 8.031 7.808 0.223 1
1 728 . 10 1 1 A 71 71 ILE HA H 70 3.265 3.727 -0.462 1
1 738 . 10 1 1 A 71 71 ILE C C 70 178.056 177.902 0.154 1
1 739 . 10 1 1 A 71 71 ILE CA C 70 63.756 63.983 -0.227 1
1 740 . 10 1 1 A 71 71 ILE CB C 70 37.321 36.644 0.677 1
1 744 . 10 1 1 A 71 71 ILE N N 70 118.906 120.449 -1.543 1
1 745 . 10 1 1 A 72 72 SER H H 71 7.803 7.966 -0.163 1
1 746 . 10 1 1 A 72 72 SER HA H 71 4.029 4.371 -0.342 1
1 749 . 10 1 1 A 72 72 SER CA C 71 61.380 61.310 0.070 1
1 750 . 10 1 1 A 72 72 SER CB C 71 63.288 63.327 -0.039 1
1 751 . 10 1 1 A 72 72 SER N N 71 113.735 118.685 -4.950 1
1 752 . 10 1 1 A 73 73 LEU H H 72 7.952 7.946 0.006 1
1 753 . 10 1 1 A 73 73 LEU HA H 72 4.418 4.138 0.280 1
1 763 . 10 1 1 A 73 73 LEU C C 72 177.767 178.307 -0.540 1
1 764 . 10 1 1 A 73 73 LEU CA C 72 56.543 57.421 -0.878 1
1 765 . 10 1 1 A 73 73 LEU CB C 72 44.517 41.837 2.680 1
1 769 . 10 1 1 A 73 73 LEU N N 72 119.411 122.330 -2.919 1
1 770 . 10 1 1 A 74 74 VAL H H 73 8.021 7.631 0.390 1
1 771 . 10 1 1 A 74 74 VAL HA H 73 3.532 3.319 0.213 1
1 779 . 10 1 1 A 74 74 VAL C C 73 177.126 177.946 -0.820 1
1 780 . 10 1 1 A 74 74 VAL CA C 73 66.250 66.314 -0.064 1
1 781 . 10 1 1 A 74 74 VAL CB C 73 31.212 31.130 0.082 1
1 784 . 10 1 1 A 74 74 VAL N N 73 118.747 119.223 -0.476 1
1 785 . 10 1 1 A 75 75 GLU H H 74 7.232 7.949 -0.717 1
1 786 . 10 1 1 A 75 75 GLU HA H 74 3.013 4.207 -1.194 1
1 791 . 10 1 1 A 75 75 GLU C C 74 178.804 178.905 -0.101 1
1 792 . 10 1 1 A 75 75 GLU CA C 74 60.536 60.095 0.441 1
1 793 . 10 1 1 A 75 75 GLU CB C 74 27.009 29.195 -2.186 1
1 795 . 10 1 1 A 75 75 GLU N N 74 118.660 119.817 -1.157 1
1 796 . 10 1 1 A 76 76 LYS H H 75 7.051 7.517 -0.466 1
1 797 . 10 1 1 A 76 76 LYS HA H 75 3.765 4.059 -0.294 1
1 806 . 10 1 1 A 76 76 LYS C C 75 177.765 178.548 -0.783 1
1 807 . 10 1 1 A 76 76 LYS CA C 75 58.357 58.462 -0.105 1
1 808 . 10 1 1 A 76 76 LYS CB C 75 31.939 32.019 -0.080 1
1 812 . 10 1 1 A 76 76 LYS N N 75 116.112 119.052 -2.940 1
1 813 . 10 1 1 A 77 77 TYR H H 76 7.067 7.750 -0.683 1
1 814 . 10 1 1 A 77 77 TYR HA H 76 4.036 4.060 -0.024 1
1 821 . 10 1 1 A 77 77 TYR C C 76 177.752 177.120 0.632 1
1 822 . 10 1 1 A 77 77 TYR CA C 76 61.820 61.221 0.599 1
1 823 . 10 1 1 A 77 77 TYR CB C 76 38.480 38.730 -0.250 1
1 828 . 10 1 1 A 77 77 TYR N N 76 118.434 120.887 -2.453 1
1 829 . 10 1 1 A 78 78 ILE H H 77 7.554 7.885 -0.331 1
1 830 . 10 1 1 A 78 78 ILE HA H 77 3.159 3.528 -0.369 1
1 840 . 10 1 1 A 78 78 ILE C C 77 177.341 177.866 -0.525 1
1 841 . 10 1 1 A 78 78 ILE CA C 77 65.177 64.741 0.436 1
1 842 . 10 1 1 A 78 78 ILE CB C 77 37.339 37.387 -0.048 1
1 846 . 10 1 1 A 78 78 ILE N N 77 117.672 120.452 -2.780 1
1 847 . 10 1 1 A 79 79 GLU H H 78 8.296 8.037 0.259 1
1 848 . 10 1 1 A 79 79 GLU HA H 78 3.557 3.832 -0.275 1
1 853 . 10 1 1 A 79 79 GLU C C 78 177.742 178.706 -0.964 1
1 854 . 10 1 1 A 79 79 GLU CA C 78 60.847 59.894 0.953 1
1 855 . 10 1 1 A 79 79 GLU CB C 78 29.594 29.026 0.568 1
1 857 . 10 1 1 A 79 79 GLU N N 78 118.701 120.588 -1.887 1
1 858 . 10 1 1 A 80 80 GLU H H 79 8.330 8.228 0.102 1
1 859 . 10 1 1 A 80 80 GLU HA H 79 3.774 4.014 -0.240 1
1 864 . 10 1 1 A 80 80 GLU C C 79 179.926 179.226 0.700 1
1 865 . 10 1 1 A 80 80 GLU CA C 79 59.581 58.926 0.655 1
1 866 . 10 1 1 A 80 80 GLU CB C 79 29.062 29.079 -0.017 1
1 868 . 10 1 1 A 80 80 GLU N N 79 116.767 118.712 -1.945 1
1 869 . 10 1 1 A 81 81 GLN H H 80 7.634 7.639 -0.005 1
1 870 . 10 1 1 A 81 81 GLN HA H 80 3.605 3.834 -0.229 1
1 877 . 10 1 1 A 81 81 GLN C C 80 179.681 178.645 1.036 1
1 878 . 10 1 1 A 81 81 GLN CA C 80 57.765 58.410 -0.645 1
1 879 . 10 1 1 A 81 81 GLN CB C 80 28.079 27.995 0.084 1
1 881 . 10 1 1 A 81 81 GLN N N 80 116.325 118.676 -2.351 1
1 883 . 10 1 1 A 82 82 LEU H H 81 8.156 7.500 0.656 1
1 884 . 10 1 1 A 82 82 LEU HA H 81 3.536 3.738 -0.202 1
1 894 . 10 1 1 A 82 82 LEU C C 81 178.945 179.409 -0.464 1
1 895 . 10 1 1 A 82 82 LEU CA C 81 57.761 56.828 0.933 1
1 896 . 10 1 1 A 82 82 LEU CB C 81 40.961 40.943 0.018 1
1 900 . 10 1 1 A 82 82 LEU N N 81 121.546 120.199 1.347 1
1 901 . 10 1 1 A 83 83 LEU H H 82 8.326 8.103 0.223 1
1 902 . 10 1 1 A 83 83 LEU HA H 82 4.198 4.177 0.021 1
1 912 . 10 1 1 A 83 83 LEU C C 82 178.631 179.413 -0.782 1
1 913 . 10 1 1 A 83 83 LEU CA C 82 57.016 57.236 -0.220 1
1 914 . 10 1 1 A 83 83 LEU CB C 82 42.182 40.769 1.413 1
1 918 . 10 1 1 A 83 83 LEU N N 82 120.426 119.136 1.290 1
1 919 . 10 1 1 A 84 84 GLN H H 83 6.992 7.479 -0.487 1
1 920 . 10 1 1 A 84 84 GLN HA H 83 3.877 4.016 -0.139 1
1 927 . 10 1 1 A 84 84 GLN C C 83 177.008 176.925 0.083 1
1 928 . 10 1 1 A 84 84 GLN CA C 83 57.543 58.289 -0.746 1
1 929 . 10 1 1 A 84 84 GLN CB C 83 28.688 28.594 0.094 1
1 931 . 10 1 1 A 84 84 GLN N N 83 114.001 117.347 -3.346 1
1 933 . 10 1 1 A 85 85 ARG H H 84 7.072 7.363 -0.291 1
1 934 . 10 1 1 A 85 85 ARG HA H 84 4.047 4.383 -0.336 1
1 942 . 10 1 1 A 85 85 ARG C C 84 175.999 175.706 0.293 1
1 943 . 10 1 1 A 85 85 ARG CA C 84 56.764 56.148 0.616 1
1 944 . 10 1 1 A 85 85 ARG CB C 84 32.044 32.798 -0.754 1
1 947 . 10 1 1 A 85 85 ARG N N 84 115.827 116.930 -1.103 1
1 949 . 10 1 1 A 86 86 ILE H H 85 8.238 7.769 0.469 1
1 950 . 10 1 1 A 86 86 ILE HA H 85 4.389 4.488 -0.099 1
1 960 . 10 1 1 A 86 86 ILE CA C 85 58.007 57.752 0.255 1
1 961 . 10 1 1 A 86 86 ILE CB C 85 39.604 38.878 0.726 1
1 965 . 10 1 1 A 86 86 ILE N N 85 119.285 120.171 -0.886 1
1 966 . 10 1 1 A 87 87 PRO HA H 86 4.392 4.529 -0.137 1
1 973 . 10 1 1 A 87 87 PRO C C 86 177.622 176.411 1.211 1
1 974 . 10 1 1 A 87 87 PRO CA C 86 64.665 64.252 0.413 1
1 975 . 10 1 1 A 87 87 PRO CB C 86 32.020 31.679 0.341 1
1 978 . 10 1 1 A 88 88 GLU H H 87 8.312 8.192 0.120 1
1 979 . 10 1 1 A 88 88 GLU HA H 87 4.208 4.569 -0.361 1
1 984 . 10 1 1 A 88 88 GLU C C 87 175.554 175.815 -0.261 1
1 985 . 10 1 1 A 88 88 GLU CA C 87 56.045 56.267 -0.222 1
1 986 . 10 1 1 A 88 88 GLU CB C 87 28.654 30.747 -2.093 1
1 988 . 10 1 1 A 88 88 GLU N N 87 114.256 116.794 -2.538 1
1 989 . 10 1 1 A 89 89 PHE H H 88 7.946 7.617 0.329 1
1 990 . 10 1 1 A 89 89 PHE HA H 88 3.993 4.448 -0.455 1
1 998 . 10 1 1 A 89 89 PHE C C 88 173.460 174.319 -0.859 1
1 999 . 10 1 1 A 89 89 PHE CA C 88 60.119 59.099 1.020 1
1 1000 . 10 1 1 A 89 89 PHE CB C 88 39.994 39.665 0.329 1
1 1006 . 10 1 1 A 89 89 PHE N N 88 121.550 123.015 -1.465 1
1 1007 . 10 1 1 A 90 90 ASN H H 89 7.266 7.773 -0.507 1
1 1008 . 10 1 1 A 90 90 ASN HA H 89 4.454 5.018 -0.564 1
1 1013 . 10 1 1 A 90 90 ASN C C 89 173.921 175.440 -1.519 1
1 1014 . 10 1 1 A 90 90 ASN CA C 89 51.839 51.471 0.368 1
1 1015 . 10 1 1 A 90 90 ASN CB C 89 40.674 39.212 1.462 1
1 1016 . 10 1 1 A 90 90 ASN N N 89 125.344 124.924 0.420 1
1 1018 . 10 1 1 A 91 91 MET H H 90 8.968 8.828 0.140 1
1 1019 . 10 1 1 A 91 91 MET HA H 90 4.049 4.210 -0.161 1
1 1027 . 10 1 1 A 91 91 MET C C 90 177.475 178.057 -0.582 1
1 1028 . 10 1 1 A 91 91 MET CA C 90 57.758 58.445 -0.687 1
1 1029 . 10 1 1 A 91 91 MET CB C 90 32.250 32.437 -0.187 1
1 1032 . 10 1 1 A 91 91 MET N N 90 127.052 125.480 1.572 1
1 1033 . 10 1 1 A 92 92 ALA H H 91 8.292 8.085 0.207 1
1 1034 . 10 1 1 A 92 92 ALA HA H 91 4.059 4.128 -0.069 1
1 1038 . 10 1 1 A 92 92 ALA C C 91 180.412 179.712 0.700 1
1 1039 . 10 1 1 A 92 92 ALA CA C 91 55.368 55.022 0.346 1
1 1040 . 10 1 1 A 92 92 ALA CB C 91 17.527 18.428 -0.901 1
1 1041 . 10 1 1 A 92 92 ALA N N 91 123.752 121.526 2.226 1
1 1042 . 10 1 1 A 93 93 ALA H H 92 7.931 8.112 -0.181 1
1 1043 . 10 1 1 A 93 93 ALA HA H 92 4.054 4.051 0.003 1
1 1047 . 10 1 1 A 93 93 ALA C C 92 180.482 179.980 0.502 1
1 1048 . 10 1 1 A 93 93 ALA CA C 92 54.614 55.031 -0.417 1
1 1049 . 10 1 1 A 93 93 ALA CB C 92 18.098 18.224 -0.126 1
1 1050 . 10 1 1 A 93 93 ALA N N 92 121.158 119.921 1.237 1
1 1051 . 10 1 1 A 94 94 PHE H H 93 8.110 7.824 0.286 1
1 1052 . 10 1 1 A 94 94 PHE HA H 93 4.304 4.119 0.185 1
1 1060 . 10 1 1 A 94 94 PHE C C 93 177.350 177.158 0.192 1
1 1061 . 10 1 1 A 94 94 PHE CA C 93 61.641 61.419 0.222 1
1 1062 . 10 1 1 A 94 94 PHE CB C 93 40.014 39.118 0.896 1
1 1068 . 10 1 1 A 94 94 PHE N N 93 119.807 120.197 -0.390 1
1 1069 . 10 1 1 A 95 95 THR H H 94 8.726 8.216 0.510 1
1 1070 . 10 1 1 A 95 95 THR HA H 94 3.569 3.902 -0.333 1
1 1075 . 10 1 1 A 95 95 THR C C 94 176.932 176.798 0.134 1
1 1076 . 10 1 1 A 95 95 THR CA C 94 66.833 65.570 1.263 1
1 1077 . 10 1 1 A 95 95 THR CB C 94 68.445 68.303 0.142 1
1 1079 . 10 1 1 A 95 95 THR N N 94 113.074 112.154 0.920 1
1 1080 . 10 1 1 A 96 96 THR H H 95 7.657 7.745 -0.088 1
1 1081 . 10 1 1 A 96 96 THR HA H 95 3.945 4.039 -0.094 1
1 1086 . 10 1 1 A 96 96 THR C C 95 176.386 176.409 -0.023 1
1 1087 . 10 1 1 A 96 96 THR CA C 95 66.550 65.899 0.651 1
1 1088 . 10 1 1 A 96 96 THR CB C 95 68.583 68.864 -0.281 1
1 1090 . 10 1 1 A 96 96 THR N N 95 117.927 116.480 1.447 1
1 1091 . 10 1 1 A 97 97 THR H H 96 7.699 7.752 -0.053 1
1 1092 . 10 1 1 A 97 97 THR HA H 96 3.905 4.333 -0.428 1
1 1097 . 10 1 1 A 97 97 THR C C 96 176.572 176.076 0.496 1
1 1098 . 10 1 1 A 97 97 THR CA C 96 65.979 66.428 -0.449 1
1 1099 . 10 1 1 A 97 97 THR CB C 96 68.553 68.395 0.158 1
1 1101 . 10 1 1 A 97 97 THR N N 96 118.518 116.428 2.090 1
1 1102 . 10 1 1 A 98 98 LEU H H 97 8.304 8.060 0.244 1
1 1103 . 10 1 1 A 98 98 LEU HA H 97 3.725 3.742 -0.017 1
1 1113 . 10 1 1 A 98 98 LEU C C 97 178.490 178.357 0.133 1
1 1114 . 10 1 1 A 98 98 LEU CA C 97 58.517 57.861 0.656 1
1 1115 . 10 1 1 A 98 98 LEU CB C 97 41.697 40.970 0.727 1
1 1119 . 10 1 1 A 98 98 LEU N N 97 122.882 121.969 0.913 1
1 1120 . 10 1 1 A 99 99 GLN H H 98 7.639 7.926 -0.287 1
1 1121 . 10 1 1 A 99 99 GLN HA H 98 3.927 4.010 -0.083 1
1 1128 . 10 1 1 A 99 99 GLN C C 98 178.068 177.928 0.140 1
1 1129 . 10 1 1 A 99 99 GLN CA C 98 58.735 59.259 -0.524 1
1 1130 . 10 1 1 A 99 99 GLN CB C 98 27.986 28.343 -0.357 1
1 1132 . 10 1 1 A 99 99 GLN N N 98 114.302 118.436 -4.134 1
1 1134 . 10 1 1 A 100 100 HIS H H 99 7.575 8.051 -0.476 1
1 1135 . 10 1 1 A 100 100 HIS HA H 99 4.524 4.433 0.091 1
1 1139 . 10 1 1 A 100 100 HIS C C 99 174.789 177.265 -2.476 1
1 1140 . 10 1 1 A 100 100 HIS CA C 99 56.154 57.629 -1.475 1
1 1141 . 10 1 1 A 100 100 HIS CB C 99 28.946 29.859 -0.913 1
1 1143 . 10 1 1 A 100 100 HIS N N 99 114.778 116.446 -1.668 1
1 1144 . 10 1 1 A 101 101 HIS H H 100 7.773 7.466 0.307 1
1 1145 . 10 1 1 A 101 101 HIS HA H 100 4.704 3.926 0.778 1
1 1149 . 10 1 1 A 101 101 HIS C C 100 174.818 176.890 -2.072 1
1 1150 . 10 1 1 A 101 101 HIS CA C 100 54.830 57.986 -3.156 1
1 1151 . 10 1 1 A 101 101 HIS CB C 100 29.749 29.811 -0.062 1
1 1153 . 10 1 1 A 101 101 HIS N N 100 117.397 119.877 -2.480 1
1 1154 . 10 1 1 A 102 102 LYS H H 101 7.324 7.968 -0.644 1
1 1155 . 10 1 1 A 102 102 LYS HA H 101 3.611 4.013 -0.402 1
1 1164 . 10 1 1 A 102 102 LYS C C 101 176.823 178.297 -1.474 1
1 1165 . 10 1 1 A 102 102 LYS CA C 101 59.915 58.849 1.066 1
1 1166 . 10 1 1 A 102 102 LYS CB C 101 32.825 31.937 0.888 1
1 1170 . 10 1 1 A 102 102 LYS N N 101 120.533 118.920 1.613 1
1 1171 . 10 1 1 A 103 103 ASP H H 102 8.361 8.714 -0.353 1
1 1172 . 10 1 1 A 103 103 ASP HA H 102 4.421 4.374 0.047 1
1 1175 . 10 1 1 A 103 103 ASP C C 102 176.793 175.976 0.817 1
1 1176 . 10 1 1 A 103 103 ASP CA C 102 55.500 54.900 0.600 1
1 1177 . 10 1 1 A 103 103 ASP CB C 102 40.178 39.410 0.768 1
1 1178 . 10 1 1 A 103 103 ASP N N 102 114.814 116.449 -1.635 1
1 1179 . 10 1 1 A 104 104 GLU H H 103 7.858 7.744 0.114 1
1 1180 . 10 1 1 A 104 104 GLU HA H 103 4.339 4.329 0.010 1
1 1183 . 10 1 1 A 104 104 GLU C C 103 175.777 176.318 -0.541 1
1 1184 . 10 1 1 A 104 104 GLU CA C 103 56.356 57.360 -1.004 1
1 1185 . 10 1 1 A 104 104 GLU CB C 103 31.293 31.308 -0.015 1
1 1186 . 10 1 1 A 104 104 GLU N N 103 116.826 117.295 -0.469 1
1 1187 . 10 1 1 A 105 105 VAL H H 104 7.201 7.405 -0.204 1
1 1188 . 10 1 1 A 105 105 VAL HA H 104 4.296 4.165 0.131 1
1 1196 . 10 1 1 A 105 105 VAL C C 104 174.482 175.736 -1.254 1
1 1197 . 10 1 1 A 105 105 VAL CA C 104 60.370 62.632 -2.262 1
1 1198 . 10 1 1 A 105 105 VAL CB C 104 34.341 33.002 1.339 1
1 1201 . 10 1 1 A 105 105 VAL N N 104 116.422 119.327 -2.905 1
1 1202 . 10 1 1 A 106 106 ALA H H 105 8.487 8.464 0.023 1
1 1203 . 10 1 1 A 106 106 ALA HA H 105 4.172 4.410 -0.238 1
1 1207 . 10 1 1 A 106 106 ALA C C 105 179.030 178.853 0.177 1
1 1208 . 10 1 1 A 106 106 ALA CA C 105 52.966 52.539 0.427 1
1 1209 . 10 1 1 A 106 106 ALA CB C 105 19.371 19.319 0.052 1
1 1210 . 10 1 1 A 106 106 ALA N N 105 128.313 128.648 -0.335 1
1 1211 . 10 1 1 A 107 107 GLY H H 106 8.738 8.791 -0.053 1
1 1212 . 10 1 1 A 107 107 GLY HA2 H 106 3.773 3.873 -0.100 1
1 1213 . 10 1 1 A 107 107 GLY HA3 H 106 3.998 3.934 0.064 1
1 1214 . 10 1 1 A 107 107 GLY C C 106 174.958 175.449 -0.491 1
1 1215 . 10 1 1 A 107 107 GLY CA C 106 47.449 47.171 0.278 1
1 1216 . 10 1 1 A 107 107 GLY N N 106 110.612 110.790 -0.178 1
1 1217 . 10 1 1 A 108 108 ASP H H 107 8.535 7.859 0.676 1
1 1218 . 10 1 1 A 108 108 ASP HA H 107 4.333 4.366 -0.033 1
1 1221 . 10 1 1 A 108 108 ASP C C 107 179.133 178.901 0.232 1
1 1222 . 10 1 1 A 108 108 ASP CA C 107 56.721 56.377 0.344 1
1 1223 . 10 1 1 A 108 108 ASP CB C 107 39.336 40.529 -1.193 1
1 1224 . 10 1 1 A 108 108 ASP N N 107 117.474 122.029 -4.555 1
1 1225 . 10 1 1 A 109 109 ILE H H 108 7.459 7.567 -0.108 1
1 1226 . 10 1 1 A 109 109 ILE HA H 108 3.688 3.827 -0.139 1
1 1236 . 10 1 1 A 109 109 ILE C C 108 176.735 178.420 -1.685 1
1 1237 . 10 1 1 A 109 109 ILE CA C 108 63.474 65.355 -1.881 1
1 1238 . 10 1 1 A 109 109 ILE CB C 108 37.340 37.734 -0.394 1
1 1242 . 10 1 1 A 109 109 ILE N N 108 119.609 119.809 -0.200 1
1 1243 . 10 1 1 A 110 110 PHE H H 109 7.920 8.295 -0.375 1
1 1244 . 10 1 1 A 110 110 PHE HA H 109 3.759 4.073 -0.314 1
1 1252 . 10 1 1 A 110 110 PHE C C 109 177.132 177.379 -0.247 1
1 1253 . 10 1 1 A 110 110 PHE CA C 109 62.766 61.242 1.524 1
1 1254 . 10 1 1 A 110 110 PHE CB C 109 39.752 39.268 0.484 1
1 1260 . 10 1 1 A 110 110 PHE N N 109 120.906 120.469 0.437 1
1 1261 . 10 1 1 A 111 111 ASP H H 110 8.639 8.279 0.360 1
1 1262 . 10 1 1 A 111 111 ASP HA H 110 4.216 4.225 -0.009 1
1 1265 . 10 1 1 A 111 111 ASP C C 110 178.900 178.416 0.484 1
1 1266 . 10 1 1 A 111 111 ASP CA C 110 57.105 57.272 -0.167 1
1 1267 . 10 1 1 A 111 111 ASP CB C 110 39.697 41.724 -2.027 1
1 1268 . 10 1 1 A 111 111 ASP N N 110 117.124 119.032 -1.908 1
1 1269 . 10 1 1 A 112 112 MET H H 111 7.331 7.523 -0.192 1
1 1270 . 10 1 1 A 112 112 MET HA H 111 4.081 4.153 -0.072 1
1 1278 . 10 1 1 A 112 112 MET C C 111 179.052 178.152 0.900 1
1 1279 . 10 1 1 A 112 112 MET CA C 111 58.202 58.100 0.102 1
1 1280 . 10 1 1 A 112 112 MET CB C 111 31.827 32.462 -0.635 1
1 1283 . 10 1 1 A 112 112 MET N N 111 118.061 119.435 -1.374 1
1 1284 . 10 1 1 A 113 113 LEU H H 112 8.001 8.012 -0.011 1
1 1285 . 10 1 1 A 113 113 LEU HA H 112 3.723 3.552 0.171 1
1 1295 . 10 1 1 A 113 113 LEU C C 112 179.747 178.575 1.172 1
1 1296 . 10 1 1 A 113 113 LEU CA C 112 57.371 57.364 0.007 1
1 1297 . 10 1 1 A 113 113 LEU CB C 112 40.671 40.950 -0.279 1
1 1301 . 10 1 1 A 113 113 LEU N N 112 120.426 119.632 0.794 1
1 1302 . 10 1 1 A 114 114 LEU H H 113 7.744 7.655 0.089 1
1 1303 . 10 1 1 A 114 114 LEU HA H 113 4.007 3.481 0.526 1
1 1313 . 10 1 1 A 114 114 LEU C C 113 179.358 178.464 0.894 1
1 1314 . 10 1 1 A 114 114 LEU CA C 113 57.202 57.494 -0.292 1
1 1315 . 10 1 1 A 114 114 LEU CB C 113 41.727 41.570 0.157 1
1 1319 . 10 1 1 A 114 114 LEU N N 113 119.584 119.606 -0.022 1
1 1320 . 10 1 1 A 115 115 THR H H 114 7.353 7.653 -0.300 1
1 1321 . 10 1 1 A 115 115 THR HA H 114 4.071 4.188 -0.117 1
1 1327 . 10 1 1 A 115 115 THR C C 114 173.591 176.411 -2.820 1
1 1328 . 10 1 1 A 115 115 THR CA C 114 65.332 64.220 1.112 1
1 1329 . 10 1 1 A 115 115 THR CB C 114 70.319 68.734 1.585 1
1 1331 . 10 1 1 A 115 115 THR N N 114 107.535 112.345 -4.810 1
1 1332 . 10 1 1 A 116 116 PHE H H 115 6.979 7.773 -0.794 1
1 1333 . 10 1 1 A 116 116 PHE HA H 115 5.022 4.263 0.759 1
1 1341 . 10 1 1 A 116 116 PHE C C 115 176.488 176.265 0.223 1
1 1342 . 10 1 1 A 116 116 PHE CA C 115 55.911 60.840 -4.929 1
1 1343 . 10 1 1 A 116 116 PHE CB C 115 38.521 39.192 -0.671 1
1 1349 . 10 1 1 A 116 116 PHE N N 115 112.366 120.072 -7.706 1
1 1350 . 10 1 1 A 117 117 THR H H 116 7.564 7.988 -0.424 1
1 1351 . 10 1 1 A 117 117 THR HA H 116 4.626 4.898 -0.272 1
1 1356 . 10 1 1 A 117 117 THR C C 116 174.085 174.127 -0.042 1
1 1357 . 10 1 1 A 117 117 THR CA C 116 61.636 62.329 -0.693 1
1 1358 . 10 1 1 A 117 117 THR CB C 116 70.915 72.186 -1.271 1
1 1360 . 10 1 1 A 117 117 THR N N 116 105.498 112.162 -6.664 1
1 1361 . 10 1 1 A 118 118 ASP H H 117 8.270 7.462 0.808 1
1 1362 . 10 1 1 A 118 118 ASP HA H 117 4.955 5.009 -0.054 1
1 1365 . 10 1 1 A 118 118 ASP C C 117 176.328 176.212 0.116 1
1 1366 . 10 1 1 A 118 118 ASP CA C 117 53.417 53.500 -0.083 1
1 1367 . 10 1 1 A 118 118 ASP CB C 117 43.388 38.867 4.521 1
1 1368 . 10 1 1 A 118 118 ASP N N 117 124.409 121.427 2.982 1
1 1369 . 10 1 1 A 119 119 PHE H H 118 8.973 8.724 0.249 1
1 1370 . 10 1 1 A 119 119 PHE HA H 118 3.506 4.181 -0.675 1
1 1378 . 10 1 1 A 119 119 PHE CA C 118 61.490 61.087 0.403 1
1 1379 . 10 1 1 A 119 119 PHE CB C 118 39.246 39.530 -0.284 1
1 1385 . 10 1 1 A 119 119 PHE N N 118 126.688 125.485 1.203 1
1 1386 . 10 1 1 A 120 120 LEU H H 119 8.099 8.216 -0.117 1
1 1387 . 10 1 1 A 120 120 LEU HA H 119 3.842 4.023 -0.181 1
1 1397 . 10 1 1 A 120 120 LEU C C 119 179.601 178.436 1.165 1
1 1398 . 10 1 1 A 120 120 LEU CA C 119 58.174 58.045 0.129 1
1 1399 . 10 1 1 A 120 120 LEU CB C 119 40.315 41.447 -1.132 1
1 1403 . 10 1 1 A 120 120 LEU N N 119 117.930 120.396 -2.466 1
1 1404 . 10 1 1 A 121 121 ALA H H 120 7.729 7.605 0.124 1
1 1405 . 10 1 1 A 121 121 ALA HA H 120 3.996 4.083 -0.087 1
1 1409 . 10 1 1 A 121 121 ALA C C 120 180.995 179.681 1.314 1
1 1410 . 10 1 1 A 121 121 ALA CA C 120 54.832 54.611 0.221 1
1 1411 . 10 1 1 A 121 121 ALA CB C 120 17.706 18.208 -0.502 1
1 1412 . 10 1 1 A 121 121 ALA N N 120 123.195 120.854 2.341 1
1 1413 . 10 1 1 A 122 122 PHE H H 121 7.943 7.789 0.154 1
1 1414 . 10 1 1 A 122 122 PHE HA H 121 3.887 3.749 0.138 1
1 1419 . 10 1 1 A 122 122 PHE C C 121 175.410 176.764 -1.354 1
1 1420 . 10 1 1 A 122 122 PHE CA C 121 61.075 60.653 0.422 1
1 1421 . 10 1 1 A 122 122 PHE CB C 121 38.115 38.913 -0.798 1
1 1424 . 10 1 1 A 122 122 PHE N N 121 121.798 119.881 1.917 1
1 1425 . 10 1 1 A 123 123 LYS H H 122 8.468 7.847 0.621 1
1 1426 . 10 1 1 A 123 123 LYS HA H 122 3.077 3.770 -0.693 1
1 1435 . 10 1 1 A 123 123 LYS C C 122 178.453 178.851 -0.398 1
1 1436 . 10 1 1 A 123 123 LYS CA C 122 59.855 59.887 -0.032 1
1 1437 . 10 1 1 A 123 123 LYS CB C 122 32.374 32.070 0.304 1
1 1441 . 10 1 1 A 123 123 LYS N N 122 120.614 118.165 2.449 1
1 1442 . 10 1 1 A 124 124 GLU H H 123 8.100 7.820 0.280 1
1 1443 . 10 1 1 A 124 124 GLU HA H 123 3.652 3.988 -0.336 1
1 1448 . 10 1 1 A 124 124 GLU C C 123 177.743 178.494 -0.751 1
1 1449 . 10 1 1 A 124 124 GLU CA C 123 59.406 59.525 -0.119 1
1 1450 . 10 1 1 A 124 124 GLU CB C 123 28.811 29.046 -0.235 1
1 1452 . 10 1 1 A 124 124 GLU N N 123 117.404 118.966 -1.562 1
1 1453 . 10 1 1 A 125 125 MET H H 124 7.537 7.465 0.072 1
1 1454 . 10 1 1 A 125 125 MET HA H 124 3.860 3.926 -0.066 1
1 1462 . 10 1 1 A 125 125 MET C C 124 179.522 178.288 1.234 1
1 1463 . 10 1 1 A 125 125 MET CA C 124 58.832 58.449 0.383 1
1 1464 . 10 1 1 A 125 125 MET CB C 124 31.765 31.309 0.456 1
1 1467 . 10 1 1 A 125 125 MET N N 124 119.413 118.838 0.575 1
1 1468 . 10 1 1 A 126 126 PHE H H 125 7.148 7.376 -0.228 1
1 1469 . 10 1 1 A 126 126 PHE HA H 125 3.633 4.265 -0.632 1
1 1476 . 10 1 1 A 126 126 PHE C C 125 178.994 178.397 0.597 1
1 1477 . 10 1 1 A 126 126 PHE CA C 125 63.148 61.067 2.081 1
1 1478 . 10 1 1 A 126 126 PHE CB C 125 39.830 38.881 0.949 1
1 1483 . 10 1 1 A 126 126 PHE N N 125 120.013 118.983 1.030 1
1 1484 . 10 1 1 A 127 127 LEU H H 126 8.369 8.587 -0.218 1
1 1485 . 10 1 1 A 127 127 LEU HA H 126 3.972 4.047 -0.075 1
1 1495 . 10 1 1 A 127 127 LEU C C 126 180.621 179.275 1.346 1
1 1496 . 10 1 1 A 127 127 LEU CA C 126 57.944 57.778 0.166 1
1 1497 . 10 1 1 A 127 127 LEU CB C 126 40.543 41.068 -0.525 1
1 1501 . 10 1 1 A 127 127 LEU N N 126 119.692 119.728 -0.036 1
1 1502 . 10 1 1 A 128 128 ASP H H 127 8.578 8.045 0.533 1
1 1503 . 10 1 1 A 128 128 ASP HA H 127 4.308 4.339 -0.031 1
1 1506 . 10 1 1 A 128 128 ASP C C 127 178.254 178.182 0.072 1
1 1507 . 10 1 1 A 128 128 ASP CA C 127 56.964 57.262 -0.298 1
1 1508 . 10 1 1 A 128 128 ASP CB C 127 39.735 40.908 -1.173 1
1 1509 . 10 1 1 A 128 128 ASP N N 127 121.926 119.812 2.114 1
1 1510 . 10 1 1 A 129 129 TYR H H 128 7.710 8.095 -0.385 1
1 1511 . 10 1 1 A 129 129 TYR HA H 128 3.908 4.020 -0.112 1
1 1518 . 10 1 1 A 129 129 TYR C C 128 177.633 177.749 -0.116 1
1 1519 . 10 1 1 A 129 129 TYR CA C 128 61.796 61.385 0.411 1
1 1520 . 10 1 1 A 129 129 TYR CB C 128 39.372 38.512 0.860 1
1 1525 . 10 1 1 A 129 129 TYR N N 128 122.548 120.359 2.189 1
1 1526 . 10 1 1 A 130 130 ARG H H 129 8.622 8.305 0.317 1
1 1527 . 10 1 1 A 130 130 ARG HA H 129 3.722 3.956 -0.234 1
1 1535 . 10 1 1 A 130 130 ARG CA C 129 60.084 59.505 0.579 1
1 1536 . 10 1 1 A 130 130 ARG CB C 129 29.902 29.868 0.034 1
1 1539 . 10 1 1 A 130 130 ARG N N 129 118.302 119.120 -0.818 1
1 1541 . 10 1 1 A 131 131 ALA H H 130 7.936 8.016 -0.080 1
1 1542 . 10 1 1 A 131 131 ALA HA H 130 3.997 4.085 -0.088 1
1 1546 . 10 1 1 A 131 131 ALA C C 130 180.456 179.495 0.961 1
1 1547 . 10 1 1 A 131 131 ALA CA C 130 55.133 54.993 0.140 1
1 1548 . 10 1 1 A 131 131 ALA CB C 130 17.750 18.185 -0.435 1
1 1549 . 10 1 1 A 131 131 ALA N N 130 119.788 121.828 -2.040 1
1 1550 . 10 1 1 A 132 132 GLU H H 131 7.622 7.643 -0.021 1
1 1551 . 10 1 1 A 132 132 GLU HA H 131 3.862 3.983 -0.121 1
1 1556 . 10 1 1 A 132 132 GLU C C 131 179.528 178.454 1.074 1
1 1557 . 10 1 1 A 132 132 GLU CA C 131 58.849 58.821 0.028 1
1 1558 . 10 1 1 A 132 132 GLU CB C 131 28.930 29.322 -0.392 1
1 1560 . 10 1 1 A 132 132 GLU N N 131 118.428 118.716 -0.288 1
1 1561 . 10 1 1 A 133 133 LYS H H 132 7.853 7.569 0.284 1
1 1562 . 10 1 1 A 133 133 LYS HA H 132 3.722 4.056 -0.334 1
1 1571 . 10 1 1 A 133 133 LYS C C 132 175.725 177.464 -1.739 1
1 1572 . 10 1 1 A 133 133 LYS CA C 132 57.544 58.262 -0.718 1
1 1573 . 10 1 1 A 133 133 LYS CB C 132 31.770 31.898 -0.128 1
1 1577 . 10 1 1 A 133 133 LYS N N 132 119.473 118.311 1.162 1
1 1578 . 10 1 1 A 134 134 GLU H H 133 8.151 7.839 0.312 1
1 1579 . 10 1 1 A 134 134 GLU HA H 133 4.161 4.428 -0.267 1
1 1584 . 10 1 1 A 134 134 GLU C C 133 177.453 177.702 -0.249 1
1 1585 . 10 1 1 A 134 134 GLU CA C 133 57.222 56.495 0.727 1
1 1586 . 10 1 1 A 134 134 GLU CB C 133 30.091 30.226 -0.135 1
1 1588 . 10 1 1 A 134 134 GLU N N 133 116.525 117.804 -1.279 1
1 1589 . 10 1 1 A 135 135 GLY H H 134 7.702 7.716 -0.014 1
1 1590 . 10 1 1 A 135 135 GLY HA2 H 134 3.896 4.073 -0.177 1
1 1591 . 10 1 1 A 135 135 GLY HA3 H 134 3.897 4.078 -0.181 1
1 1592 . 10 1 1 A 135 135 GLY C C 134 174.538 175.327 -0.789 1
1 1593 . 10 1 1 A 135 135 GLY CA C 134 45.975 45.291 0.684 1
1 1594 . 10 1 1 A 135 135 GLY N N 134 107.924 107.181 0.743 1
1 1595 . 10 1 1 A 136 136 ARG H H 135 8.045 7.841 0.204 1
1 1596 . 10 1 1 A 136 136 ARG HA H 135 4.323 4.142 0.181 1
1 1604 . 10 1 1 A 136 136 ARG C C 135 175.864 176.538 -0.674 1
1 1605 . 10 1 1 A 136 136 ARG CA C 135 56.016 58.640 -2.624 1
1 1606 . 10 1 1 A 136 136 ARG CB C 135 30.987 30.166 0.821 1
1 1609 . 10 1 1 A 136 136 ARG N N 135 119.708 121.138 -1.430 1
1 1 . 11 1 1 A 14 14 PHE CA C 13 58.199 59.206 -1.007 1
1 2 . 11 1 1 A 14 14 PHE CB C 13 39.717 40.627 -0.910 1
1 3 . 11 1 1 A 15 15 SER H H 14 8.299 8.299 0.000 1
1 4 . 11 1 1 A 15 15 SER HA H 14 4.359 4.385 -0.026 1
1 7 . 11 1 1 A 15 15 SER CA C 14 58.249 61.340 -3.091 1
1 8 . 11 1 1 A 15 15 SER CB C 14 63.936 63.792 0.144 1
1 9 . 11 1 1 A 15 15 SER N N 14 117.379 115.851 1.528 1
1 10 . 11 1 1 A 16 16 SER H H 15 8.255 7.970 0.285 1
1 11 . 11 1 1 A 16 16 SER HA H 15 3.729 4.195 -0.466 1
1 14 . 11 1 1 A 16 16 SER CA C 15 58.224 60.894 -2.670 1
1 15 . 11 1 1 A 16 16 SER CB C 15 63.886 61.785 2.101 1
1 16 . 11 1 1 A 16 16 SER N N 15 117.694 114.346 3.348 1
1 17 . 11 1 1 A 17 17 ALA H H 16 8.333 8.429 -0.096 1
1 18 . 11 1 1 A 17 17 ALA HA H 16 4.252 4.258 -0.006 1
1 22 . 11 1 1 A 17 17 ALA CA C 16 53.377 54.473 -1.096 1
1 23 . 11 1 1 A 17 17 ALA CB C 16 18.896 18.463 0.433 1
1 24 . 11 1 1 A 17 17 ALA N N 16 125.462 124.886 0.576 1
1 25 . 11 1 1 A 18 18 SER H H 17 8.219 7.917 0.302 1
1 26 . 11 1 1 A 18 18 SER HA H 17 4.332 4.823 -0.491 1
1 29 . 11 1 1 A 18 18 SER CA C 17 59.105 57.899 1.206 1
1 30 . 11 1 1 A 18 18 SER CB C 17 63.592 64.219 -0.627 1
1 31 . 11 1 1 A 18 18 SER N N 17 114.821 111.481 3.340 1
1 32 . 11 1 1 A 19 19 ASP H H 18 8.309 8.471 -0.162 1
1 33 . 11 1 1 A 19 19 ASP HA H 18 4.554 5.000 -0.446 1
1 36 . 11 1 1 A 19 19 ASP C C 18 176.528 176.690 -0.162 1
1 37 . 11 1 1 A 19 19 ASP CA C 18 55.272 55.500 -0.228 1
1 38 . 11 1 1 A 19 19 ASP CB C 18 40.883 41.060 -0.177 1
1 39 . 11 1 1 A 19 19 ASP N N 18 123.367 121.344 2.023 1
1 40 . 11 1 1 A 20 20 ALA H H 19 8.133 8.713 -0.580 1
1 41 . 11 1 1 A 20 20 ALA HA H 19 4.170 4.121 0.049 1
1 45 . 11 1 1 A 20 20 ALA C C 19 179.857 178.987 0.870 1
1 46 . 11 1 1 A 20 20 ALA CA C 19 54.341 55.534 -1.193 1
1 47 . 11 1 1 A 20 20 ALA CB C 19 18.660 18.635 0.025 1
1 48 . 11 1 1 A 20 20 ALA N N 19 123.350 123.182 0.168 1
1 49 . 11 1 1 A 21 21 GLU H H 20 8.140 8.110 0.030 1
1 50 . 11 1 1 A 21 21 GLU HA H 20 4.128 4.115 0.013 1
1 55 . 11 1 1 A 21 21 GLU C C 20 177.675 178.716 -1.041 1
1 56 . 11 1 1 A 21 21 GLU CA C 20 58.520 59.367 -0.847 1
1 57 . 11 1 1 A 21 21 GLU CB C 20 29.765 29.458 0.307 1
1 59 . 11 1 1 A 21 21 GLU N N 20 119.063 119.352 -0.289 1
1 60 . 11 1 1 A 22 22 PHE H H 21 8.009 8.096 -0.087 1
1 61 . 11 1 1 A 22 22 PHE HA H 21 4.123 4.419 -0.296 1
1 68 . 11 1 1 A 22 22 PHE C C 21 176.410 177.065 -0.655 1
1 69 . 11 1 1 A 22 22 PHE CA C 21 62.202 61.648 0.554 1
1 70 . 11 1 1 A 22 22 PHE CB C 21 39.223 39.558 -0.335 1
1 75 . 11 1 1 A 22 22 PHE N N 21 121.211 121.114 0.097 1
1 76 . 11 1 1 A 23 23 ASP H H 22 8.261 8.278 -0.017 1
1 77 . 11 1 1 A 23 23 ASP HA H 22 4.041 4.205 -0.164 1
1 80 . 11 1 1 A 23 23 ASP C C 22 179.078 178.754 0.324 1
1 81 . 11 1 1 A 23 23 ASP CA C 22 57.048 57.244 -0.196 1
1 82 . 11 1 1 A 23 23 ASP CB C 22 40.154 39.968 0.186 1
1 83 . 11 1 1 A 23 23 ASP N N 22 116.876 118.349 -1.473 1
1 84 . 11 1 1 A 24 24 ALA H H 23 7.651 7.536 0.115 1
1 85 . 11 1 1 A 24 24 ALA HA H 23 3.785 3.925 -0.140 1
1 89 . 11 1 1 A 24 24 ALA C C 23 179.577 179.458 0.119 1
1 90 . 11 1 1 A 24 24 ALA CA C 23 54.341 55.066 -0.725 1
1 91 . 11 1 1 A 24 24 ALA CB C 23 17.762 18.220 -0.458 1
1 92 . 11 1 1 A 24 24 ALA N N 23 121.873 122.563 -0.690 1
1 93 . 11 1 1 A 25 25 VAL H H 24 7.718 7.920 -0.202 1
1 94 . 11 1 1 A 25 25 VAL HA H 24 3.216 3.687 -0.471 1
1 102 . 11 1 1 A 25 25 VAL C C 24 177.805 178.024 -0.219 1
1 103 . 11 1 1 A 25 25 VAL CA C 24 66.789 67.007 -0.218 1
1 104 . 11 1 1 A 25 25 VAL CB C 24 31.277 31.424 -0.147 1
1 107 . 11 1 1 A 25 25 VAL N N 24 117.890 118.042 -0.152 1
1 108 . 11 1 1 A 26 26 VAL H H 25 7.867 7.746 0.121 1
1 109 . 11 1 1 A 26 26 VAL HA H 25 3.274 3.552 -0.278 1
1 117 . 11 1 1 A 26 26 VAL C C 25 177.788 177.989 -0.201 1
1 118 . 11 1 1 A 26 26 VAL CA C 25 67.282 66.102 1.180 1
1 119 . 11 1 1 A 26 26 VAL CB C 25 31.266 31.308 -0.042 1
1 122 . 11 1 1 A 26 26 VAL N N 25 118.170 119.341 -1.171 1
1 123 . 11 1 1 A 27 27 GLY H H 26 7.544 7.693 -0.149 1
1 124 . 11 1 1 A 27 27 GLY HA2 H 26 3.592 3.509 0.083 1
1 125 . 11 1 1 A 27 27 GLY HA3 H 26 3.721 3.618 0.103 1
1 126 . 11 1 1 A 27 27 GLY C C 26 176.717 176.513 0.204 1
1 127 . 11 1 1 A 27 27 GLY CA C 26 47.085 47.278 -0.193 1
1 128 . 11 1 1 A 27 27 GLY N N 26 105.795 107.457 -1.662 1
1 129 . 11 1 1 A 28 28 TYR H H 27 7.625 7.459 0.166 1
1 130 . 11 1 1 A 28 28 TYR HA H 27 4.546 4.557 -0.011 1
1 137 . 11 1 1 A 28 28 TYR C C 27 178.991 178.157 0.834 1
1 138 . 11 1 1 A 28 28 TYR CA C 27 58.845 59.738 -0.893 1
1 139 . 11 1 1 A 28 28 TYR CB C 27 37.602 37.712 -0.110 1
1 144 . 11 1 1 A 28 28 TYR N N 27 119.933 121.817 -1.884 1
1 145 . 11 1 1 A 29 29 LEU H H 28 8.517 8.502 0.015 1
1 146 . 11 1 1 A 29 29 LEU HA H 28 3.728 3.859 -0.131 1
1 156 . 11 1 1 A 29 29 LEU CA C 28 58.281 58.191 0.090 1
1 157 . 11 1 1 A 29 29 LEU CB C 28 41.948 41.351 0.597 1
1 161 . 11 1 1 A 29 29 LEU N N 28 119.669 120.282 -0.613 1
1 162 . 11 1 1 A 30 30 GLU H H 29 8.072 7.906 0.166 1
1 163 . 11 1 1 A 30 30 GLU HA H 29 3.722 3.911 -0.189 1
1 168 . 11 1 1 A 30 30 GLU C C 29 177.731 178.749 -1.018 1
1 169 . 11 1 1 A 30 30 GLU CA C 29 59.763 59.924 -0.161 1
1 170 . 11 1 1 A 30 30 GLU CB C 29 28.844 29.277 -0.433 1
1 172 . 11 1 1 A 30 30 GLU N N 29 117.666 117.592 0.074 1
1 173 . 11 1 1 A 31 31 ASP H H 30 7.243 7.994 -0.751 1
1 174 . 11 1 1 A 31 31 ASP HA H 30 4.297 4.381 -0.084 1
1 177 . 11 1 1 A 31 31 ASP CA C 30 56.953 57.358 -0.405 1
1 178 . 11 1 1 A 31 31 ASP CB C 30 40.730 42.143 -1.413 1
1 179 . 11 1 1 A 31 31 ASP N N 30 116.720 119.542 -2.822 1
1 180 . 11 1 1 A 32 32 ILE H H 31 7.940 7.628 0.312 1
1 181 . 11 1 1 A 32 32 ILE HA H 31 3.640 3.659 -0.019 1
1 191 . 11 1 1 A 32 32 ILE C C 31 177.980 178.182 -0.202 1
1 192 . 11 1 1 A 32 32 ILE CA C 31 64.692 64.252 0.440 1
1 193 . 11 1 1 A 32 32 ILE CB C 31 38.938 36.759 2.179 1
1 197 . 11 1 1 A 32 32 ILE N N 31 119.728 119.065 0.663 1
1 198 . 11 1 1 A 33 33 ILE H H 32 7.984 7.818 0.166 1
1 199 . 11 1 1 A 33 33 ILE HA H 32 3.598 3.171 0.427 1
1 209 . 11 1 1 A 33 33 ILE C C 32 176.723 177.017 -0.294 1
1 210 . 11 1 1 A 33 33 ILE CA C 32 63.241 64.773 -1.532 1
1 211 . 11 1 1 A 33 33 ILE CB C 32 37.580 37.834 -0.254 1
1 215 . 11 1 1 A 33 33 ILE N N 32 113.919 122.011 -8.092 1
1 216 . 11 1 1 A 34 34 MET H H 33 7.288 7.670 -0.382 1
1 217 . 11 1 1 A 34 34 MET HA H 33 4.496 4.666 -0.170 1
1 225 . 11 1 1 A 34 34 MET C C 33 176.423 175.874 0.549 1
1 226 . 11 1 1 A 34 34 MET CA C 33 54.634 54.345 0.289 1
1 227 . 11 1 1 A 34 34 MET CB C 33 31.934 31.056 0.878 1
1 230 . 11 1 1 A 34 34 MET N N 33 115.130 116.977 -1.847 1
1 231 . 11 1 1 A 35 35 ASP H H 34 7.405 7.637 -0.232 1
1 232 . 11 1 1 A 35 35 ASP HA H 34 4.484 4.610 -0.126 1
1 235 . 11 1 1 A 35 35 ASP C C 34 177.139 176.403 0.736 1
1 236 . 11 1 1 A 35 35 ASP CA C 34 54.625 54.649 -0.024 1
1 237 . 11 1 1 A 35 35 ASP CB C 34 43.554 42.767 0.787 1
1 238 . 11 1 1 A 35 35 ASP N N 34 121.814 122.569 -0.755 1
1 239 . 11 1 1 A 36 36 ASP H H 35 8.765 9.170 -0.405 1
1 240 . 11 1 1 A 36 36 ASP HA H 35 4.235 4.223 0.012 1
1 243 . 11 1 1 A 36 36 ASP C C 35 178.320 177.892 0.428 1
1 244 . 11 1 1 A 36 36 ASP CA C 35 57.832 58.359 -0.527 1
1 245 . 11 1 1 A 36 36 ASP CB C 35 40.914 41.268 -0.354 1
1 246 . 11 1 1 A 36 36 ASP N N 35 125.883 128.322 -2.439 1
1 247 . 11 1 1 A 37 37 GLU H H 36 8.905 8.045 0.860 1
1 248 . 11 1 1 A 37 37 GLU HA H 36 3.933 4.067 -0.134 1
1 253 . 11 1 1 A 37 37 GLU C C 36 179.304 179.199 0.105 1
1 254 . 11 1 1 A 37 37 GLU CA C 36 59.828 59.275 0.553 1
1 255 . 11 1 1 A 37 37 GLU CB C 36 29.380 29.359 0.021 1
1 257 . 11 1 1 A 37 37 GLU N N 36 119.077 119.034 0.043 1
1 258 . 11 1 1 A 38 38 PHE H H 37 7.460 8.351 -0.891 1
1 259 . 11 1 1 A 38 38 PHE HA H 37 3.642 4.083 -0.441 1
1 267 . 11 1 1 A 38 38 PHE C C 37 176.483 177.910 -1.427 1
1 268 . 11 1 1 A 38 38 PHE CA C 37 61.411 61.106 0.305 1
1 269 . 11 1 1 A 38 38 PHE CB C 37 39.355 39.194 0.161 1
1 275 . 11 1 1 A 38 38 PHE N N 37 119.968 120.765 -0.797 1
1 276 . 11 1 1 A 39 39 GLN H H 38 7.968 8.084 -0.116 1
1 277 . 11 1 1 A 39 39 GLN HA H 38 3.712 3.842 -0.130 1
1 284 . 11 1 1 A 39 39 GLN CA C 38 59.153 58.641 0.512 1
1 285 . 11 1 1 A 39 39 GLN CB C 38 28.213 28.388 -0.175 1
1 287 . 11 1 1 A 39 39 GLN N N 38 116.433 118.271 -1.838 1
1 289 . 11 1 1 A 40 40 LEU H H 39 7.930 7.558 0.372 1
1 290 . 11 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 11 1 1 A 40 40 LEU C C 39 177.731 178.024 -0.293 1
1 301 . 11 1 1 A 40 40 LEU CA C 39 57.915 57.979 -0.064 1
1 302 . 11 1 1 A 40 40 LEU CB C 39 41.989 41.747 0.242 1
1 306 . 11 1 1 A 40 40 LEU N N 39 119.505 121.564 -2.059 1
1 307 . 11 1 1 A 41 41 LEU H H 40 7.174 8.024 -0.850 1
1 308 . 11 1 1 A 41 41 LEU HA H 40 3.835 3.959 -0.124 1
1 318 . 11 1 1 A 41 41 LEU C C 40 179.738 178.269 1.469 1
1 319 . 11 1 1 A 41 41 LEU CA C 40 58.266 58.246 0.020 1
1 320 . 11 1 1 A 41 41 LEU CB C 40 42.050 41.620 0.430 1
1 324 . 11 1 1 A 41 41 LEU N N 40 120.971 119.704 1.267 1
1 325 . 11 1 1 A 42 42 GLN H H 41 8.058 7.971 0.087 1
1 326 . 11 1 1 A 42 42 GLN HA H 41 3.556 3.750 -0.194 1
1 333 . 11 1 1 A 42 42 GLN C C 41 177.642 178.548 -0.906 1
1 334 . 11 1 1 A 42 42 GLN CA C 41 59.826 59.302 0.524 1
1 335 . 11 1 1 A 42 42 GLN CB C 41 28.762 28.132 0.630 1
1 337 . 11 1 1 A 42 42 GLN N N 41 117.899 117.908 -0.009 1
1 339 . 11 1 1 A 43 43 ARG H H 42 8.179 7.892 0.287 1
1 340 . 11 1 1 A 43 43 ARG HA H 42 3.655 3.952 -0.297 1
1 347 . 11 1 1 A 43 43 ARG C C 42 178.051 178.296 -0.245 1
1 348 . 11 1 1 A 43 43 ARG CA C 42 59.766 58.780 0.986 1
1 349 . 11 1 1 A 43 43 ARG CB C 42 29.941 30.011 -0.070 1
1 352 . 11 1 1 A 43 43 ARG N N 42 119.392 119.852 -0.460 1
1 353 . 11 1 1 A 44 44 ASN H H 43 8.525 7.901 0.624 1
1 354 . 11 1 1 A 44 44 ASN HA H 43 4.332 4.369 -0.037 1
1 359 . 11 1 1 A 44 44 ASN C C 43 178.150 177.775 0.375 1
1 360 . 11 1 1 A 44 44 ASN CA C 43 55.841 56.155 -0.314 1
1 361 . 11 1 1 A 44 44 ASN CB C 43 37.632 39.139 -1.507 1
1 362 . 11 1 1 A 44 44 ASN N N 43 116.214 117.664 -1.450 1
1 364 . 11 1 1 A 45 45 PHE H H 44 7.586 7.862 -0.276 1
1 365 . 11 1 1 A 45 45 PHE HA H 44 4.132 4.313 -0.181 1
1 372 . 11 1 1 A 45 45 PHE C C 44 176.691 178.641 -1.950 1
1 373 . 11 1 1 A 45 45 PHE CA C 44 62.333 60.900 1.433 1
1 374 . 11 1 1 A 45 45 PHE CB C 44 39.449 38.848 0.601 1
1 379 . 11 1 1 A 45 45 PHE N N 44 121.501 117.666 3.835 1
1 380 . 11 1 1 A 46 46 MET H H 45 8.190 8.327 -0.137 1
1 381 . 11 1 1 A 46 46 MET HA H 45 4.060 4.253 -0.193 1
1 389 . 11 1 1 A 46 46 MET C C 45 179.754 178.206 1.548 1
1 390 . 11 1 1 A 46 46 MET CA C 45 57.742 57.999 -0.257 1
1 391 . 11 1 1 A 46 46 MET CB C 45 29.912 31.317 -1.405 1
1 394 . 11 1 1 A 46 46 MET N N 45 116.727 117.957 -1.230 1
1 395 . 11 1 1 A 47 47 ASP H H 46 8.579 8.204 0.375 1
1 396 . 11 1 1 A 47 47 ASP HA H 46 4.804 4.664 0.140 1
1 399 . 11 1 1 A 47 47 ASP C C 46 177.854 178.514 -0.660 1
1 400 . 11 1 1 A 47 47 ASP CA C 46 57.277 57.274 0.003 1
1 401 . 11 1 1 A 47 47 ASP CB C 46 40.776 41.702 -0.926 1
1 402 . 11 1 1 A 47 47 ASP N N 46 117.798 120.692 -2.894 1
1 403 . 11 1 1 A 48 48 LYS H H 47 7.339 7.962 -0.623 1
1 404 . 11 1 1 A 48 48 LYS HA H 47 3.828 4.223 -0.395 1
1 413 . 11 1 1 A 48 48 LYS C C 47 178.812 178.666 0.146 1
1 414 . 11 1 1 A 48 48 LYS CA C 47 58.953 58.446 0.507 1
1 415 . 11 1 1 A 48 48 LYS CB C 47 32.796 32.866 -0.070 1
1 419 . 11 1 1 A 48 48 LYS N N 47 117.852 119.736 -1.884 1
1 420 . 11 1 1 A 49 49 TYR H H 48 6.841 8.671 -1.830 1
1 421 . 11 1 1 A 49 49 TYR HA H 48 4.995 4.297 0.698 1
1 428 . 11 1 1 A 49 49 TYR C C 48 178.138 178.460 -0.322 1
1 429 . 11 1 1 A 49 49 TYR CA C 48 58.620 59.896 -1.276 1
1 430 . 11 1 1 A 49 49 TYR CB C 48 42.939 38.438 4.501 1
1 435 . 11 1 1 A 49 49 TYR N N 48 112.109 119.823 -7.714 1
1 436 . 11 1 1 A 50 50 TYR H H 49 8.491 8.042 0.449 1
1 437 . 11 1 1 A 50 50 TYR HA H 49 4.598 4.186 0.412 1
1 444 . 11 1 1 A 50 50 TYR C C 49 176.015 178.020 -2.005 1
1 445 . 11 1 1 A 50 50 TYR CA C 49 62.442 59.588 2.854 1
1 446 . 11 1 1 A 50 50 TYR CB C 49 36.588 37.044 -0.456 1
1 451 . 11 1 1 A 50 50 TYR N N 49 118.294 119.246 -0.952 1
1 452 . 11 1 1 A 51 51 LEU H H 50 7.512 7.623 -0.111 1
1 453 . 11 1 1 A 51 51 LEU HA H 50 3.878 3.471 0.407 1
1 463 . 11 1 1 A 51 51 LEU C C 50 178.625 178.476 0.149 1
1 464 . 11 1 1 A 51 51 LEU CA C 50 55.994 57.225 -1.231 1
1 465 . 11 1 1 A 51 51 LEU CB C 50 40.743 41.267 -0.524 1
1 469 . 11 1 1 A 51 51 LEU N N 50 118.478 121.243 -2.765 1
1 470 . 11 1 1 A 52 52 GLU H H 51 8.042 7.882 0.160 1
1 471 . 11 1 1 A 52 52 GLU HA H 51 4.197 3.895 0.302 1
1 476 . 11 1 1 A 52 52 GLU C C 51 177.629 177.670 -0.041 1
1 477 . 11 1 1 A 52 52 GLU CA C 51 56.141 59.458 -3.317 1
1 478 . 11 1 1 A 52 52 GLU CB C 51 29.162 29.086 0.076 1
1 480 . 11 1 1 A 52 52 GLU N N 51 115.067 117.984 -2.917 1
1 481 . 11 1 1 A 53 53 PHE H H 52 7.465 7.957 -0.492 1
1 482 . 11 1 1 A 53 53 PHE HA H 52 4.431 4.649 -0.218 1
1 490 . 11 1 1 A 53 53 PHE C C 52 174.325 174.737 -0.412 1
1 491 . 11 1 1 A 53 53 PHE CA C 52 58.986 56.966 2.020 1
1 492 . 11 1 1 A 53 53 PHE CB C 52 40.183 37.297 2.886 1
1 498 . 11 1 1 A 53 53 PHE N N 52 116.768 118.719 -1.951 1
1 499 . 11 1 1 A 54 54 GLU H H 53 7.484 8.511 -1.027 1
1 500 . 11 1 1 A 54 54 GLU HA H 53 4.583 4.895 -0.312 1
1 505 . 11 1 1 A 54 54 GLU C C 53 175.722 175.732 -0.010 1
1 506 . 11 1 1 A 54 54 GLU CA C 53 54.248 55.072 -0.824 1
1 507 . 11 1 1 A 54 54 GLU CB C 53 34.409 31.347 3.062 1
1 509 . 11 1 1 A 54 54 GLU N N 53 118.844 123.885 -5.041 1
1 510 . 11 1 1 A 55 55 ASP H H 54 9.008 8.616 0.392 1
1 511 . 11 1 1 A 55 55 ASP HA H 54 4.735 4.676 0.059 1
1 514 . 11 1 1 A 55 55 ASP C C 54 175.421 175.542 -0.121 1
1 515 . 11 1 1 A 55 55 ASP CA C 54 52.888 53.894 -1.006 1
1 516 . 11 1 1 A 55 55 ASP CB C 54 38.894 40.221 -1.327 1
1 517 . 11 1 1 A 55 55 ASP N N 54 123.654 123.314 0.340 1
1 518 . 11 1 1 A 56 56 THR H H 55 7.819 8.360 -0.541 1
1 519 . 11 1 1 A 56 56 THR HA H 55 4.574 5.056 -0.482 1
1 524 . 11 1 1 A 56 56 THR C C 55 174.096 174.139 -0.043 1
1 525 . 11 1 1 A 56 56 THR CA C 55 59.172 60.209 -1.037 1
1 526 . 11 1 1 A 56 56 THR CB C 55 71.889 72.280 -0.391 1
1 528 . 11 1 1 A 56 56 THR N N 55 112.015 116.634 -4.619 1
1 529 . 11 1 1 A 57 57 GLU H H 56 8.527 8.530 -0.003 1
1 530 . 11 1 1 A 57 57 GLU HA H 56 4.217 4.719 -0.502 1
1 535 . 11 1 1 A 57 57 GLU C C 56 177.042 176.025 1.017 1
1 536 . 11 1 1 A 57 57 GLU CA C 56 56.869 55.733 1.136 1
1 537 . 11 1 1 A 57 57 GLU CB C 56 29.731 30.590 -0.859 1
1 539 . 11 1 1 A 57 57 GLU N N 56 117.531 119.196 -1.665 1
1 540 . 11 1 1 A 58 58 GLU H H 57 7.587 7.913 -0.326 1
1 541 . 11 1 1 A 58 58 GLU HA H 57 3.941 4.883 -0.942 1
1 546 . 11 1 1 A 58 58 GLU C C 57 176.849 175.634 1.215 1
1 547 . 11 1 1 A 58 58 GLU CA C 57 56.924 55.020 1.904 1
1 548 . 11 1 1 A 58 58 GLU CB C 57 30.251 31.908 -1.657 1
1 550 . 11 1 1 A 58 58 GLU N N 57 119.183 119.960 -0.777 1
1 551 . 11 1 1 A 59 59 ASN H H 58 9.120 8.803 0.317 1
1 552 . 11 1 1 A 59 59 ASN HA H 58 4.922 5.193 -0.271 1
1 557 . 11 1 1 A 59 59 ASN C C 58 174.254 174.444 -0.190 1
1 558 . 11 1 1 A 59 59 ASN CA C 58 51.956 52.764 -0.808 1
1 559 . 11 1 1 A 59 59 ASN CB C 58 37.404 39.428 -2.024 1
1 560 . 11 1 1 A 59 59 ASN N N 58 126.767 121.014 5.753 1
1 562 . 11 1 1 A 60 60 LYS H H 59 5.892 9.241 -3.349 1
1 563 . 11 1 1 A 60 60 LYS HA H 59 3.798 4.587 -0.789 1
1 572 . 11 1 1 A 60 60 LYS C C 59 177.908 177.730 0.178 1
1 573 . 11 1 1 A 60 60 LYS CA C 59 56.623 54.767 1.856 1
1 574 . 11 1 1 A 60 60 LYS CB C 59 32.279 34.244 -1.965 1
1 578 . 11 1 1 A 60 60 LYS N N 59 121.527 124.922 -3.395 1
1 579 . 11 1 1 A 61 61 LEU H H 60 8.473 8.814 -0.341 1
1 580 . 11 1 1 A 61 61 LEU HA H 60 3.891 4.225 -0.334 1
1 590 . 11 1 1 A 61 61 LEU C C 60 179.843 178.480 1.363 1
1 591 . 11 1 1 A 61 61 LEU CA C 60 58.301 56.365 1.936 1
1 592 . 11 1 1 A 61 61 LEU CB C 60 41.305 41.451 -0.146 1
1 596 . 11 1 1 A 61 61 LEU N N 60 125.639 122.996 2.643 1
1 597 . 11 1 1 A 62 62 ILE H H 61 7.698 7.740 -0.042 1
1 598 . 11 1 1 A 62 62 ILE HA H 61 3.952 3.847 0.105 1
1 608 . 11 1 1 A 62 62 ILE C C 61 175.392 177.224 -1.832 1
1 609 . 11 1 1 A 62 62 ILE CA C 61 61.743 63.130 -1.387 1
1 610 . 11 1 1 A 62 62 ILE CB C 61 39.108 37.669 1.439 1
1 614 . 11 1 1 A 62 62 ILE N N 61 114.111 119.664 -5.553 1
1 615 . 11 1 1 A 63 63 TYR H H 62 7.273 7.661 -0.388 1
1 616 . 11 1 1 A 63 63 TYR HA H 62 4.343 4.329 0.014 1
1 623 . 11 1 1 A 63 63 TYR C C 62 178.264 178.634 -0.370 1
1 624 . 11 1 1 A 63 63 TYR CA C 62 57.231 61.119 -3.888 1
1 625 . 11 1 1 A 63 63 TYR CB C 62 36.332 37.402 -1.070 1
1 630 . 11 1 1 A 63 63 TYR N N 62 117.689 121.389 -3.700 1
1 631 . 11 1 1 A 64 64 THR H H 63 7.747 7.912 -0.165 1
1 632 . 11 1 1 A 64 64 THR HA H 63 4.266 4.246 0.020 1
1 637 . 11 1 1 A 64 64 THR CA C 63 69.362 67.558 1.804 1
1 638 . 11 1 1 A 64 64 THR CB C 63 66.962 67.920 -0.958 1
1 640 . 11 1 1 A 64 64 THR N N 63 113.755 116.091 -2.336 1
1 641 . 11 1 1 A 65 65 PRO HA H 64 4.372 4.374 -0.002 1
1 648 . 11 1 1 A 65 65 PRO C C 64 179.913 179.319 0.594 1
1 649 . 11 1 1 A 65 65 PRO CA C 64 66.011 66.125 -0.114 1
1 650 . 11 1 1 A 65 65 PRO CB C 64 30.642 30.674 -0.032 1
1 653 . 11 1 1 A 66 66 ILE H H 65 7.377 7.261 0.116 1
1 654 . 11 1 1 A 66 66 ILE HA H 65 3.530 3.877 -0.347 1
1 664 . 11 1 1 A 66 66 ILE C C 65 177.543 178.497 -0.954 1
1 665 . 11 1 1 A 66 66 ILE CA C 65 66.647 64.342 2.305 1
1 666 . 11 1 1 A 66 66 ILE CB C 65 38.029 37.674 0.355 1
1 670 . 11 1 1 A 66 66 ILE N N 65 118.353 116.780 1.573 1
1 671 . 11 1 1 A 67 67 PHE H H 66 8.480 8.358 0.122 1
1 672 . 11 1 1 A 67 67 PHE HA H 66 4.115 4.278 -0.163 1
1 680 . 11 1 1 A 67 67 PHE C C 66 177.293 177.418 -0.125 1
1 681 . 11 1 1 A 67 67 PHE CA C 66 59.570 62.365 -2.795 1
1 682 . 11 1 1 A 67 67 PHE CB C 66 38.865 39.254 -0.389 1
1 688 . 11 1 1 A 67 67 PHE N N 66 122.420 120.641 1.779 1
1 689 . 11 1 1 A 68 68 ASN H H 67 8.595 8.555 0.040 1
1 690 . 11 1 1 A 68 68 ASN HA H 67 4.211 4.374 -0.163 1
1 695 . 11 1 1 A 68 68 ASN C C 67 178.697 177.897 0.800 1
1 696 . 11 1 1 A 68 68 ASN CA C 67 56.056 56.301 -0.245 1
1 697 . 11 1 1 A 68 68 ASN CB C 67 37.704 38.203 -0.499 1
1 698 . 11 1 1 A 68 68 ASN N N 67 115.573 117.640 -2.067 1
1 700 . 11 1 1 A 69 69 GLU H H 68 8.414 8.052 0.362 1
1 701 . 11 1 1 A 69 69 GLU HA H 68 4.102 4.173 -0.071 1
1 706 . 11 1 1 A 69 69 GLU C C 68 177.880 178.717 -0.837 1
1 707 . 11 1 1 A 69 69 GLU CA C 68 59.399 59.385 0.014 1
1 708 . 11 1 1 A 69 69 GLU CB C 68 29.855 29.497 0.358 1
1 710 . 11 1 1 A 69 69 GLU N N 68 123.510 120.087 3.423 1
1 711 . 11 1 1 A 70 70 TYR H H 69 8.659 8.060 0.599 1
1 712 . 11 1 1 A 70 70 TYR HA H 69 3.362 4.093 -0.731 1
1 719 . 11 1 1 A 70 70 TYR C C 69 178.143 177.118 1.025 1
1 720 . 11 1 1 A 70 70 TYR CA C 69 60.686 60.717 -0.031 1
1 721 . 11 1 1 A 70 70 TYR CB C 69 38.560 38.858 -0.298 1
1 726 . 11 1 1 A 70 70 TYR N N 69 122.130 120.580 1.550 1
1 727 . 11 1 1 A 71 71 ILE H H 70 8.031 7.821 0.210 1
1 728 . 11 1 1 A 71 71 ILE HA H 70 3.265 3.701 -0.436 1
1 738 . 11 1 1 A 71 71 ILE C C 70 178.056 176.999 1.057 1
1 739 . 11 1 1 A 71 71 ILE CA C 70 63.756 63.796 -0.040 1
1 740 . 11 1 1 A 71 71 ILE CB C 70 37.321 36.910 0.411 1
1 744 . 11 1 1 A 71 71 ILE N N 70 118.906 120.416 -1.510 1
1 745 . 11 1 1 A 72 72 SER H H 71 7.803 7.648 0.155 1
1 746 . 11 1 1 A 72 72 SER HA H 71 4.029 4.375 -0.346 1
1 749 . 11 1 1 A 72 72 SER CA C 71 61.380 60.520 0.860 1
1 750 . 11 1 1 A 72 72 SER CB C 71 63.288 63.533 -0.245 1
1 751 . 11 1 1 A 72 72 SER N N 71 113.735 116.554 -2.819 1
1 752 . 11 1 1 A 73 73 LEU H H 72 7.952 8.028 -0.076 1
1 753 . 11 1 1 A 73 73 LEU HA H 72 4.418 4.124 0.294 1
1 763 . 11 1 1 A 73 73 LEU C C 72 177.767 178.354 -0.587 1
1 764 . 11 1 1 A 73 73 LEU CA C 72 56.543 57.432 -0.889 1
1 765 . 11 1 1 A 73 73 LEU CB C 72 44.517 41.679 2.838 1
1 769 . 11 1 1 A 73 73 LEU N N 72 119.411 122.514 -3.103 1
1 770 . 11 1 1 A 74 74 VAL H H 73 8.021 7.470 0.551 1
1 771 . 11 1 1 A 74 74 VAL HA H 73 3.532 3.356 0.176 1
1 779 . 11 1 1 A 74 74 VAL C C 73 177.126 177.909 -0.783 1
1 780 . 11 1 1 A 74 74 VAL CA C 73 66.250 66.428 -0.178 1
1 781 . 11 1 1 A 74 74 VAL CB C 73 31.212 31.114 0.098 1
1 784 . 11 1 1 A 74 74 VAL N N 73 118.747 119.222 -0.475 1
1 785 . 11 1 1 A 75 75 GLU H H 74 7.232 8.050 -0.818 1
1 786 . 11 1 1 A 75 75 GLU HA H 74 3.013 4.297 -1.284 1
1 791 . 11 1 1 A 75 75 GLU C C 74 178.804 179.326 -0.522 1
1 792 . 11 1 1 A 75 75 GLU CA C 74 60.536 59.911 0.625 1
1 793 . 11 1 1 A 75 75 GLU CB C 74 27.009 29.139 -2.130 1
1 795 . 11 1 1 A 75 75 GLU N N 74 118.660 119.781 -1.121 1
1 796 . 11 1 1 A 76 76 LYS H H 75 7.051 8.033 -0.982 1
1 797 . 11 1 1 A 76 76 LYS HA H 75 3.765 4.094 -0.329 1
1 806 . 11 1 1 A 76 76 LYS C C 75 177.765 178.561 -0.796 1
1 807 . 11 1 1 A 76 76 LYS CA C 75 58.357 58.442 -0.085 1
1 808 . 11 1 1 A 76 76 LYS CB C 75 31.939 32.485 -0.546 1
1 812 . 11 1 1 A 76 76 LYS N N 75 116.112 119.481 -3.369 1
1 813 . 11 1 1 A 77 77 TYR H H 76 7.067 7.893 -0.826 1
1 814 . 11 1 1 A 77 77 TYR HA H 76 4.036 4.091 -0.055 1
1 821 . 11 1 1 A 77 77 TYR C C 76 177.752 177.326 0.426 1
1 822 . 11 1 1 A 77 77 TYR CA C 76 61.820 61.298 0.522 1
1 823 . 11 1 1 A 77 77 TYR CB C 76 38.480 38.735 -0.255 1
1 828 . 11 1 1 A 77 77 TYR N N 76 118.434 121.964 -3.530 1
1 829 . 11 1 1 A 78 78 ILE H H 77 7.554 8.177 -0.623 1
1 830 . 11 1 1 A 78 78 ILE HA H 77 3.159 3.503 -0.344 1
1 840 . 11 1 1 A 78 78 ILE C C 77 177.341 177.830 -0.489 1
1 841 . 11 1 1 A 78 78 ILE CA C 77 65.177 64.704 0.473 1
1 842 . 11 1 1 A 78 78 ILE CB C 77 37.339 37.392 -0.053 1
1 846 . 11 1 1 A 78 78 ILE N N 77 117.672 120.488 -2.816 1
1 847 . 11 1 1 A 79 79 GLU H H 78 8.296 7.967 0.329 1
1 848 . 11 1 1 A 79 79 GLU HA H 78 3.557 3.787 -0.230 1
1 853 . 11 1 1 A 79 79 GLU C C 78 177.742 178.694 -0.952 1
1 854 . 11 1 1 A 79 79 GLU CA C 78 60.847 60.082 0.765 1
1 855 . 11 1 1 A 79 79 GLU CB C 78 29.594 29.340 0.254 1
1 857 . 11 1 1 A 79 79 GLU N N 78 118.701 120.588 -1.887 1
1 858 . 11 1 1 A 80 80 GLU H H 79 8.330 8.332 -0.002 1
1 859 . 11 1 1 A 80 80 GLU HA H 79 3.774 4.001 -0.227 1
1 864 . 11 1 1 A 80 80 GLU C C 79 179.926 179.301 0.625 1
1 865 . 11 1 1 A 80 80 GLU CA C 79 59.581 58.924 0.657 1
1 866 . 11 1 1 A 80 80 GLU CB C 79 29.062 28.971 0.091 1
1 868 . 11 1 1 A 80 80 GLU N N 79 116.767 117.905 -1.138 1
1 869 . 11 1 1 A 81 81 GLN H H 80 7.634 7.607 0.027 1
1 870 . 11 1 1 A 81 81 GLN HA H 80 3.605 3.876 -0.271 1
1 877 . 11 1 1 A 81 81 GLN C C 80 179.681 178.514 1.167 1
1 878 . 11 1 1 A 81 81 GLN CA C 80 57.765 58.318 -0.553 1
1 879 . 11 1 1 A 81 81 GLN CB C 80 28.079 27.849 0.230 1
1 881 . 11 1 1 A 81 81 GLN N N 80 116.325 118.679 -2.354 1
1 883 . 11 1 1 A 82 82 LEU H H 81 8.156 7.539 0.617 1
1 884 . 11 1 1 A 82 82 LEU HA H 81 3.536 3.791 -0.255 1
1 894 . 11 1 1 A 82 82 LEU C C 81 178.945 179.192 -0.247 1
1 895 . 11 1 1 A 82 82 LEU CA C 81 57.761 56.902 0.859 1
1 896 . 11 1 1 A 82 82 LEU CB C 81 40.961 41.105 -0.144 1
1 900 . 11 1 1 A 82 82 LEU N N 81 121.546 120.318 1.228 1
1 901 . 11 1 1 A 83 83 LEU H H 82 8.326 8.136 0.190 1
1 902 . 11 1 1 A 83 83 LEU HA H 82 4.198 4.177 0.021 1
1 912 . 11 1 1 A 83 83 LEU C C 82 178.631 179.222 -0.591 1
1 913 . 11 1 1 A 83 83 LEU CA C 82 57.016 57.103 -0.087 1
1 914 . 11 1 1 A 83 83 LEU CB C 82 42.182 40.809 1.373 1
1 918 . 11 1 1 A 83 83 LEU N N 82 120.426 118.862 1.564 1
1 919 . 11 1 1 A 84 84 GLN H H 83 6.992 7.617 -0.625 1
1 920 . 11 1 1 A 84 84 GLN HA H 83 3.877 4.026 -0.149 1
1 927 . 11 1 1 A 84 84 GLN C C 83 177.008 176.736 0.272 1
1 928 . 11 1 1 A 84 84 GLN CA C 83 57.543 58.291 -0.748 1
1 929 . 11 1 1 A 84 84 GLN CB C 83 28.688 28.465 0.223 1
1 931 . 11 1 1 A 84 84 GLN N N 83 114.001 117.257 -3.256 1
1 933 . 11 1 1 A 85 85 ARG H H 84 7.072 7.366 -0.294 1
1 934 . 11 1 1 A 85 85 ARG HA H 84 4.047 4.421 -0.374 1
1 942 . 11 1 1 A 85 85 ARG C C 84 175.999 174.869 1.130 1
1 943 . 11 1 1 A 85 85 ARG CA C 84 56.764 55.582 1.182 1
1 944 . 11 1 1 A 85 85 ARG CB C 84 32.044 32.093 -0.049 1
1 947 . 11 1 1 A 85 85 ARG N N 84 115.827 116.763 -0.936 1
1 949 . 11 1 1 A 86 86 ILE H H 85 8.238 7.358 0.880 1
1 950 . 11 1 1 A 86 86 ILE HA H 85 4.389 4.597 -0.208 1
1 960 . 11 1 1 A 86 86 ILE CA C 85 58.007 57.974 0.033 1
1 961 . 11 1 1 A 86 86 ILE CB C 85 39.604 38.985 0.619 1
1 965 . 11 1 1 A 86 86 ILE N N 85 119.285 119.021 0.264 1
1 966 . 11 1 1 A 87 87 PRO HA H 86 4.392 4.578 -0.186 1
1 973 . 11 1 1 A 87 87 PRO C C 86 177.622 177.423 0.199 1
1 974 . 11 1 1 A 87 87 PRO CA C 86 64.665 64.238 0.427 1
1 975 . 11 1 1 A 87 87 PRO CB C 86 32.020 31.718 0.302 1
1 978 . 11 1 1 A 88 88 GLU H H 87 8.312 8.603 -0.291 1
1 979 . 11 1 1 A 88 88 GLU HA H 87 4.208 4.389 -0.181 1
1 984 . 11 1 1 A 88 88 GLU C C 87 175.554 176.572 -1.018 1
1 985 . 11 1 1 A 88 88 GLU CA C 87 56.045 55.845 0.200 1
1 986 . 11 1 1 A 88 88 GLU CB C 87 28.654 29.390 -0.736 1
1 988 . 11 1 1 A 88 88 GLU N N 87 114.256 115.726 -1.470 1
1 989 . 11 1 1 A 89 89 PHE H H 88 7.946 7.434 0.512 1
1 990 . 11 1 1 A 89 89 PHE HA H 88 3.993 4.356 -0.363 1
1 998 . 11 1 1 A 89 89 PHE C C 88 173.460 175.114 -1.654 1
1 999 . 11 1 1 A 89 89 PHE CA C 88 60.119 59.529 0.590 1
1 1000 . 11 1 1 A 89 89 PHE CB C 88 39.994 39.660 0.334 1
1 1006 . 11 1 1 A 89 89 PHE N N 88 121.550 122.455 -0.905 1
1 1007 . 11 1 1 A 90 90 ASN H H 89 7.266 7.892 -0.626 1
1 1008 . 11 1 1 A 90 90 ASN HA H 89 4.454 4.998 -0.544 1
1 1013 . 11 1 1 A 90 90 ASN C C 89 173.921 175.040 -1.119 1
1 1014 . 11 1 1 A 90 90 ASN CA C 89 51.839 51.563 0.276 1
1 1015 . 11 1 1 A 90 90 ASN CB C 89 40.674 39.187 1.487 1
1 1016 . 11 1 1 A 90 90 ASN N N 89 125.344 124.566 0.778 1
1 1018 . 11 1 1 A 91 91 MET H H 90 8.968 8.836 0.132 1
1 1019 . 11 1 1 A 91 91 MET HA H 90 4.049 4.229 -0.180 1
1 1027 . 11 1 1 A 91 91 MET C C 90 177.475 178.148 -0.673 1
1 1028 . 11 1 1 A 91 91 MET CA C 90 57.758 58.988 -1.230 1
1 1029 . 11 1 1 A 91 91 MET CB C 90 32.250 32.648 -0.398 1
1 1032 . 11 1 1 A 91 91 MET N N 90 127.052 124.326 2.726 1
1 1033 . 11 1 1 A 92 92 ALA H H 91 8.292 8.089 0.203 1
1 1034 . 11 1 1 A 92 92 ALA HA H 91 4.059 4.100 -0.041 1
1 1038 . 11 1 1 A 92 92 ALA C C 91 180.412 180.001 0.411 1
1 1039 . 11 1 1 A 92 92 ALA CA C 91 55.368 55.126 0.242 1
1 1040 . 11 1 1 A 92 92 ALA CB C 91 17.527 18.392 -0.865 1
1 1041 . 11 1 1 A 92 92 ALA N N 91 123.752 121.136 2.616 1
1 1042 . 11 1 1 A 93 93 ALA H H 92 7.931 7.976 -0.045 1
1 1043 . 11 1 1 A 93 93 ALA HA H 92 4.054 4.081 -0.027 1
1 1047 . 11 1 1 A 93 93 ALA C C 92 180.482 179.864 0.618 1
1 1048 . 11 1 1 A 93 93 ALA CA C 92 54.614 54.893 -0.279 1
1 1049 . 11 1 1 A 93 93 ALA CB C 92 18.098 18.187 -0.089 1
1 1050 . 11 1 1 A 93 93 ALA N N 92 121.158 120.009 1.149 1
1 1051 . 11 1 1 A 94 94 PHE H H 93 8.110 7.928 0.182 1
1 1052 . 11 1 1 A 94 94 PHE HA H 93 4.304 4.128 0.176 1
1 1060 . 11 1 1 A 94 94 PHE C C 93 177.350 177.562 -0.212 1
1 1061 . 11 1 1 A 94 94 PHE CA C 93 61.641 61.428 0.213 1
1 1062 . 11 1 1 A 94 94 PHE CB C 93 40.014 39.294 0.720 1
1 1068 . 11 1 1 A 94 94 PHE N N 93 119.807 119.777 0.030 1
1 1069 . 11 1 1 A 95 95 THR H H 94 8.726 8.330 0.396 1
1 1070 . 11 1 1 A 95 95 THR HA H 94 3.569 3.979 -0.410 1
1 1075 . 11 1 1 A 95 95 THR C C 94 176.932 176.967 -0.035 1
1 1076 . 11 1 1 A 95 95 THR CA C 94 66.833 65.536 1.297 1
1 1077 . 11 1 1 A 95 95 THR CB C 94 68.445 68.123 0.322 1
1 1079 . 11 1 1 A 95 95 THR N N 94 113.074 112.518 0.556 1
1 1080 . 11 1 1 A 96 96 THR H H 95 7.657 7.786 -0.129 1
1 1081 . 11 1 1 A 96 96 THR HA H 95 3.945 3.965 -0.020 1
1 1086 . 11 1 1 A 96 96 THR C C 95 176.386 176.151 0.235 1
1 1087 . 11 1 1 A 96 96 THR CA C 95 66.550 66.069 0.481 1
1 1088 . 11 1 1 A 96 96 THR CB C 95 68.583 68.532 0.051 1
1 1090 . 11 1 1 A 96 96 THR N N 95 117.927 116.483 1.444 1
1 1091 . 11 1 1 A 97 97 THR H H 96 7.699 7.551 0.148 1
1 1092 . 11 1 1 A 97 97 THR HA H 96 3.905 3.845 0.060 1
1 1097 . 11 1 1 A 97 97 THR C C 96 176.572 176.359 0.213 1
1 1098 . 11 1 1 A 97 97 THR CA C 96 65.979 66.070 -0.091 1
1 1099 . 11 1 1 A 97 97 THR CB C 96 68.553 68.093 0.460 1
1 1101 . 11 1 1 A 97 97 THR N N 96 118.518 116.525 1.993 1
1 1102 . 11 1 1 A 98 98 LEU H H 97 8.304 8.024 0.280 1
1 1103 . 11 1 1 A 98 98 LEU HA H 97 3.725 3.850 -0.125 1
1 1113 . 11 1 1 A 98 98 LEU C C 97 178.490 178.191 0.299 1
1 1114 . 11 1 1 A 98 98 LEU CA C 97 58.517 57.950 0.567 1
1 1115 . 11 1 1 A 98 98 LEU CB C 97 41.697 41.248 0.449 1
1 1119 . 11 1 1 A 98 98 LEU N N 97 122.882 121.826 1.056 1
1 1120 . 11 1 1 A 99 99 GLN H H 98 7.639 8.475 -0.836 1
1 1121 . 11 1 1 A 99 99 GLN HA H 98 3.927 4.171 -0.244 1
1 1128 . 11 1 1 A 99 99 GLN C C 98 178.068 177.797 0.271 1
1 1129 . 11 1 1 A 99 99 GLN CA C 98 58.735 58.066 0.669 1
1 1130 . 11 1 1 A 99 99 GLN CB C 98 27.986 28.082 -0.096 1
1 1132 . 11 1 1 A 99 99 GLN N N 98 114.302 116.244 -1.942 1
1 1134 . 11 1 1 A 100 100 HIS H H 99 7.575 7.972 -0.397 1
1 1135 . 11 1 1 A 100 100 HIS HA H 99 4.524 4.397 0.127 1
1 1139 . 11 1 1 A 100 100 HIS C C 99 174.789 177.109 -2.320 1
1 1140 . 11 1 1 A 100 100 HIS CA C 99 56.154 58.862 -2.708 1
1 1141 . 11 1 1 A 100 100 HIS CB C 99 28.946 30.409 -1.463 1
1 1143 . 11 1 1 A 100 100 HIS N N 99 114.778 120.078 -5.300 1
1 1144 . 11 1 1 A 101 101 HIS H H 100 7.773 8.449 -0.676 1
1 1145 . 11 1 1 A 101 101 HIS HA H 100 4.704 4.162 0.542 1
1 1149 . 11 1 1 A 101 101 HIS C C 100 174.818 177.133 -2.315 1
1 1150 . 11 1 1 A 101 101 HIS CA C 100 54.830 58.524 -3.694 1
1 1151 . 11 1 1 A 101 101 HIS CB C 100 29.749 28.471 1.278 1
1 1153 . 11 1 1 A 101 101 HIS N N 100 117.397 115.836 1.561 1
1 1154 . 11 1 1 A 102 102 LYS H H 101 7.324 8.361 -1.037 1
1 1155 . 11 1 1 A 102 102 LYS HA H 101 3.611 4.047 -0.436 1
1 1164 . 11 1 1 A 102 102 LYS C C 101 176.823 178.358 -1.535 1
1 1165 . 11 1 1 A 102 102 LYS CA C 101 59.915 58.675 1.240 1
1 1166 . 11 1 1 A 102 102 LYS CB C 101 32.825 31.301 1.524 1
1 1170 . 11 1 1 A 102 102 LYS N N 101 120.533 118.186 2.347 1
1 1171 . 11 1 1 A 103 103 ASP H H 102 8.361 7.533 0.828 1
1 1172 . 11 1 1 A 103 103 ASP HA H 102 4.421 4.417 0.004 1
1 1175 . 11 1 1 A 103 103 ASP C C 102 176.793 177.936 -1.143 1
1 1176 . 11 1 1 A 103 103 ASP CA C 102 55.500 56.016 -0.516 1
1 1177 . 11 1 1 A 103 103 ASP CB C 102 40.178 40.643 -0.465 1
1 1178 . 11 1 1 A 103 103 ASP N N 102 114.814 119.840 -5.026 1
1 1179 . 11 1 1 A 104 104 GLU H H 103 7.858 7.983 -0.125 1
1 1180 . 11 1 1 A 104 104 GLU HA H 103 4.339 4.410 -0.071 1
1 1183 . 11 1 1 A 104 104 GLU C C 103 175.777 176.151 -0.374 1
1 1184 . 11 1 1 A 104 104 GLU CA C 103 56.356 57.861 -1.505 1
1 1185 . 11 1 1 A 104 104 GLU CB C 103 31.293 30.843 0.450 1
1 1186 . 11 1 1 A 104 104 GLU N N 103 116.826 119.205 -2.379 1
1 1187 . 11 1 1 A 105 105 VAL H H 104 7.201 7.331 -0.130 1
1 1188 . 11 1 1 A 105 105 VAL HA H 104 4.296 4.148 0.148 1
1 1196 . 11 1 1 A 105 105 VAL C C 104 174.482 175.420 -0.938 1
1 1197 . 11 1 1 A 105 105 VAL CA C 104 60.370 61.571 -1.201 1
1 1198 . 11 1 1 A 105 105 VAL CB C 104 34.341 33.238 1.103 1
1 1201 . 11 1 1 A 105 105 VAL N N 104 116.422 116.577 -0.155 1
1 1202 . 11 1 1 A 106 106 ALA H H 105 8.487 8.588 -0.101 1
1 1203 . 11 1 1 A 106 106 ALA HA H 105 4.172 4.415 -0.243 1
1 1207 . 11 1 1 A 106 106 ALA C C 105 179.030 178.360 0.670 1
1 1208 . 11 1 1 A 106 106 ALA CA C 105 52.966 51.601 1.365 1
1 1209 . 11 1 1 A 106 106 ALA CB C 105 19.371 18.881 0.490 1
1 1210 . 11 1 1 A 106 106 ALA N N 105 128.313 125.133 3.180 1
1 1211 . 11 1 1 A 107 107 GLY H H 106 8.738 8.757 -0.019 1
1 1212 . 11 1 1 A 107 107 GLY HA2 H 106 3.773 3.877 -0.104 1
1 1213 . 11 1 1 A 107 107 GLY HA3 H 106 3.998 3.935 0.063 1
1 1214 . 11 1 1 A 107 107 GLY C C 106 174.958 175.796 -0.838 1
1 1215 . 11 1 1 A 107 107 GLY CA C 106 47.449 47.142 0.307 1
1 1216 . 11 1 1 A 107 107 GLY N N 106 110.612 110.534 0.078 1
1 1217 . 11 1 1 A 108 108 ASP H H 107 8.535 8.449 0.086 1
1 1218 . 11 1 1 A 108 108 ASP HA H 107 4.333 4.331 0.002 1
1 1221 . 11 1 1 A 108 108 ASP C C 107 179.133 178.249 0.884 1
1 1222 . 11 1 1 A 108 108 ASP CA C 107 56.721 56.806 -0.085 1
1 1223 . 11 1 1 A 108 108 ASP CB C 107 39.336 39.624 -0.288 1
1 1224 . 11 1 1 A 108 108 ASP N N 107 117.474 120.873 -3.399 1
1 1225 . 11 1 1 A 109 109 ILE H H 108 7.459 7.698 -0.239 1
1 1226 . 11 1 1 A 109 109 ILE HA H 108 3.688 3.822 -0.134 1
1 1236 . 11 1 1 A 109 109 ILE C C 108 176.735 178.408 -1.673 1
1 1237 . 11 1 1 A 109 109 ILE CA C 108 63.474 65.356 -1.882 1
1 1238 . 11 1 1 A 109 109 ILE CB C 108 37.340 37.597 -0.257 1
1 1242 . 11 1 1 A 109 109 ILE N N 108 119.609 121.097 -1.488 1
1 1243 . 11 1 1 A 110 110 PHE H H 109 7.920 8.289 -0.369 1
1 1244 . 11 1 1 A 110 110 PHE HA H 109 3.759 4.076 -0.317 1
1 1252 . 11 1 1 A 110 110 PHE C C 109 177.132 177.391 -0.259 1
1 1253 . 11 1 1 A 110 110 PHE CA C 109 62.766 61.245 1.521 1
1 1254 . 11 1 1 A 110 110 PHE CB C 109 39.752 39.281 0.471 1
1 1260 . 11 1 1 A 110 110 PHE N N 109 120.906 120.488 0.418 1
1 1261 . 11 1 1 A 111 111 ASP H H 110 8.639 8.215 0.424 1
1 1262 . 11 1 1 A 111 111 ASP HA H 110 4.216 4.206 0.010 1
1 1265 . 11 1 1 A 111 111 ASP C C 110 178.900 178.416 0.484 1
1 1266 . 11 1 1 A 111 111 ASP CA C 110 57.105 57.226 -0.121 1
1 1267 . 11 1 1 A 111 111 ASP CB C 110 39.697 41.681 -1.984 1
1 1268 . 11 1 1 A 111 111 ASP N N 110 117.124 119.027 -1.903 1
1 1269 . 11 1 1 A 112 112 MET H H 111 7.331 7.526 -0.195 1
1 1270 . 11 1 1 A 112 112 MET HA H 111 4.081 4.138 -0.057 1
1 1278 . 11 1 1 A 112 112 MET C C 111 179.052 178.165 0.887 1
1 1279 . 11 1 1 A 112 112 MET CA C 111 58.202 58.136 0.066 1
1 1280 . 11 1 1 A 112 112 MET CB C 111 31.827 32.368 -0.541 1
1 1283 . 11 1 1 A 112 112 MET N N 111 118.061 119.495 -1.434 1
1 1284 . 11 1 1 A 113 113 LEU H H 112 8.001 8.063 -0.062 1
1 1285 . 11 1 1 A 113 113 LEU HA H 112 3.723 3.584 0.139 1
1 1295 . 11 1 1 A 113 113 LEU C C 112 179.747 178.629 1.118 1
1 1296 . 11 1 1 A 113 113 LEU CA C 112 57.371 57.404 -0.033 1
1 1297 . 11 1 1 A 113 113 LEU CB C 112 40.671 41.083 -0.412 1
1 1301 . 11 1 1 A 113 113 LEU N N 112 120.426 119.676 0.750 1
1 1302 . 11 1 1 A 114 114 LEU H H 113 7.744 7.606 0.138 1
1 1303 . 11 1 1 A 114 114 LEU HA H 113 4.007 3.541 0.466 1
1 1313 . 11 1 1 A 114 114 LEU C C 113 179.358 178.473 0.885 1
1 1314 . 11 1 1 A 114 114 LEU CA C 113 57.202 57.517 -0.315 1
1 1315 . 11 1 1 A 114 114 LEU CB C 113 41.727 41.568 0.159 1
1 1319 . 11 1 1 A 114 114 LEU N N 113 119.584 119.632 -0.048 1
1 1320 . 11 1 1 A 115 115 THR H H 114 7.353 7.667 -0.314 1
1 1321 . 11 1 1 A 115 115 THR HA H 114 4.071 4.134 -0.063 1
1 1327 . 11 1 1 A 115 115 THR C C 114 173.591 176.397 -2.806 1
1 1328 . 11 1 1 A 115 115 THR CA C 114 65.332 64.337 0.995 1
1 1329 . 11 1 1 A 115 115 THR CB C 114 70.319 68.752 1.567 1
1 1331 . 11 1 1 A 115 115 THR N N 114 107.535 112.355 -4.820 1
1 1332 . 11 1 1 A 116 116 PHE H H 115 6.979 7.783 -0.804 1
1 1333 . 11 1 1 A 116 116 PHE HA H 115 5.022 4.251 0.771 1
1 1341 . 11 1 1 A 116 116 PHE C C 115 176.488 176.201 0.287 1
1 1342 . 11 1 1 A 116 116 PHE CA C 115 55.911 60.823 -4.912 1
1 1343 . 11 1 1 A 116 116 PHE CB C 115 38.521 39.176 -0.655 1
1 1349 . 11 1 1 A 116 116 PHE N N 115 112.366 120.030 -7.664 1
1 1350 . 11 1 1 A 117 117 THR H H 116 7.564 7.987 -0.423 1
1 1351 . 11 1 1 A 117 117 THR HA H 116 4.626 4.936 -0.310 1
1 1356 . 11 1 1 A 117 117 THR C C 116 174.085 174.442 -0.357 1
1 1357 . 11 1 1 A 117 117 THR CA C 116 61.636 62.436 -0.800 1
1 1358 . 11 1 1 A 117 117 THR CB C 116 70.915 72.370 -1.455 1
1 1360 . 11 1 1 A 117 117 THR N N 116 105.498 112.143 -6.645 1
1 1361 . 11 1 1 A 118 118 ASP H H 117 8.270 7.477 0.793 1
1 1362 . 11 1 1 A 118 118 ASP HA H 117 4.955 4.976 -0.021 1
1 1365 . 11 1 1 A 118 118 ASP C C 117 176.328 176.257 0.071 1
1 1366 . 11 1 1 A 118 118 ASP CA C 117 53.417 53.810 -0.393 1
1 1367 . 11 1 1 A 118 118 ASP CB C 117 43.388 39.164 4.224 1
1 1368 . 11 1 1 A 118 118 ASP N N 117 124.409 121.411 2.998 1
1 1369 . 11 1 1 A 119 119 PHE H H 118 8.973 8.804 0.169 1
1 1370 . 11 1 1 A 119 119 PHE HA H 118 3.506 4.178 -0.672 1
1 1378 . 11 1 1 A 119 119 PHE CA C 118 61.490 61.352 0.138 1
1 1379 . 11 1 1 A 119 119 PHE CB C 118 39.246 39.474 -0.228 1
1 1385 . 11 1 1 A 119 119 PHE N N 118 126.688 125.558 1.130 1
1 1386 . 11 1 1 A 120 120 LEU H H 119 8.099 8.373 -0.274 1
1 1387 . 11 1 1 A 120 120 LEU HA H 119 3.842 3.919 -0.077 1
1 1397 . 11 1 1 A 120 120 LEU C C 119 179.601 179.381 0.220 1
1 1398 . 11 1 1 A 120 120 LEU CA C 119 58.174 57.913 0.261 1
1 1399 . 11 1 1 A 120 120 LEU CB C 119 40.315 41.066 -0.751 1
1 1403 . 11 1 1 A 120 120 LEU N N 119 117.930 119.986 -2.056 1
1 1404 . 11 1 1 A 121 121 ALA H H 120 7.729 7.559 0.170 1
1 1405 . 11 1 1 A 121 121 ALA HA H 120 3.996 4.082 -0.086 1
1 1409 . 11 1 1 A 121 121 ALA C C 120 180.995 179.557 1.438 1
1 1410 . 11 1 1 A 121 121 ALA CA C 120 54.832 54.699 0.133 1
1 1411 . 11 1 1 A 121 121 ALA CB C 120 17.706 18.292 -0.586 1
1 1412 . 11 1 1 A 121 121 ALA N N 120 123.195 121.279 1.916 1
1 1413 . 11 1 1 A 122 122 PHE H H 121 7.943 7.929 0.014 1
1 1414 . 11 1 1 A 122 122 PHE HA H 121 3.887 3.767 0.120 1
1 1419 . 11 1 1 A 122 122 PHE C C 121 175.410 176.664 -1.254 1
1 1420 . 11 1 1 A 122 122 PHE CA C 121 61.075 60.627 0.448 1
1 1421 . 11 1 1 A 122 122 PHE CB C 121 38.115 38.698 -0.583 1
1 1424 . 11 1 1 A 122 122 PHE N N 121 121.798 120.199 1.599 1
1 1425 . 11 1 1 A 123 123 LYS H H 122 8.468 7.786 0.682 1
1 1426 . 11 1 1 A 123 123 LYS HA H 122 3.077 3.630 -0.553 1
1 1435 . 11 1 1 A 123 123 LYS C C 122 178.453 178.883 -0.430 1
1 1436 . 11 1 1 A 123 123 LYS CA C 122 59.855 59.725 0.130 1
1 1437 . 11 1 1 A 123 123 LYS CB C 122 32.374 32.090 0.284 1
1 1441 . 11 1 1 A 123 123 LYS N N 122 120.614 118.402 2.212 1
1 1442 . 11 1 1 A 124 124 GLU H H 123 8.100 7.859 0.241 1
1 1443 . 11 1 1 A 124 124 GLU HA H 123 3.652 3.997 -0.345 1
1 1448 . 11 1 1 A 124 124 GLU C C 123 177.743 178.486 -0.743 1
1 1449 . 11 1 1 A 124 124 GLU CA C 123 59.406 59.402 0.004 1
1 1450 . 11 1 1 A 124 124 GLU CB C 123 28.811 29.186 -0.375 1
1 1452 . 11 1 1 A 124 124 GLU N N 123 117.404 118.850 -1.446 1
1 1453 . 11 1 1 A 125 125 MET H H 124 7.537 7.611 -0.074 1
1 1454 . 11 1 1 A 125 125 MET HA H 124 3.860 3.951 -0.091 1
1 1462 . 11 1 1 A 125 125 MET C C 124 179.522 178.309 1.213 1
1 1463 . 11 1 1 A 125 125 MET CA C 124 58.832 58.403 0.429 1
1 1464 . 11 1 1 A 125 125 MET CB C 124 31.765 31.531 0.234 1
1 1467 . 11 1 1 A 125 125 MET N N 124 119.413 118.952 0.461 1
1 1468 . 11 1 1 A 126 126 PHE H H 125 7.148 7.432 -0.284 1
1 1469 . 11 1 1 A 126 126 PHE HA H 125 3.633 4.215 -0.582 1
1 1476 . 11 1 1 A 126 126 PHE C C 125 178.994 178.298 0.696 1
1 1477 . 11 1 1 A 126 126 PHE CA C 125 63.148 61.200 1.948 1
1 1478 . 11 1 1 A 126 126 PHE CB C 125 39.830 38.341 1.489 1
1 1483 . 11 1 1 A 126 126 PHE N N 125 120.013 119.048 0.965 1
1 1484 . 11 1 1 A 127 127 LEU H H 126 8.369 8.596 -0.227 1
1 1485 . 11 1 1 A 127 127 LEU HA H 126 3.972 4.003 -0.031 1
1 1495 . 11 1 1 A 127 127 LEU C C 126 180.621 179.158 1.463 1
1 1496 . 11 1 1 A 127 127 LEU CA C 126 57.944 57.888 0.056 1
1 1497 . 11 1 1 A 127 127 LEU CB C 126 40.543 41.006 -0.463 1
1 1501 . 11 1 1 A 127 127 LEU N N 126 119.692 119.617 0.075 1
1 1502 . 11 1 1 A 128 128 ASP H H 127 8.578 8.088 0.490 1
1 1503 . 11 1 1 A 128 128 ASP HA H 127 4.308 4.356 -0.048 1
1 1506 . 11 1 1 A 128 128 ASP C C 127 178.254 178.193 0.061 1
1 1507 . 11 1 1 A 128 128 ASP CA C 127 56.964 57.126 -0.162 1
1 1508 . 11 1 1 A 128 128 ASP CB C 127 39.735 40.861 -1.126 1
1 1509 . 11 1 1 A 128 128 ASP N N 127 121.926 119.763 2.163 1
1 1510 . 11 1 1 A 129 129 TYR H H 128 7.710 8.215 -0.505 1
1 1511 . 11 1 1 A 129 129 TYR HA H 128 3.908 4.013 -0.105 1
1 1518 . 11 1 1 A 129 129 TYR C C 128 177.633 177.511 0.122 1
1 1519 . 11 1 1 A 129 129 TYR CA C 128 61.796 61.562 0.234 1
1 1520 . 11 1 1 A 129 129 TYR CB C 128 39.372 38.493 0.879 1
1 1525 . 11 1 1 A 129 129 TYR N N 128 122.548 120.272 2.276 1
1 1526 . 11 1 1 A 130 130 ARG H H 129 8.622 8.631 -0.009 1
1 1527 . 11 1 1 A 130 130 ARG HA H 129 3.722 4.022 -0.300 1
1 1535 . 11 1 1 A 130 130 ARG CA C 129 60.084 59.769 0.315 1
1 1536 . 11 1 1 A 130 130 ARG CB C 129 29.902 30.052 -0.150 1
1 1539 . 11 1 1 A 130 130 ARG N N 129 118.302 119.320 -1.018 1
1 1541 . 11 1 1 A 131 131 ALA H H 130 7.936 8.101 -0.165 1
1 1542 . 11 1 1 A 131 131 ALA HA H 130 3.997 4.050 -0.053 1
1 1546 . 11 1 1 A 131 131 ALA C C 130 180.456 180.463 -0.007 1
1 1547 . 11 1 1 A 131 131 ALA CA C 130 55.133 54.994 0.139 1
1 1548 . 11 1 1 A 131 131 ALA CB C 130 17.750 18.132 -0.382 1
1 1549 . 11 1 1 A 131 131 ALA N N 130 119.788 120.978 -1.190 1
1 1550 . 11 1 1 A 132 132 GLU H H 131 7.622 7.627 -0.005 1
1 1551 . 11 1 1 A 132 132 GLU HA H 131 3.862 4.009 -0.147 1
1 1556 . 11 1 1 A 132 132 GLU C C 131 179.528 178.849 0.679 1
1 1557 . 11 1 1 A 132 132 GLU CA C 131 58.849 58.820 0.029 1
1 1558 . 11 1 1 A 132 132 GLU CB C 131 28.930 29.405 -0.475 1
1 1560 . 11 1 1 A 132 132 GLU N N 131 118.428 118.495 -0.067 1
1 1561 . 11 1 1 A 133 133 LYS H H 132 7.853 7.653 0.200 1
1 1562 . 11 1 1 A 133 133 LYS HA H 132 3.722 3.965 -0.243 1
1 1571 . 11 1 1 A 133 133 LYS C C 132 175.725 178.407 -2.682 1
1 1572 . 11 1 1 A 133 133 LYS CA C 132 57.544 58.823 -1.279 1
1 1573 . 11 1 1 A 133 133 LYS CB C 132 31.770 31.794 -0.024 1
1 1577 . 11 1 1 A 133 133 LYS N N 132 119.473 118.325 1.148 1
1 1578 . 11 1 1 A 134 134 GLU H H 133 8.151 7.538 0.613 1
1 1579 . 11 1 1 A 134 134 GLU HA H 133 4.161 4.344 -0.183 1
1 1584 . 11 1 1 A 134 134 GLU C C 133 177.453 176.977 0.476 1
1 1585 . 11 1 1 A 134 134 GLU CA C 133 57.222 56.208 1.014 1
1 1586 . 11 1 1 A 134 134 GLU CB C 133 30.091 30.325 -0.234 1
1 1588 . 11 1 1 A 134 134 GLU N N 133 116.525 117.160 -0.635 1
1 1589 . 11 1 1 A 135 135 GLY H H 134 7.702 7.817 -0.115 1
1 1590 . 11 1 1 A 135 135 GLY HA2 H 134 3.896 3.943 -0.047 1
1 1591 . 11 1 1 A 135 135 GLY HA3 H 134 3.897 3.953 -0.056 1
1 1592 . 11 1 1 A 135 135 GLY C C 134 174.538 174.045 0.493 1
1 1593 . 11 1 1 A 135 135 GLY CA C 134 45.975 46.440 -0.465 1
1 1594 . 11 1 1 A 135 135 GLY N N 134 107.924 108.538 -0.614 1
1 1595 . 11 1 1 A 136 136 ARG H H 135 8.045 7.828 0.217 1
1 1596 . 11 1 1 A 136 136 ARG HA H 135 4.323 4.553 -0.230 1
1 1604 . 11 1 1 A 136 136 ARG C C 135 175.864 176.473 -0.609 1
1 1605 . 11 1 1 A 136 136 ARG CA C 135 56.016 57.568 -1.552 1
1 1606 . 11 1 1 A 136 136 ARG CB C 135 30.987 32.959 -1.972 1
1 1609 . 11 1 1 A 136 136 ARG N N 135 119.708 119.804 -0.096 1
1 1 . 12 1 1 A 14 14 PHE CA C 13 58.199 58.115 0.084 1
1 2 . 12 1 1 A 14 14 PHE CB C 13 39.717 42.233 -2.516 1
1 3 . 12 1 1 A 15 15 SER H H 14 8.299 8.402 -0.103 1
1 4 . 12 1 1 A 15 15 SER HA H 14 4.359 4.418 -0.059 1
1 7 . 12 1 1 A 15 15 SER CA C 14 58.249 58.276 -0.027 1
1 8 . 12 1 1 A 15 15 SER CB C 14 63.936 63.515 0.421 1
1 9 . 12 1 1 A 15 15 SER N N 14 117.379 122.830 -5.451 1
1 10 . 12 1 1 A 16 16 SER H H 15 8.255 8.769 -0.514 1
1 11 . 12 1 1 A 16 16 SER HA H 15 3.729 4.829 -1.100 1
1 14 . 12 1 1 A 16 16 SER CA C 15 58.224 58.691 -0.467 1
1 15 . 12 1 1 A 16 16 SER CB C 15 63.886 65.724 -1.838 1
1 16 . 12 1 1 A 16 16 SER N N 15 117.694 122.839 -5.145 1
1 17 . 12 1 1 A 17 17 ALA H H 16 8.333 8.147 0.186 1
1 18 . 12 1 1 A 17 17 ALA HA H 16 4.252 4.230 0.022 1
1 22 . 12 1 1 A 17 17 ALA CA C 16 53.377 54.767 -1.390 1
1 23 . 12 1 1 A 17 17 ALA CB C 16 18.896 18.233 0.663 1
1 24 . 12 1 1 A 17 17 ALA N N 16 125.462 124.192 1.270 1
1 25 . 12 1 1 A 18 18 SER H H 17 8.219 7.837 0.382 1
1 26 . 12 1 1 A 18 18 SER HA H 17 4.332 4.531 -0.199 1
1 29 . 12 1 1 A 18 18 SER CA C 17 59.105 58.087 1.018 1
1 30 . 12 1 1 A 18 18 SER CB C 17 63.592 63.933 -0.341 1
1 31 . 12 1 1 A 18 18 SER N N 17 114.821 108.972 5.849 1
1 32 . 12 1 1 A 19 19 ASP H H 18 8.309 7.718 0.591 1
1 33 . 12 1 1 A 19 19 ASP HA H 18 4.554 4.980 -0.426 1
1 36 . 12 1 1 A 19 19 ASP C C 18 176.528 176.688 -0.160 1
1 37 . 12 1 1 A 19 19 ASP CA C 18 55.272 52.578 2.694 1
1 38 . 12 1 1 A 19 19 ASP CB C 18 40.883 43.710 -2.827 1
1 39 . 12 1 1 A 19 19 ASP N N 18 123.367 120.831 2.536 1
1 40 . 12 1 1 A 20 20 ALA H H 19 8.133 8.576 -0.443 1
1 41 . 12 1 1 A 20 20 ALA HA H 19 4.170 4.087 0.083 1
1 45 . 12 1 1 A 20 20 ALA C C 19 179.857 179.814 0.043 1
1 46 . 12 1 1 A 20 20 ALA CA C 19 54.341 55.109 -0.768 1
1 47 . 12 1 1 A 20 20 ALA CB C 19 18.660 18.347 0.313 1
1 48 . 12 1 1 A 20 20 ALA N N 19 123.350 121.310 2.040 1
1 49 . 12 1 1 A 21 21 GLU H H 20 8.140 8.271 -0.131 1
1 50 . 12 1 1 A 21 21 GLU HA H 20 4.128 4.090 0.038 1
1 55 . 12 1 1 A 21 21 GLU C C 20 177.675 179.309 -1.634 1
1 56 . 12 1 1 A 21 21 GLU CA C 20 58.520 59.461 -0.941 1
1 57 . 12 1 1 A 21 21 GLU CB C 20 29.765 29.727 0.038 1
1 59 . 12 1 1 A 21 21 GLU N N 20 119.063 118.597 0.466 1
1 60 . 12 1 1 A 22 22 PHE H H 21 8.009 8.039 -0.030 1
1 61 . 12 1 1 A 22 22 PHE HA H 21 4.123 4.305 -0.182 1
1 68 . 12 1 1 A 22 22 PHE C C 21 176.410 177.384 -0.974 1
1 69 . 12 1 1 A 22 22 PHE CA C 21 62.202 61.179 1.023 1
1 70 . 12 1 1 A 22 22 PHE CB C 21 39.223 39.227 -0.004 1
1 75 . 12 1 1 A 22 22 PHE N N 21 121.211 121.648 -0.437 1
1 76 . 12 1 1 A 23 23 ASP H H 22 8.261 8.613 -0.352 1
1 77 . 12 1 1 A 23 23 ASP HA H 22 4.041 4.363 -0.322 1
1 80 . 12 1 1 A 23 23 ASP C C 22 179.078 178.312 0.766 1
1 81 . 12 1 1 A 23 23 ASP CA C 22 57.048 57.732 -0.684 1
1 82 . 12 1 1 A 23 23 ASP CB C 22 40.154 41.449 -1.295 1
1 83 . 12 1 1 A 23 23 ASP N N 22 116.876 118.926 -2.050 1
1 84 . 12 1 1 A 24 24 ALA H H 23 7.651 7.576 0.075 1
1 85 . 12 1 1 A 24 24 ALA HA H 23 3.785 3.903 -0.118 1
1 89 . 12 1 1 A 24 24 ALA C C 23 179.577 179.493 0.084 1
1 90 . 12 1 1 A 24 24 ALA CA C 23 54.341 55.003 -0.662 1
1 91 . 12 1 1 A 24 24 ALA CB C 23 17.762 18.342 -0.580 1
1 92 . 12 1 1 A 24 24 ALA N N 23 121.873 121.509 0.364 1
1 93 . 12 1 1 A 25 25 VAL H H 24 7.718 8.083 -0.365 1
1 94 . 12 1 1 A 25 25 VAL HA H 24 3.216 3.706 -0.490 1
1 102 . 12 1 1 A 25 25 VAL C C 24 177.805 178.369 -0.564 1
1 103 . 12 1 1 A 25 25 VAL CA C 24 66.789 66.921 -0.132 1
1 104 . 12 1 1 A 25 25 VAL CB C 24 31.277 31.368 -0.091 1
1 107 . 12 1 1 A 25 25 VAL N N 24 117.890 118.414 -0.524 1
1 108 . 12 1 1 A 26 26 VAL H H 25 7.867 7.701 0.166 1
1 109 . 12 1 1 A 26 26 VAL HA H 25 3.274 3.564 -0.290 1
1 117 . 12 1 1 A 26 26 VAL C C 25 177.788 177.644 0.144 1
1 118 . 12 1 1 A 26 26 VAL CA C 25 67.282 66.227 1.055 1
1 119 . 12 1 1 A 26 26 VAL CB C 25 31.266 31.273 -0.007 1
1 122 . 12 1 1 A 26 26 VAL N N 25 118.170 119.856 -1.686 1
1 123 . 12 1 1 A 27 27 GLY H H 26 7.544 7.630 -0.086 1
1 124 . 12 1 1 A 27 27 GLY HA2 H 26 3.592 3.482 0.110 1
1 125 . 12 1 1 A 27 27 GLY HA3 H 26 3.721 3.606 0.115 1
1 126 . 12 1 1 A 27 27 GLY C C 26 176.717 176.323 0.394 1
1 127 . 12 1 1 A 27 27 GLY CA C 26 47.085 47.173 -0.088 1
1 128 . 12 1 1 A 27 27 GLY N N 26 105.795 107.847 -2.052 1
1 129 . 12 1 1 A 28 28 TYR H H 27 7.625 7.347 0.278 1
1 130 . 12 1 1 A 28 28 TYR HA H 27 4.546 4.703 -0.157 1
1 137 . 12 1 1 A 28 28 TYR C C 27 178.991 178.121 0.870 1
1 138 . 12 1 1 A 28 28 TYR CA C 27 58.845 59.740 -0.895 1
1 139 . 12 1 1 A 28 28 TYR CB C 27 37.602 37.612 -0.010 1
1 144 . 12 1 1 A 28 28 TYR N N 27 119.933 121.494 -1.561 1
1 145 . 12 1 1 A 29 29 LEU H H 28 8.517 8.263 0.254 1
1 146 . 12 1 1 A 29 29 LEU HA H 28 3.728 3.859 -0.131 1
1 156 . 12 1 1 A 29 29 LEU CA C 28 58.281 57.965 0.316 1
1 157 . 12 1 1 A 29 29 LEU CB C 28 41.948 41.444 0.504 1
1 161 . 12 1 1 A 29 29 LEU N N 28 119.669 120.175 -0.506 1
1 162 . 12 1 1 A 30 30 GLU H H 29 8.072 7.936 0.136 1
1 163 . 12 1 1 A 30 30 GLU HA H 29 3.722 3.874 -0.152 1
1 168 . 12 1 1 A 30 30 GLU C C 29 177.731 179.325 -1.594 1
1 169 . 12 1 1 A 30 30 GLU CA C 29 59.763 59.923 -0.160 1
1 170 . 12 1 1 A 30 30 GLU CB C 29 28.844 29.363 -0.519 1
1 172 . 12 1 1 A 30 30 GLU N N 29 117.666 117.711 -0.045 1
1 173 . 12 1 1 A 31 31 ASP H H 30 7.243 7.849 -0.606 1
1 174 . 12 1 1 A 31 31 ASP HA H 30 4.297 4.384 -0.087 1
1 177 . 12 1 1 A 31 31 ASP CA C 30 56.953 57.382 -0.429 1
1 178 . 12 1 1 A 31 31 ASP CB C 30 40.730 40.903 -0.173 1
1 179 . 12 1 1 A 31 31 ASP N N 30 116.720 119.218 -2.498 1
1 180 . 12 1 1 A 32 32 ILE H H 31 7.940 7.429 0.511 1
1 181 . 12 1 1 A 32 32 ILE HA H 31 3.640 3.741 -0.101 1
1 191 . 12 1 1 A 32 32 ILE C C 31 177.980 178.031 -0.051 1
1 192 . 12 1 1 A 32 32 ILE CA C 31 64.692 64.021 0.671 1
1 193 . 12 1 1 A 32 32 ILE CB C 31 38.938 36.874 2.064 1
1 197 . 12 1 1 A 32 32 ILE N N 31 119.728 120.190 -0.462 1
1 198 . 12 1 1 A 33 33 ILE H H 32 7.984 7.882 0.102 1
1 199 . 12 1 1 A 33 33 ILE HA H 32 3.598 3.207 0.391 1
1 209 . 12 1 1 A 33 33 ILE C C 32 176.723 176.861 -0.138 1
1 210 . 12 1 1 A 33 33 ILE CA C 32 63.241 64.247 -1.006 1
1 211 . 12 1 1 A 33 33 ILE CB C 32 37.580 37.378 0.202 1
1 215 . 12 1 1 A 33 33 ILE N N 32 113.919 120.974 -7.055 1
1 216 . 12 1 1 A 34 34 MET H H 33 7.288 7.868 -0.580 1
1 217 . 12 1 1 A 34 34 MET HA H 33 4.496 4.701 -0.205 1
1 225 . 12 1 1 A 34 34 MET C C 33 176.423 175.775 0.648 1
1 226 . 12 1 1 A 34 34 MET CA C 33 54.634 54.169 0.465 1
1 227 . 12 1 1 A 34 34 MET CB C 33 31.934 31.680 0.254 1
1 230 . 12 1 1 A 34 34 MET N N 33 115.130 117.021 -1.891 1
1 231 . 12 1 1 A 35 35 ASP H H 34 7.405 7.551 -0.146 1
1 232 . 12 1 1 A 35 35 ASP HA H 34 4.484 4.574 -0.090 1
1 235 . 12 1 1 A 35 35 ASP C C 34 177.139 176.935 0.204 1
1 236 . 12 1 1 A 35 35 ASP CA C 34 54.625 54.444 0.181 1
1 237 . 12 1 1 A 35 35 ASP CB C 34 43.554 42.554 1.000 1
1 238 . 12 1 1 A 35 35 ASP N N 34 121.814 122.414 -0.600 1
1 239 . 12 1 1 A 36 36 ASP H H 35 8.765 8.804 -0.039 1
1 240 . 12 1 1 A 36 36 ASP HA H 35 4.235 4.331 -0.096 1
1 243 . 12 1 1 A 36 36 ASP C C 35 178.320 178.433 -0.113 1
1 244 . 12 1 1 A 36 36 ASP CA C 35 57.832 57.958 -0.126 1
1 245 . 12 1 1 A 36 36 ASP CB C 35 40.914 40.482 0.432 1
1 246 . 12 1 1 A 36 36 ASP N N 35 125.883 125.386 0.497 1
1 247 . 12 1 1 A 37 37 GLU H H 36 8.905 8.012 0.893 1
1 248 . 12 1 1 A 37 37 GLU HA H 36 3.933 4.147 -0.214 1
1 253 . 12 1 1 A 37 37 GLU C C 36 179.304 179.019 0.285 1
1 254 . 12 1 1 A 37 37 GLU CA C 36 59.828 59.233 0.595 1
1 255 . 12 1 1 A 37 37 GLU CB C 36 29.380 29.245 0.135 1
1 257 . 12 1 1 A 37 37 GLU N N 36 119.077 119.950 -0.873 1
1 258 . 12 1 1 A 38 38 PHE H H 37 7.460 8.229 -0.769 1
1 259 . 12 1 1 A 38 38 PHE HA H 37 3.642 3.974 -0.332 1
1 267 . 12 1 1 A 38 38 PHE C C 37 176.483 178.120 -1.637 1
1 268 . 12 1 1 A 38 38 PHE CA C 37 61.411 61.301 0.110 1
1 269 . 12 1 1 A 38 38 PHE CB C 37 39.355 39.026 0.329 1
1 275 . 12 1 1 A 38 38 PHE N N 37 119.968 120.746 -0.778 1
1 276 . 12 1 1 A 39 39 GLN H H 38 7.968 7.917 0.051 1
1 277 . 12 1 1 A 39 39 GLN HA H 38 3.712 3.851 -0.139 1
1 284 . 12 1 1 A 39 39 GLN CA C 38 59.153 58.782 0.371 1
1 285 . 12 1 1 A 39 39 GLN CB C 38 28.213 28.541 -0.328 1
1 287 . 12 1 1 A 39 39 GLN N N 38 116.433 118.490 -2.057 1
1 289 . 12 1 1 A 40 40 LEU H H 39 7.930 7.617 0.313 1
1 290 . 12 1 1 A 40 40 LEU HA H 39 3.916 4.024 -0.108 1
1 300 . 12 1 1 A 40 40 LEU C C 39 177.731 178.187 -0.456 1
1 301 . 12 1 1 A 40 40 LEU CA C 39 57.915 57.918 -0.003 1
1 302 . 12 1 1 A 40 40 LEU CB C 39 41.989 41.497 0.492 1
1 306 . 12 1 1 A 40 40 LEU N N 39 119.505 121.607 -2.102 1
1 307 . 12 1 1 A 41 41 LEU H H 40 7.174 8.096 -0.922 1
1 308 . 12 1 1 A 41 41 LEU HA H 40 3.835 4.057 -0.222 1
1 318 . 12 1 1 A 41 41 LEU C C 40 179.738 178.141 1.597 1
1 319 . 12 1 1 A 41 41 LEU CA C 40 58.266 58.215 0.051 1
1 320 . 12 1 1 A 41 41 LEU CB C 40 42.050 41.403 0.647 1
1 324 . 12 1 1 A 41 41 LEU N N 40 120.971 119.826 1.145 1
1 325 . 12 1 1 A 42 42 GLN H H 41 8.058 7.846 0.212 1
1 326 . 12 1 1 A 42 42 GLN HA H 41 3.556 3.711 -0.155 1
1 333 . 12 1 1 A 42 42 GLN C C 41 177.642 178.586 -0.944 1
1 334 . 12 1 1 A 42 42 GLN CA C 41 59.826 59.154 0.672 1
1 335 . 12 1 1 A 42 42 GLN CB C 41 28.762 28.090 0.672 1
1 337 . 12 1 1 A 42 42 GLN N N 41 117.899 118.004 -0.105 1
1 339 . 12 1 1 A 43 43 ARG H H 42 8.179 7.734 0.445 1
1 340 . 12 1 1 A 43 43 ARG HA H 42 3.655 4.017 -0.362 1
1 347 . 12 1 1 A 43 43 ARG C C 42 178.051 178.830 -0.779 1
1 348 . 12 1 1 A 43 43 ARG CA C 42 59.766 58.954 0.812 1
1 349 . 12 1 1 A 43 43 ARG CB C 42 29.941 29.611 0.330 1
1 352 . 12 1 1 A 43 43 ARG N N 42 119.392 118.675 0.717 1
1 353 . 12 1 1 A 44 44 ASN H H 43 8.525 8.239 0.286 1
1 354 . 12 1 1 A 44 44 ASN HA H 43 4.332 4.400 -0.068 1
1 359 . 12 1 1 A 44 44 ASN C C 43 178.150 177.827 0.323 1
1 360 . 12 1 1 A 44 44 ASN CA C 43 55.841 56.209 -0.368 1
1 361 . 12 1 1 A 44 44 ASN CB C 43 37.632 39.427 -1.795 1
1 362 . 12 1 1 A 44 44 ASN N N 43 116.214 117.695 -1.481 1
1 364 . 12 1 1 A 45 45 PHE H H 44 7.586 7.823 -0.237 1
1 365 . 12 1 1 A 45 45 PHE HA H 44 4.132 4.324 -0.192 1
1 372 . 12 1 1 A 45 45 PHE C C 44 176.691 178.556 -1.865 1
1 373 . 12 1 1 A 45 45 PHE CA C 44 62.333 60.572 1.761 1
1 374 . 12 1 1 A 45 45 PHE CB C 44 39.449 38.839 0.610 1
1 379 . 12 1 1 A 45 45 PHE N N 44 121.501 117.396 4.105 1
1 380 . 12 1 1 A 46 46 MET H H 45 8.190 8.279 -0.089 1
1 381 . 12 1 1 A 46 46 MET HA H 45 4.060 4.240 -0.180 1
1 389 . 12 1 1 A 46 46 MET C C 45 179.754 178.207 1.547 1
1 390 . 12 1 1 A 46 46 MET CA C 45 57.742 58.016 -0.274 1
1 391 . 12 1 1 A 46 46 MET CB C 45 29.912 31.317 -1.405 1
1 394 . 12 1 1 A 46 46 MET N N 45 116.727 117.625 -0.898 1
1 395 . 12 1 1 A 47 47 ASP H H 46 8.579 8.297 0.282 1
1 396 . 12 1 1 A 47 47 ASP HA H 46 4.804 4.766 0.038 1
1 399 . 12 1 1 A 47 47 ASP C C 46 177.854 177.641 0.213 1
1 400 . 12 1 1 A 47 47 ASP CA C 46 57.277 57.309 -0.032 1
1 401 . 12 1 1 A 47 47 ASP CB C 46 40.776 41.628 -0.852 1
1 402 . 12 1 1 A 47 47 ASP N N 46 117.798 120.827 -3.029 1
1 403 . 12 1 1 A 48 48 LYS H H 47 7.339 7.897 -0.558 1
1 404 . 12 1 1 A 48 48 LYS HA H 47 3.828 4.303 -0.475 1
1 413 . 12 1 1 A 48 48 LYS C C 47 178.812 178.661 0.151 1
1 414 . 12 1 1 A 48 48 LYS CA C 47 58.953 57.491 1.462 1
1 415 . 12 1 1 A 48 48 LYS CB C 47 32.796 33.313 -0.517 1
1 419 . 12 1 1 A 48 48 LYS N N 47 117.852 117.939 -0.087 1
1 420 . 12 1 1 A 49 49 TYR H H 48 6.841 8.516 -1.675 1
1 421 . 12 1 1 A 49 49 TYR HA H 48 4.995 4.284 0.711 1
1 428 . 12 1 1 A 49 49 TYR C C 48 178.138 178.568 -0.430 1
1 429 . 12 1 1 A 49 49 TYR CA C 48 58.620 59.797 -1.177 1
1 430 . 12 1 1 A 49 49 TYR CB C 48 42.939 38.270 4.669 1
1 435 . 12 1 1 A 49 49 TYR N N 48 112.109 119.097 -6.988 1
1 436 . 12 1 1 A 50 50 TYR H H 49 8.491 8.121 0.370 1
1 437 . 12 1 1 A 50 50 TYR HA H 49 4.598 4.193 0.405 1
1 444 . 12 1 1 A 50 50 TYR C C 49 176.015 177.466 -1.451 1
1 445 . 12 1 1 A 50 50 TYR CA C 49 62.442 59.400 3.042 1
1 446 . 12 1 1 A 50 50 TYR CB C 49 36.588 36.934 -0.346 1
1 451 . 12 1 1 A 50 50 TYR N N 49 118.294 118.813 -0.519 1
1 452 . 12 1 1 A 51 51 LEU H H 50 7.512 7.426 0.086 1
1 453 . 12 1 1 A 51 51 LEU HA H 50 3.878 3.573 0.305 1
1 463 . 12 1 1 A 51 51 LEU C C 50 178.625 178.964 -0.339 1
1 464 . 12 1 1 A 51 51 LEU CA C 50 55.994 57.111 -1.117 1
1 465 . 12 1 1 A 51 51 LEU CB C 50 40.743 41.464 -0.721 1
1 469 . 12 1 1 A 51 51 LEU N N 50 118.478 121.820 -3.342 1
1 470 . 12 1 1 A 52 52 GLU H H 51 8.042 7.939 0.103 1
1 471 . 12 1 1 A 52 52 GLU HA H 51 4.197 4.129 0.068 1
1 476 . 12 1 1 A 52 52 GLU C C 51 177.629 177.519 0.110 1
1 477 . 12 1 1 A 52 52 GLU CA C 51 56.141 58.913 -2.772 1
1 478 . 12 1 1 A 52 52 GLU CB C 51 29.162 29.598 -0.436 1
1 480 . 12 1 1 A 52 52 GLU N N 51 115.067 118.039 -2.972 1
1 481 . 12 1 1 A 53 53 PHE H H 52 7.465 7.915 -0.450 1
1 482 . 12 1 1 A 53 53 PHE HA H 52 4.431 4.634 -0.203 1
1 490 . 12 1 1 A 53 53 PHE C C 52 174.325 174.849 -0.524 1
1 491 . 12 1 1 A 53 53 PHE CA C 52 58.986 57.172 1.814 1
1 492 . 12 1 1 A 53 53 PHE CB C 52 40.183 37.599 2.584 1
1 498 . 12 1 1 A 53 53 PHE N N 52 116.768 119.022 -2.254 1
1 499 . 12 1 1 A 54 54 GLU H H 53 7.484 8.652 -1.168 1
1 500 . 12 1 1 A 54 54 GLU HA H 53 4.583 4.782 -0.199 1
1 505 . 12 1 1 A 54 54 GLU C C 53 175.722 175.749 -0.027 1
1 506 . 12 1 1 A 54 54 GLU CA C 53 54.248 55.744 -1.496 1
1 507 . 12 1 1 A 54 54 GLU CB C 53 34.409 31.795 2.614 1
1 509 . 12 1 1 A 54 54 GLU N N 53 118.844 124.415 -5.571 1
1 510 . 12 1 1 A 55 55 ASP H H 54 9.008 8.645 0.363 1
1 511 . 12 1 1 A 55 55 ASP HA H 54 4.735 4.943 -0.208 1
1 514 . 12 1 1 A 55 55 ASP C C 54 175.421 175.973 -0.552 1
1 515 . 12 1 1 A 55 55 ASP CA C 54 52.888 53.768 -0.880 1
1 516 . 12 1 1 A 55 55 ASP CB C 54 38.894 40.554 -1.660 1
1 517 . 12 1 1 A 55 55 ASP N N 54 123.654 123.825 -0.171 1
1 518 . 12 1 1 A 56 56 THR H H 55 7.819 8.142 -0.323 1
1 519 . 12 1 1 A 56 56 THR HA H 55 4.574 4.984 -0.410 1
1 524 . 12 1 1 A 56 56 THR C C 55 174.096 174.102 -0.006 1
1 525 . 12 1 1 A 56 56 THR CA C 55 59.172 60.177 -1.005 1
1 526 . 12 1 1 A 56 56 THR CB C 55 71.889 72.180 -0.291 1
1 528 . 12 1 1 A 56 56 THR N N 55 112.015 114.783 -2.768 1
1 529 . 12 1 1 A 57 57 GLU H H 56 8.527 8.575 -0.048 1
1 530 . 12 1 1 A 57 57 GLU HA H 56 4.217 4.573 -0.356 1
1 535 . 12 1 1 A 57 57 GLU C C 56 177.042 175.495 1.547 1
1 536 . 12 1 1 A 57 57 GLU CA C 56 56.869 56.002 0.867 1
1 537 . 12 1 1 A 57 57 GLU CB C 56 29.731 30.684 -0.953 1
1 539 . 12 1 1 A 57 57 GLU N N 56 117.531 118.560 -1.029 1
1 540 . 12 1 1 A 58 58 GLU H H 57 7.587 7.762 -0.175 1
1 541 . 12 1 1 A 58 58 GLU HA H 57 3.941 5.040 -1.099 1
1 546 . 12 1 1 A 58 58 GLU C C 57 176.849 175.307 1.542 1
1 547 . 12 1 1 A 58 58 GLU CA C 57 56.924 55.050 1.874 1
1 548 . 12 1 1 A 58 58 GLU CB C 57 30.251 32.448 -2.197 1
1 550 . 12 1 1 A 58 58 GLU N N 57 119.183 117.339 1.844 1
1 551 . 12 1 1 A 59 59 ASN H H 58 9.120 8.663 0.457 1
1 552 . 12 1 1 A 59 59 ASN HA H 58 4.922 5.187 -0.265 1
1 557 . 12 1 1 A 59 59 ASN C C 58 174.254 175.035 -0.781 1
1 558 . 12 1 1 A 59 59 ASN CA C 58 51.956 53.310 -1.354 1
1 559 . 12 1 1 A 59 59 ASN CB C 58 37.404 39.460 -2.056 1
1 560 . 12 1 1 A 59 59 ASN N N 58 126.767 121.995 4.772 1
1 562 . 12 1 1 A 60 60 LYS H H 59 5.892 9.364 -3.472 1
1 563 . 12 1 1 A 60 60 LYS HA H 59 3.798 4.563 -0.765 1
1 572 . 12 1 1 A 60 60 LYS C C 59 177.908 177.998 -0.090 1
1 573 . 12 1 1 A 60 60 LYS CA C 59 56.623 54.679 1.944 1
1 574 . 12 1 1 A 60 60 LYS CB C 59 32.279 34.434 -2.155 1
1 578 . 12 1 1 A 60 60 LYS N N 59 121.527 122.298 -0.771 1
1 579 . 12 1 1 A 61 61 LEU H H 60 8.473 8.839 -0.366 1
1 580 . 12 1 1 A 61 61 LEU HA H 60 3.891 4.242 -0.351 1
1 590 . 12 1 1 A 61 61 LEU C C 60 179.843 177.927 1.916 1
1 591 . 12 1 1 A 61 61 LEU CA C 60 58.301 57.262 1.039 1
1 592 . 12 1 1 A 61 61 LEU CB C 60 41.305 41.901 -0.596 1
1 596 . 12 1 1 A 61 61 LEU N N 60 125.639 125.244 0.395 1
1 597 . 12 1 1 A 62 62 ILE H H 61 7.698 7.800 -0.102 1
1 598 . 12 1 1 A 62 62 ILE HA H 61 3.952 3.828 0.124 1
1 608 . 12 1 1 A 62 62 ILE C C 61 175.392 177.155 -1.763 1
1 609 . 12 1 1 A 62 62 ILE CA C 61 61.743 63.237 -1.494 1
1 610 . 12 1 1 A 62 62 ILE CB C 61 39.108 37.659 1.449 1
1 614 . 12 1 1 A 62 62 ILE N N 61 114.111 118.636 -4.525 1
1 615 . 12 1 1 A 63 63 TYR H H 62 7.273 7.699 -0.426 1
1 616 . 12 1 1 A 63 63 TYR HA H 62 4.343 4.162 0.181 1
1 623 . 12 1 1 A 63 63 TYR C C 62 178.264 178.527 -0.263 1
1 624 . 12 1 1 A 63 63 TYR CA C 62 57.231 60.869 -3.638 1
1 625 . 12 1 1 A 63 63 TYR CB C 62 36.332 37.346 -1.014 1
1 630 . 12 1 1 A 63 63 TYR N N 62 117.689 121.279 -3.590 1
1 631 . 12 1 1 A 64 64 THR H H 63 7.747 7.985 -0.238 1
1 632 . 12 1 1 A 64 64 THR HA H 63 4.266 4.215 0.051 1
1 637 . 12 1 1 A 64 64 THR CA C 63 69.362 67.563 1.799 1
1 638 . 12 1 1 A 64 64 THR CB C 63 66.962 67.432 -0.470 1
1 640 . 12 1 1 A 64 64 THR N N 63 113.755 116.218 -2.463 1
1 641 . 12 1 1 A 65 65 PRO HA H 64 4.372 4.368 0.004 1
1 648 . 12 1 1 A 65 65 PRO C C 64 179.913 179.366 0.547 1
1 649 . 12 1 1 A 65 65 PRO CA C 64 66.011 66.186 -0.175 1
1 650 . 12 1 1 A 65 65 PRO CB C 64 30.642 30.662 -0.020 1
1 653 . 12 1 1 A 66 66 ILE H H 65 7.377 7.320 0.057 1
1 654 . 12 1 1 A 66 66 ILE HA H 65 3.530 3.873 -0.343 1
1 664 . 12 1 1 A 66 66 ILE C C 65 177.543 178.365 -0.822 1
1 665 . 12 1 1 A 66 66 ILE CA C 65 66.647 64.207 2.440 1
1 666 . 12 1 1 A 66 66 ILE CB C 65 38.029 37.669 0.360 1
1 670 . 12 1 1 A 66 66 ILE N N 65 118.353 116.611 1.742 1
1 671 . 12 1 1 A 67 67 PHE H H 66 8.480 8.446 0.034 1
1 672 . 12 1 1 A 67 67 PHE HA H 66 4.115 4.355 -0.240 1
1 680 . 12 1 1 A 67 67 PHE C C 66 177.293 177.995 -0.702 1
1 681 . 12 1 1 A 67 67 PHE CA C 66 59.570 62.109 -2.539 1
1 682 . 12 1 1 A 67 67 PHE CB C 66 38.865 39.600 -0.735 1
1 688 . 12 1 1 A 67 67 PHE N N 66 122.420 120.540 1.880 1
1 689 . 12 1 1 A 68 68 ASN H H 67 8.595 8.376 0.219 1
1 690 . 12 1 1 A 68 68 ASN HA H 67 4.211 4.376 -0.165 1
1 695 . 12 1 1 A 68 68 ASN C C 67 178.697 178.198 0.499 1
1 696 . 12 1 1 A 68 68 ASN CA C 67 56.056 56.240 -0.184 1
1 697 . 12 1 1 A 68 68 ASN CB C 67 37.704 38.057 -0.353 1
1 698 . 12 1 1 A 68 68 ASN N N 67 115.573 117.687 -2.114 1
1 700 . 12 1 1 A 69 69 GLU H H 68 8.414 7.974 0.440 1
1 701 . 12 1 1 A 69 69 GLU HA H 68 4.102 4.171 -0.069 1
1 706 . 12 1 1 A 69 69 GLU C C 68 177.880 178.832 -0.952 1
1 707 . 12 1 1 A 69 69 GLU CA C 68 59.399 59.427 -0.028 1
1 708 . 12 1 1 A 69 69 GLU CB C 68 29.855 29.379 0.476 1
1 710 . 12 1 1 A 69 69 GLU N N 68 123.510 119.949 3.561 1
1 711 . 12 1 1 A 70 70 TYR H H 69 8.659 8.103 0.556 1
1 712 . 12 1 1 A 70 70 TYR HA H 69 3.362 4.164 -0.802 1
1 719 . 12 1 1 A 70 70 TYR C C 69 178.143 176.939 1.204 1
1 720 . 12 1 1 A 70 70 TYR CA C 69 60.686 61.493 -0.807 1
1 721 . 12 1 1 A 70 70 TYR CB C 69 38.560 38.798 -0.238 1
1 726 . 12 1 1 A 70 70 TYR N N 69 122.130 120.975 1.155 1
1 727 . 12 1 1 A 71 71 ILE H H 70 8.031 8.027 0.004 1
1 728 . 12 1 1 A 71 71 ILE HA H 70 3.265 3.703 -0.438 1
1 738 . 12 1 1 A 71 71 ILE C C 70 178.056 178.205 -0.149 1
1 739 . 12 1 1 A 71 71 ILE CA C 70 63.756 64.139 -0.383 1
1 740 . 12 1 1 A 71 71 ILE CB C 70 37.321 36.690 0.631 1
1 744 . 12 1 1 A 71 71 ILE N N 70 118.906 120.416 -1.510 1
1 745 . 12 1 1 A 72 72 SER H H 71 7.803 7.675 0.128 1
1 746 . 12 1 1 A 72 72 SER HA H 71 4.029 4.327 -0.298 1
1 749 . 12 1 1 A 72 72 SER CA C 71 61.380 61.093 0.287 1
1 750 . 12 1 1 A 72 72 SER CB C 71 63.288 63.036 0.252 1
1 751 . 12 1 1 A 72 72 SER N N 71 113.735 117.232 -3.497 1
1 752 . 12 1 1 A 73 73 LEU H H 72 7.952 8.062 -0.110 1
1 753 . 12 1 1 A 73 73 LEU HA H 72 4.418 4.165 0.253 1
1 763 . 12 1 1 A 73 73 LEU C C 72 177.767 178.347 -0.580 1
1 764 . 12 1 1 A 73 73 LEU CA C 72 56.543 57.509 -0.966 1
1 765 . 12 1 1 A 73 73 LEU CB C 72 44.517 41.804 2.713 1
1 769 . 12 1 1 A 73 73 LEU N N 72 119.411 122.597 -3.186 1
1 770 . 12 1 1 A 74 74 VAL H H 73 8.021 7.375 0.646 1
1 771 . 12 1 1 A 74 74 VAL HA H 73 3.532 3.317 0.215 1
1 779 . 12 1 1 A 74 74 VAL C C 73 177.126 178.025 -0.899 1
1 780 . 12 1 1 A 74 74 VAL CA C 73 66.250 66.594 -0.344 1
1 781 . 12 1 1 A 74 74 VAL CB C 73 31.212 31.009 0.203 1
1 784 . 12 1 1 A 74 74 VAL N N 73 118.747 119.301 -0.554 1
1 785 . 12 1 1 A 75 75 GLU H H 74 7.232 7.946 -0.714 1
1 786 . 12 1 1 A 75 75 GLU HA H 74 3.013 4.227 -1.214 1
1 791 . 12 1 1 A 75 75 GLU C C 74 178.804 179.372 -0.568 1
1 792 . 12 1 1 A 75 75 GLU CA C 74 60.536 59.845 0.691 1
1 793 . 12 1 1 A 75 75 GLU CB C 74 27.009 29.081 -2.072 1
1 795 . 12 1 1 A 75 75 GLU N N 74 118.660 119.593 -0.933 1
1 796 . 12 1 1 A 76 76 LYS H H 75 7.051 8.035 -0.984 1
1 797 . 12 1 1 A 76 76 LYS HA H 75 3.765 4.155 -0.390 1
1 806 . 12 1 1 A 76 76 LYS C C 75 177.765 178.035 -0.270 1
1 807 . 12 1 1 A 76 76 LYS CA C 75 58.357 58.194 0.163 1
1 808 . 12 1 1 A 76 76 LYS CB C 75 31.939 32.262 -0.323 1
1 812 . 12 1 1 A 76 76 LYS N N 75 116.112 119.601 -3.489 1
1 813 . 12 1 1 A 77 77 TYR H H 76 7.067 7.994 -0.927 1
1 814 . 12 1 1 A 77 77 TYR HA H 76 4.036 4.169 -0.133 1
1 821 . 12 1 1 A 77 77 TYR C C 76 177.752 177.089 0.663 1
1 822 . 12 1 1 A 77 77 TYR CA C 76 61.820 61.262 0.558 1
1 823 . 12 1 1 A 77 77 TYR CB C 76 38.480 38.721 -0.241 1
1 828 . 12 1 1 A 77 77 TYR N N 76 118.434 122.063 -3.629 1
1 829 . 12 1 1 A 78 78 ILE H H 77 7.554 8.518 -0.964 1
1 830 . 12 1 1 A 78 78 ILE HA H 77 3.159 3.599 -0.440 1
1 840 . 12 1 1 A 78 78 ILE C C 77 177.341 177.726 -0.385 1
1 841 . 12 1 1 A 78 78 ILE CA C 77 65.177 65.300 -0.123 1
1 842 . 12 1 1 A 78 78 ILE CB C 77 37.339 37.843 -0.504 1
1 846 . 12 1 1 A 78 78 ILE N N 77 117.672 121.551 -3.879 1
1 847 . 12 1 1 A 79 79 GLU H H 78 8.296 8.168 0.128 1
1 848 . 12 1 1 A 79 79 GLU HA H 78 3.557 3.740 -0.183 1
1 853 . 12 1 1 A 79 79 GLU C C 78 177.742 178.787 -1.045 1
1 854 . 12 1 1 A 79 79 GLU CA C 78 60.847 60.073 0.774 1
1 855 . 12 1 1 A 79 79 GLU CB C 78 29.594 29.114 0.480 1
1 857 . 12 1 1 A 79 79 GLU N N 78 118.701 120.932 -2.231 1
1 858 . 12 1 1 A 80 80 GLU H H 79 8.330 8.267 0.063 1
1 859 . 12 1 1 A 80 80 GLU HA H 79 3.774 3.983 -0.209 1
1 864 . 12 1 1 A 80 80 GLU C C 79 179.926 179.291 0.635 1
1 865 . 12 1 1 A 80 80 GLU CA C 79 59.581 59.007 0.574 1
1 866 . 12 1 1 A 80 80 GLU CB C 79 29.062 29.295 -0.233 1
1 868 . 12 1 1 A 80 80 GLU N N 79 116.767 117.848 -1.081 1
1 869 . 12 1 1 A 81 81 GLN H H 80 7.634 7.638 -0.004 1
1 870 . 12 1 1 A 81 81 GLN HA H 80 3.605 3.863 -0.258 1
1 877 . 12 1 1 A 81 81 GLN C C 80 179.681 178.543 1.138 1
1 878 . 12 1 1 A 81 81 GLN CA C 80 57.765 58.572 -0.807 1
1 879 . 12 1 1 A 81 81 GLN CB C 80 28.079 28.081 -0.002 1
1 881 . 12 1 1 A 81 81 GLN N N 80 116.325 118.662 -2.337 1
1 883 . 12 1 1 A 82 82 LEU H H 81 8.156 7.464 0.692 1
1 884 . 12 1 1 A 82 82 LEU HA H 81 3.536 3.788 -0.252 1
1 894 . 12 1 1 A 82 82 LEU C C 81 178.945 179.312 -0.367 1
1 895 . 12 1 1 A 82 82 LEU CA C 81 57.761 56.789 0.972 1
1 896 . 12 1 1 A 82 82 LEU CB C 81 40.961 40.951 0.010 1
1 900 . 12 1 1 A 82 82 LEU N N 81 121.546 119.960 1.586 1
1 901 . 12 1 1 A 83 83 LEU H H 82 8.326 7.971 0.355 1
1 902 . 12 1 1 A 83 83 LEU HA H 82 4.198 4.156 0.042 1
1 912 . 12 1 1 A 83 83 LEU C C 82 178.631 179.121 -0.490 1
1 913 . 12 1 1 A 83 83 LEU CA C 82 57.016 57.008 0.008 1
1 914 . 12 1 1 A 83 83 LEU CB C 82 42.182 40.753 1.429 1
1 918 . 12 1 1 A 83 83 LEU N N 82 120.426 119.051 1.375 1
1 919 . 12 1 1 A 84 84 GLN H H 83 6.992 7.614 -0.622 1
1 920 . 12 1 1 A 84 84 GLN HA H 83 3.877 4.012 -0.135 1
1 927 . 12 1 1 A 84 84 GLN C C 83 177.008 176.783 0.225 1
1 928 . 12 1 1 A 84 84 GLN CA C 83 57.543 58.353 -0.810 1
1 929 . 12 1 1 A 84 84 GLN CB C 83 28.688 28.517 0.171 1
1 931 . 12 1 1 A 84 84 GLN N N 83 114.001 117.239 -3.238 1
1 933 . 12 1 1 A 85 85 ARG H H 84 7.072 7.357 -0.285 1
1 934 . 12 1 1 A 85 85 ARG HA H 84 4.047 4.407 -0.360 1
1 942 . 12 1 1 A 85 85 ARG C C 84 175.999 174.816 1.183 1
1 943 . 12 1 1 A 85 85 ARG CA C 84 56.764 55.579 1.185 1
1 944 . 12 1 1 A 85 85 ARG CB C 84 32.044 32.127 -0.083 1
1 947 . 12 1 1 A 85 85 ARG N N 84 115.827 116.740 -0.913 1
1 949 . 12 1 1 A 86 86 ILE H H 85 8.238 7.317 0.921 1
1 950 . 12 1 1 A 86 86 ILE HA H 85 4.389 4.531 -0.142 1
1 960 . 12 1 1 A 86 86 ILE CA C 85 58.007 57.842 0.165 1
1 961 . 12 1 1 A 86 86 ILE CB C 85 39.604 38.990 0.614 1
1 965 . 12 1 1 A 86 86 ILE N N 85 119.285 119.190 0.095 1
1 966 . 12 1 1 A 87 87 PRO HA H 86 4.392 4.584 -0.192 1
1 973 . 12 1 1 A 87 87 PRO C C 86 177.622 176.290 1.332 1
1 974 . 12 1 1 A 87 87 PRO CA C 86 64.665 64.212 0.453 1
1 975 . 12 1 1 A 87 87 PRO CB C 86 32.020 31.707 0.313 1
1 978 . 12 1 1 A 88 88 GLU H H 87 8.312 8.206 0.106 1
1 979 . 12 1 1 A 88 88 GLU HA H 87 4.208 4.565 -0.357 1
1 984 . 12 1 1 A 88 88 GLU C C 87 175.554 175.752 -0.198 1
1 985 . 12 1 1 A 88 88 GLU CA C 87 56.045 56.191 -0.146 1
1 986 . 12 1 1 A 88 88 GLU CB C 87 28.654 30.666 -2.012 1
1 988 . 12 1 1 A 88 88 GLU N N 87 114.256 116.769 -2.513 1
1 989 . 12 1 1 A 89 89 PHE H H 88 7.946 7.363 0.583 1
1 990 . 12 1 1 A 89 89 PHE HA H 88 3.993 4.333 -0.340 1
1 998 . 12 1 1 A 89 89 PHE C C 88 173.460 174.714 -1.254 1
1 999 . 12 1 1 A 89 89 PHE CA C 88 60.119 59.575 0.544 1
1 1000 . 12 1 1 A 89 89 PHE CB C 88 39.994 39.641 0.353 1
1 1006 . 12 1 1 A 89 89 PHE N N 88 121.550 123.465 -1.915 1
1 1007 . 12 1 1 A 90 90 ASN H H 89 7.266 7.769 -0.503 1
1 1008 . 12 1 1 A 90 90 ASN HA H 89 4.454 5.060 -0.606 1
1 1013 . 12 1 1 A 90 90 ASN C C 89 173.921 175.159 -1.238 1
1 1014 . 12 1 1 A 90 90 ASN CA C 89 51.839 51.640 0.199 1
1 1015 . 12 1 1 A 90 90 ASN CB C 89 40.674 39.442 1.232 1
1 1016 . 12 1 1 A 90 90 ASN N N 89 125.344 124.824 0.520 1
1 1018 . 12 1 1 A 91 91 MET H H 90 8.968 8.623 0.345 1
1 1019 . 12 1 1 A 91 91 MET HA H 90 4.049 4.267 -0.218 1
1 1027 . 12 1 1 A 91 91 MET C C 90 177.475 178.090 -0.615 1
1 1028 . 12 1 1 A 91 91 MET CA C 90 57.758 57.823 -0.065 1
1 1029 . 12 1 1 A 91 91 MET CB C 90 32.250 32.483 -0.233 1
1 1032 . 12 1 1 A 91 91 MET N N 90 127.052 124.486 2.566 1
1 1033 . 12 1 1 A 92 92 ALA H H 91 8.292 8.012 0.280 1
1 1034 . 12 1 1 A 92 92 ALA HA H 91 4.059 4.153 -0.094 1
1 1038 . 12 1 1 A 92 92 ALA C C 91 180.412 179.624 0.788 1
1 1039 . 12 1 1 A 92 92 ALA CA C 91 55.368 54.841 0.527 1
1 1040 . 12 1 1 A 92 92 ALA CB C 91 17.527 18.619 -1.092 1
1 1041 . 12 1 1 A 92 92 ALA N N 91 123.752 120.963 2.789 1
1 1042 . 12 1 1 A 93 93 ALA H H 92 7.931 8.057 -0.126 1
1 1043 . 12 1 1 A 93 93 ALA HA H 92 4.054 4.088 -0.034 1
1 1047 . 12 1 1 A 93 93 ALA C C 92 180.482 179.951 0.531 1
1 1048 . 12 1 1 A 93 93 ALA CA C 92 54.614 54.861 -0.247 1
1 1049 . 12 1 1 A 93 93 ALA CB C 92 18.098 18.116 -0.018 1
1 1050 . 12 1 1 A 93 93 ALA N N 92 121.158 120.238 0.920 1
1 1051 . 12 1 1 A 94 94 PHE H H 93 8.110 7.845 0.265 1
1 1052 . 12 1 1 A 94 94 PHE HA H 93 4.304 4.169 0.135 1
1 1060 . 12 1 1 A 94 94 PHE C C 93 177.350 177.518 -0.168 1
1 1061 . 12 1 1 A 94 94 PHE CA C 93 61.641 61.395 0.246 1
1 1062 . 12 1 1 A 94 94 PHE CB C 93 40.014 39.238 0.776 1
1 1068 . 12 1 1 A 94 94 PHE N N 93 119.807 119.737 0.070 1
1 1069 . 12 1 1 A 95 95 THR H H 94 8.726 8.124 0.602 1
1 1070 . 12 1 1 A 95 95 THR HA H 94 3.569 3.969 -0.400 1
1 1075 . 12 1 1 A 95 95 THR C C 94 176.932 176.544 0.388 1
1 1076 . 12 1 1 A 95 95 THR CA C 94 66.833 65.426 1.407 1
1 1077 . 12 1 1 A 95 95 THR CB C 94 68.445 68.111 0.334 1
1 1079 . 12 1 1 A 95 95 THR N N 94 113.074 112.649 0.425 1
1 1080 . 12 1 1 A 96 96 THR H H 95 7.657 8.032 -0.375 1
1 1081 . 12 1 1 A 96 96 THR HA H 95 3.945 4.044 -0.099 1
1 1086 . 12 1 1 A 96 96 THR C C 95 176.386 176.743 -0.357 1
1 1087 . 12 1 1 A 96 96 THR CA C 95 66.550 65.544 1.006 1
1 1088 . 12 1 1 A 96 96 THR CB C 95 68.583 69.040 -0.457 1
1 1090 . 12 1 1 A 96 96 THR N N 95 117.927 117.783 0.144 1
1 1091 . 12 1 1 A 97 97 THR H H 96 7.699 7.685 0.014 1
1 1092 . 12 1 1 A 97 97 THR HA H 96 3.905 3.999 -0.094 1
1 1097 . 12 1 1 A 97 97 THR C C 96 176.572 176.622 -0.050 1
1 1098 . 12 1 1 A 97 97 THR CA C 96 65.979 66.368 -0.389 1
1 1099 . 12 1 1 A 97 97 THR CB C 96 68.553 68.372 0.181 1
1 1101 . 12 1 1 A 97 97 THR N N 96 118.518 116.963 1.555 1
1 1102 . 12 1 1 A 98 98 LEU H H 97 8.304 8.170 0.134 1
1 1103 . 12 1 1 A 98 98 LEU HA H 97 3.725 3.823 -0.098 1
1 1113 . 12 1 1 A 98 98 LEU C C 97 178.490 178.753 -0.263 1
1 1114 . 12 1 1 A 98 98 LEU CA C 97 58.517 57.992 0.525 1
1 1115 . 12 1 1 A 98 98 LEU CB C 97 41.697 41.147 0.550 1
1 1119 . 12 1 1 A 98 98 LEU N N 97 122.882 122.170 0.712 1
1 1120 . 12 1 1 A 99 99 GLN H H 98 7.639 7.867 -0.228 1
1 1121 . 12 1 1 A 99 99 GLN HA H 98 3.927 4.051 -0.124 1
1 1128 . 12 1 1 A 99 99 GLN C C 98 178.068 178.689 -0.621 1
1 1129 . 12 1 1 A 99 99 GLN CA C 98 58.735 59.209 -0.474 1
1 1130 . 12 1 1 A 99 99 GLN CB C 98 27.986 28.379 -0.393 1
1 1132 . 12 1 1 A 99 99 GLN N N 98 114.302 118.596 -4.294 1
1 1134 . 12 1 1 A 100 100 HIS H H 99 7.575 7.876 -0.301 1
1 1135 . 12 1 1 A 100 100 HIS HA H 99 4.524 4.409 0.115 1
1 1139 . 12 1 1 A 100 100 HIS C C 99 174.789 177.678 -2.889 1
1 1140 . 12 1 1 A 100 100 HIS CA C 99 56.154 59.990 -3.836 1
1 1141 . 12 1 1 A 100 100 HIS CB C 99 28.946 30.605 -1.659 1
1 1143 . 12 1 1 A 100 100 HIS N N 99 114.778 119.344 -4.566 1
1 1144 . 12 1 1 A 101 101 HIS H H 100 7.773 8.099 -0.326 1
1 1145 . 12 1 1 A 101 101 HIS HA H 100 4.704 4.403 0.301 1
1 1149 . 12 1 1 A 101 101 HIS C C 100 174.818 177.114 -2.296 1
1 1150 . 12 1 1 A 101 101 HIS CA C 100 54.830 58.664 -3.834 1
1 1151 . 12 1 1 A 101 101 HIS CB C 100 29.749 28.621 1.128 1
1 1153 . 12 1 1 A 101 101 HIS N N 100 117.397 117.326 0.071 1
1 1154 . 12 1 1 A 102 102 LYS H H 101 7.324 8.114 -0.790 1
1 1155 . 12 1 1 A 102 102 LYS HA H 101 3.611 4.019 -0.408 1
1 1164 . 12 1 1 A 102 102 LYS C C 101 176.823 178.112 -1.289 1
1 1165 . 12 1 1 A 102 102 LYS CA C 101 59.915 59.012 0.903 1
1 1166 . 12 1 1 A 102 102 LYS CB C 101 32.825 31.980 0.845 1
1 1170 . 12 1 1 A 102 102 LYS N N 101 120.533 122.197 -1.664 1
1 1171 . 12 1 1 A 103 103 ASP H H 102 8.361 7.676 0.685 1
1 1172 . 12 1 1 A 103 103 ASP HA H 102 4.421 4.508 -0.087 1
1 1175 . 12 1 1 A 103 103 ASP C C 102 176.793 177.047 -0.254 1
1 1176 . 12 1 1 A 103 103 ASP CA C 102 55.500 56.225 -0.725 1
1 1177 . 12 1 1 A 103 103 ASP CB C 102 40.178 40.524 -0.346 1
1 1178 . 12 1 1 A 103 103 ASP N N 102 114.814 117.678 -2.864 1
1 1179 . 12 1 1 A 104 104 GLU H H 103 7.858 8.250 -0.392 1
1 1180 . 12 1 1 A 104 104 GLU HA H 103 4.339 4.563 -0.224 1
1 1183 . 12 1 1 A 104 104 GLU C C 103 175.777 176.620 -0.843 1
1 1184 . 12 1 1 A 104 104 GLU CA C 103 56.356 58.041 -1.685 1
1 1185 . 12 1 1 A 104 104 GLU CB C 103 31.293 31.716 -0.423 1
1 1186 . 12 1 1 A 104 104 GLU N N 103 116.826 119.254 -2.428 1
1 1187 . 12 1 1 A 105 105 VAL H H 104 7.201 7.837 -0.636 1
1 1188 . 12 1 1 A 105 105 VAL HA H 104 4.296 4.140 0.156 1
1 1196 . 12 1 1 A 105 105 VAL C C 104 174.482 175.580 -1.098 1
1 1197 . 12 1 1 A 105 105 VAL CA C 104 60.370 62.637 -2.267 1
1 1198 . 12 1 1 A 105 105 VAL CB C 104 34.341 32.819 1.522 1
1 1201 . 12 1 1 A 105 105 VAL N N 104 116.422 119.795 -3.373 1
1 1202 . 12 1 1 A 106 106 ALA H H 105 8.487 8.453 0.034 1
1 1203 . 12 1 1 A 106 106 ALA HA H 105 4.172 4.386 -0.214 1
1 1207 . 12 1 1 A 106 106 ALA C C 105 179.030 178.880 0.150 1
1 1208 . 12 1 1 A 106 106 ALA CA C 105 52.966 52.675 0.291 1
1 1209 . 12 1 1 A 106 106 ALA CB C 105 19.371 19.645 -0.274 1
1 1210 . 12 1 1 A 106 106 ALA N N 105 128.313 128.655 -0.342 1
1 1211 . 12 1 1 A 107 107 GLY H H 106 8.738 8.805 -0.067 1
1 1212 . 12 1 1 A 107 107 GLY HA2 H 106 3.773 3.875 -0.102 1
1 1213 . 12 1 1 A 107 107 GLY HA3 H 106 3.998 3.942 0.056 1
1 1214 . 12 1 1 A 107 107 GLY C C 106 174.958 175.545 -0.587 1
1 1215 . 12 1 1 A 107 107 GLY CA C 106 47.449 47.188 0.261 1
1 1216 . 12 1 1 A 107 107 GLY N N 106 110.612 110.887 -0.275 1
1 1217 . 12 1 1 A 108 108 ASP H H 107 8.535 8.364 0.171 1
1 1218 . 12 1 1 A 108 108 ASP HA H 107 4.333 4.376 -0.043 1
1 1221 . 12 1 1 A 108 108 ASP C C 107 179.133 178.828 0.305 1
1 1222 . 12 1 1 A 108 108 ASP CA C 107 56.721 57.008 -0.287 1
1 1223 . 12 1 1 A 108 108 ASP CB C 107 39.336 41.365 -2.029 1
1 1224 . 12 1 1 A 108 108 ASP N N 107 117.474 121.517 -4.043 1
1 1225 . 12 1 1 A 109 109 ILE H H 108 7.459 7.876 -0.417 1
1 1226 . 12 1 1 A 109 109 ILE HA H 108 3.688 3.809 -0.121 1
1 1236 . 12 1 1 A 109 109 ILE C C 108 176.735 178.441 -1.706 1
1 1237 . 12 1 1 A 109 109 ILE CA C 108 63.474 65.406 -1.932 1
1 1238 . 12 1 1 A 109 109 ILE CB C 108 37.340 37.601 -0.261 1
1 1242 . 12 1 1 A 109 109 ILE N N 108 119.609 119.630 -0.021 1
1 1243 . 12 1 1 A 110 110 PHE H H 109 7.920 8.354 -0.434 1
1 1244 . 12 1 1 A 110 110 PHE HA H 109 3.759 4.098 -0.339 1
1 1252 . 12 1 1 A 110 110 PHE C C 109 177.132 177.406 -0.274 1
1 1253 . 12 1 1 A 110 110 PHE CA C 109 62.766 61.245 1.521 1
1 1254 . 12 1 1 A 110 110 PHE CB C 109 39.752 39.315 0.437 1
1 1260 . 12 1 1 A 110 110 PHE N N 109 120.906 120.426 0.480 1
1 1261 . 12 1 1 A 111 111 ASP H H 110 8.639 8.244 0.395 1
1 1262 . 12 1 1 A 111 111 ASP HA H 110 4.216 4.226 -0.010 1
1 1265 . 12 1 1 A 111 111 ASP C C 110 178.900 178.395 0.505 1
1 1266 . 12 1 1 A 111 111 ASP CA C 110 57.105 57.247 -0.142 1
1 1267 . 12 1 1 A 111 111 ASP CB C 110 39.697 41.702 -2.005 1
1 1268 . 12 1 1 A 111 111 ASP N N 110 117.124 119.055 -1.931 1
1 1269 . 12 1 1 A 112 112 MET H H 111 7.331 7.541 -0.210 1
1 1270 . 12 1 1 A 112 112 MET HA H 111 4.081 4.144 -0.063 1
1 1278 . 12 1 1 A 112 112 MET C C 111 179.052 178.177 0.875 1
1 1279 . 12 1 1 A 112 112 MET CA C 111 58.202 58.133 0.069 1
1 1280 . 12 1 1 A 112 112 MET CB C 111 31.827 32.408 -0.581 1
1 1283 . 12 1 1 A 112 112 MET N N 111 118.061 119.462 -1.401 1
1 1284 . 12 1 1 A 113 113 LEU H H 112 8.001 8.064 -0.063 1
1 1285 . 12 1 1 A 113 113 LEU HA H 112 3.723 3.624 0.099 1
1 1295 . 12 1 1 A 113 113 LEU C C 112 179.747 178.709 1.038 1
1 1296 . 12 1 1 A 113 113 LEU CA C 112 57.371 57.472 -0.101 1
1 1297 . 12 1 1 A 113 113 LEU CB C 112 40.671 41.183 -0.512 1
1 1301 . 12 1 1 A 113 113 LEU N N 112 120.426 119.859 0.567 1
1 1302 . 12 1 1 A 114 114 LEU H H 113 7.744 7.624 0.120 1
1 1303 . 12 1 1 A 114 114 LEU HA H 113 4.007 3.528 0.479 1
1 1313 . 12 1 1 A 114 114 LEU C C 113 179.358 178.530 0.828 1
1 1314 . 12 1 1 A 114 114 LEU CA C 113 57.202 57.517 -0.315 1
1 1315 . 12 1 1 A 114 114 LEU CB C 113 41.727 41.578 0.149 1
1 1319 . 12 1 1 A 114 114 LEU N N 113 119.584 119.654 -0.070 1
1 1320 . 12 1 1 A 115 115 THR H H 114 7.353 7.579 -0.226 1
1 1321 . 12 1 1 A 115 115 THR HA H 114 4.071 4.057 0.014 1
1 1327 . 12 1 1 A 115 115 THR C C 114 173.591 176.271 -2.680 1
1 1328 . 12 1 1 A 115 115 THR CA C 114 65.332 64.590 0.742 1
1 1329 . 12 1 1 A 115 115 THR CB C 114 70.319 68.494 1.825 1
1 1331 . 12 1 1 A 115 115 THR N N 114 107.535 112.320 -4.785 1
1 1332 . 12 1 1 A 116 116 PHE H H 115 6.979 7.932 -0.953 1
1 1333 . 12 1 1 A 116 116 PHE HA H 115 5.022 4.388 0.634 1
1 1341 . 12 1 1 A 116 116 PHE C C 115 176.488 175.982 0.506 1
1 1342 . 12 1 1 A 116 116 PHE CA C 115 55.911 61.091 -5.180 1
1 1343 . 12 1 1 A 116 116 PHE CB C 115 38.521 38.992 -0.471 1
1 1349 . 12 1 1 A 116 116 PHE N N 115 112.366 120.036 -7.670 1
1 1350 . 12 1 1 A 117 117 THR H H 116 7.564 8.050 -0.486 1
1 1351 . 12 1 1 A 117 117 THR HA H 116 4.626 4.880 -0.254 1
1 1356 . 12 1 1 A 117 117 THR C C 116 174.085 173.933 0.152 1
1 1357 . 12 1 1 A 117 117 THR CA C 116 61.636 62.509 -0.873 1
1 1358 . 12 1 1 A 117 117 THR CB C 116 70.915 72.363 -1.448 1
1 1360 . 12 1 1 A 117 117 THR N N 116 105.498 112.895 -7.397 1
1 1361 . 12 1 1 A 118 118 ASP H H 117 8.270 7.604 0.666 1
1 1362 . 12 1 1 A 118 118 ASP HA H 117 4.955 5.010 -0.055 1
1 1365 . 12 1 1 A 118 118 ASP C C 117 176.328 176.141 0.187 1
1 1366 . 12 1 1 A 118 118 ASP CA C 117 53.417 53.219 0.198 1
1 1367 . 12 1 1 A 118 118 ASP CB C 117 43.388 38.705 4.683 1
1 1368 . 12 1 1 A 118 118 ASP N N 117 124.409 121.261 3.148 1
1 1369 . 12 1 1 A 119 119 PHE H H 118 8.973 8.639 0.334 1
1 1370 . 12 1 1 A 119 119 PHE HA H 118 3.506 4.235 -0.729 1
1 1378 . 12 1 1 A 119 119 PHE CA C 118 61.490 61.122 0.368 1
1 1379 . 12 1 1 A 119 119 PHE CB C 118 39.246 39.543 -0.297 1
1 1385 . 12 1 1 A 119 119 PHE N N 118 126.688 125.379 1.309 1
1 1386 . 12 1 1 A 120 120 LEU H H 119 8.099 8.278 -0.179 1
1 1387 . 12 1 1 A 120 120 LEU HA H 119 3.842 4.033 -0.191 1
1 1397 . 12 1 1 A 120 120 LEU C C 119 179.601 178.609 0.992 1
1 1398 . 12 1 1 A 120 120 LEU CA C 119 58.174 58.047 0.127 1
1 1399 . 12 1 1 A 120 120 LEU CB C 119 40.315 41.347 -1.032 1
1 1403 . 12 1 1 A 120 120 LEU N N 119 117.930 120.380 -2.450 1
1 1404 . 12 1 1 A 121 121 ALA H H 120 7.729 7.556 0.173 1
1 1405 . 12 1 1 A 121 121 ALA HA H 120 3.996 4.092 -0.096 1
1 1409 . 12 1 1 A 121 121 ALA C C 120 180.995 179.582 1.413 1
1 1410 . 12 1 1 A 121 121 ALA CA C 120 54.832 54.637 0.195 1
1 1411 . 12 1 1 A 121 121 ALA CB C 120 17.706 18.329 -0.623 1
1 1412 . 12 1 1 A 121 121 ALA N N 120 123.195 121.147 2.048 1
1 1413 . 12 1 1 A 122 122 PHE H H 121 7.943 7.876 0.067 1
1 1414 . 12 1 1 A 122 122 PHE HA H 121 3.887 3.847 0.040 1
1 1419 . 12 1 1 A 122 122 PHE C C 121 175.410 176.843 -1.433 1
1 1420 . 12 1 1 A 122 122 PHE CA C 121 61.075 60.699 0.376 1
1 1421 . 12 1 1 A 122 122 PHE CB C 121 38.115 38.776 -0.661 1
1 1424 . 12 1 1 A 122 122 PHE N N 121 121.798 120.450 1.348 1
1 1425 . 12 1 1 A 123 123 LYS H H 122 8.468 7.906 0.562 1
1 1426 . 12 1 1 A 123 123 LYS HA H 122 3.077 3.942 -0.865 1
1 1435 . 12 1 1 A 123 123 LYS C C 122 178.453 178.982 -0.529 1
1 1436 . 12 1 1 A 123 123 LYS CA C 122 59.855 60.005 -0.150 1
1 1437 . 12 1 1 A 123 123 LYS CB C 122 32.374 32.401 -0.027 1
1 1441 . 12 1 1 A 123 123 LYS N N 122 120.614 118.354 2.260 1
1 1442 . 12 1 1 A 124 124 GLU H H 123 8.100 7.887 0.213 1
1 1443 . 12 1 1 A 124 124 GLU HA H 123 3.652 4.043 -0.391 1
1 1448 . 12 1 1 A 124 124 GLU C C 123 177.743 178.523 -0.780 1
1 1449 . 12 1 1 A 124 124 GLU CA C 123 59.406 59.419 -0.013 1
1 1450 . 12 1 1 A 124 124 GLU CB C 123 28.811 29.393 -0.582 1
1 1452 . 12 1 1 A 124 124 GLU N N 123 117.404 118.776 -1.372 1
1 1453 . 12 1 1 A 125 125 MET H H 124 7.537 7.573 -0.036 1
1 1454 . 12 1 1 A 125 125 MET HA H 124 3.860 3.936 -0.076 1
1 1462 . 12 1 1 A 125 125 MET C C 124 179.522 178.346 1.176 1
1 1463 . 12 1 1 A 125 125 MET CA C 124 58.832 58.471 0.361 1
1 1464 . 12 1 1 A 125 125 MET CB C 124 31.765 31.494 0.271 1
1 1467 . 12 1 1 A 125 125 MET N N 124 119.413 118.943 0.470 1
1 1468 . 12 1 1 A 126 126 PHE H H 125 7.148 7.472 -0.324 1
1 1469 . 12 1 1 A 126 126 PHE HA H 125 3.633 4.236 -0.603 1
1 1476 . 12 1 1 A 126 126 PHE C C 125 178.994 178.217 0.777 1
1 1477 . 12 1 1 A 126 126 PHE CA C 125 63.148 61.176 1.972 1
1 1478 . 12 1 1 A 126 126 PHE CB C 125 39.830 38.377 1.453 1
1 1483 . 12 1 1 A 126 126 PHE N N 125 120.013 118.940 1.073 1
1 1484 . 12 1 1 A 127 127 LEU H H 126 8.369 8.455 -0.086 1
1 1485 . 12 1 1 A 127 127 LEU HA H 126 3.972 4.021 -0.049 1
1 1495 . 12 1 1 A 127 127 LEU C C 126 180.621 178.832 1.789 1
1 1496 . 12 1 1 A 127 127 LEU CA C 126 57.944 57.932 0.012 1
1 1497 . 12 1 1 A 127 127 LEU CB C 126 40.543 41.314 -0.771 1
1 1501 . 12 1 1 A 127 127 LEU N N 126 119.692 119.793 -0.101 1
1 1502 . 12 1 1 A 128 128 ASP H H 127 8.578 8.060 0.518 1
1 1503 . 12 1 1 A 128 128 ASP HA H 127 4.308 4.334 -0.026 1
1 1506 . 12 1 1 A 128 128 ASP C C 127 178.254 178.233 0.021 1
1 1507 . 12 1 1 A 128 128 ASP CA C 127 56.964 57.213 -0.249 1
1 1508 . 12 1 1 A 128 128 ASP CB C 127 39.735 40.964 -1.229 1
1 1509 . 12 1 1 A 128 128 ASP N N 127 121.926 119.483 2.443 1
1 1510 . 12 1 1 A 129 129 TYR H H 128 7.710 8.221 -0.511 1
1 1511 . 12 1 1 A 129 129 TYR HA H 128 3.908 4.007 -0.099 1
1 1518 . 12 1 1 A 129 129 TYR C C 128 177.633 177.625 0.008 1
1 1519 . 12 1 1 A 129 129 TYR CA C 128 61.796 61.297 0.499 1
1 1520 . 12 1 1 A 129 129 TYR CB C 128 39.372 38.455 0.917 1
1 1525 . 12 1 1 A 129 129 TYR N N 128 122.548 120.259 2.289 1
1 1526 . 12 1 1 A 130 130 ARG H H 129 8.622 8.489 0.133 1
1 1527 . 12 1 1 A 130 130 ARG HA H 129 3.722 3.757 -0.035 1
1 1535 . 12 1 1 A 130 130 ARG CA C 129 60.084 59.648 0.436 1
1 1536 . 12 1 1 A 130 130 ARG CB C 129 29.902 29.897 0.005 1
1 1539 . 12 1 1 A 130 130 ARG N N 129 118.302 119.138 -0.836 1
1 1541 . 12 1 1 A 131 131 ALA H H 130 7.936 7.868 0.068 1
1 1542 . 12 1 1 A 131 131 ALA HA H 130 3.997 4.122 -0.125 1
1 1546 . 12 1 1 A 131 131 ALA C C 130 180.456 180.296 0.160 1
1 1547 . 12 1 1 A 131 131 ALA CA C 130 55.133 54.771 0.362 1
1 1548 . 12 1 1 A 131 131 ALA CB C 130 17.750 18.227 -0.477 1
1 1549 . 12 1 1 A 131 131 ALA N N 130 119.788 120.777 -0.989 1
1 1550 . 12 1 1 A 132 132 GLU H H 131 7.622 7.536 0.086 1
1 1551 . 12 1 1 A 132 132 GLU HA H 131 3.862 3.991 -0.129 1
1 1556 . 12 1 1 A 132 132 GLU C C 131 179.528 178.392 1.136 1
1 1557 . 12 1 1 A 132 132 GLU CA C 131 58.849 58.628 0.221 1
1 1558 . 12 1 1 A 132 132 GLU CB C 131 28.930 29.288 -0.358 1
1 1560 . 12 1 1 A 132 132 GLU N N 131 118.428 118.636 -0.208 1
1 1561 . 12 1 1 A 133 133 LYS H H 132 7.853 7.662 0.191 1
1 1562 . 12 1 1 A 133 133 LYS HA H 132 3.722 4.049 -0.327 1
1 1571 . 12 1 1 A 133 133 LYS C C 132 175.725 177.607 -1.882 1
1 1572 . 12 1 1 A 133 133 LYS CA C 132 57.544 58.041 -0.497 1
1 1573 . 12 1 1 A 133 133 LYS CB C 132 31.770 31.917 -0.147 1
1 1577 . 12 1 1 A 133 133 LYS N N 132 119.473 118.024 1.449 1
1 1578 . 12 1 1 A 134 134 GLU H H 133 8.151 7.759 0.392 1
1 1579 . 12 1 1 A 134 134 GLU HA H 133 4.161 4.190 -0.029 1
1 1584 . 12 1 1 A 134 134 GLU C C 133 177.453 178.057 -0.604 1
1 1585 . 12 1 1 A 134 134 GLU CA C 133 57.222 57.437 -0.215 1
1 1586 . 12 1 1 A 134 134 GLU CB C 133 30.091 29.561 0.530 1
1 1588 . 12 1 1 A 134 134 GLU N N 133 116.525 118.268 -1.743 1
1 1589 . 12 1 1 A 135 135 GLY H H 134 7.702 7.658 0.044 1
1 1590 . 12 1 1 A 135 135 GLY HA2 H 134 3.896 3.952 -0.056 1
1 1591 . 12 1 1 A 135 135 GLY HA3 H 134 3.897 3.960 -0.063 1
1 1592 . 12 1 1 A 135 135 GLY C C 134 174.538 173.819 0.719 1
1 1593 . 12 1 1 A 135 135 GLY CA C 134 45.975 45.201 0.774 1
1 1594 . 12 1 1 A 135 135 GLY N N 134 107.924 108.131 -0.207 1
1 1595 . 12 1 1 A 136 136 ARG H H 135 8.045 7.673 0.372 1
1 1596 . 12 1 1 A 136 136 ARG HA H 135 4.323 4.014 0.309 1
1 1604 . 12 1 1 A 136 136 ARG C C 135 175.864 176.685 -0.821 1
1 1605 . 12 1 1 A 136 136 ARG CA C 135 56.016 57.759 -1.743 1
1 1606 . 12 1 1 A 136 136 ARG CB C 135 30.987 29.832 1.155 1
1 1609 . 12 1 1 A 136 136 ARG N N 135 119.708 121.930 -2.222 1
1 1 . 13 1 1 A 14 14 PHE CA C 13 58.199 56.709 1.490 1
1 2 . 13 1 1 A 14 14 PHE CB C 13 39.717 41.768 -2.051 1
1 3 . 13 1 1 A 15 15 SER H H 14 8.299 8.350 -0.051 1
1 4 . 13 1 1 A 15 15 SER HA H 14 4.359 4.476 -0.117 1
1 7 . 13 1 1 A 15 15 SER CA C 14 58.249 59.752 -1.503 1
1 8 . 13 1 1 A 15 15 SER CB C 14 63.936 65.092 -1.156 1
1 9 . 13 1 1 A 15 15 SER N N 14 117.379 122.613 -5.234 1
1 10 . 13 1 1 A 16 16 SER H H 15 8.255 7.531 0.724 1
1 11 . 13 1 1 A 16 16 SER HA H 15 3.729 3.987 -0.258 1
1 14 . 13 1 1 A 16 16 SER CA C 15 58.224 60.918 -2.694 1
1 15 . 13 1 1 A 16 16 SER CB C 15 63.886 60.824 3.062 1
1 16 . 13 1 1 A 16 16 SER N N 15 117.694 114.762 2.932 1
1 17 . 13 1 1 A 17 17 ALA H H 16 8.333 8.355 -0.022 1
1 18 . 13 1 1 A 17 17 ALA HA H 16 4.252 4.513 -0.261 1
1 22 . 13 1 1 A 17 17 ALA CA C 16 53.377 53.023 0.354 1
1 23 . 13 1 1 A 17 17 ALA CB C 16 18.896 19.077 -0.181 1
1 24 . 13 1 1 A 17 17 ALA N N 16 125.462 123.836 1.626 1
1 25 . 13 1 1 A 18 18 SER H H 17 8.219 7.967 0.252 1
1 26 . 13 1 1 A 18 18 SER HA H 17 4.332 4.659 -0.327 1
1 29 . 13 1 1 A 18 18 SER CA C 17 59.105 57.676 1.429 1
1 30 . 13 1 1 A 18 18 SER CB C 17 63.592 64.084 -0.492 1
1 31 . 13 1 1 A 18 18 SER N N 17 114.821 112.904 1.917 1
1 32 . 13 1 1 A 19 19 ASP H H 18 8.309 7.716 0.593 1
1 33 . 13 1 1 A 19 19 ASP HA H 18 4.554 4.903 -0.349 1
1 36 . 13 1 1 A 19 19 ASP C C 18 176.528 176.260 0.268 1
1 37 . 13 1 1 A 19 19 ASP CA C 18 55.272 52.954 2.318 1
1 38 . 13 1 1 A 19 19 ASP CB C 18 40.883 41.804 -0.921 1
1 39 . 13 1 1 A 19 19 ASP N N 18 123.367 118.315 5.052 1
1 40 . 13 1 1 A 20 20 ALA H H 19 8.133 8.747 -0.614 1
1 41 . 13 1 1 A 20 20 ALA HA H 19 4.170 4.097 0.073 1
1 45 . 13 1 1 A 20 20 ALA C C 19 179.857 179.437 0.420 1
1 46 . 13 1 1 A 20 20 ALA CA C 19 54.341 55.252 -0.911 1
1 47 . 13 1 1 A 20 20 ALA CB C 19 18.660 18.458 0.202 1
1 48 . 13 1 1 A 20 20 ALA N N 19 123.350 121.051 2.299 1
1 49 . 13 1 1 A 21 21 GLU H H 20 8.140 8.145 -0.005 1
1 50 . 13 1 1 A 21 21 GLU HA H 20 4.128 4.080 0.048 1
1 55 . 13 1 1 A 21 21 GLU C C 20 177.675 178.668 -0.993 1
1 56 . 13 1 1 A 21 21 GLU CA C 20 58.520 59.493 -0.973 1
1 57 . 13 1 1 A 21 21 GLU CB C 20 29.765 29.504 0.261 1
1 59 . 13 1 1 A 21 21 GLU N N 20 119.063 119.413 -0.350 1
1 60 . 13 1 1 A 22 22 PHE H H 21 8.009 8.064 -0.055 1
1 61 . 13 1 1 A 22 22 PHE HA H 21 4.123 4.315 -0.192 1
1 68 . 13 1 1 A 22 22 PHE C C 21 176.410 177.539 -1.129 1
1 69 . 13 1 1 A 22 22 PHE CA C 21 62.202 60.868 1.334 1
1 70 . 13 1 1 A 22 22 PHE CB C 21 39.223 39.041 0.182 1
1 75 . 13 1 1 A 22 22 PHE N N 21 121.211 120.963 0.248 1
1 76 . 13 1 1 A 23 23 ASP H H 22 8.261 8.016 0.245 1
1 77 . 13 1 1 A 23 23 ASP HA H 22 4.041 4.523 -0.482 1
1 80 . 13 1 1 A 23 23 ASP C C 22 179.078 178.189 0.889 1
1 81 . 13 1 1 A 23 23 ASP CA C 22 57.048 58.005 -0.957 1
1 82 . 13 1 1 A 23 23 ASP CB C 22 40.154 42.041 -1.887 1
1 83 . 13 1 1 A 23 23 ASP N N 22 116.876 118.989 -2.113 1
1 84 . 13 1 1 A 24 24 ALA H H 23 7.651 7.748 -0.097 1
1 85 . 13 1 1 A 24 24 ALA HA H 23 3.785 4.004 -0.219 1
1 89 . 13 1 1 A 24 24 ALA C C 23 179.577 179.818 -0.241 1
1 90 . 13 1 1 A 24 24 ALA CA C 23 54.341 55.147 -0.806 1
1 91 . 13 1 1 A 24 24 ALA CB C 23 17.762 18.475 -0.713 1
1 92 . 13 1 1 A 24 24 ALA N N 23 121.873 121.329 0.544 1
1 93 . 13 1 1 A 25 25 VAL H H 24 7.718 7.747 -0.029 1
1 94 . 13 1 1 A 25 25 VAL HA H 24 3.216 3.540 -0.324 1
1 102 . 13 1 1 A 25 25 VAL C C 24 177.805 178.311 -0.506 1
1 103 . 13 1 1 A 25 25 VAL CA C 24 66.789 66.903 -0.114 1
1 104 . 13 1 1 A 25 25 VAL CB C 24 31.277 31.189 0.088 1
1 107 . 13 1 1 A 25 25 VAL N N 24 117.890 118.516 -0.626 1
1 108 . 13 1 1 A 26 26 VAL H H 25 7.867 7.764 0.103 1
1 109 . 13 1 1 A 26 26 VAL HA H 25 3.274 3.553 -0.279 1
1 117 . 13 1 1 A 26 26 VAL C C 25 177.788 177.666 0.122 1
1 118 . 13 1 1 A 26 26 VAL CA C 25 67.282 66.276 1.006 1
1 119 . 13 1 1 A 26 26 VAL CB C 25 31.266 31.390 -0.124 1
1 122 . 13 1 1 A 26 26 VAL N N 25 118.170 119.661 -1.491 1
1 123 . 13 1 1 A 27 27 GLY H H 26 7.544 7.677 -0.133 1
1 124 . 13 1 1 A 27 27 GLY HA2 H 26 3.592 3.504 0.088 1
1 125 . 13 1 1 A 27 27 GLY HA3 H 26 3.721 3.610 0.111 1
1 126 . 13 1 1 A 27 27 GLY C C 26 176.717 176.159 0.558 1
1 127 . 13 1 1 A 27 27 GLY CA C 26 47.085 47.175 -0.090 1
1 128 . 13 1 1 A 27 27 GLY N N 26 105.795 107.873 -2.078 1
1 129 . 13 1 1 A 28 28 TYR H H 27 7.625 7.431 0.194 1
1 130 . 13 1 1 A 28 28 TYR HA H 27 4.546 4.564 -0.018 1
1 137 . 13 1 1 A 28 28 TYR C C 27 178.991 178.243 0.748 1
1 138 . 13 1 1 A 28 28 TYR CA C 27 58.845 59.849 -1.004 1
1 139 . 13 1 1 A 28 28 TYR CB C 27 37.602 37.591 0.011 1
1 144 . 13 1 1 A 28 28 TYR N N 27 119.933 121.466 -1.533 1
1 145 . 13 1 1 A 29 29 LEU H H 28 8.517 8.072 0.445 1
1 146 . 13 1 1 A 29 29 LEU HA H 28 3.728 3.789 -0.061 1
1 156 . 13 1 1 A 29 29 LEU CA C 28 58.281 58.056 0.225 1
1 157 . 13 1 1 A 29 29 LEU CB C 28 41.948 41.305 0.643 1
1 161 . 13 1 1 A 29 29 LEU N N 28 119.669 120.524 -0.855 1
1 162 . 13 1 1 A 30 30 GLU H H 29 8.072 8.001 0.071 1
1 163 . 13 1 1 A 30 30 GLU HA H 29 3.722 3.888 -0.166 1
1 168 . 13 1 1 A 30 30 GLU C C 29 177.731 179.182 -1.451 1
1 169 . 13 1 1 A 30 30 GLU CA C 29 59.763 59.966 -0.203 1
1 170 . 13 1 1 A 30 30 GLU CB C 29 28.844 29.303 -0.459 1
1 172 . 13 1 1 A 30 30 GLU N N 29 117.666 117.703 -0.037 1
1 173 . 13 1 1 A 31 31 ASP H H 30 7.243 7.714 -0.471 1
1 174 . 13 1 1 A 31 31 ASP HA H 30 4.297 4.366 -0.069 1
1 177 . 13 1 1 A 31 31 ASP CA C 30 56.953 57.330 -0.377 1
1 178 . 13 1 1 A 31 31 ASP CB C 30 40.730 40.939 -0.209 1
1 179 . 13 1 1 A 31 31 ASP N N 30 116.720 119.258 -2.538 1
1 180 . 13 1 1 A 32 32 ILE H H 31 7.940 7.515 0.425 1
1 181 . 13 1 1 A 32 32 ILE HA H 31 3.640 3.675 -0.035 1
1 191 . 13 1 1 A 32 32 ILE C C 31 177.980 178.122 -0.142 1
1 192 . 13 1 1 A 32 32 ILE CA C 31 64.692 64.271 0.421 1
1 193 . 13 1 1 A 32 32 ILE CB C 31 38.938 37.604 1.334 1
1 197 . 13 1 1 A 32 32 ILE N N 31 119.728 119.923 -0.195 1
1 198 . 13 1 1 A 33 33 ILE H H 32 7.984 7.900 0.084 1
1 199 . 13 1 1 A 33 33 ILE HA H 32 3.598 3.459 0.139 1
1 209 . 13 1 1 A 33 33 ILE C C 32 176.723 177.059 -0.336 1
1 210 . 13 1 1 A 33 33 ILE CA C 32 63.241 64.637 -1.396 1
1 211 . 13 1 1 A 33 33 ILE CB C 32 37.580 37.715 -0.135 1
1 215 . 13 1 1 A 33 33 ILE N N 32 113.919 120.968 -7.049 1
1 216 . 13 1 1 A 34 34 MET H H 33 7.288 7.336 -0.048 1
1 217 . 13 1 1 A 34 34 MET HA H 33 4.496 4.547 -0.051 1
1 225 . 13 1 1 A 34 34 MET C C 33 176.423 176.228 0.195 1
1 226 . 13 1 1 A 34 34 MET CA C 33 54.634 57.145 -2.511 1
1 227 . 13 1 1 A 34 34 MET CB C 33 31.934 33.462 -1.528 1
1 230 . 13 1 1 A 34 34 MET N N 33 115.130 118.968 -3.838 1
1 231 . 13 1 1 A 35 35 ASP H H 34 7.405 7.317 0.088 1
1 232 . 13 1 1 A 35 35 ASP HA H 34 4.484 4.377 0.107 1
1 235 . 13 1 1 A 35 35 ASP C C 34 177.139 177.150 -0.011 1
1 236 . 13 1 1 A 35 35 ASP CA C 34 54.625 55.114 -0.489 1
1 237 . 13 1 1 A 35 35 ASP CB C 34 43.554 42.466 1.088 1
1 238 . 13 1 1 A 35 35 ASP N N 34 121.814 119.609 2.205 1
1 239 . 13 1 1 A 36 36 ASP H H 35 8.765 9.062 -0.297 1
1 240 . 13 1 1 A 36 36 ASP HA H 35 4.235 4.352 -0.117 1
1 243 . 13 1 1 A 36 36 ASP C C 35 178.320 178.510 -0.190 1
1 244 . 13 1 1 A 36 36 ASP CA C 35 57.832 57.234 0.598 1
1 245 . 13 1 1 A 36 36 ASP CB C 35 40.914 39.814 1.100 1
1 246 . 13 1 1 A 36 36 ASP N N 35 125.883 126.468 -0.585 1
1 247 . 13 1 1 A 37 37 GLU H H 36 8.905 8.263 0.642 1
1 248 . 13 1 1 A 37 37 GLU HA H 36 3.933 4.072 -0.139 1
1 253 . 13 1 1 A 37 37 GLU C C 36 179.304 179.090 0.214 1
1 254 . 13 1 1 A 37 37 GLU CA C 36 59.828 59.126 0.702 1
1 255 . 13 1 1 A 37 37 GLU CB C 36 29.380 29.314 0.066 1
1 257 . 13 1 1 A 37 37 GLU N N 36 119.077 120.392 -1.315 1
1 258 . 13 1 1 A 38 38 PHE H H 37 7.460 8.271 -0.811 1
1 259 . 13 1 1 A 38 38 PHE HA H 37 3.642 4.064 -0.422 1
1 267 . 13 1 1 A 38 38 PHE C C 37 176.483 177.822 -1.339 1
1 268 . 13 1 1 A 38 38 PHE CA C 37 61.411 61.146 0.265 1
1 269 . 13 1 1 A 38 38 PHE CB C 37 39.355 39.117 0.238 1
1 275 . 13 1 1 A 38 38 PHE N N 37 119.968 120.826 -0.858 1
1 276 . 13 1 1 A 39 39 GLN H H 38 7.968 8.043 -0.075 1
1 277 . 13 1 1 A 39 39 GLN HA H 38 3.712 3.725 -0.013 1
1 284 . 13 1 1 A 39 39 GLN CA C 38 59.153 58.545 0.608 1
1 285 . 13 1 1 A 39 39 GLN CB C 38 28.213 28.234 -0.021 1
1 287 . 13 1 1 A 39 39 GLN N N 38 116.433 118.486 -2.053 1
1 289 . 13 1 1 A 40 40 LEU H H 39 7.930 7.548 0.382 1
1 290 . 13 1 1 A 40 40 LEU HA H 39 3.916 4.016 -0.100 1
1 300 . 13 1 1 A 40 40 LEU C C 39 177.731 178.041 -0.310 1
1 301 . 13 1 1 A 40 40 LEU CA C 39 57.915 57.905 0.010 1
1 302 . 13 1 1 A 40 40 LEU CB C 39 41.989 41.471 0.518 1
1 306 . 13 1 1 A 40 40 LEU N N 39 119.505 121.629 -2.124 1
1 307 . 13 1 1 A 41 41 LEU H H 40 7.174 7.656 -0.482 1
1 308 . 13 1 1 A 41 41 LEU HA H 40 3.835 3.991 -0.156 1
1 318 . 13 1 1 A 41 41 LEU C C 40 179.738 178.305 1.433 1
1 319 . 13 1 1 A 41 41 LEU CA C 40 58.266 58.275 -0.009 1
1 320 . 13 1 1 A 41 41 LEU CB C 40 42.050 41.484 0.566 1
1 324 . 13 1 1 A 41 41 LEU N N 40 120.971 119.778 1.193 1
1 325 . 13 1 1 A 42 42 GLN H H 41 8.058 7.891 0.167 1
1 326 . 13 1 1 A 42 42 GLN HA H 41 3.556 3.754 -0.198 1
1 333 . 13 1 1 A 42 42 GLN C C 41 177.642 178.412 -0.770 1
1 334 . 13 1 1 A 42 42 GLN CA C 41 59.826 59.212 0.614 1
1 335 . 13 1 1 A 42 42 GLN CB C 41 28.762 28.119 0.643 1
1 337 . 13 1 1 A 42 42 GLN N N 41 117.899 117.800 0.099 1
1 339 . 13 1 1 A 43 43 ARG H H 42 8.179 7.750 0.429 1
1 340 . 13 1 1 A 43 43 ARG HA H 42 3.655 3.957 -0.302 1
1 347 . 13 1 1 A 43 43 ARG C C 42 178.051 178.339 -0.288 1
1 348 . 13 1 1 A 43 43 ARG CA C 42 59.766 59.092 0.674 1
1 349 . 13 1 1 A 43 43 ARG CB C 42 29.941 29.714 0.227 1
1 352 . 13 1 1 A 43 43 ARG N N 42 119.392 119.520 -0.128 1
1 353 . 13 1 1 A 44 44 ASN H H 43 8.525 8.256 0.269 1
1 354 . 13 1 1 A 44 44 ASN HA H 43 4.332 4.380 -0.048 1
1 359 . 13 1 1 A 44 44 ASN C C 43 178.150 177.865 0.285 1
1 360 . 13 1 1 A 44 44 ASN CA C 43 55.841 56.237 -0.396 1
1 361 . 13 1 1 A 44 44 ASN CB C 43 37.632 39.408 -1.776 1
1 362 . 13 1 1 A 44 44 ASN N N 43 116.214 117.650 -1.436 1
1 364 . 13 1 1 A 45 45 PHE H H 44 7.586 8.023 -0.437 1
1 365 . 13 1 1 A 45 45 PHE HA H 44 4.132 4.269 -0.137 1
1 372 . 13 1 1 A 45 45 PHE C C 44 176.691 179.009 -2.318 1
1 373 . 13 1 1 A 45 45 PHE CA C 44 62.333 60.742 1.591 1
1 374 . 13 1 1 A 45 45 PHE CB C 44 39.449 38.524 0.925 1
1 379 . 13 1 1 A 45 45 PHE N N 44 121.501 117.866 3.635 1
1 380 . 13 1 1 A 46 46 MET H H 45 8.190 8.291 -0.101 1
1 381 . 13 1 1 A 46 46 MET HA H 45 4.060 4.357 -0.297 1
1 389 . 13 1 1 A 46 46 MET C C 45 179.754 178.204 1.550 1
1 390 . 13 1 1 A 46 46 MET CA C 45 57.742 57.230 0.512 1
1 391 . 13 1 1 A 46 46 MET CB C 45 29.912 32.060 -2.148 1
1 394 . 13 1 1 A 46 46 MET N N 45 116.727 119.420 -2.693 1
1 395 . 13 1 1 A 47 47 ASP H H 46 8.579 8.236 0.343 1
1 396 . 13 1 1 A 47 47 ASP HA H 46 4.804 4.498 0.306 1
1 399 . 13 1 1 A 47 47 ASP C C 46 177.854 177.616 0.238 1
1 400 . 13 1 1 A 47 47 ASP CA C 46 57.277 57.183 0.094 1
1 401 . 13 1 1 A 47 47 ASP CB C 46 40.776 41.585 -0.809 1
1 402 . 13 1 1 A 47 47 ASP N N 46 117.798 120.618 -2.820 1
1 403 . 13 1 1 A 48 48 LYS H H 47 7.339 7.748 -0.409 1
1 404 . 13 1 1 A 48 48 LYS HA H 47 3.828 4.341 -0.513 1
1 413 . 13 1 1 A 48 48 LYS C C 47 178.812 178.609 0.203 1
1 414 . 13 1 1 A 48 48 LYS CA C 47 58.953 57.573 1.380 1
1 415 . 13 1 1 A 48 48 LYS CB C 47 32.796 33.473 -0.677 1
1 419 . 13 1 1 A 48 48 LYS N N 47 117.852 117.697 0.155 1
1 420 . 13 1 1 A 49 49 TYR H H 48 6.841 8.543 -1.702 1
1 421 . 13 1 1 A 49 49 TYR HA H 48 4.995 4.231 0.764 1
1 428 . 13 1 1 A 49 49 TYR C C 48 178.138 178.510 -0.372 1
1 429 . 13 1 1 A 49 49 TYR CA C 48 58.620 59.730 -1.110 1
1 430 . 13 1 1 A 49 49 TYR CB C 48 42.939 38.056 4.883 1
1 435 . 13 1 1 A 49 49 TYR N N 48 112.109 119.289 -7.180 1
1 436 . 13 1 1 A 50 50 TYR H H 49 8.491 8.179 0.312 1
1 437 . 13 1 1 A 50 50 TYR HA H 49 4.598 4.152 0.446 1
1 444 . 13 1 1 A 50 50 TYR C C 49 176.015 177.702 -1.687 1
1 445 . 13 1 1 A 50 50 TYR CA C 49 62.442 59.363 3.079 1
1 446 . 13 1 1 A 50 50 TYR CB C 49 36.588 36.875 -0.287 1
1 451 . 13 1 1 A 50 50 TYR N N 49 118.294 119.309 -1.015 1
1 452 . 13 1 1 A 51 51 LEU H H 50 7.512 7.530 -0.018 1
1 453 . 13 1 1 A 51 51 LEU HA H 50 3.878 3.530 0.348 1
1 463 . 13 1 1 A 51 51 LEU C C 50 178.625 178.649 -0.024 1
1 464 . 13 1 1 A 51 51 LEU CA C 50 55.994 57.245 -1.251 1
1 465 . 13 1 1 A 51 51 LEU CB C 50 40.743 41.420 -0.677 1
1 469 . 13 1 1 A 51 51 LEU N N 50 118.478 121.850 -3.372 1
1 470 . 13 1 1 A 52 52 GLU H H 51 8.042 7.967 0.075 1
1 471 . 13 1 1 A 52 52 GLU HA H 51 4.197 4.005 0.192 1
1 476 . 13 1 1 A 52 52 GLU C C 51 177.629 177.756 -0.127 1
1 477 . 13 1 1 A 52 52 GLU CA C 51 56.141 59.525 -3.384 1
1 478 . 13 1 1 A 52 52 GLU CB C 51 29.162 29.612 -0.450 1
1 480 . 13 1 1 A 52 52 GLU N N 51 115.067 117.988 -2.921 1
1 481 . 13 1 1 A 53 53 PHE H H 52 7.465 8.023 -0.558 1
1 482 . 13 1 1 A 53 53 PHE HA H 52 4.431 4.688 -0.257 1
1 490 . 13 1 1 A 53 53 PHE C C 52 174.325 175.058 -0.733 1
1 491 . 13 1 1 A 53 53 PHE CA C 52 58.986 56.977 2.009 1
1 492 . 13 1 1 A 53 53 PHE CB C 52 40.183 37.311 2.872 1
1 498 . 13 1 1 A 53 53 PHE N N 52 116.768 118.805 -2.037 1
1 499 . 13 1 1 A 54 54 GLU H H 53 7.484 8.726 -1.242 1
1 500 . 13 1 1 A 54 54 GLU HA H 53 4.583 4.922 -0.339 1
1 505 . 13 1 1 A 54 54 GLU C C 53 175.722 174.947 0.775 1
1 506 . 13 1 1 A 54 54 GLU CA C 53 54.248 54.860 -0.612 1
1 507 . 13 1 1 A 54 54 GLU CB C 53 34.409 32.047 2.362 1
1 509 . 13 1 1 A 54 54 GLU N N 53 118.844 123.668 -4.824 1
1 510 . 13 1 1 A 55 55 ASP H H 54 9.008 8.703 0.305 1
1 511 . 13 1 1 A 55 55 ASP HA H 54 4.735 4.939 -0.204 1
1 514 . 13 1 1 A 55 55 ASP C C 54 175.421 175.684 -0.263 1
1 515 . 13 1 1 A 55 55 ASP CA C 54 52.888 53.510 -0.622 1
1 516 . 13 1 1 A 55 55 ASP CB C 54 38.894 41.024 -2.130 1
1 517 . 13 1 1 A 55 55 ASP N N 54 123.654 122.248 1.406 1
1 518 . 13 1 1 A 56 56 THR H H 55 7.819 8.558 -0.739 1
1 519 . 13 1 1 A 56 56 THR HA H 55 4.574 4.979 -0.405 1
1 524 . 13 1 1 A 56 56 THR C C 55 174.096 174.086 0.010 1
1 525 . 13 1 1 A 56 56 THR CA C 55 59.172 59.631 -0.459 1
1 526 . 13 1 1 A 56 56 THR CB C 55 71.889 72.103 -0.214 1
1 528 . 13 1 1 A 56 56 THR N N 55 112.015 117.543 -5.528 1
1 529 . 13 1 1 A 57 57 GLU H H 56 8.527 8.711 -0.184 1
1 530 . 13 1 1 A 57 57 GLU HA H 56 4.217 4.591 -0.374 1
1 535 . 13 1 1 A 57 57 GLU C C 56 177.042 176.212 0.830 1
1 536 . 13 1 1 A 57 57 GLU CA C 56 56.869 56.079 0.790 1
1 537 . 13 1 1 A 57 57 GLU CB C 56 29.731 30.339 -0.608 1
1 539 . 13 1 1 A 57 57 GLU N N 56 117.531 118.025 -0.494 1
1 540 . 13 1 1 A 58 58 GLU H H 57 7.587 7.756 -0.169 1
1 541 . 13 1 1 A 58 58 GLU HA H 57 3.941 4.604 -0.663 1
1 546 . 13 1 1 A 58 58 GLU C C 57 176.849 175.971 0.878 1
1 547 . 13 1 1 A 58 58 GLU CA C 57 56.924 56.135 0.789 1
1 548 . 13 1 1 A 58 58 GLU CB C 57 30.251 30.915 -0.664 1
1 550 . 13 1 1 A 58 58 GLU N N 57 119.183 122.398 -3.215 1
1 551 . 13 1 1 A 59 59 ASN H H 58 9.120 8.715 0.405 1
1 552 . 13 1 1 A 59 59 ASN HA H 58 4.922 5.212 -0.290 1
1 557 . 13 1 1 A 59 59 ASN C C 58 174.254 174.225 0.029 1
1 558 . 13 1 1 A 59 59 ASN CA C 58 51.956 52.824 -0.868 1
1 559 . 13 1 1 A 59 59 ASN CB C 58 37.404 40.028 -2.624 1
1 560 . 13 1 1 A 59 59 ASN N N 58 126.767 125.329 1.438 1
1 562 . 13 1 1 A 60 60 LYS H H 59 5.892 9.076 -3.184 1
1 563 . 13 1 1 A 60 60 LYS HA H 59 3.798 4.748 -0.950 1
1 572 . 13 1 1 A 60 60 LYS C C 59 177.908 176.741 1.167 1
1 573 . 13 1 1 A 60 60 LYS CA C 59 56.623 54.597 2.026 1
1 574 . 13 1 1 A 60 60 LYS CB C 59 32.279 35.264 -2.985 1
1 578 . 13 1 1 A 60 60 LYS N N 59 121.527 125.992 -4.465 1
1 579 . 13 1 1 A 61 61 LEU H H 60 8.473 8.809 -0.336 1
1 580 . 13 1 1 A 61 61 LEU HA H 60 3.891 4.218 -0.327 1
1 590 . 13 1 1 A 61 61 LEU C C 60 179.843 178.604 1.239 1
1 591 . 13 1 1 A 61 61 LEU CA C 60 58.301 56.123 2.178 1
1 592 . 13 1 1 A 61 61 LEU CB C 60 41.305 41.584 -0.279 1
1 596 . 13 1 1 A 61 61 LEU N N 60 125.639 123.459 2.180 1
1 597 . 13 1 1 A 62 62 ILE H H 61 7.698 7.594 0.104 1
1 598 . 13 1 1 A 62 62 ILE HA H 61 3.952 3.869 0.083 1
1 608 . 13 1 1 A 62 62 ILE C C 61 175.392 177.023 -1.631 1
1 609 . 13 1 1 A 62 62 ILE CA C 61 61.743 63.384 -1.641 1
1 610 . 13 1 1 A 62 62 ILE CB C 61 39.108 37.749 1.359 1
1 614 . 13 1 1 A 62 62 ILE N N 61 114.111 120.023 -5.912 1
1 615 . 13 1 1 A 63 63 TYR H H 62 7.273 7.552 -0.279 1
1 616 . 13 1 1 A 63 63 TYR HA H 62 4.343 4.138 0.205 1
1 623 . 13 1 1 A 63 63 TYR C C 62 178.264 178.561 -0.297 1
1 624 . 13 1 1 A 63 63 TYR CA C 62 57.231 60.886 -3.655 1
1 625 . 13 1 1 A 63 63 TYR CB C 62 36.332 37.816 -1.484 1
1 630 . 13 1 1 A 63 63 TYR N N 62 117.689 121.379 -3.690 1
1 631 . 13 1 1 A 64 64 THR H H 63 7.747 8.139 -0.392 1
1 632 . 13 1 1 A 64 64 THR HA H 63 4.266 4.244 0.022 1
1 637 . 13 1 1 A 64 64 THR CA C 63 69.362 67.571 1.791 1
1 638 . 13 1 1 A 64 64 THR CB C 63 66.962 67.619 -0.657 1
1 640 . 13 1 1 A 64 64 THR N N 63 113.755 116.321 -2.566 1
1 641 . 13 1 1 A 65 65 PRO HA H 64 4.372 4.378 -0.006 1
1 648 . 13 1 1 A 65 65 PRO C C 64 179.913 179.512 0.401 1
1 649 . 13 1 1 A 65 65 PRO CA C 64 66.011 66.361 -0.350 1
1 650 . 13 1 1 A 65 65 PRO CB C 64 30.642 30.755 -0.113 1
1 653 . 13 1 1 A 66 66 ILE H H 65 7.377 7.403 -0.026 1
1 654 . 13 1 1 A 66 66 ILE HA H 65 3.530 3.911 -0.381 1
1 664 . 13 1 1 A 66 66 ILE C C 65 177.543 178.312 -0.769 1
1 665 . 13 1 1 A 66 66 ILE CA C 65 66.647 64.389 2.258 1
1 666 . 13 1 1 A 66 66 ILE CB C 65 38.029 37.865 0.164 1
1 670 . 13 1 1 A 66 66 ILE N N 65 118.353 116.701 1.652 1
1 671 . 13 1 1 A 67 67 PHE H H 66 8.480 8.476 0.004 1
1 672 . 13 1 1 A 67 67 PHE HA H 66 4.115 4.399 -0.284 1
1 680 . 13 1 1 A 67 67 PHE C C 66 177.293 177.839 -0.546 1
1 681 . 13 1 1 A 67 67 PHE CA C 66 59.570 62.252 -2.682 1
1 682 . 13 1 1 A 67 67 PHE CB C 66 38.865 39.537 -0.672 1
1 688 . 13 1 1 A 67 67 PHE N N 66 122.420 120.432 1.988 1
1 689 . 13 1 1 A 68 68 ASN H H 67 8.595 8.181 0.414 1
1 690 . 13 1 1 A 68 68 ASN HA H 67 4.211 4.354 -0.143 1
1 695 . 13 1 1 A 68 68 ASN C C 67 178.697 178.182 0.515 1
1 696 . 13 1 1 A 68 68 ASN CA C 67 56.056 56.387 -0.331 1
1 697 . 13 1 1 A 68 68 ASN CB C 67 37.704 37.949 -0.245 1
1 698 . 13 1 1 A 68 68 ASN N N 67 115.573 117.216 -1.643 1
1 700 . 13 1 1 A 69 69 GLU H H 68 8.414 8.084 0.330 1
1 701 . 13 1 1 A 69 69 GLU HA H 68 4.102 4.199 -0.097 1
1 706 . 13 1 1 A 69 69 GLU C C 68 177.880 178.861 -0.981 1
1 707 . 13 1 1 A 69 69 GLU CA C 68 59.399 59.453 -0.054 1
1 708 . 13 1 1 A 69 69 GLU CB C 68 29.855 29.582 0.273 1
1 710 . 13 1 1 A 69 69 GLU N N 68 123.510 120.071 3.439 1
1 711 . 13 1 1 A 70 70 TYR H H 69 8.659 8.142 0.517 1
1 712 . 13 1 1 A 70 70 TYR HA H 69 3.362 4.128 -0.766 1
1 719 . 13 1 1 A 70 70 TYR C C 69 178.143 177.035 1.108 1
1 720 . 13 1 1 A 70 70 TYR CA C 69 60.686 60.992 -0.306 1
1 721 . 13 1 1 A 70 70 TYR CB C 69 38.560 38.990 -0.430 1
1 726 . 13 1 1 A 70 70 TYR N N 69 122.130 120.742 1.388 1
1 727 . 13 1 1 A 71 71 ILE H H 70 8.031 7.721 0.310 1
1 728 . 13 1 1 A 71 71 ILE HA H 70 3.265 3.681 -0.416 1
1 738 . 13 1 1 A 71 71 ILE C C 70 178.056 177.600 0.456 1
1 739 . 13 1 1 A 71 71 ILE CA C 70 63.756 64.030 -0.274 1
1 740 . 13 1 1 A 71 71 ILE CB C 70 37.321 36.581 0.740 1
1 744 . 13 1 1 A 71 71 ILE N N 70 118.906 120.137 -1.231 1
1 745 . 13 1 1 A 72 72 SER H H 71 7.803 7.827 -0.024 1
1 746 . 13 1 1 A 72 72 SER HA H 71 4.029 4.341 -0.312 1
1 749 . 13 1 1 A 72 72 SER CA C 71 61.380 60.931 0.449 1
1 750 . 13 1 1 A 72 72 SER CB C 71 63.288 62.955 0.333 1
1 751 . 13 1 1 A 72 72 SER N N 71 113.735 116.784 -3.049 1
1 752 . 13 1 1 A 73 73 LEU H H 72 7.952 7.927 0.025 1
1 753 . 13 1 1 A 73 73 LEU HA H 72 4.418 4.123 0.295 1
1 763 . 13 1 1 A 73 73 LEU C C 72 177.767 178.227 -0.460 1
1 764 . 13 1 1 A 73 73 LEU CA C 72 56.543 57.457 -0.914 1
1 765 . 13 1 1 A 73 73 LEU CB C 72 44.517 41.837 2.680 1
1 769 . 13 1 1 A 73 73 LEU N N 72 119.411 122.484 -3.073 1
1 770 . 13 1 1 A 74 74 VAL H H 73 8.021 7.569 0.452 1
1 771 . 13 1 1 A 74 74 VAL HA H 73 3.532 3.328 0.204 1
1 779 . 13 1 1 A 74 74 VAL C C 73 177.126 177.964 -0.838 1
1 780 . 13 1 1 A 74 74 VAL CA C 73 66.250 66.296 -0.046 1
1 781 . 13 1 1 A 74 74 VAL CB C 73 31.212 31.168 0.044 1
1 784 . 13 1 1 A 74 74 VAL N N 73 118.747 119.082 -0.335 1
1 785 . 13 1 1 A 75 75 GLU H H 74 7.232 7.888 -0.656 1
1 786 . 13 1 1 A 75 75 GLU HA H 74 3.013 4.158 -1.145 1
1 791 . 13 1 1 A 75 75 GLU C C 74 178.804 179.091 -0.287 1
1 792 . 13 1 1 A 75 75 GLU CA C 74 60.536 59.989 0.547 1
1 793 . 13 1 1 A 75 75 GLU CB C 74 27.009 29.114 -2.105 1
1 795 . 13 1 1 A 75 75 GLU N N 74 118.660 119.861 -1.201 1
1 796 . 13 1 1 A 76 76 LYS H H 75 7.051 7.466 -0.415 1
1 797 . 13 1 1 A 76 76 LYS HA H 75 3.765 3.993 -0.228 1
1 806 . 13 1 1 A 76 76 LYS C C 75 177.765 178.479 -0.714 1
1 807 . 13 1 1 A 76 76 LYS CA C 75 58.357 58.895 -0.538 1
1 808 . 13 1 1 A 76 76 LYS CB C 75 31.939 31.974 -0.035 1
1 812 . 13 1 1 A 76 76 LYS N N 75 116.112 119.717 -3.605 1
1 813 . 13 1 1 A 77 77 TYR H H 76 7.067 7.674 -0.607 1
1 814 . 13 1 1 A 77 77 TYR HA H 76 4.036 4.137 -0.101 1
1 821 . 13 1 1 A 77 77 TYR C C 76 177.752 177.145 0.607 1
1 822 . 13 1 1 A 77 77 TYR CA C 76 61.820 61.389 0.431 1
1 823 . 13 1 1 A 77 77 TYR CB C 76 38.480 38.593 -0.113 1
1 828 . 13 1 1 A 77 77 TYR N N 76 118.434 120.643 -2.209 1
1 829 . 13 1 1 A 78 78 ILE H H 77 7.554 8.207 -0.653 1
1 830 . 13 1 1 A 78 78 ILE HA H 77 3.159 3.484 -0.325 1
1 840 . 13 1 1 A 78 78 ILE C C 77 177.341 177.916 -0.575 1
1 841 . 13 1 1 A 78 78 ILE CA C 77 65.177 65.247 -0.070 1
1 842 . 13 1 1 A 78 78 ILE CB C 77 37.339 37.961 -0.622 1
1 846 . 13 1 1 A 78 78 ILE N N 77 117.672 121.345 -3.673 1
1 847 . 13 1 1 A 79 79 GLU H H 78 8.296 7.931 0.365 1
1 848 . 13 1 1 A 79 79 GLU HA H 78 3.557 3.795 -0.238 1
1 853 . 13 1 1 A 79 79 GLU C C 78 177.742 178.827 -1.085 1
1 854 . 13 1 1 A 79 79 GLU CA C 78 60.847 59.991 0.856 1
1 855 . 13 1 1 A 79 79 GLU CB C 78 29.594 29.173 0.421 1
1 857 . 13 1 1 A 79 79 GLU N N 78 118.701 120.760 -2.059 1
1 858 . 13 1 1 A 80 80 GLU H H 79 8.330 8.207 0.123 1
1 859 . 13 1 1 A 80 80 GLU HA H 79 3.774 4.007 -0.233 1
1 864 . 13 1 1 A 80 80 GLU C C 79 179.926 179.167 0.759 1
1 865 . 13 1 1 A 80 80 GLU CA C 79 59.581 58.962 0.619 1
1 866 . 13 1 1 A 80 80 GLU CB C 79 29.062 29.221 -0.159 1
1 868 . 13 1 1 A 80 80 GLU N N 79 116.767 118.479 -1.712 1
1 869 . 13 1 1 A 81 81 GLN H H 80 7.634 7.661 -0.027 1
1 870 . 13 1 1 A 81 81 GLN HA H 80 3.605 3.831 -0.226 1
1 877 . 13 1 1 A 81 81 GLN C C 80 179.681 178.979 0.702 1
1 878 . 13 1 1 A 81 81 GLN CA C 80 57.765 58.520 -0.755 1
1 879 . 13 1 1 A 81 81 GLN CB C 80 28.079 27.822 0.257 1
1 881 . 13 1 1 A 81 81 GLN N N 80 116.325 118.633 -2.308 1
1 883 . 13 1 1 A 82 82 LEU H H 81 8.156 7.547 0.609 1
1 884 . 13 1 1 A 82 82 LEU HA H 81 3.536 3.689 -0.153 1
1 894 . 13 1 1 A 82 82 LEU C C 81 178.945 179.440 -0.495 1
1 895 . 13 1 1 A 82 82 LEU CA C 81 57.761 57.135 0.626 1
1 896 . 13 1 1 A 82 82 LEU CB C 81 40.961 40.743 0.218 1
1 900 . 13 1 1 A 82 82 LEU N N 81 121.546 120.215 1.331 1
1 901 . 13 1 1 A 83 83 LEU H H 82 8.326 7.917 0.409 1
1 902 . 13 1 1 A 83 83 LEU HA H 82 4.198 4.175 0.023 1
1 912 . 13 1 1 A 83 83 LEU C C 82 178.631 179.297 -0.666 1
1 913 . 13 1 1 A 83 83 LEU CA C 82 57.016 57.271 -0.255 1
1 914 . 13 1 1 A 83 83 LEU CB C 82 42.182 40.804 1.378 1
1 918 . 13 1 1 A 83 83 LEU N N 82 120.426 119.710 0.716 1
1 919 . 13 1 1 A 84 84 GLN H H 83 6.992 7.523 -0.531 1
1 920 . 13 1 1 A 84 84 GLN HA H 83 3.877 4.012 -0.135 1
1 927 . 13 1 1 A 84 84 GLN C C 83 177.008 176.530 0.478 1
1 928 . 13 1 1 A 84 84 GLN CA C 83 57.543 58.284 -0.741 1
1 929 . 13 1 1 A 84 84 GLN CB C 83 28.688 28.635 0.053 1
1 931 . 13 1 1 A 84 84 GLN N N 83 114.001 117.477 -3.476 1
1 933 . 13 1 1 A 85 85 ARG H H 84 7.072 7.643 -0.571 1
1 934 . 13 1 1 A 85 85 ARG HA H 84 4.047 4.477 -0.430 1
1 942 . 13 1 1 A 85 85 ARG C C 84 175.999 175.555 0.444 1
1 943 . 13 1 1 A 85 85 ARG CA C 84 56.764 56.698 0.066 1
1 944 . 13 1 1 A 85 85 ARG CB C 84 32.044 32.232 -0.188 1
1 947 . 13 1 1 A 85 85 ARG N N 84 115.827 118.797 -2.970 1
1 949 . 13 1 1 A 86 86 ILE H H 85 8.238 7.786 0.452 1
1 950 . 13 1 1 A 86 86 ILE HA H 85 4.389 4.511 -0.122 1
1 960 . 13 1 1 A 86 86 ILE CA C 85 58.007 57.839 0.168 1
1 961 . 13 1 1 A 86 86 ILE CB C 85 39.604 38.796 0.808 1
1 965 . 13 1 1 A 86 86 ILE N N 85 119.285 118.117 1.168 1
1 966 . 13 1 1 A 87 87 PRO HA H 86 4.392 4.526 -0.134 1
1 973 . 13 1 1 A 87 87 PRO C C 86 177.622 176.264 1.358 1
1 974 . 13 1 1 A 87 87 PRO CA C 86 64.665 64.264 0.401 1
1 975 . 13 1 1 A 87 87 PRO CB C 86 32.020 31.594 0.426 1
1 978 . 13 1 1 A 88 88 GLU H H 87 8.312 8.209 0.103 1
1 979 . 13 1 1 A 88 88 GLU HA H 87 4.208 4.571 -0.363 1
1 984 . 13 1 1 A 88 88 GLU C C 87 175.554 175.783 -0.229 1
1 985 . 13 1 1 A 88 88 GLU CA C 87 56.045 56.264 -0.219 1
1 986 . 13 1 1 A 88 88 GLU CB C 87 28.654 30.705 -2.051 1
1 988 . 13 1 1 A 88 88 GLU N N 87 114.256 116.791 -2.535 1
1 989 . 13 1 1 A 89 89 PHE H H 88 7.946 7.662 0.284 1
1 990 . 13 1 1 A 89 89 PHE HA H 88 3.993 4.596 -0.603 1
1 998 . 13 1 1 A 89 89 PHE C C 88 173.460 174.657 -1.197 1
1 999 . 13 1 1 A 89 89 PHE CA C 88 60.119 58.852 1.267 1
1 1000 . 13 1 1 A 89 89 PHE CB C 88 39.994 39.888 0.106 1
1 1006 . 13 1 1 A 89 89 PHE N N 88 121.550 123.104 -1.554 1
1 1007 . 13 1 1 A 90 90 ASN H H 89 7.266 7.803 -0.537 1
1 1008 . 13 1 1 A 90 90 ASN HA H 89 4.454 4.938 -0.484 1
1 1013 . 13 1 1 A 90 90 ASN C C 89 173.921 175.102 -1.181 1
1 1014 . 13 1 1 A 90 90 ASN CA C 89 51.839 51.302 0.537 1
1 1015 . 13 1 1 A 90 90 ASN CB C 89 40.674 39.518 1.156 1
1 1016 . 13 1 1 A 90 90 ASN N N 89 125.344 125.141 0.203 1
1 1018 . 13 1 1 A 91 91 MET H H 90 8.968 8.719 0.249 1
1 1019 . 13 1 1 A 91 91 MET HA H 90 4.049 4.181 -0.132 1
1 1027 . 13 1 1 A 91 91 MET C C 90 177.475 177.845 -0.370 1
1 1028 . 13 1 1 A 91 91 MET CA C 90 57.758 57.872 -0.114 1
1 1029 . 13 1 1 A 91 91 MET CB C 90 32.250 32.548 -0.298 1
1 1032 . 13 1 1 A 91 91 MET N N 90 127.052 125.415 1.637 1
1 1033 . 13 1 1 A 92 92 ALA H H 91 8.292 7.612 0.680 1
1 1034 . 13 1 1 A 92 92 ALA HA H 91 4.059 4.134 -0.075 1
1 1038 . 13 1 1 A 92 92 ALA C C 91 180.412 179.704 0.708 1
1 1039 . 13 1 1 A 92 92 ALA CA C 91 55.368 54.872 0.496 1
1 1040 . 13 1 1 A 92 92 ALA CB C 91 17.527 18.874 -1.347 1
1 1041 . 13 1 1 A 92 92 ALA N N 91 123.752 120.976 2.776 1
1 1042 . 13 1 1 A 93 93 ALA H H 92 7.931 7.942 -0.011 1
1 1043 . 13 1 1 A 93 93 ALA HA H 92 4.054 4.097 -0.043 1
1 1047 . 13 1 1 A 93 93 ALA C C 92 180.482 179.823 0.659 1
1 1048 . 13 1 1 A 93 93 ALA CA C 92 54.614 54.861 -0.247 1
1 1049 . 13 1 1 A 93 93 ALA CB C 92 18.098 18.179 -0.081 1
1 1050 . 13 1 1 A 93 93 ALA N N 92 121.158 120.174 0.984 1
1 1051 . 13 1 1 A 94 94 PHE H H 93 8.110 7.794 0.316 1
1 1052 . 13 1 1 A 94 94 PHE HA H 93 4.304 4.161 0.143 1
1 1060 . 13 1 1 A 94 94 PHE C C 93 177.350 177.317 0.033 1
1 1061 . 13 1 1 A 94 94 PHE CA C 93 61.641 61.466 0.175 1
1 1062 . 13 1 1 A 94 94 PHE CB C 93 40.014 39.224 0.790 1
1 1068 . 13 1 1 A 94 94 PHE N N 93 119.807 119.994 -0.187 1
1 1069 . 13 1 1 A 95 95 THR H H 94 8.726 8.182 0.544 1
1 1070 . 13 1 1 A 95 95 THR HA H 94 3.569 4.079 -0.510 1
1 1075 . 13 1 1 A 95 95 THR C C 94 176.932 177.064 -0.132 1
1 1076 . 13 1 1 A 95 95 THR CA C 94 66.833 65.553 1.280 1
1 1077 . 13 1 1 A 95 95 THR CB C 94 68.445 68.195 0.250 1
1 1079 . 13 1 1 A 95 95 THR N N 94 113.074 112.141 0.933 1
1 1080 . 13 1 1 A 96 96 THR H H 95 7.657 7.828 -0.171 1
1 1081 . 13 1 1 A 96 96 THR HA H 95 3.945 4.074 -0.129 1
1 1086 . 13 1 1 A 96 96 THR C C 95 176.386 176.394 -0.008 1
1 1087 . 13 1 1 A 96 96 THR CA C 95 66.550 66.207 0.343 1
1 1088 . 13 1 1 A 96 96 THR CB C 95 68.583 68.718 -0.135 1
1 1090 . 13 1 1 A 96 96 THR N N 95 117.927 116.623 1.304 1
1 1091 . 13 1 1 A 97 97 THR H H 96 7.699 7.738 -0.039 1
1 1092 . 13 1 1 A 97 97 THR HA H 96 3.905 4.010 -0.105 1
1 1097 . 13 1 1 A 97 97 THR C C 96 176.572 176.420 0.152 1
1 1098 . 13 1 1 A 97 97 THR CA C 96 65.979 66.338 -0.359 1
1 1099 . 13 1 1 A 97 97 THR CB C 96 68.553 68.402 0.151 1
1 1101 . 13 1 1 A 97 97 THR N N 96 118.518 116.521 1.997 1
1 1102 . 13 1 1 A 98 98 LEU H H 97 8.304 8.134 0.170 1
1 1103 . 13 1 1 A 98 98 LEU HA H 97 3.725 3.840 -0.115 1
1 1113 . 13 1 1 A 98 98 LEU C C 97 178.490 178.750 -0.260 1
1 1114 . 13 1 1 A 98 98 LEU CA C 97 58.517 58.094 0.423 1
1 1115 . 13 1 1 A 98 98 LEU CB C 97 41.697 41.127 0.570 1
1 1119 . 13 1 1 A 98 98 LEU N N 97 122.882 121.982 0.900 1
1 1120 . 13 1 1 A 99 99 GLN H H 98 7.639 8.037 -0.398 1
1 1121 . 13 1 1 A 99 99 GLN HA H 98 3.927 4.065 -0.138 1
1 1128 . 13 1 1 A 99 99 GLN C C 98 178.068 177.848 0.220 1
1 1129 . 13 1 1 A 99 99 GLN CA C 98 58.735 58.958 -0.223 1
1 1130 . 13 1 1 A 99 99 GLN CB C 98 27.986 28.290 -0.304 1
1 1132 . 13 1 1 A 99 99 GLN N N 98 114.302 117.822 -3.520 1
1 1134 . 13 1 1 A 100 100 HIS H H 99 7.575 7.489 0.086 1
1 1135 . 13 1 1 A 100 100 HIS HA H 99 4.524 4.448 0.076 1
1 1139 . 13 1 1 A 100 100 HIS C C 99 174.789 177.591 -2.802 1
1 1140 . 13 1 1 A 100 100 HIS CA C 99 56.154 58.657 -2.503 1
1 1141 . 13 1 1 A 100 100 HIS CB C 99 28.946 30.964 -2.018 1
1 1143 . 13 1 1 A 100 100 HIS N N 99 114.778 118.093 -3.315 1
1 1144 . 13 1 1 A 101 101 HIS H H 100 7.773 7.976 -0.203 1
1 1145 . 13 1 1 A 101 101 HIS HA H 100 4.704 3.997 0.707 1
1 1149 . 13 1 1 A 101 101 HIS C C 100 174.818 176.965 -2.147 1
1 1150 . 13 1 1 A 101 101 HIS CA C 100 54.830 58.155 -3.325 1
1 1151 . 13 1 1 A 101 101 HIS CB C 100 29.749 30.111 -0.362 1
1 1153 . 13 1 1 A 101 101 HIS N N 100 117.397 119.160 -1.763 1
1 1154 . 13 1 1 A 102 102 LYS H H 101 7.324 8.049 -0.725 1
1 1155 . 13 1 1 A 102 102 LYS HA H 101 3.611 4.080 -0.469 1
1 1164 . 13 1 1 A 102 102 LYS C C 101 176.823 178.066 -1.243 1
1 1165 . 13 1 1 A 102 102 LYS CA C 101 59.915 58.983 0.932 1
1 1166 . 13 1 1 A 102 102 LYS CB C 101 32.825 32.019 0.806 1
1 1170 . 13 1 1 A 102 102 LYS N N 101 120.533 118.988 1.545 1
1 1171 . 13 1 1 A 103 103 ASP H H 102 8.361 7.707 0.654 1
1 1172 . 13 1 1 A 103 103 ASP HA H 102 4.421 4.538 -0.117 1
1 1175 . 13 1 1 A 103 103 ASP C C 102 176.793 176.757 0.036 1
1 1176 . 13 1 1 A 103 103 ASP CA C 102 55.500 56.054 -0.554 1
1 1177 . 13 1 1 A 103 103 ASP CB C 102 40.178 40.352 -0.174 1
1 1178 . 13 1 1 A 103 103 ASP N N 102 114.814 117.627 -2.813 1
1 1179 . 13 1 1 A 104 104 GLU H H 103 7.858 8.255 -0.397 1
1 1180 . 13 1 1 A 104 104 GLU HA H 103 4.339 4.575 -0.236 1
1 1183 . 13 1 1 A 104 104 GLU C C 103 175.777 176.378 -0.601 1
1 1184 . 13 1 1 A 104 104 GLU CA C 103 56.356 57.905 -1.549 1
1 1185 . 13 1 1 A 104 104 GLU CB C 103 31.293 31.709 -0.416 1
1 1186 . 13 1 1 A 104 104 GLU N N 103 116.826 118.965 -2.139 1
1 1187 . 13 1 1 A 105 105 VAL H H 104 7.201 7.732 -0.531 1
1 1188 . 13 1 1 A 105 105 VAL HA H 104 4.296 4.163 0.133 1
1 1196 . 13 1 1 A 105 105 VAL C C 104 174.482 175.591 -1.109 1
1 1197 . 13 1 1 A 105 105 VAL CA C 104 60.370 62.667 -2.297 1
1 1198 . 13 1 1 A 105 105 VAL CB C 104 34.341 33.205 1.136 1
1 1201 . 13 1 1 A 105 105 VAL N N 104 116.422 119.779 -3.357 1
1 1202 . 13 1 1 A 106 106 ALA H H 105 8.487 8.480 0.007 1
1 1203 . 13 1 1 A 106 106 ALA HA H 105 4.172 4.419 -0.247 1
1 1207 . 13 1 1 A 106 106 ALA C C 105 179.030 178.879 0.151 1
1 1208 . 13 1 1 A 106 106 ALA CA C 105 52.966 52.675 0.291 1
1 1209 . 13 1 1 A 106 106 ALA CB C 105 19.371 19.723 -0.352 1
1 1210 . 13 1 1 A 106 106 ALA N N 105 128.313 128.668 -0.355 1
1 1211 . 13 1 1 A 107 107 GLY H H 106 8.738 8.801 -0.063 1
1 1212 . 13 1 1 A 107 107 GLY HA2 H 106 3.773 3.875 -0.102 1
1 1213 . 13 1 1 A 107 107 GLY HA3 H 106 3.998 3.946 0.052 1
1 1214 . 13 1 1 A 107 107 GLY C C 106 174.958 175.852 -0.894 1
1 1215 . 13 1 1 A 107 107 GLY CA C 106 47.449 47.150 0.299 1
1 1216 . 13 1 1 A 107 107 GLY N N 106 110.612 110.832 -0.220 1
1 1217 . 13 1 1 A 108 108 ASP H H 107 8.535 8.478 0.057 1
1 1218 . 13 1 1 A 108 108 ASP HA H 107 4.333 4.344 -0.011 1
1 1221 . 13 1 1 A 108 108 ASP C C 107 179.133 178.346 0.787 1
1 1222 . 13 1 1 A 108 108 ASP CA C 107 56.721 56.678 0.043 1
1 1223 . 13 1 1 A 108 108 ASP CB C 107 39.336 39.660 -0.324 1
1 1224 . 13 1 1 A 108 108 ASP N N 107 117.474 120.976 -3.502 1
1 1225 . 13 1 1 A 109 109 ILE H H 108 7.459 7.899 -0.440 1
1 1226 . 13 1 1 A 109 109 ILE HA H 108 3.688 3.821 -0.133 1
1 1236 . 13 1 1 A 109 109 ILE C C 108 176.735 178.447 -1.712 1
1 1237 . 13 1 1 A 109 109 ILE CA C 108 63.474 65.404 -1.930 1
1 1238 . 13 1 1 A 109 109 ILE CB C 108 37.340 37.621 -0.281 1
1 1242 . 13 1 1 A 109 109 ILE N N 108 119.609 121.155 -1.546 1
1 1243 . 13 1 1 A 110 110 PHE H H 109 7.920 8.388 -0.468 1
1 1244 . 13 1 1 A 110 110 PHE HA H 109 3.759 4.085 -0.326 1
1 1252 . 13 1 1 A 110 110 PHE C C 109 177.132 177.383 -0.251 1
1 1253 . 13 1 1 A 110 110 PHE CA C 109 62.766 61.235 1.531 1
1 1254 . 13 1 1 A 110 110 PHE CB C 109 39.752 39.317 0.435 1
1 1260 . 13 1 1 A 110 110 PHE N N 109 120.906 120.458 0.448 1
1 1261 . 13 1 1 A 111 111 ASP H H 110 8.639 8.233 0.406 1
1 1262 . 13 1 1 A 111 111 ASP HA H 110 4.216 4.195 0.021 1
1 1265 . 13 1 1 A 111 111 ASP C C 110 178.900 178.372 0.528 1
1 1266 . 13 1 1 A 111 111 ASP CA C 110 57.105 57.265 -0.160 1
1 1267 . 13 1 1 A 111 111 ASP CB C 110 39.697 41.801 -2.104 1
1 1268 . 13 1 1 A 111 111 ASP N N 110 117.124 119.028 -1.904 1
1 1269 . 13 1 1 A 112 112 MET H H 111 7.331 7.543 -0.212 1
1 1270 . 13 1 1 A 112 112 MET HA H 111 4.081 4.155 -0.074 1
1 1278 . 13 1 1 A 112 112 MET C C 111 179.052 178.152 0.900 1
1 1279 . 13 1 1 A 112 112 MET CA C 111 58.202 58.121 0.081 1
1 1280 . 13 1 1 A 112 112 MET CB C 111 31.827 32.462 -0.635 1
1 1283 . 13 1 1 A 112 112 MET N N 111 118.061 119.431 -1.370 1
1 1284 . 13 1 1 A 113 113 LEU H H 112 8.001 8.021 -0.020 1
1 1285 . 13 1 1 A 113 113 LEU HA H 112 3.723 3.564 0.159 1
1 1295 . 13 1 1 A 113 113 LEU C C 112 179.747 178.508 1.239 1
1 1296 . 13 1 1 A 113 113 LEU CA C 112 57.371 57.337 0.034 1
1 1297 . 13 1 1 A 113 113 LEU CB C 112 40.671 41.016 -0.345 1
1 1301 . 13 1 1 A 113 113 LEU N N 112 120.426 119.638 0.788 1
1 1302 . 13 1 1 A 114 114 LEU H H 113 7.744 7.640 0.104 1
1 1303 . 13 1 1 A 114 114 LEU HA H 113 4.007 3.442 0.565 1
1 1313 . 13 1 1 A 114 114 LEU C C 113 179.358 178.512 0.846 1
1 1314 . 13 1 1 A 114 114 LEU CA C 113 57.202 57.430 -0.228 1
1 1315 . 13 1 1 A 114 114 LEU CB C 113 41.727 41.559 0.168 1
1 1319 . 13 1 1 A 114 114 LEU N N 113 119.584 119.562 0.022 1
1 1320 . 13 1 1 A 115 115 THR H H 114 7.353 7.580 -0.227 1
1 1321 . 13 1 1 A 115 115 THR HA H 114 4.071 4.073 -0.002 1
1 1327 . 13 1 1 A 115 115 THR C C 114 173.591 176.357 -2.766 1
1 1328 . 13 1 1 A 115 115 THR CA C 114 65.332 64.362 0.970 1
1 1329 . 13 1 1 A 115 115 THR CB C 114 70.319 68.686 1.633 1
1 1331 . 13 1 1 A 115 115 THR N N 114 107.535 112.268 -4.733 1
1 1332 . 13 1 1 A 116 116 PHE H H 115 6.979 7.654 -0.675 1
1 1333 . 13 1 1 A 116 116 PHE HA H 115 5.022 4.323 0.699 1
1 1341 . 13 1 1 A 116 116 PHE C C 115 176.488 176.136 0.352 1
1 1342 . 13 1 1 A 116 116 PHE CA C 115 55.911 60.980 -5.069 1
1 1343 . 13 1 1 A 116 116 PHE CB C 115 38.521 39.124 -0.603 1
1 1349 . 13 1 1 A 116 116 PHE N N 115 112.366 120.083 -7.717 1
1 1350 . 13 1 1 A 117 117 THR H H 116 7.564 8.082 -0.518 1
1 1351 . 13 1 1 A 117 117 THR HA H 116 4.626 4.901 -0.275 1
1 1356 . 13 1 1 A 117 117 THR C C 116 174.085 174.043 0.042 1
1 1357 . 13 1 1 A 117 117 THR CA C 116 61.636 62.431 -0.795 1
1 1358 . 13 1 1 A 117 117 THR CB C 116 70.915 72.372 -1.457 1
1 1360 . 13 1 1 A 117 117 THR N N 116 105.498 112.591 -7.093 1
1 1361 . 13 1 1 A 118 118 ASP H H 117 8.270 7.715 0.555 1
1 1362 . 13 1 1 A 118 118 ASP HA H 117 4.955 4.682 0.273 1
1 1365 . 13 1 1 A 118 118 ASP C C 117 176.328 176.370 -0.042 1
1 1366 . 13 1 1 A 118 118 ASP CA C 117 53.417 53.371 0.046 1
1 1367 . 13 1 1 A 118 118 ASP CB C 117 43.388 40.331 3.057 1
1 1368 . 13 1 1 A 118 118 ASP N N 117 124.409 122.060 2.349 1
1 1369 . 13 1 1 A 119 119 PHE H H 118 8.973 8.800 0.173 1
1 1370 . 13 1 1 A 119 119 PHE HA H 118 3.506 4.215 -0.709 1
1 1378 . 13 1 1 A 119 119 PHE CA C 118 61.490 61.155 0.335 1
1 1379 . 13 1 1 A 119 119 PHE CB C 118 39.246 39.518 -0.272 1
1 1385 . 13 1 1 A 119 119 PHE N N 118 126.688 126.412 0.276 1
1 1386 . 13 1 1 A 120 120 LEU H H 119 8.099 8.315 -0.216 1
1 1387 . 13 1 1 A 120 120 LEU HA H 119 3.842 3.932 -0.090 1
1 1397 . 13 1 1 A 120 120 LEU C C 119 179.601 179.487 0.114 1
1 1398 . 13 1 1 A 120 120 LEU CA C 119 58.174 57.868 0.306 1
1 1399 . 13 1 1 A 120 120 LEU CB C 119 40.315 41.541 -1.226 1
1 1403 . 13 1 1 A 120 120 LEU N N 119 117.930 119.843 -1.913 1
1 1404 . 13 1 1 A 121 121 ALA H H 120 7.729 8.001 -0.272 1
1 1405 . 13 1 1 A 121 121 ALA HA H 120 3.996 4.101 -0.105 1
1 1409 . 13 1 1 A 121 121 ALA C C 120 180.995 179.695 1.300 1
1 1410 . 13 1 1 A 121 121 ALA CA C 120 54.832 54.562 0.270 1
1 1411 . 13 1 1 A 121 121 ALA CB C 120 17.706 18.209 -0.503 1
1 1412 . 13 1 1 A 121 121 ALA N N 120 123.195 120.474 2.721 1
1 1413 . 13 1 1 A 122 122 PHE H H 121 7.943 7.740 0.203 1
1 1414 . 13 1 1 A 122 122 PHE HA H 121 3.887 3.783 0.104 1
1 1419 . 13 1 1 A 122 122 PHE C C 121 175.410 176.764 -1.354 1
1 1420 . 13 1 1 A 122 122 PHE CA C 121 61.075 60.725 0.350 1
1 1421 . 13 1 1 A 122 122 PHE CB C 121 38.115 38.952 -0.837 1
1 1424 . 13 1 1 A 122 122 PHE N N 121 121.798 119.903 1.895 1
1 1425 . 13 1 1 A 123 123 LYS H H 122 8.468 7.891 0.577 1
1 1426 . 13 1 1 A 123 123 LYS HA H 122 3.077 3.854 -0.777 1
1 1435 . 13 1 1 A 123 123 LYS C C 122 178.453 178.899 -0.446 1
1 1436 . 13 1 1 A 123 123 LYS CA C 122 59.855 59.939 -0.084 1
1 1437 . 13 1 1 A 123 123 LYS CB C 122 32.374 32.279 0.095 1
1 1441 . 13 1 1 A 123 123 LYS N N 122 120.614 118.474 2.140 1
1 1442 . 13 1 1 A 124 124 GLU H H 123 8.100 7.999 0.101 1
1 1443 . 13 1 1 A 124 124 GLU HA H 123 3.652 3.934 -0.282 1
1 1448 . 13 1 1 A 124 124 GLU C C 123 177.743 179.115 -1.372 1
1 1449 . 13 1 1 A 124 124 GLU CA C 123 59.406 59.614 -0.208 1
1 1450 . 13 1 1 A 124 124 GLU CB C 123 28.811 29.077 -0.266 1
1 1452 . 13 1 1 A 124 124 GLU N N 123 117.404 119.228 -1.824 1
1 1453 . 13 1 1 A 125 125 MET H H 124 7.537 7.440 0.097 1
1 1454 . 13 1 1 A 125 125 MET HA H 124 3.860 3.963 -0.103 1
1 1462 . 13 1 1 A 125 125 MET C C 124 179.522 178.292 1.230 1
1 1463 . 13 1 1 A 125 125 MET CA C 124 58.832 58.354 0.478 1
1 1464 . 13 1 1 A 125 125 MET CB C 124 31.765 31.430 0.335 1
1 1467 . 13 1 1 A 125 125 MET N N 124 119.413 119.638 -0.225 1
1 1468 . 13 1 1 A 126 126 PHE H H 125 7.148 7.418 -0.270 1
1 1469 . 13 1 1 A 126 126 PHE HA H 125 3.633 4.229 -0.596 1
1 1476 . 13 1 1 A 126 126 PHE C C 125 178.994 178.403 0.591 1
1 1477 . 13 1 1 A 126 126 PHE CA C 125 63.148 61.046 2.102 1
1 1478 . 13 1 1 A 126 126 PHE CB C 125 39.830 38.698 1.132 1
1 1483 . 13 1 1 A 126 126 PHE N N 125 120.013 118.877 1.136 1
1 1484 . 13 1 1 A 127 127 LEU H H 126 8.369 8.620 -0.251 1
1 1485 . 13 1 1 A 127 127 LEU HA H 126 3.972 4.043 -0.071 1
1 1495 . 13 1 1 A 127 127 LEU C C 126 180.621 179.142 1.479 1
1 1496 . 13 1 1 A 127 127 LEU CA C 126 57.944 57.986 -0.042 1
1 1497 . 13 1 1 A 127 127 LEU CB C 126 40.543 41.223 -0.680 1
1 1501 . 13 1 1 A 127 127 LEU N N 126 119.692 119.923 -0.231 1
1 1502 . 13 1 1 A 128 128 ASP H H 127 8.578 8.032 0.546 1
1 1503 . 13 1 1 A 128 128 ASP HA H 127 4.308 4.327 -0.019 1
1 1506 . 13 1 1 A 128 128 ASP C C 127 178.254 178.028 0.226 1
1 1507 . 13 1 1 A 128 128 ASP CA C 127 56.964 57.318 -0.354 1
1 1508 . 13 1 1 A 128 128 ASP CB C 127 39.735 41.074 -1.339 1
1 1509 . 13 1 1 A 128 128 ASP N N 127 121.926 119.940 1.986 1
1 1510 . 13 1 1 A 129 129 TYR H H 128 7.710 8.041 -0.331 1
1 1511 . 13 1 1 A 129 129 TYR HA H 128 3.908 4.039 -0.131 1
1 1518 . 13 1 1 A 129 129 TYR C C 128 177.633 177.638 -0.005 1
1 1519 . 13 1 1 A 129 129 TYR CA C 128 61.796 61.643 0.153 1
1 1520 . 13 1 1 A 129 129 TYR CB C 128 39.372 38.773 0.599 1
1 1525 . 13 1 1 A 129 129 TYR N N 128 122.548 120.309 2.239 1
1 1526 . 13 1 1 A 130 130 ARG H H 129 8.622 8.349 0.273 1
1 1527 . 13 1 1 A 130 130 ARG HA H 129 3.722 4.101 -0.379 1
1 1535 . 13 1 1 A 130 130 ARG CA C 129 60.084 59.834 0.250 1
1 1536 . 13 1 1 A 130 130 ARG CB C 129 29.902 30.064 -0.162 1
1 1539 . 13 1 1 A 130 130 ARG N N 129 118.302 119.598 -1.296 1
1 1541 . 13 1 1 A 131 131 ALA H H 130 7.936 8.281 -0.345 1
1 1542 . 13 1 1 A 131 131 ALA HA H 130 3.997 4.028 -0.031 1
1 1546 . 13 1 1 A 131 131 ALA C C 130 180.456 180.111 0.345 1
1 1547 . 13 1 1 A 131 131 ALA CA C 130 55.133 55.099 0.034 1
1 1548 . 13 1 1 A 131 131 ALA CB C 130 17.750 18.343 -0.593 1
1 1549 . 13 1 1 A 131 131 ALA N N 130 119.788 121.511 -1.723 1
1 1550 . 13 1 1 A 132 132 GLU H H 131 7.622 7.774 -0.152 1
1 1551 . 13 1 1 A 132 132 GLU HA H 131 3.862 3.932 -0.070 1
1 1556 . 13 1 1 A 132 132 GLU C C 131 179.528 179.453 0.075 1
1 1557 . 13 1 1 A 132 132 GLU CA C 131 58.849 59.293 -0.444 1
1 1558 . 13 1 1 A 132 132 GLU CB C 131 28.930 28.961 -0.031 1
1 1560 . 13 1 1 A 132 132 GLU N N 131 118.428 118.028 0.400 1
1 1561 . 13 1 1 A 133 133 LYS H H 132 7.853 7.529 0.324 1
1 1562 . 13 1 1 A 133 133 LYS HA H 132 3.722 3.989 -0.267 1
1 1571 . 13 1 1 A 133 133 LYS C C 132 175.725 177.524 -1.799 1
1 1572 . 13 1 1 A 133 133 LYS CA C 132 57.544 58.830 -1.286 1
1 1573 . 13 1 1 A 133 133 LYS CB C 132 31.770 32.296 -0.526 1
1 1577 . 13 1 1 A 133 133 LYS N N 132 119.473 119.604 -0.131 1
1 1578 . 13 1 1 A 134 134 GLU H H 133 8.151 7.761 0.390 1
1 1579 . 13 1 1 A 134 134 GLU HA H 133 4.161 4.579 -0.418 1
1 1584 . 13 1 1 A 134 134 GLU C C 133 177.453 176.165 1.288 1
1 1585 . 13 1 1 A 134 134 GLU CA C 133 57.222 56.249 0.973 1
1 1586 . 13 1 1 A 134 134 GLU CB C 133 30.091 30.890 -0.799 1
1 1588 . 13 1 1 A 134 134 GLU N N 133 116.525 116.200 0.325 1
1 1589 . 13 1 1 A 135 135 GLY H H 134 7.702 7.524 0.178 1
1 1590 . 13 1 1 A 135 135 GLY HA2 H 134 3.896 4.080 -0.184 1
1 1591 . 13 1 1 A 135 135 GLY HA3 H 134 3.897 4.083 -0.186 1
1 1592 . 13 1 1 A 135 135 GLY C C 134 174.538 172.420 2.118 1
1 1593 . 13 1 1 A 135 135 GLY CA C 134 45.975 45.724 0.251 1
1 1594 . 13 1 1 A 135 135 GLY N N 134 107.924 106.786 1.138 1
1 1595 . 13 1 1 A 136 136 ARG H H 135 8.045 8.360 -0.315 1
1 1596 . 13 1 1 A 136 136 ARG HA H 135 4.323 4.916 -0.593 1
1 1604 . 13 1 1 A 136 136 ARG C C 135 175.864 174.473 1.391 1
1 1605 . 13 1 1 A 136 136 ARG CA C 135 56.016 54.850 1.166 1
1 1606 . 13 1 1 A 136 136 ARG CB C 135 30.987 33.764 -2.777 1
1 1609 . 13 1 1 A 136 136 ARG N N 135 119.708 122.673 -2.965 1
1 1 . 14 1 1 A 14 14 PHE CA C 13 58.199 57.020 1.179 1
1 2 . 14 1 1 A 14 14 PHE CB C 13 39.717 40.838 -1.121 1
1 3 . 14 1 1 A 15 15 SER H H 14 8.299 7.781 0.518 1
1 4 . 14 1 1 A 15 15 SER HA H 14 4.359 4.321 0.038 1
1 7 . 14 1 1 A 15 15 SER CA C 14 58.249 59.150 -0.901 1
1 8 . 14 1 1 A 15 15 SER CB C 14 63.936 63.018 0.918 1
1 9 . 14 1 1 A 15 15 SER N N 14 117.379 116.412 0.967 1
1 10 . 14 1 1 A 16 16 SER H H 15 8.255 8.093 0.162 1
1 11 . 14 1 1 A 16 16 SER HA H 15 3.729 4.752 -1.023 1
1 14 . 14 1 1 A 16 16 SER CA C 15 58.224 58.263 -0.039 1
1 15 . 14 1 1 A 16 16 SER CB C 15 63.886 65.248 -1.362 1
1 16 . 14 1 1 A 16 16 SER N N 15 117.694 111.948 5.746 1
1 17 . 14 1 1 A 17 17 ALA H H 16 8.333 8.292 0.041 1
1 18 . 14 1 1 A 17 17 ALA HA H 16 4.252 4.311 -0.059 1
1 22 . 14 1 1 A 17 17 ALA CA C 16 53.377 55.242 -1.865 1
1 23 . 14 1 1 A 17 17 ALA CB C 16 18.896 18.531 0.365 1
1 24 . 14 1 1 A 17 17 ALA N N 16 125.462 124.814 0.648 1
1 25 . 14 1 1 A 18 18 SER H H 17 8.219 7.801 0.418 1
1 26 . 14 1 1 A 18 18 SER HA H 17 4.332 4.362 -0.030 1
1 29 . 14 1 1 A 18 18 SER CA C 17 59.105 59.050 0.055 1
1 30 . 14 1 1 A 18 18 SER CB C 17 63.592 63.898 -0.306 1
1 31 . 14 1 1 A 18 18 SER N N 17 114.821 110.795 4.026 1
1 32 . 14 1 1 A 19 19 ASP H H 18 8.309 7.734 0.575 1
1 33 . 14 1 1 A 19 19 ASP HA H 18 4.554 5.001 -0.447 1
1 36 . 14 1 1 A 19 19 ASP C C 18 176.528 177.010 -0.482 1
1 37 . 14 1 1 A 19 19 ASP CA C 18 55.272 52.861 2.411 1
1 38 . 14 1 1 A 19 19 ASP CB C 18 40.883 42.988 -2.105 1
1 39 . 14 1 1 A 19 19 ASP N N 18 123.367 121.596 1.771 1
1 40 . 14 1 1 A 20 20 ALA H H 19 8.133 8.840 -0.707 1
1 41 . 14 1 1 A 20 20 ALA HA H 19 4.170 4.063 0.107 1
1 45 . 14 1 1 A 20 20 ALA C C 19 179.857 179.510 0.347 1
1 46 . 14 1 1 A 20 20 ALA CA C 19 54.341 55.020 -0.679 1
1 47 . 14 1 1 A 20 20 ALA CB C 19 18.660 18.265 0.395 1
1 48 . 14 1 1 A 20 20 ALA N N 19 123.350 122.859 0.491 1
1 49 . 14 1 1 A 21 21 GLU H H 20 8.140 8.200 -0.060 1
1 50 . 14 1 1 A 21 21 GLU HA H 20 4.128 4.093 0.035 1
1 55 . 14 1 1 A 21 21 GLU C C 20 177.675 178.587 -0.912 1
1 56 . 14 1 1 A 21 21 GLU CA C 20 58.520 59.445 -0.925 1
1 57 . 14 1 1 A 21 21 GLU CB C 20 29.765 29.547 0.218 1
1 59 . 14 1 1 A 21 21 GLU N N 20 119.063 119.498 -0.435 1
1 60 . 14 1 1 A 22 22 PHE H H 21 8.009 8.008 0.001 1
1 61 . 14 1 1 A 22 22 PHE HA H 21 4.123 4.286 -0.163 1
1 68 . 14 1 1 A 22 22 PHE C C 21 176.410 176.845 -0.435 1
1 69 . 14 1 1 A 22 22 PHE CA C 21 62.202 61.480 0.722 1
1 70 . 14 1 1 A 22 22 PHE CB C 21 39.223 39.083 0.140 1
1 75 . 14 1 1 A 22 22 PHE N N 21 121.211 120.924 0.287 1
1 76 . 14 1 1 A 23 23 ASP H H 22 8.261 8.546 -0.285 1
1 77 . 14 1 1 A 23 23 ASP HA H 22 4.041 4.389 -0.348 1
1 80 . 14 1 1 A 23 23 ASP C C 22 179.078 178.151 0.927 1
1 81 . 14 1 1 A 23 23 ASP CA C 22 57.048 57.831 -0.783 1
1 82 . 14 1 1 A 23 23 ASP CB C 22 40.154 42.064 -1.910 1
1 83 . 14 1 1 A 23 23 ASP N N 22 116.876 119.138 -2.262 1
1 84 . 14 1 1 A 24 24 ALA H H 23 7.651 7.533 0.118 1
1 85 . 14 1 1 A 24 24 ALA HA H 23 3.785 3.827 -0.042 1
1 89 . 14 1 1 A 24 24 ALA C C 23 179.577 179.798 -0.221 1
1 90 . 14 1 1 A 24 24 ALA CA C 23 54.341 55.163 -0.822 1
1 91 . 14 1 1 A 24 24 ALA CB C 23 17.762 18.157 -0.395 1
1 92 . 14 1 1 A 24 24 ALA N N 23 121.873 121.774 0.099 1
1 93 . 14 1 1 A 25 25 VAL H H 24 7.718 8.001 -0.283 1
1 94 . 14 1 1 A 25 25 VAL HA H 24 3.216 3.582 -0.366 1
1 102 . 14 1 1 A 25 25 VAL C C 24 177.805 178.328 -0.523 1
1 103 . 14 1 1 A 25 25 VAL CA C 24 66.789 66.805 -0.016 1
1 104 . 14 1 1 A 25 25 VAL CB C 24 31.277 31.198 0.079 1
1 107 . 14 1 1 A 25 25 VAL N N 24 117.890 118.577 -0.687 1
1 108 . 14 1 1 A 26 26 VAL H H 25 7.867 7.714 0.153 1
1 109 . 14 1 1 A 26 26 VAL HA H 25 3.274 3.497 -0.223 1
1 117 . 14 1 1 A 26 26 VAL C C 25 177.788 177.995 -0.207 1
1 118 . 14 1 1 A 26 26 VAL CA C 25 67.282 66.409 0.873 1
1 119 . 14 1 1 A 26 26 VAL CB C 25 31.266 31.490 -0.224 1
1 122 . 14 1 1 A 26 26 VAL N N 25 118.170 119.796 -1.626 1
1 123 . 14 1 1 A 27 27 GLY H H 26 7.544 7.626 -0.082 1
1 124 . 14 1 1 A 27 27 GLY HA2 H 26 3.592 3.515 0.077 1
1 125 . 14 1 1 A 27 27 GLY HA3 H 26 3.721 3.634 0.087 1
1 126 . 14 1 1 A 27 27 GLY C C 26 176.717 176.516 0.201 1
1 127 . 14 1 1 A 27 27 GLY CA C 26 47.085 47.214 -0.129 1
1 128 . 14 1 1 A 27 27 GLY N N 26 105.795 107.434 -1.639 1
1 129 . 14 1 1 A 28 28 TYR H H 27 7.625 7.442 0.183 1
1 130 . 14 1 1 A 28 28 TYR HA H 27 4.546 4.593 -0.047 1
1 137 . 14 1 1 A 28 28 TYR C C 27 178.991 178.196 0.795 1
1 138 . 14 1 1 A 28 28 TYR CA C 27 58.845 59.663 -0.818 1
1 139 . 14 1 1 A 28 28 TYR CB C 27 37.602 37.693 -0.091 1
1 144 . 14 1 1 A 28 28 TYR N N 27 119.933 122.124 -2.191 1
1 145 . 14 1 1 A 29 29 LEU H H 28 8.517 8.231 0.286 1
1 146 . 14 1 1 A 29 29 LEU HA H 28 3.728 3.827 -0.099 1
1 156 . 14 1 1 A 29 29 LEU CA C 28 58.281 57.947 0.334 1
1 157 . 14 1 1 A 29 29 LEU CB C 28 41.948 41.423 0.525 1
1 161 . 14 1 1 A 29 29 LEU N N 28 119.669 120.380 -0.711 1
1 162 . 14 1 1 A 30 30 GLU H H 29 8.072 7.982 0.090 1
1 163 . 14 1 1 A 30 30 GLU HA H 29 3.722 3.880 -0.158 1
1 168 . 14 1 1 A 30 30 GLU C C 29 177.731 178.819 -1.088 1
1 169 . 14 1 1 A 30 30 GLU CA C 29 59.763 59.990 -0.227 1
1 170 . 14 1 1 A 30 30 GLU CB C 29 28.844 29.468 -0.624 1
1 172 . 14 1 1 A 30 30 GLU N N 29 117.666 117.905 -0.239 1
1 173 . 14 1 1 A 31 31 ASP H H 30 7.243 8.087 -0.844 1
1 174 . 14 1 1 A 31 31 ASP HA H 30 4.297 4.388 -0.091 1
1 177 . 14 1 1 A 31 31 ASP CA C 30 56.953 57.226 -0.273 1
1 178 . 14 1 1 A 31 31 ASP CB C 30 40.730 42.309 -1.579 1
1 179 . 14 1 1 A 31 31 ASP N N 30 116.720 119.479 -2.759 1
1 180 . 14 1 1 A 32 32 ILE H H 31 7.940 7.435 0.505 1
1 181 . 14 1 1 A 32 32 ILE HA H 31 3.640 3.739 -0.099 1
1 191 . 14 1 1 A 32 32 ILE C C 31 177.980 178.068 -0.088 1
1 192 . 14 1 1 A 32 32 ILE CA C 31 64.692 64.118 0.574 1
1 193 . 14 1 1 A 32 32 ILE CB C 31 38.938 36.980 1.958 1
1 197 . 14 1 1 A 32 32 ILE N N 31 119.728 118.005 1.723 1
1 198 . 14 1 1 A 33 33 ILE H H 32 7.984 7.721 0.263 1
1 199 . 14 1 1 A 33 33 ILE HA H 32 3.598 3.374 0.224 1
1 209 . 14 1 1 A 33 33 ILE C C 32 176.723 177.041 -0.318 1
1 210 . 14 1 1 A 33 33 ILE CA C 32 63.241 64.713 -1.472 1
1 211 . 14 1 1 A 33 33 ILE CB C 32 37.580 37.925 -0.345 1
1 215 . 14 1 1 A 33 33 ILE N N 32 113.919 120.584 -6.665 1
1 216 . 14 1 1 A 34 34 MET H H 33 7.288 7.705 -0.417 1
1 217 . 14 1 1 A 34 34 MET HA H 33 4.496 4.745 -0.249 1
1 225 . 14 1 1 A 34 34 MET C C 33 176.423 175.679 0.744 1
1 226 . 14 1 1 A 34 34 MET CA C 33 54.634 54.202 0.432 1
1 227 . 14 1 1 A 34 34 MET CB C 33 31.934 32.007 -0.073 1
1 230 . 14 1 1 A 34 34 MET N N 33 115.130 116.713 -1.583 1
1 231 . 14 1 1 A 35 35 ASP H H 34 7.405 7.666 -0.261 1
1 232 . 14 1 1 A 35 35 ASP HA H 34 4.484 4.745 -0.261 1
1 235 . 14 1 1 A 35 35 ASP C C 34 177.139 176.671 0.468 1
1 236 . 14 1 1 A 35 35 ASP CA C 34 54.625 54.266 0.359 1
1 237 . 14 1 1 A 35 35 ASP CB C 34 43.554 42.991 0.563 1
1 238 . 14 1 1 A 35 35 ASP N N 34 121.814 122.672 -0.858 1
1 239 . 14 1 1 A 36 36 ASP H H 35 8.765 8.847 -0.082 1
1 240 . 14 1 1 A 36 36 ASP HA H 35 4.235 4.336 -0.101 1
1 243 . 14 1 1 A 36 36 ASP C C 35 178.320 178.439 -0.119 1
1 244 . 14 1 1 A 36 36 ASP CA C 35 57.832 57.945 -0.113 1
1 245 . 14 1 1 A 36 36 ASP CB C 35 40.914 40.376 0.538 1
1 246 . 14 1 1 A 36 36 ASP N N 35 125.883 125.341 0.542 1
1 247 . 14 1 1 A 37 37 GLU H H 36 8.905 8.255 0.650 1
1 248 . 14 1 1 A 37 37 GLU HA H 36 3.933 4.127 -0.194 1
1 253 . 14 1 1 A 37 37 GLU C C 36 179.304 179.096 0.208 1
1 254 . 14 1 1 A 37 37 GLU CA C 36 59.828 59.226 0.602 1
1 255 . 14 1 1 A 37 37 GLU CB C 36 29.380 29.245 0.135 1
1 257 . 14 1 1 A 37 37 GLU N N 36 119.077 119.819 -0.742 1
1 258 . 14 1 1 A 38 38 PHE H H 37 7.460 8.514 -1.054 1
1 259 . 14 1 1 A 38 38 PHE HA H 37 3.642 3.968 -0.326 1
1 267 . 14 1 1 A 38 38 PHE C C 37 176.483 178.090 -1.607 1
1 268 . 14 1 1 A 38 38 PHE CA C 37 61.411 61.218 0.193 1
1 269 . 14 1 1 A 38 38 PHE CB C 37 39.355 38.990 0.365 1
1 275 . 14 1 1 A 38 38 PHE N N 37 119.968 120.600 -0.632 1
1 276 . 14 1 1 A 39 39 GLN H H 38 7.968 8.047 -0.079 1
1 277 . 14 1 1 A 39 39 GLN HA H 38 3.712 3.850 -0.138 1
1 284 . 14 1 1 A 39 39 GLN CA C 38 59.153 58.802 0.351 1
1 285 . 14 1 1 A 39 39 GLN CB C 38 28.213 28.595 -0.382 1
1 287 . 14 1 1 A 39 39 GLN N N 38 116.433 118.576 -2.143 1
1 289 . 14 1 1 A 40 40 LEU H H 39 7.930 7.695 0.235 1
1 290 . 14 1 1 A 40 40 LEU HA H 39 3.916 4.020 -0.104 1
1 300 . 14 1 1 A 40 40 LEU C C 39 177.731 178.265 -0.534 1
1 301 . 14 1 1 A 40 40 LEU CA C 39 57.915 57.915 0.000 1
1 302 . 14 1 1 A 40 40 LEU CB C 39 41.989 41.590 0.399 1
1 306 . 14 1 1 A 40 40 LEU N N 39 119.505 121.243 -1.738 1
1 307 . 14 1 1 A 41 41 LEU H H 40 7.174 8.062 -0.888 1
1 308 . 14 1 1 A 41 41 LEU HA H 40 3.835 4.038 -0.203 1
1 318 . 14 1 1 A 41 41 LEU C C 40 179.738 178.220 1.518 1
1 319 . 14 1 1 A 41 41 LEU CA C 40 58.266 58.071 0.195 1
1 320 . 14 1 1 A 41 41 LEU CB C 40 42.050 41.414 0.636 1
1 324 . 14 1 1 A 41 41 LEU N N 40 120.971 119.946 1.025 1
1 325 . 14 1 1 A 42 42 GLN H H 41 8.058 7.957 0.101 1
1 326 . 14 1 1 A 42 42 GLN HA H 41 3.556 3.738 -0.182 1
1 333 . 14 1 1 A 42 42 GLN C C 41 177.642 178.493 -0.851 1
1 334 . 14 1 1 A 42 42 GLN CA C 41 59.826 59.236 0.590 1
1 335 . 14 1 1 A 42 42 GLN CB C 41 28.762 27.824 0.938 1
1 337 . 14 1 1 A 42 42 GLN N N 41 117.899 118.025 -0.126 1
1 339 . 14 1 1 A 43 43 ARG H H 42 8.179 7.910 0.269 1
1 340 . 14 1 1 A 43 43 ARG HA H 42 3.655 3.944 -0.289 1
1 347 . 14 1 1 A 43 43 ARG C C 42 178.051 178.309 -0.258 1
1 348 . 14 1 1 A 43 43 ARG CA C 42 59.766 58.780 0.986 1
1 349 . 14 1 1 A 43 43 ARG CB C 42 29.941 29.926 0.015 1
1 352 . 14 1 1 A 43 43 ARG N N 42 119.392 119.846 -0.454 1
1 353 . 14 1 1 A 44 44 ASN H H 43 8.525 7.827 0.698 1
1 354 . 14 1 1 A 44 44 ASN HA H 43 4.332 4.362 -0.030 1
1 359 . 14 1 1 A 44 44 ASN C C 43 178.150 177.790 0.360 1
1 360 . 14 1 1 A 44 44 ASN CA C 43 55.841 56.148 -0.307 1
1 361 . 14 1 1 A 44 44 ASN CB C 43 37.632 39.134 -1.502 1
1 362 . 14 1 1 A 44 44 ASN N N 43 116.214 117.667 -1.453 1
1 364 . 14 1 1 A 45 45 PHE H H 44 7.586 7.763 -0.177 1
1 365 . 14 1 1 A 45 45 PHE HA H 44 4.132 4.309 -0.177 1
1 372 . 14 1 1 A 45 45 PHE C C 44 176.691 178.889 -2.198 1
1 373 . 14 1 1 A 45 45 PHE CA C 44 62.333 60.828 1.505 1
1 374 . 14 1 1 A 45 45 PHE CB C 44 39.449 39.007 0.442 1
1 379 . 14 1 1 A 45 45 PHE N N 44 121.501 117.549 3.952 1
1 380 . 14 1 1 A 46 46 MET H H 45 8.190 8.416 -0.226 1
1 381 . 14 1 1 A 46 46 MET HA H 45 4.060 4.408 -0.348 1
1 389 . 14 1 1 A 46 46 MET C C 45 179.754 178.318 1.436 1
1 390 . 14 1 1 A 46 46 MET CA C 45 57.742 57.839 -0.097 1
1 391 . 14 1 1 A 46 46 MET CB C 45 29.912 32.082 -2.170 1
1 394 . 14 1 1 A 46 46 MET N N 45 116.727 119.249 -2.522 1
1 395 . 14 1 1 A 47 47 ASP H H 46 8.579 8.270 0.309 1
1 396 . 14 1 1 A 47 47 ASP HA H 46 4.804 4.684 0.120 1
1 399 . 14 1 1 A 47 47 ASP C C 46 177.854 177.833 0.021 1
1 400 . 14 1 1 A 47 47 ASP CA C 46 57.277 57.341 -0.064 1
1 401 . 14 1 1 A 47 47 ASP CB C 46 40.776 41.701 -0.925 1
1 402 . 14 1 1 A 47 47 ASP N N 46 117.798 120.504 -2.706 1
1 403 . 14 1 1 A 48 48 LYS H H 47 7.339 7.966 -0.627 1
1 404 . 14 1 1 A 48 48 LYS HA H 47 3.828 4.271 -0.443 1
1 413 . 14 1 1 A 48 48 LYS C C 47 178.812 178.799 0.013 1
1 414 . 14 1 1 A 48 48 LYS CA C 47 58.953 57.915 1.038 1
1 415 . 14 1 1 A 48 48 LYS CB C 47 32.796 33.258 -0.462 1
1 419 . 14 1 1 A 48 48 LYS N N 47 117.852 118.766 -0.914 1
1 420 . 14 1 1 A 49 49 TYR H H 48 6.841 8.485 -1.644 1
1 421 . 14 1 1 A 49 49 TYR HA H 48 4.995 4.284 0.711 1
1 428 . 14 1 1 A 49 49 TYR C C 48 178.138 178.713 -0.575 1
1 429 . 14 1 1 A 49 49 TYR CA C 48 58.620 59.816 -1.196 1
1 430 . 14 1 1 A 49 49 TYR CB C 48 42.939 38.286 4.653 1
1 435 . 14 1 1 A 49 49 TYR N N 48 112.109 119.473 -7.364 1
1 436 . 14 1 1 A 50 50 TYR H H 49 8.491 8.352 0.139 1
1 437 . 14 1 1 A 50 50 TYR HA H 49 4.598 4.130 0.468 1
1 444 . 14 1 1 A 50 50 TYR C C 49 176.015 177.622 -1.607 1
1 445 . 14 1 1 A 50 50 TYR CA C 49 62.442 59.554 2.888 1
1 446 . 14 1 1 A 50 50 TYR CB C 49 36.588 36.895 -0.307 1
1 451 . 14 1 1 A 50 50 TYR N N 49 118.294 118.833 -0.539 1
1 452 . 14 1 1 A 51 51 LEU H H 50 7.512 7.362 0.150 1
1 453 . 14 1 1 A 51 51 LEU HA H 50 3.878 3.594 0.284 1
1 463 . 14 1 1 A 51 51 LEU C C 50 178.625 178.605 0.020 1
1 464 . 14 1 1 A 51 51 LEU CA C 50 55.994 57.158 -1.164 1
1 465 . 14 1 1 A 51 51 LEU CB C 50 40.743 41.434 -0.691 1
1 469 . 14 1 1 A 51 51 LEU N N 50 118.478 121.844 -3.366 1
1 470 . 14 1 1 A 52 52 GLU H H 51 8.042 7.871 0.171 1
1 471 . 14 1 1 A 52 52 GLU HA H 51 4.197 3.948 0.249 1
1 476 . 14 1 1 A 52 52 GLU C C 51 177.629 177.597 0.032 1
1 477 . 14 1 1 A 52 52 GLU CA C 51 56.141 59.370 -3.229 1
1 478 . 14 1 1 A 52 52 GLU CB C 51 29.162 29.220 -0.058 1
1 480 . 14 1 1 A 52 52 GLU N N 51 115.067 117.971 -2.904 1
1 481 . 14 1 1 A 53 53 PHE H H 52 7.465 7.882 -0.417 1
1 482 . 14 1 1 A 53 53 PHE HA H 52 4.431 4.713 -0.282 1
1 490 . 14 1 1 A 53 53 PHE C C 52 174.325 174.823 -0.498 1
1 491 . 14 1 1 A 53 53 PHE CA C 52 58.986 57.071 1.915 1
1 492 . 14 1 1 A 53 53 PHE CB C 52 40.183 37.487 2.696 1
1 498 . 14 1 1 A 53 53 PHE N N 52 116.768 118.711 -1.943 1
1 499 . 14 1 1 A 54 54 GLU H H 53 7.484 8.654 -1.170 1
1 500 . 14 1 1 A 54 54 GLU HA H 53 4.583 4.819 -0.236 1
1 505 . 14 1 1 A 54 54 GLU C C 53 175.722 175.681 0.041 1
1 506 . 14 1 1 A 54 54 GLU CA C 53 54.248 55.599 -1.351 1
1 507 . 14 1 1 A 54 54 GLU CB C 53 34.409 31.921 2.488 1
1 509 . 14 1 1 A 54 54 GLU N N 53 118.844 124.294 -5.450 1
1 510 . 14 1 1 A 55 55 ASP H H 54 9.008 8.696 0.312 1
1 511 . 14 1 1 A 55 55 ASP HA H 54 4.735 4.880 -0.145 1
1 514 . 14 1 1 A 55 55 ASP C C 54 175.421 175.707 -0.286 1
1 515 . 14 1 1 A 55 55 ASP CA C 54 52.888 53.758 -0.870 1
1 516 . 14 1 1 A 55 55 ASP CB C 54 38.894 40.481 -1.587 1
1 517 . 14 1 1 A 55 55 ASP N N 54 123.654 124.498 -0.844 1
1 518 . 14 1 1 A 56 56 THR H H 55 7.819 7.816 0.003 1
1 519 . 14 1 1 A 56 56 THR HA H 55 4.574 4.965 -0.391 1
1 524 . 14 1 1 A 56 56 THR C C 55 174.096 174.924 -0.828 1
1 525 . 14 1 1 A 56 56 THR CA C 55 59.172 59.539 -0.367 1
1 526 . 14 1 1 A 56 56 THR CB C 55 71.889 72.172 -0.283 1
1 528 . 14 1 1 A 56 56 THR N N 55 112.015 116.714 -4.699 1
1 529 . 14 1 1 A 57 57 GLU H H 56 8.527 9.066 -0.539 1
1 530 . 14 1 1 A 57 57 GLU HA H 56 4.217 4.093 0.124 1
1 535 . 14 1 1 A 57 57 GLU C C 56 177.042 177.115 -0.073 1
1 536 . 14 1 1 A 57 57 GLU CA C 56 56.869 59.589 -2.720 1
1 537 . 14 1 1 A 57 57 GLU CB C 56 29.731 29.558 0.173 1
1 539 . 14 1 1 A 57 57 GLU N N 56 117.531 122.555 -5.024 1
1 540 . 14 1 1 A 58 58 GLU H H 57 7.587 7.905 -0.318 1
1 541 . 14 1 1 A 58 58 GLU HA H 57 3.941 4.391 -0.450 1
1 546 . 14 1 1 A 58 58 GLU C C 57 176.849 176.039 0.810 1
1 547 . 14 1 1 A 58 58 GLU CA C 57 56.924 56.664 0.260 1
1 548 . 14 1 1 A 58 58 GLU CB C 57 30.251 30.251 0.000 1
1 550 . 14 1 1 A 58 58 GLU N N 57 119.183 119.310 -0.127 1
1 551 . 14 1 1 A 59 59 ASN H H 58 9.120 8.824 0.296 1
1 552 . 14 1 1 A 59 59 ASN HA H 58 4.922 5.173 -0.251 1
1 557 . 14 1 1 A 59 59 ASN C C 58 174.254 174.811 -0.557 1
1 558 . 14 1 1 A 59 59 ASN CA C 58 51.956 53.350 -1.394 1
1 559 . 14 1 1 A 59 59 ASN CB C 58 37.404 39.875 -2.471 1
1 560 . 14 1 1 A 59 59 ASN N N 58 126.767 123.906 2.861 1
1 562 . 14 1 1 A 60 60 LYS H H 59 5.892 9.151 -3.259 1
1 563 . 14 1 1 A 60 60 LYS HA H 59 3.798 4.654 -0.856 1
1 572 . 14 1 1 A 60 60 LYS C C 59 177.908 177.538 0.370 1
1 573 . 14 1 1 A 60 60 LYS CA C 59 56.623 54.531 2.092 1
1 574 . 14 1 1 A 60 60 LYS CB C 59 32.279 34.791 -2.512 1
1 578 . 14 1 1 A 60 60 LYS N N 59 121.527 123.659 -2.132 1
1 579 . 14 1 1 A 61 61 LEU H H 60 8.473 8.870 -0.397 1
1 580 . 14 1 1 A 61 61 LEU HA H 60 3.891 4.307 -0.416 1
1 590 . 14 1 1 A 61 61 LEU C C 60 179.843 177.952 1.891 1
1 591 . 14 1 1 A 61 61 LEU CA C 60 58.301 56.936 1.365 1
1 592 . 14 1 1 A 61 61 LEU CB C 60 41.305 42.299 -0.994 1
1 596 . 14 1 1 A 61 61 LEU N N 60 125.639 125.208 0.431 1
1 597 . 14 1 1 A 62 62 ILE H H 61 7.698 7.804 -0.106 1
1 598 . 14 1 1 A 62 62 ILE HA H 61 3.952 3.812 0.140 1
1 608 . 14 1 1 A 62 62 ILE C C 61 175.392 177.198 -1.806 1
1 609 . 14 1 1 A 62 62 ILE CA C 61 61.743 63.204 -1.461 1
1 610 . 14 1 1 A 62 62 ILE CB C 61 39.108 37.755 1.353 1
1 614 . 14 1 1 A 62 62 ILE N N 61 114.111 118.829 -4.718 1
1 615 . 14 1 1 A 63 63 TYR H H 62 7.273 7.723 -0.450 1
1 616 . 14 1 1 A 63 63 TYR HA H 62 4.343 4.106 0.237 1
1 623 . 14 1 1 A 63 63 TYR C C 62 178.264 178.549 -0.285 1
1 624 . 14 1 1 A 63 63 TYR CA C 62 57.231 60.743 -3.512 1
1 625 . 14 1 1 A 63 63 TYR CB C 62 36.332 37.375 -1.043 1
1 630 . 14 1 1 A 63 63 TYR N N 62 117.689 121.464 -3.775 1
1 631 . 14 1 1 A 64 64 THR H H 63 7.747 7.885 -0.138 1
1 632 . 14 1 1 A 64 64 THR HA H 63 4.266 4.229 0.037 1
1 637 . 14 1 1 A 64 64 THR CA C 63 69.362 67.556 1.806 1
1 638 . 14 1 1 A 64 64 THR CB C 63 66.962 67.558 -0.596 1
1 640 . 14 1 1 A 64 64 THR N N 63 113.755 116.033 -2.278 1
1 641 . 14 1 1 A 65 65 PRO HA H 64 4.372 4.374 -0.002 1
1 648 . 14 1 1 A 65 65 PRO C C 64 179.913 179.295 0.618 1
1 649 . 14 1 1 A 65 65 PRO CA C 64 66.011 65.993 0.018 1
1 650 . 14 1 1 A 65 65 PRO CB C 64 30.642 30.594 0.048 1
1 653 . 14 1 1 A 66 66 ILE H H 65 7.377 7.303 0.074 1
1 654 . 14 1 1 A 66 66 ILE HA H 65 3.530 3.864 -0.334 1
1 664 . 14 1 1 A 66 66 ILE C C 65 177.543 178.139 -0.596 1
1 665 . 14 1 1 A 66 66 ILE CA C 65 66.647 64.305 2.342 1
1 666 . 14 1 1 A 66 66 ILE CB C 65 38.029 37.682 0.347 1
1 670 . 14 1 1 A 66 66 ILE N N 65 118.353 116.695 1.658 1
1 671 . 14 1 1 A 67 67 PHE H H 66 8.480 8.551 -0.071 1
1 672 . 14 1 1 A 67 67 PHE HA H 66 4.115 4.425 -0.310 1
1 680 . 14 1 1 A 67 67 PHE C C 66 177.293 178.314 -1.021 1
1 681 . 14 1 1 A 67 67 PHE CA C 66 59.570 61.792 -2.222 1
1 682 . 14 1 1 A 67 67 PHE CB C 66 38.865 39.480 -0.615 1
1 688 . 14 1 1 A 67 67 PHE N N 66 122.420 120.531 1.889 1
1 689 . 14 1 1 A 68 68 ASN H H 67 8.595 8.084 0.511 1
1 690 . 14 1 1 A 68 68 ASN HA H 67 4.211 4.433 -0.222 1
1 695 . 14 1 1 A 68 68 ASN C C 67 178.697 178.173 0.524 1
1 696 . 14 1 1 A 68 68 ASN CA C 67 56.056 56.096 -0.040 1
1 697 . 14 1 1 A 68 68 ASN CB C 67 37.704 37.989 -0.285 1
1 698 . 14 1 1 A 68 68 ASN N N 67 115.573 117.236 -1.663 1
1 700 . 14 1 1 A 69 69 GLU H H 68 8.414 7.927 0.487 1
1 701 . 14 1 1 A 69 69 GLU HA H 68 4.102 4.388 -0.286 1
1 706 . 14 1 1 A 69 69 GLU C C 68 177.880 178.781 -0.901 1
1 707 . 14 1 1 A 69 69 GLU CA C 68 59.399 59.175 0.224 1
1 708 . 14 1 1 A 69 69 GLU CB C 68 29.855 29.141 0.714 1
1 710 . 14 1 1 A 69 69 GLU N N 68 123.510 119.894 3.616 1
1 711 . 14 1 1 A 70 70 TYR H H 69 8.659 8.078 0.581 1
1 712 . 14 1 1 A 70 70 TYR HA H 69 3.362 4.124 -0.762 1
1 719 . 14 1 1 A 70 70 TYR C C 69 178.143 176.945 1.198 1
1 720 . 14 1 1 A 70 70 TYR CA C 69 60.686 61.100 -0.414 1
1 721 . 14 1 1 A 70 70 TYR CB C 69 38.560 38.868 -0.308 1
1 726 . 14 1 1 A 70 70 TYR N N 69 122.130 120.945 1.185 1
1 727 . 14 1 1 A 71 71 ILE H H 70 8.031 7.808 0.223 1
1 728 . 14 1 1 A 71 71 ILE HA H 70 3.265 3.724 -0.459 1
1 738 . 14 1 1 A 71 71 ILE C C 70 178.056 177.631 0.425 1
1 739 . 14 1 1 A 71 71 ILE CA C 70 63.756 63.994 -0.238 1
1 740 . 14 1 1 A 71 71 ILE CB C 70 37.321 36.546 0.775 1
1 744 . 14 1 1 A 71 71 ILE N N 70 118.906 120.137 -1.231 1
1 745 . 14 1 1 A 72 72 SER H H 71 7.803 7.692 0.111 1
1 746 . 14 1 1 A 72 72 SER HA H 71 4.029 4.281 -0.252 1
1 749 . 14 1 1 A 72 72 SER CA C 71 61.380 60.949 0.431 1
1 750 . 14 1 1 A 72 72 SER CB C 71 63.288 63.156 0.132 1
1 751 . 14 1 1 A 72 72 SER N N 71 113.735 114.674 -0.939 1
1 752 . 14 1 1 A 73 73 LEU H H 72 7.952 7.947 0.005 1
1 753 . 14 1 1 A 73 73 LEU HA H 72 4.418 4.119 0.299 1
1 763 . 14 1 1 A 73 73 LEU C C 72 177.767 178.328 -0.561 1
1 764 . 14 1 1 A 73 73 LEU CA C 72 56.543 57.423 -0.880 1
1 765 . 14 1 1 A 73 73 LEU CB C 72 44.517 41.790 2.727 1
1 769 . 14 1 1 A 73 73 LEU N N 72 119.411 123.446 -4.035 1
1 770 . 14 1 1 A 74 74 VAL H H 73 8.021 7.679 0.342 1
1 771 . 14 1 1 A 74 74 VAL HA H 73 3.532 3.363 0.169 1
1 779 . 14 1 1 A 74 74 VAL C C 73 177.126 177.984 -0.858 1
1 780 . 14 1 1 A 74 74 VAL CA C 73 66.250 66.350 -0.100 1
1 781 . 14 1 1 A 74 74 VAL CB C 73 31.212 31.143 0.069 1
1 784 . 14 1 1 A 74 74 VAL N N 73 118.747 119.245 -0.498 1
1 785 . 14 1 1 A 75 75 GLU H H 74 7.232 8.071 -0.839 1
1 786 . 14 1 1 A 75 75 GLU HA H 74 3.013 4.280 -1.267 1
1 791 . 14 1 1 A 75 75 GLU C C 74 178.804 179.191 -0.387 1
1 792 . 14 1 1 A 75 75 GLU CA C 74 60.536 59.841 0.695 1
1 793 . 14 1 1 A 75 75 GLU CB C 74 27.009 29.185 -2.176 1
1 795 . 14 1 1 A 75 75 GLU N N 74 118.660 119.906 -1.246 1
1 796 . 14 1 1 A 76 76 LYS H H 75 7.051 7.900 -0.849 1
1 797 . 14 1 1 A 76 76 LYS HA H 75 3.765 4.086 -0.321 1
1 806 . 14 1 1 A 76 76 LYS C C 75 177.765 178.201 -0.436 1
1 807 . 14 1 1 A 76 76 LYS CA C 75 58.357 58.499 -0.142 1
1 808 . 14 1 1 A 76 76 LYS CB C 75 31.939 32.637 -0.698 1
1 812 . 14 1 1 A 76 76 LYS N N 75 116.112 119.495 -3.383 1
1 813 . 14 1 1 A 77 77 TYR H H 76 7.067 7.905 -0.838 1
1 814 . 14 1 1 A 77 77 TYR HA H 76 4.036 4.191 -0.155 1
1 821 . 14 1 1 A 77 77 TYR C C 76 177.752 176.967 0.785 1
1 822 . 14 1 1 A 77 77 TYR CA C 76 61.820 61.215 0.605 1
1 823 . 14 1 1 A 77 77 TYR CB C 76 38.480 38.680 -0.200 1
1 828 . 14 1 1 A 77 77 TYR N N 76 118.434 121.419 -2.985 1
1 829 . 14 1 1 A 78 78 ILE H H 77 7.554 8.312 -0.758 1
1 830 . 14 1 1 A 78 78 ILE HA H 77 3.159 3.610 -0.451 1
1 840 . 14 1 1 A 78 78 ILE C C 77 177.341 177.947 -0.606 1
1 841 . 14 1 1 A 78 78 ILE CA C 77 65.177 65.306 -0.129 1
1 842 . 14 1 1 A 78 78 ILE CB C 77 37.339 38.038 -0.699 1
1 846 . 14 1 1 A 78 78 ILE N N 77 117.672 121.148 -3.476 1
1 847 . 14 1 1 A 79 79 GLU H H 78 8.296 8.062 0.234 1
1 848 . 14 1 1 A 79 79 GLU HA H 78 3.557 3.805 -0.248 1
1 853 . 14 1 1 A 79 79 GLU C C 78 177.742 179.148 -1.406 1
1 854 . 14 1 1 A 79 79 GLU CA C 78 60.847 60.160 0.687 1
1 855 . 14 1 1 A 79 79 GLU CB C 78 29.594 29.319 0.275 1
1 857 . 14 1 1 A 79 79 GLU N N 78 118.701 120.780 -2.079 1
1 858 . 14 1 1 A 80 80 GLU H H 79 8.330 8.262 0.068 1
1 859 . 14 1 1 A 80 80 GLU HA H 79 3.774 4.026 -0.252 1
1 864 . 14 1 1 A 80 80 GLU C C 79 179.926 179.270 0.656 1
1 865 . 14 1 1 A 80 80 GLU CA C 79 59.581 58.945 0.636 1
1 866 . 14 1 1 A 80 80 GLU CB C 79 29.062 29.496 -0.434 1
1 868 . 14 1 1 A 80 80 GLU N N 79 116.767 117.832 -1.065 1
1 869 . 14 1 1 A 81 81 GLN H H 80 7.634 7.769 -0.135 1
1 870 . 14 1 1 A 81 81 GLN HA H 80 3.605 3.852 -0.247 1
1 877 . 14 1 1 A 81 81 GLN C C 80 179.681 178.825 0.856 1
1 878 . 14 1 1 A 81 81 GLN CA C 80 57.765 58.551 -0.786 1
1 879 . 14 1 1 A 81 81 GLN CB C 80 28.079 27.903 0.176 1
1 881 . 14 1 1 A 81 81 GLN N N 80 116.325 118.812 -2.487 1
1 883 . 14 1 1 A 82 82 LEU H H 81 8.156 7.797 0.359 1
1 884 . 14 1 1 A 82 82 LEU HA H 81 3.536 3.756 -0.220 1
1 894 . 14 1 1 A 82 82 LEU C C 81 178.945 179.367 -0.422 1
1 895 . 14 1 1 A 82 82 LEU CA C 81 57.761 57.096 0.665 1
1 896 . 14 1 1 A 82 82 LEU CB C 81 40.961 40.710 0.251 1
1 900 . 14 1 1 A 82 82 LEU N N 81 121.546 120.024 1.522 1
1 901 . 14 1 1 A 83 83 LEU H H 82 8.326 8.028 0.298 1
1 902 . 14 1 1 A 83 83 LEU HA H 82 4.198 4.343 -0.145 1
1 912 . 14 1 1 A 83 83 LEU C C 82 178.631 179.089 -0.458 1
1 913 . 14 1 1 A 83 83 LEU CA C 82 57.016 57.055 -0.039 1
1 914 . 14 1 1 A 83 83 LEU CB C 82 42.182 40.691 1.491 1
1 918 . 14 1 1 A 83 83 LEU N N 82 120.426 119.059 1.367 1
1 919 . 14 1 1 A 84 84 GLN H H 83 6.992 7.687 -0.695 1
1 920 . 14 1 1 A 84 84 GLN HA H 83 3.877 3.953 -0.076 1
1 927 . 14 1 1 A 84 84 GLN C C 83 177.008 177.017 -0.009 1
1 928 . 14 1 1 A 84 84 GLN CA C 83 57.543 58.838 -1.295 1
1 929 . 14 1 1 A 84 84 GLN CB C 83 28.688 28.421 0.267 1
1 931 . 14 1 1 A 84 84 GLN N N 83 114.001 117.664 -3.663 1
1 933 . 14 1 1 A 85 85 ARG H H 84 7.072 7.499 -0.427 1
1 934 . 14 1 1 A 85 85 ARG HA H 84 4.047 4.383 -0.336 1
1 942 . 14 1 1 A 85 85 ARG C C 84 175.999 175.351 0.648 1
1 943 . 14 1 1 A 85 85 ARG CA C 84 56.764 55.713 1.051 1
1 944 . 14 1 1 A 85 85 ARG CB C 84 32.044 32.192 -0.148 1
1 947 . 14 1 1 A 85 85 ARG N N 84 115.827 115.906 -0.079 1
1 949 . 14 1 1 A 86 86 ILE H H 85 8.238 7.761 0.477 1
1 950 . 14 1 1 A 86 86 ILE HA H 85 4.389 4.597 -0.208 1
1 960 . 14 1 1 A 86 86 ILE CA C 85 58.007 57.920 0.087 1
1 961 . 14 1 1 A 86 86 ILE CB C 85 39.604 38.904 0.700 1
1 965 . 14 1 1 A 86 86 ILE N N 85 119.285 119.076 0.209 1
1 966 . 14 1 1 A 87 87 PRO HA H 86 4.392 4.529 -0.137 1
1 973 . 14 1 1 A 87 87 PRO C C 86 177.622 176.305 1.317 1
1 974 . 14 1 1 A 87 87 PRO CA C 86 64.665 64.251 0.414 1
1 975 . 14 1 1 A 87 87 PRO CB C 86 32.020 31.635 0.385 1
1 978 . 14 1 1 A 88 88 GLU H H 87 8.312 8.200 0.112 1
1 979 . 14 1 1 A 88 88 GLU HA H 87 4.208 4.575 -0.367 1
1 984 . 14 1 1 A 88 88 GLU C C 87 175.554 175.786 -0.232 1
1 985 . 14 1 1 A 88 88 GLU CA C 87 56.045 56.188 -0.143 1
1 986 . 14 1 1 A 88 88 GLU CB C 87 28.654 30.608 -1.954 1
1 988 . 14 1 1 A 88 88 GLU N N 87 114.256 116.819 -2.563 1
1 989 . 14 1 1 A 89 89 PHE H H 88 7.946 7.533 0.413 1
1 990 . 14 1 1 A 89 89 PHE HA H 88 3.993 4.355 -0.362 1
1 998 . 14 1 1 A 89 89 PHE C C 88 173.460 174.552 -1.092 1
1 999 . 14 1 1 A 89 89 PHE CA C 88 60.119 59.472 0.647 1
1 1000 . 14 1 1 A 89 89 PHE CB C 88 39.994 39.611 0.383 1
1 1006 . 14 1 1 A 89 89 PHE N N 88 121.550 123.353 -1.803 1
1 1007 . 14 1 1 A 90 90 ASN H H 89 7.266 7.812 -0.546 1
1 1008 . 14 1 1 A 90 90 ASN HA H 89 4.454 5.319 -0.865 1
1 1013 . 14 1 1 A 90 90 ASN C C 89 173.921 175.000 -1.079 1
1 1014 . 14 1 1 A 90 90 ASN CA C 89 51.839 51.392 0.447 1
1 1015 . 14 1 1 A 90 90 ASN CB C 89 40.674 39.333 1.341 1
1 1016 . 14 1 1 A 90 90 ASN N N 89 125.344 123.108 2.236 1
1 1018 . 14 1 1 A 91 91 MET H H 90 8.968 8.781 0.187 1
1 1019 . 14 1 1 A 91 91 MET HA H 90 4.049 4.356 -0.307 1
1 1027 . 14 1 1 A 91 91 MET C C 90 177.475 178.164 -0.689 1
1 1028 . 14 1 1 A 91 91 MET CA C 90 57.758 58.627 -0.869 1
1 1029 . 14 1 1 A 91 91 MET CB C 90 32.250 31.968 0.282 1
1 1032 . 14 1 1 A 91 91 MET N N 90 127.052 123.753 3.299 1
1 1033 . 14 1 1 A 92 92 ALA H H 91 8.292 8.113 0.179 1
1 1034 . 14 1 1 A 92 92 ALA HA H 91 4.059 4.135 -0.076 1
1 1038 . 14 1 1 A 92 92 ALA C C 91 180.412 179.712 0.700 1
1 1039 . 14 1 1 A 92 92 ALA CA C 91 55.368 54.969 0.399 1
1 1040 . 14 1 1 A 92 92 ALA CB C 91 17.527 18.722 -1.195 1
1 1041 . 14 1 1 A 92 92 ALA N N 91 123.752 121.455 2.297 1
1 1042 . 14 1 1 A 93 93 ALA H H 92 7.931 7.984 -0.053 1
1 1043 . 14 1 1 A 93 93 ALA HA H 92 4.054 4.128 -0.074 1
1 1047 . 14 1 1 A 93 93 ALA C C 92 180.482 179.860 0.622 1
1 1048 . 14 1 1 A 93 93 ALA CA C 92 54.614 54.935 -0.321 1
1 1049 . 14 1 1 A 93 93 ALA CB C 92 18.098 18.318 -0.220 1
1 1050 . 14 1 1 A 93 93 ALA N N 92 121.158 119.966 1.192 1
1 1051 . 14 1 1 A 94 94 PHE H H 93 8.110 7.856 0.254 1
1 1052 . 14 1 1 A 94 94 PHE HA H 93 4.304 4.137 0.167 1
1 1060 . 14 1 1 A 94 94 PHE C C 93 177.350 177.294 0.056 1
1 1061 . 14 1 1 A 94 94 PHE CA C 93 61.641 61.465 0.176 1
1 1062 . 14 1 1 A 94 94 PHE CB C 93 40.014 39.165 0.849 1
1 1068 . 14 1 1 A 94 94 PHE N N 93 119.807 120.251 -0.444 1
1 1069 . 14 1 1 A 95 95 THR H H 94 8.726 8.190 0.536 1
1 1070 . 14 1 1 A 95 95 THR HA H 94 3.569 3.990 -0.421 1
1 1075 . 14 1 1 A 95 95 THR C C 94 176.932 176.814 0.118 1
1 1076 . 14 1 1 A 95 95 THR CA C 94 66.833 65.605 1.228 1
1 1077 . 14 1 1 A 95 95 THR CB C 94 68.445 68.313 0.132 1
1 1079 . 14 1 1 A 95 95 THR N N 94 113.074 112.313 0.761 1
1 1080 . 14 1 1 A 96 96 THR H H 95 7.657 7.785 -0.128 1
1 1081 . 14 1 1 A 96 96 THR HA H 95 3.945 4.064 -0.119 1
1 1086 . 14 1 1 A 96 96 THR C C 95 176.386 176.397 -0.011 1
1 1087 . 14 1 1 A 96 96 THR CA C 95 66.550 66.042 0.508 1
1 1088 . 14 1 1 A 96 96 THR CB C 95 68.583 68.786 -0.203 1
1 1090 . 14 1 1 A 96 96 THR N N 95 117.927 117.130 0.797 1
1 1091 . 14 1 1 A 97 97 THR H H 96 7.699 7.770 -0.071 1
1 1092 . 14 1 1 A 97 97 THR HA H 96 3.905 4.366 -0.461 1
1 1097 . 14 1 1 A 97 97 THR C C 96 176.572 176.192 0.380 1
1 1098 . 14 1 1 A 97 97 THR CA C 96 65.979 66.586 -0.607 1
1 1099 . 14 1 1 A 97 97 THR CB C 96 68.553 68.429 0.124 1
1 1101 . 14 1 1 A 97 97 THR N N 96 118.518 116.607 1.911 1
1 1102 . 14 1 1 A 98 98 LEU H H 97 8.304 8.030 0.274 1
1 1103 . 14 1 1 A 98 98 LEU HA H 97 3.725 3.749 -0.024 1
1 1113 . 14 1 1 A 98 98 LEU C C 97 178.490 178.711 -0.221 1
1 1114 . 14 1 1 A 98 98 LEU CA C 97 58.517 57.848 0.669 1
1 1115 . 14 1 1 A 98 98 LEU CB C 97 41.697 40.959 0.738 1
1 1119 . 14 1 1 A 98 98 LEU N N 97 122.882 121.967 0.915 1
1 1120 . 14 1 1 A 99 99 GLN H H 98 7.639 8.026 -0.387 1
1 1121 . 14 1 1 A 99 99 GLN HA H 98 3.927 4.247 -0.320 1
1 1128 . 14 1 1 A 99 99 GLN C C 98 178.068 178.006 0.062 1
1 1129 . 14 1 1 A 99 99 GLN CA C 98 58.735 59.058 -0.323 1
1 1130 . 14 1 1 A 99 99 GLN CB C 98 27.986 28.539 -0.553 1
1 1132 . 14 1 1 A 99 99 GLN N N 98 114.302 118.307 -4.005 1
1 1134 . 14 1 1 A 100 100 HIS H H 99 7.575 7.786 -0.211 1
1 1135 . 14 1 1 A 100 100 HIS HA H 99 4.524 4.627 -0.103 1
1 1139 . 14 1 1 A 100 100 HIS C C 99 174.789 177.376 -2.587 1
1 1140 . 14 1 1 A 100 100 HIS CA C 99 56.154 56.994 -0.840 1
1 1141 . 14 1 1 A 100 100 HIS CB C 99 28.946 30.707 -1.761 1
1 1143 . 14 1 1 A 100 100 HIS N N 99 114.778 116.777 -1.999 1
1 1144 . 14 1 1 A 101 101 HIS H H 100 7.773 7.500 0.273 1
1 1145 . 14 1 1 A 101 101 HIS HA H 100 4.704 4.011 0.693 1
1 1149 . 14 1 1 A 101 101 HIS C C 100 174.818 176.903 -2.085 1
1 1150 . 14 1 1 A 101 101 HIS CA C 100 54.830 58.016 -3.186 1
1 1151 . 14 1 1 A 101 101 HIS CB C 100 29.749 30.138 -0.389 1
1 1153 . 14 1 1 A 101 101 HIS N N 100 117.397 120.166 -2.769 1
1 1154 . 14 1 1 A 102 102 LYS H H 101 7.324 8.465 -1.141 1
1 1155 . 14 1 1 A 102 102 LYS HA H 101 3.611 4.067 -0.456 1
1 1164 . 14 1 1 A 102 102 LYS C C 101 176.823 177.063 -0.240 1
1 1165 . 14 1 1 A 102 102 LYS CA C 101 59.915 58.608 1.307 1
1 1166 . 14 1 1 A 102 102 LYS CB C 101 32.825 31.386 1.439 1
1 1170 . 14 1 1 A 102 102 LYS N N 101 120.533 117.052 3.481 1
1 1171 . 14 1 1 A 103 103 ASP H H 102 8.361 7.692 0.669 1
1 1172 . 14 1 1 A 103 103 ASP HA H 102 4.421 4.559 -0.138 1
1 1175 . 14 1 1 A 103 103 ASP C C 102 176.793 176.857 -0.064 1
1 1176 . 14 1 1 A 103 103 ASP CA C 102 55.500 56.044 -0.544 1
1 1177 . 14 1 1 A 103 103 ASP CB C 102 40.178 40.337 -0.159 1
1 1178 . 14 1 1 A 103 103 ASP N N 102 114.814 118.852 -4.038 1
1 1179 . 14 1 1 A 104 104 GLU H H 103 7.858 8.091 -0.233 1
1 1180 . 14 1 1 A 104 104 GLU HA H 103 4.339 4.521 -0.182 1
1 1183 . 14 1 1 A 104 104 GLU C C 103 175.777 176.020 -0.243 1
1 1184 . 14 1 1 A 104 104 GLU CA C 103 56.356 57.694 -1.338 1
1 1185 . 14 1 1 A 104 104 GLU CB C 103 31.293 31.902 -0.609 1
1 1186 . 14 1 1 A 104 104 GLU N N 103 116.826 118.403 -1.577 1
1 1187 . 14 1 1 A 105 105 VAL H H 104 7.201 7.252 -0.051 1
1 1188 . 14 1 1 A 105 105 VAL HA H 104 4.296 4.272 0.024 1
1 1196 . 14 1 1 A 105 105 VAL C C 104 174.482 175.628 -1.146 1
1 1197 . 14 1 1 A 105 105 VAL CA C 104 60.370 61.447 -1.077 1
1 1198 . 14 1 1 A 105 105 VAL CB C 104 34.341 33.758 0.583 1
1 1201 . 14 1 1 A 105 105 VAL N N 104 116.422 116.167 0.255 1
1 1202 . 14 1 1 A 106 106 ALA H H 105 8.487 8.591 -0.104 1
1 1203 . 14 1 1 A 106 106 ALA HA H 105 4.172 4.391 -0.219 1
1 1207 . 14 1 1 A 106 106 ALA C C 105 179.030 178.646 0.384 1
1 1208 . 14 1 1 A 106 106 ALA CA C 105 52.966 51.725 1.241 1
1 1209 . 14 1 1 A 106 106 ALA CB C 105 19.371 18.506 0.865 1
1 1210 . 14 1 1 A 106 106 ALA N N 105 128.313 124.824 3.489 1
1 1211 . 14 1 1 A 107 107 GLY H H 106 8.738 8.738 0.000 1
1 1212 . 14 1 1 A 107 107 GLY HA2 H 106 3.773 3.872 -0.099 1
1 1213 . 14 1 1 A 107 107 GLY HA3 H 106 3.998 3.937 0.061 1
1 1214 . 14 1 1 A 107 107 GLY C C 106 174.958 175.475 -0.517 1
1 1215 . 14 1 1 A 107 107 GLY CA C 106 47.449 47.155 0.294 1
1 1216 . 14 1 1 A 107 107 GLY N N 106 110.612 110.666 -0.054 1
1 1217 . 14 1 1 A 108 108 ASP H H 107 8.535 7.837 0.698 1
1 1218 . 14 1 1 A 108 108 ASP HA H 107 4.333 4.359 -0.026 1
1 1221 . 14 1 1 A 108 108 ASP C C 107 179.133 179.107 0.026 1
1 1222 . 14 1 1 A 108 108 ASP CA C 107 56.721 56.350 0.371 1
1 1223 . 14 1 1 A 108 108 ASP CB C 107 39.336 40.677 -1.341 1
1 1224 . 14 1 1 A 108 108 ASP N N 107 117.474 122.300 -4.826 1
1 1225 . 14 1 1 A 109 109 ILE H H 108 7.459 7.979 -0.520 1
1 1226 . 14 1 1 A 109 109 ILE HA H 108 3.688 3.761 -0.073 1
1 1236 . 14 1 1 A 109 109 ILE C C 108 176.735 178.349 -1.614 1
1 1237 . 14 1 1 A 109 109 ILE CA C 108 63.474 65.593 -2.119 1
1 1238 . 14 1 1 A 109 109 ILE CB C 108 37.340 37.825 -0.485 1
1 1242 . 14 1 1 A 109 109 ILE N N 108 119.609 119.564 0.045 1
1 1243 . 14 1 1 A 110 110 PHE H H 109 7.920 8.319 -0.399 1
1 1244 . 14 1 1 A 110 110 PHE HA H 109 3.759 4.092 -0.333 1
1 1252 . 14 1 1 A 110 110 PHE C C 109 177.132 177.352 -0.220 1
1 1253 . 14 1 1 A 110 110 PHE CA C 109 62.766 61.233 1.533 1
1 1254 . 14 1 1 A 110 110 PHE CB C 109 39.752 39.321 0.431 1
1 1260 . 14 1 1 A 110 110 PHE N N 109 120.906 120.323 0.583 1
1 1261 . 14 1 1 A 111 111 ASP H H 110 8.639 8.218 0.421 1
1 1262 . 14 1 1 A 111 111 ASP HA H 110 4.216 4.242 -0.026 1
1 1265 . 14 1 1 A 111 111 ASP C C 110 178.900 178.403 0.497 1
1 1266 . 14 1 1 A 111 111 ASP CA C 110 57.105 57.320 -0.215 1
1 1267 . 14 1 1 A 111 111 ASP CB C 110 39.697 42.038 -2.341 1
1 1268 . 14 1 1 A 111 111 ASP N N 110 117.124 118.781 -1.657 1
1 1269 . 14 1 1 A 112 112 MET H H 111 7.331 7.609 -0.278 1
1 1270 . 14 1 1 A 112 112 MET HA H 111 4.081 4.164 -0.083 1
1 1278 . 14 1 1 A 112 112 MET C C 111 179.052 178.174 0.878 1
1 1279 . 14 1 1 A 112 112 MET CA C 111 58.202 58.044 0.158 1
1 1280 . 14 1 1 A 112 112 MET CB C 111 31.827 32.406 -0.579 1
1 1283 . 14 1 1 A 112 112 MET N N 111 118.061 119.422 -1.361 1
1 1284 . 14 1 1 A 113 113 LEU H H 112 8.001 8.063 -0.062 1
1 1285 . 14 1 1 A 113 113 LEU HA H 112 3.723 3.660 0.063 1
1 1295 . 14 1 1 A 113 113 LEU C C 112 179.747 178.838 0.909 1
1 1296 . 14 1 1 A 113 113 LEU CA C 112 57.371 57.543 -0.172 1
1 1297 . 14 1 1 A 113 113 LEU CB C 112 40.671 40.894 -0.223 1
1 1301 . 14 1 1 A 113 113 LEU N N 112 120.426 119.634 0.792 1
1 1302 . 14 1 1 A 114 114 LEU H H 113 7.744 7.403 0.341 1
1 1303 . 14 1 1 A 114 114 LEU HA H 113 4.007 3.635 0.372 1
1 1313 . 14 1 1 A 114 114 LEU C C 113 179.358 178.657 0.701 1
1 1314 . 14 1 1 A 114 114 LEU CA C 113 57.202 57.443 -0.241 1
1 1315 . 14 1 1 A 114 114 LEU CB C 113 41.727 41.165 0.562 1
1 1319 . 14 1 1 A 114 114 LEU N N 113 119.584 118.503 1.081 1
1 1320 . 14 1 1 A 115 115 THR H H 114 7.353 7.649 -0.296 1
1 1321 . 14 1 1 A 115 115 THR HA H 114 4.071 4.048 0.023 1
1 1327 . 14 1 1 A 115 115 THR C C 114 173.591 176.293 -2.702 1
1 1328 . 14 1 1 A 115 115 THR CA C 114 65.332 64.669 0.663 1
1 1329 . 14 1 1 A 115 115 THR CB C 114 70.319 68.502 1.817 1
1 1331 . 14 1 1 A 115 115 THR N N 114 107.535 110.502 -2.967 1
1 1332 . 14 1 1 A 116 116 PHE H H 115 6.979 7.844 -0.865 1
1 1333 . 14 1 1 A 116 116 PHE HA H 115 5.022 4.385 0.637 1
1 1341 . 14 1 1 A 116 116 PHE C C 115 176.488 176.076 0.412 1
1 1342 . 14 1 1 A 116 116 PHE CA C 115 55.911 61.068 -5.157 1
1 1343 . 14 1 1 A 116 116 PHE CB C 115 38.521 39.083 -0.562 1
1 1349 . 14 1 1 A 116 116 PHE N N 115 112.366 120.064 -7.698 1
1 1350 . 14 1 1 A 117 117 THR H H 116 7.564 8.165 -0.601 1
1 1351 . 14 1 1 A 117 117 THR HA H 116 4.626 4.910 -0.284 1
1 1356 . 14 1 1 A 117 117 THR C C 116 174.085 174.038 0.047 1
1 1357 . 14 1 1 A 117 117 THR CA C 116 61.636 62.708 -1.072 1
1 1358 . 14 1 1 A 117 117 THR CB C 116 70.915 72.465 -1.550 1
1 1360 . 14 1 1 A 117 117 THR N N 116 105.498 112.543 -7.045 1
1 1361 . 14 1 1 A 118 118 ASP H H 117 8.270 7.779 0.491 1
1 1362 . 14 1 1 A 118 118 ASP HA H 117 4.955 4.944 0.011 1
1 1365 . 14 1 1 A 118 118 ASP C C 117 176.328 176.222 0.106 1
1 1366 . 14 1 1 A 118 118 ASP CA C 117 53.417 53.798 -0.381 1
1 1367 . 14 1 1 A 118 118 ASP CB C 117 43.388 38.908 4.480 1
1 1368 . 14 1 1 A 118 118 ASP N N 117 124.409 121.446 2.963 1
1 1369 . 14 1 1 A 119 119 PHE H H 118 8.973 8.861 0.112 1
1 1370 . 14 1 1 A 119 119 PHE HA H 118 3.506 4.203 -0.697 1
1 1378 . 14 1 1 A 119 119 PHE CA C 118 61.490 61.284 0.206 1
1 1379 . 14 1 1 A 119 119 PHE CB C 118 39.246 39.486 -0.240 1
1 1385 . 14 1 1 A 119 119 PHE N N 118 126.688 125.446 1.242 1
1 1386 . 14 1 1 A 120 120 LEU H H 119 8.099 8.348 -0.249 1
1 1387 . 14 1 1 A 120 120 LEU HA H 119 3.842 3.901 -0.059 1
1 1397 . 14 1 1 A 120 120 LEU C C 119 179.601 179.514 0.087 1
1 1398 . 14 1 1 A 120 120 LEU CA C 119 58.174 57.863 0.311 1
1 1399 . 14 1 1 A 120 120 LEU CB C 119 40.315 41.371 -1.056 1
1 1403 . 14 1 1 A 120 120 LEU N N 119 117.930 119.982 -2.052 1
1 1404 . 14 1 1 A 121 121 ALA H H 120 7.729 7.717 0.012 1
1 1405 . 14 1 1 A 121 121 ALA HA H 120 3.996 4.094 -0.098 1
1 1409 . 14 1 1 A 121 121 ALA C C 120 180.995 179.673 1.322 1
1 1410 . 14 1 1 A 121 121 ALA CA C 120 54.832 54.549 0.283 1
1 1411 . 14 1 1 A 121 121 ALA CB C 120 17.706 18.162 -0.456 1
1 1412 . 14 1 1 A 121 121 ALA N N 120 123.195 120.512 2.683 1
1 1413 . 14 1 1 A 122 122 PHE H H 121 7.943 7.745 0.198 1
1 1414 . 14 1 1 A 122 122 PHE HA H 121 3.887 3.752 0.135 1
1 1419 . 14 1 1 A 122 122 PHE C C 121 175.410 176.705 -1.295 1
1 1420 . 14 1 1 A 122 122 PHE CA C 121 61.075 60.639 0.436 1
1 1421 . 14 1 1 A 122 122 PHE CB C 121 38.115 38.905 -0.790 1
1 1424 . 14 1 1 A 122 122 PHE N N 121 121.798 119.867 1.931 1
1 1425 . 14 1 1 A 123 123 LYS H H 122 8.468 7.862 0.606 1
1 1426 . 14 1 1 A 123 123 LYS HA H 122 3.077 3.625 -0.548 1
1 1435 . 14 1 1 A 123 123 LYS C C 122 178.453 178.930 -0.477 1
1 1436 . 14 1 1 A 123 123 LYS CA C 122 59.855 59.840 0.015 1
1 1437 . 14 1 1 A 123 123 LYS CB C 122 32.374 32.323 0.051 1
1 1441 . 14 1 1 A 123 123 LYS N N 122 120.614 118.299 2.315 1
1 1442 . 14 1 1 A 124 124 GLU H H 123 8.100 7.878 0.222 1
1 1443 . 14 1 1 A 124 124 GLU HA H 123 3.652 3.908 -0.256 1
1 1448 . 14 1 1 A 124 124 GLU C C 123 177.743 179.065 -1.322 1
1 1449 . 14 1 1 A 124 124 GLU CA C 123 59.406 59.580 -0.174 1
1 1450 . 14 1 1 A 124 124 GLU CB C 123 28.811 29.180 -0.369 1
1 1452 . 14 1 1 A 124 124 GLU N N 123 117.404 119.069 -1.665 1
1 1453 . 14 1 1 A 125 125 MET H H 124 7.537 7.325 0.212 1
1 1454 . 14 1 1 A 125 125 MET HA H 124 3.860 3.940 -0.080 1
1 1462 . 14 1 1 A 125 125 MET C C 124 179.522 178.334 1.188 1
1 1463 . 14 1 1 A 125 125 MET CA C 124 58.832 58.364 0.468 1
1 1464 . 14 1 1 A 125 125 MET CB C 124 31.765 31.434 0.331 1
1 1467 . 14 1 1 A 125 125 MET N N 124 119.413 119.446 -0.033 1
1 1468 . 14 1 1 A 126 126 PHE H H 125 7.148 7.355 -0.207 1
1 1469 . 14 1 1 A 126 126 PHE HA H 125 3.633 4.254 -0.621 1
1 1476 . 14 1 1 A 126 126 PHE C C 125 178.994 178.264 0.730 1
1 1477 . 14 1 1 A 126 126 PHE CA C 125 63.148 61.165 1.983 1
1 1478 . 14 1 1 A 126 126 PHE CB C 125 39.830 38.273 1.557 1
1 1483 . 14 1 1 A 126 126 PHE N N 125 120.013 118.768 1.245 1
1 1484 . 14 1 1 A 127 127 LEU H H 126 8.369 8.269 0.100 1
1 1485 . 14 1 1 A 127 127 LEU HA H 126 3.972 4.017 -0.045 1
1 1495 . 14 1 1 A 127 127 LEU C C 126 180.621 179.141 1.480 1
1 1496 . 14 1 1 A 127 127 LEU CA C 126 57.944 57.775 0.169 1
1 1497 . 14 1 1 A 127 127 LEU CB C 126 40.543 40.992 -0.449 1
1 1501 . 14 1 1 A 127 127 LEU N N 126 119.692 119.586 0.106 1
1 1502 . 14 1 1 A 128 128 ASP H H 127 8.578 8.141 0.437 1
1 1503 . 14 1 1 A 128 128 ASP HA H 127 4.308 4.322 -0.014 1
1 1506 . 14 1 1 A 128 128 ASP C C 127 178.254 178.069 0.185 1
1 1507 . 14 1 1 A 128 128 ASP CA C 127 56.964 57.254 -0.290 1
1 1508 . 14 1 1 A 128 128 ASP CB C 127 39.735 40.888 -1.153 1
1 1509 . 14 1 1 A 128 128 ASP N N 127 121.926 119.619 2.307 1
1 1510 . 14 1 1 A 129 129 TYR H H 128 7.710 8.039 -0.329 1
1 1511 . 14 1 1 A 129 129 TYR HA H 128 3.908 4.021 -0.113 1
1 1518 . 14 1 1 A 129 129 TYR C C 128 177.633 177.296 0.337 1
1 1519 . 14 1 1 A 129 129 TYR CA C 128 61.796 61.458 0.338 1
1 1520 . 14 1 1 A 129 129 TYR CB C 128 39.372 38.764 0.608 1
1 1525 . 14 1 1 A 129 129 TYR N N 128 122.548 120.115 2.433 1
1 1526 . 14 1 1 A 130 130 ARG H H 129 8.622 8.273 0.349 1
1 1527 . 14 1 1 A 130 130 ARG HA H 129 3.722 3.698 0.024 1
1 1535 . 14 1 1 A 130 130 ARG CA C 129 60.084 59.675 0.409 1
1 1536 . 14 1 1 A 130 130 ARG CB C 129 29.902 29.584 0.318 1
1 1539 . 14 1 1 A 130 130 ARG N N 129 118.302 119.063 -0.761 1
1 1541 . 14 1 1 A 131 131 ALA H H 130 7.936 7.967 -0.031 1
1 1542 . 14 1 1 A 131 131 ALA HA H 130 3.997 4.080 -0.083 1
1 1546 . 14 1 1 A 131 131 ALA C C 130 180.456 179.644 0.812 1
1 1547 . 14 1 1 A 131 131 ALA CA C 130 55.133 54.938 0.195 1
1 1548 . 14 1 1 A 131 131 ALA CB C 130 17.750 18.391 -0.641 1
1 1549 . 14 1 1 A 131 131 ALA N N 130 119.788 121.417 -1.629 1
1 1550 . 14 1 1 A 132 132 GLU H H 131 7.622 7.697 -0.075 1
1 1551 . 14 1 1 A 132 132 GLU HA H 131 3.862 4.054 -0.192 1
1 1556 . 14 1 1 A 132 132 GLU C C 131 179.528 179.174 0.354 1
1 1557 . 14 1 1 A 132 132 GLU CA C 131 58.849 58.447 0.402 1
1 1558 . 14 1 1 A 132 132 GLU CB C 131 28.930 29.132 -0.202 1
1 1560 . 14 1 1 A 132 132 GLU N N 131 118.428 117.840 0.588 1
1 1561 . 14 1 1 A 133 133 LYS H H 132 7.853 7.804 0.049 1
1 1562 . 14 1 1 A 133 133 LYS HA H 132 3.722 3.863 -0.141 1
1 1571 . 14 1 1 A 133 133 LYS C C 132 175.725 177.810 -2.085 1
1 1572 . 14 1 1 A 133 133 LYS CA C 132 57.544 58.338 -0.794 1
1 1573 . 14 1 1 A 133 133 LYS CB C 132 31.770 31.015 0.755 1
1 1577 . 14 1 1 A 133 133 LYS N N 132 119.473 118.838 0.635 1
1 1578 . 14 1 1 A 134 134 GLU H H 133 8.151 7.403 0.748 1
1 1579 . 14 1 1 A 134 134 GLU HA H 133 4.161 4.183 -0.022 1
1 1584 . 14 1 1 A 134 134 GLU C C 133 177.453 177.166 0.287 1
1 1585 . 14 1 1 A 134 134 GLU CA C 133 57.222 56.294 0.928 1
1 1586 . 14 1 1 A 134 134 GLU CB C 133 30.091 30.077 0.014 1
1 1588 . 14 1 1 A 134 134 GLU N N 133 116.525 118.323 -1.798 1
1 1589 . 14 1 1 A 135 135 GLY H H 134 7.702 7.618 0.084 1
1 1590 . 14 1 1 A 135 135 GLY HA2 H 134 3.896 3.860 0.036 1
1 1591 . 14 1 1 A 135 135 GLY HA3 H 134 3.897 3.867 0.030 1
1 1592 . 14 1 1 A 135 135 GLY C C 134 174.538 174.328 0.210 1
1 1593 . 14 1 1 A 135 135 GLY CA C 134 45.975 46.817 -0.842 1
1 1594 . 14 1 1 A 135 135 GLY N N 134 107.924 109.368 -1.444 1
1 1595 . 14 1 1 A 136 136 ARG H H 135 8.045 7.991 0.054 1
1 1596 . 14 1 1 A 136 136 ARG HA H 135 4.323 4.323 0.000 1
1 1604 . 14 1 1 A 136 136 ARG C C 135 175.864 175.385 0.479 1
1 1605 . 14 1 1 A 136 136 ARG CA C 135 56.016 55.585 0.431 1
1 1606 . 14 1 1 A 136 136 ARG CB C 135 30.987 31.062 -0.075 1
1 1609 . 14 1 1 A 136 136 ARG N N 135 119.708 118.256 1.452 1
1 1 . 15 1 1 A 14 14 PHE CA C 13 58.199 61.017 -2.818 1
1 2 . 15 1 1 A 14 14 PHE CB C 13 39.717 37.474 2.243 1
1 3 . 15 1 1 A 15 15 SER H H 14 8.299 8.570 -0.271 1
1 4 . 15 1 1 A 15 15 SER HA H 14 4.359 4.426 -0.067 1
1 7 . 15 1 1 A 15 15 SER CA C 14 58.249 59.214 -0.965 1
1 8 . 15 1 1 A 15 15 SER CB C 14 63.936 61.142 2.794 1
1 9 . 15 1 1 A 15 15 SER N N 14 117.379 114.692 2.687 1
1 10 . 15 1 1 A 16 16 SER H H 15 8.255 8.173 0.082 1
1 11 . 15 1 1 A 16 16 SER HA H 15 3.729 4.851 -1.122 1
1 14 . 15 1 1 A 16 16 SER CA C 15 58.224 58.710 -0.486 1
1 15 . 15 1 1 A 16 16 SER CB C 15 63.886 64.828 -0.942 1
1 16 . 15 1 1 A 16 16 SER N N 15 117.694 113.614 4.080 1
1 17 . 15 1 1 A 17 17 ALA H H 16 8.333 8.374 -0.041 1
1 18 . 15 1 1 A 17 17 ALA HA H 16 4.252 4.407 -0.155 1
1 22 . 15 1 1 A 17 17 ALA CA C 16 53.377 55.359 -1.982 1
1 23 . 15 1 1 A 17 17 ALA CB C 16 18.896 18.506 0.390 1
1 24 . 15 1 1 A 17 17 ALA N N 16 125.462 124.189 1.273 1
1 25 . 15 1 1 A 18 18 SER H H 17 8.219 7.904 0.315 1
1 26 . 15 1 1 A 18 18 SER HA H 17 4.332 4.637 -0.305 1
1 29 . 15 1 1 A 18 18 SER CA C 17 59.105 57.775 1.330 1
1 30 . 15 1 1 A 18 18 SER CB C 17 63.592 63.639 -0.047 1
1 31 . 15 1 1 A 18 18 SER N N 17 114.821 112.299 2.522 1
1 32 . 15 1 1 A 19 19 ASP H H 18 8.309 7.721 0.588 1
1 33 . 15 1 1 A 19 19 ASP HA H 18 4.554 5.003 -0.449 1
1 36 . 15 1 1 A 19 19 ASP C C 18 176.528 176.915 -0.387 1
1 37 . 15 1 1 A 19 19 ASP CA C 18 55.272 52.960 2.312 1
1 38 . 15 1 1 A 19 19 ASP CB C 18 40.883 43.270 -2.387 1
1 39 . 15 1 1 A 19 19 ASP N N 18 123.367 121.404 1.963 1
1 40 . 15 1 1 A 20 20 ALA H H 19 8.133 8.659 -0.526 1
1 41 . 15 1 1 A 20 20 ALA HA H 19 4.170 4.100 0.070 1
1 45 . 15 1 1 A 20 20 ALA C C 19 179.857 179.661 0.196 1
1 46 . 15 1 1 A 20 20 ALA CA C 19 54.341 55.068 -0.727 1
1 47 . 15 1 1 A 20 20 ALA CB C 19 18.660 18.264 0.396 1
1 48 . 15 1 1 A 20 20 ALA N N 19 123.350 122.087 1.263 1
1 49 . 15 1 1 A 21 21 GLU H H 20 8.140 8.218 -0.078 1
1 50 . 15 1 1 A 21 21 GLU HA H 20 4.128 4.121 0.007 1
1 55 . 15 1 1 A 21 21 GLU C C 20 177.675 178.634 -0.959 1
1 56 . 15 1 1 A 21 21 GLU CA C 20 58.520 59.447 -0.927 1
1 57 . 15 1 1 A 21 21 GLU CB C 20 29.765 29.583 0.182 1
1 59 . 15 1 1 A 21 21 GLU N N 20 119.063 119.561 -0.498 1
1 60 . 15 1 1 A 22 22 PHE H H 21 8.009 7.904 0.105 1
1 61 . 15 1 1 A 22 22 PHE HA H 21 4.123 4.390 -0.267 1
1 68 . 15 1 1 A 22 22 PHE C C 21 176.410 177.409 -0.999 1
1 69 . 15 1 1 A 22 22 PHE CA C 21 62.202 61.039 1.163 1
1 70 . 15 1 1 A 22 22 PHE CB C 21 39.223 39.035 0.188 1
1 75 . 15 1 1 A 22 22 PHE N N 21 121.211 120.929 0.282 1
1 76 . 15 1 1 A 23 23 ASP H H 22 8.261 8.592 -0.331 1
1 77 . 15 1 1 A 23 23 ASP HA H 22 4.041 4.486 -0.445 1
1 80 . 15 1 1 A 23 23 ASP C C 22 179.078 178.273 0.805 1
1 81 . 15 1 1 A 23 23 ASP CA C 22 57.048 57.968 -0.920 1
1 82 . 15 1 1 A 23 23 ASP CB C 22 40.154 42.175 -2.021 1
1 83 . 15 1 1 A 23 23 ASP N N 22 116.876 119.131 -2.255 1
1 84 . 15 1 1 A 24 24 ALA H H 23 7.651 7.576 0.075 1
1 85 . 15 1 1 A 24 24 ALA HA H 23 3.785 3.983 -0.198 1
1 89 . 15 1 1 A 24 24 ALA C C 23 179.577 179.727 -0.150 1
1 90 . 15 1 1 A 24 24 ALA CA C 23 54.341 55.142 -0.801 1
1 91 . 15 1 1 A 24 24 ALA CB C 23 17.762 18.380 -0.618 1
1 92 . 15 1 1 A 24 24 ALA N N 23 121.873 121.743 0.130 1
1 93 . 15 1 1 A 25 25 VAL H H 24 7.718 7.932 -0.214 1
1 94 . 15 1 1 A 25 25 VAL HA H 24 3.216 3.570 -0.354 1
1 102 . 15 1 1 A 25 25 VAL C C 24 177.805 178.395 -0.590 1
1 103 . 15 1 1 A 25 25 VAL CA C 24 66.789 66.611 0.178 1
1 104 . 15 1 1 A 25 25 VAL CB C 24 31.277 31.227 0.050 1
1 107 . 15 1 1 A 25 25 VAL N N 24 117.890 118.299 -0.409 1
1 108 . 15 1 1 A 26 26 VAL H H 25 7.867 7.929 -0.062 1
1 109 . 15 1 1 A 26 26 VAL HA H 25 3.274 3.603 -0.329 1
1 117 . 15 1 1 A 26 26 VAL C C 25 177.788 177.646 0.142 1
1 118 . 15 1 1 A 26 26 VAL CA C 25 67.282 66.378 0.904 1
1 119 . 15 1 1 A 26 26 VAL CB C 25 31.266 31.456 -0.190 1
1 122 . 15 1 1 A 26 26 VAL N N 25 118.170 120.375 -2.205 1
1 123 . 15 1 1 A 27 27 GLY H H 26 7.544 7.673 -0.129 1
1 124 . 15 1 1 A 27 27 GLY HA2 H 26 3.592 3.489 0.103 1
1 125 . 15 1 1 A 27 27 GLY HA3 H 26 3.721 3.615 0.106 1
1 126 . 15 1 1 A 27 27 GLY C C 26 176.717 176.372 0.345 1
1 127 . 15 1 1 A 27 27 GLY CA C 26 47.085 47.178 -0.093 1
1 128 . 15 1 1 A 27 27 GLY N N 26 105.795 107.638 -1.843 1
1 129 . 15 1 1 A 28 28 TYR H H 27 7.625 7.385 0.240 1
1 130 . 15 1 1 A 28 28 TYR HA H 27 4.546 4.630 -0.084 1
1 137 . 15 1 1 A 28 28 TYR C C 27 178.991 178.112 0.879 1
1 138 . 15 1 1 A 28 28 TYR CA C 27 58.845 59.748 -0.903 1
1 139 . 15 1 1 A 28 28 TYR CB C 27 37.602 37.702 -0.100 1
1 144 . 15 1 1 A 28 28 TYR N N 27 119.933 121.518 -1.585 1
1 145 . 15 1 1 A 29 29 LEU H H 28 8.517 8.412 0.105 1
1 146 . 15 1 1 A 29 29 LEU HA H 28 3.728 3.791 -0.063 1
1 156 . 15 1 1 A 29 29 LEU CA C 28 58.281 57.898 0.383 1
1 157 . 15 1 1 A 29 29 LEU CB C 28 41.948 41.208 0.740 1
1 161 . 15 1 1 A 29 29 LEU N N 28 119.669 119.969 -0.300 1
1 162 . 15 1 1 A 30 30 GLU H H 29 8.072 7.976 0.096 1
1 163 . 15 1 1 A 30 30 GLU HA H 29 3.722 3.878 -0.156 1
1 168 . 15 1 1 A 30 30 GLU C C 29 177.731 179.179 -1.448 1
1 169 . 15 1 1 A 30 30 GLU CA C 29 59.763 59.940 -0.177 1
1 170 . 15 1 1 A 30 30 GLU CB C 29 28.844 29.449 -0.605 1
1 172 . 15 1 1 A 30 30 GLU N N 29 117.666 118.319 -0.653 1
1 173 . 15 1 1 A 31 31 ASP H H 30 7.243 7.833 -0.590 1
1 174 . 15 1 1 A 31 31 ASP HA H 30 4.297 4.385 -0.088 1
1 177 . 15 1 1 A 31 31 ASP CA C 30 56.953 57.278 -0.325 1
1 178 . 15 1 1 A 31 31 ASP CB C 30 40.730 40.859 -0.129 1
1 179 . 15 1 1 A 31 31 ASP N N 30 116.720 119.286 -2.566 1
1 180 . 15 1 1 A 32 32 ILE H H 31 7.940 7.362 0.578 1
1 181 . 15 1 1 A 32 32 ILE HA H 31 3.640 3.589 0.051 1
1 191 . 15 1 1 A 32 32 ILE C C 31 177.980 178.194 -0.214 1
1 192 . 15 1 1 A 32 32 ILE CA C 31 64.692 65.152 -0.460 1
1 193 . 15 1 1 A 32 32 ILE CB C 31 38.938 37.512 1.426 1
1 197 . 15 1 1 A 32 32 ILE N N 31 119.728 120.041 -0.313 1
1 198 . 15 1 1 A 33 33 ILE H H 32 7.984 7.603 0.381 1
1 199 . 15 1 1 A 33 33 ILE HA H 32 3.598 3.438 0.160 1
1 209 . 15 1 1 A 33 33 ILE C C 32 176.723 177.220 -0.497 1
1 210 . 15 1 1 A 33 33 ILE CA C 32 63.241 64.570 -1.329 1
1 211 . 15 1 1 A 33 33 ILE CB C 32 37.580 37.702 -0.122 1
1 215 . 15 1 1 A 33 33 ILE N N 32 113.919 120.619 -6.700 1
1 216 . 15 1 1 A 34 34 MET H H 33 7.288 7.611 -0.323 1
1 217 . 15 1 1 A 34 34 MET HA H 33 4.496 4.660 -0.164 1
1 225 . 15 1 1 A 34 34 MET C C 33 176.423 175.776 0.647 1
1 226 . 15 1 1 A 34 34 MET CA C 33 54.634 54.896 -0.262 1
1 227 . 15 1 1 A 34 34 MET CB C 33 31.934 32.593 -0.659 1
1 230 . 15 1 1 A 34 34 MET N N 33 115.130 116.880 -1.750 1
1 231 . 15 1 1 A 35 35 ASP H H 34 7.405 7.596 -0.191 1
1 232 . 15 1 1 A 35 35 ASP HA H 34 4.484 4.460 0.024 1
1 235 . 15 1 1 A 35 35 ASP C C 34 177.139 176.989 0.150 1
1 236 . 15 1 1 A 35 35 ASP CA C 34 54.625 54.864 -0.239 1
1 237 . 15 1 1 A 35 35 ASP CB C 34 43.554 42.830 0.724 1
1 238 . 15 1 1 A 35 35 ASP N N 34 121.814 121.712 0.102 1
1 239 . 15 1 1 A 36 36 ASP H H 35 8.765 8.799 -0.034 1
1 240 . 15 1 1 A 36 36 ASP HA H 35 4.235 4.308 -0.073 1
1 243 . 15 1 1 A 36 36 ASP C C 35 178.320 178.403 -0.083 1
1 244 . 15 1 1 A 36 36 ASP CA C 35 57.832 57.944 -0.112 1
1 245 . 15 1 1 A 36 36 ASP CB C 35 40.914 40.456 0.458 1
1 246 . 15 1 1 A 36 36 ASP N N 35 125.883 125.565 0.318 1
1 247 . 15 1 1 A 37 37 GLU H H 36 8.905 8.308 0.597 1
1 248 . 15 1 1 A 37 37 GLU HA H 36 3.933 4.052 -0.119 1
1 253 . 15 1 1 A 37 37 GLU C C 36 179.304 179.175 0.129 1
1 254 . 15 1 1 A 37 37 GLU CA C 36 59.828 59.234 0.594 1
1 255 . 15 1 1 A 37 37 GLU CB C 36 29.380 29.359 0.021 1
1 257 . 15 1 1 A 37 37 GLU N N 36 119.077 120.304 -1.227 1
1 258 . 15 1 1 A 38 38 PHE H H 37 7.460 8.432 -0.972 1
1 259 . 15 1 1 A 38 38 PHE HA H 37 3.642 4.051 -0.409 1
1 267 . 15 1 1 A 38 38 PHE C C 37 176.483 178.087 -1.604 1
1 268 . 15 1 1 A 38 38 PHE CA C 37 61.411 61.287 0.124 1
1 269 . 15 1 1 A 38 38 PHE CB C 37 39.355 39.038 0.317 1
1 275 . 15 1 1 A 38 38 PHE N N 37 119.968 120.720 -0.752 1
1 276 . 15 1 1 A 39 39 GLN H H 38 7.968 7.889 0.079 1
1 277 . 15 1 1 A 39 39 GLN HA H 38 3.712 3.802 -0.090 1
1 284 . 15 1 1 A 39 39 GLN CA C 38 59.153 58.740 0.413 1
1 285 . 15 1 1 A 39 39 GLN CB C 38 28.213 28.303 -0.090 1
1 287 . 15 1 1 A 39 39 GLN N N 38 116.433 118.284 -1.851 1
1 289 . 15 1 1 A 40 40 LEU H H 39 7.930 7.397 0.533 1
1 290 . 15 1 1 A 40 40 LEU HA H 39 3.916 4.023 -0.107 1
1 300 . 15 1 1 A 40 40 LEU C C 39 177.731 178.036 -0.305 1
1 301 . 15 1 1 A 40 40 LEU CA C 39 57.915 57.904 0.011 1
1 302 . 15 1 1 A 40 40 LEU CB C 39 41.989 41.529 0.460 1
1 306 . 15 1 1 A 40 40 LEU N N 39 119.505 121.534 -2.029 1
1 307 . 15 1 1 A 41 41 LEU H H 40 7.174 7.744 -0.570 1
1 308 . 15 1 1 A 41 41 LEU HA H 40 3.835 3.947 -0.112 1
1 318 . 15 1 1 A 41 41 LEU C C 40 179.738 178.239 1.499 1
1 319 . 15 1 1 A 41 41 LEU CA C 40 58.266 58.230 0.036 1
1 320 . 15 1 1 A 41 41 LEU CB C 40 42.050 41.517 0.533 1
1 324 . 15 1 1 A 41 41 LEU N N 40 120.971 119.817 1.154 1
1 325 . 15 1 1 A 42 42 GLN H H 41 8.058 7.801 0.257 1
1 326 . 15 1 1 A 42 42 GLN HA H 41 3.556 3.797 -0.241 1
1 333 . 15 1 1 A 42 42 GLN C C 41 177.642 178.371 -0.729 1
1 334 . 15 1 1 A 42 42 GLN CA C 41 59.826 59.215 0.611 1
1 335 . 15 1 1 A 42 42 GLN CB C 41 28.762 27.822 0.940 1
1 337 . 15 1 1 A 42 42 GLN N N 41 117.899 117.643 0.256 1
1 339 . 15 1 1 A 43 43 ARG H H 42 8.179 7.929 0.250 1
1 340 . 15 1 1 A 43 43 ARG HA H 42 3.655 3.972 -0.317 1
1 347 . 15 1 1 A 43 43 ARG C C 42 178.051 178.350 -0.299 1
1 348 . 15 1 1 A 43 43 ARG CA C 42 59.766 58.912 0.854 1
1 349 . 15 1 1 A 43 43 ARG CB C 42 29.941 29.609 0.332 1
1 352 . 15 1 1 A 43 43 ARG N N 42 119.392 119.721 -0.329 1
1 353 . 15 1 1 A 44 44 ASN H H 43 8.525 8.112 0.413 1
1 354 . 15 1 1 A 44 44 ASN HA H 43 4.332 4.381 -0.049 1
1 359 . 15 1 1 A 44 44 ASN C C 43 178.150 177.853 0.297 1
1 360 . 15 1 1 A 44 44 ASN CA C 43 55.841 56.242 -0.401 1
1 361 . 15 1 1 A 44 44 ASN CB C 43 37.632 39.312 -1.680 1
1 362 . 15 1 1 A 44 44 ASN N N 43 116.214 117.575 -1.361 1
1 364 . 15 1 1 A 45 45 PHE H H 44 7.586 7.894 -0.308 1
1 365 . 15 1 1 A 45 45 PHE HA H 44 4.132 4.324 -0.192 1
1 372 . 15 1 1 A 45 45 PHE C C 44 176.691 178.666 -1.975 1
1 373 . 15 1 1 A 45 45 PHE CA C 44 62.333 60.968 1.365 1
1 374 . 15 1 1 A 45 45 PHE CB C 44 39.449 38.637 0.812 1
1 379 . 15 1 1 A 45 45 PHE N N 44 121.501 117.795 3.706 1
1 380 . 15 1 1 A 46 46 MET H H 45 8.190 8.456 -0.266 1
1 381 . 15 1 1 A 46 46 MET HA H 45 4.060 4.356 -0.296 1
1 389 . 15 1 1 A 46 46 MET C C 45 179.754 178.233 1.521 1
1 390 . 15 1 1 A 46 46 MET CA C 45 57.742 57.953 -0.211 1
1 391 . 15 1 1 A 46 46 MET CB C 45 29.912 31.305 -1.393 1
1 394 . 15 1 1 A 46 46 MET N N 45 116.727 117.745 -1.018 1
1 395 . 15 1 1 A 47 47 ASP H H 46 8.579 8.230 0.349 1
1 396 . 15 1 1 A 47 47 ASP HA H 46 4.804 4.672 0.132 1
1 399 . 15 1 1 A 47 47 ASP C C 46 177.854 178.278 -0.424 1
1 400 . 15 1 1 A 47 47 ASP CA C 46 57.277 57.288 -0.011 1
1 401 . 15 1 1 A 47 47 ASP CB C 46 40.776 41.618 -0.842 1
1 402 . 15 1 1 A 47 47 ASP N N 46 117.798 120.891 -3.093 1
1 403 . 15 1 1 A 48 48 LYS H H 47 7.339 7.872 -0.533 1
1 404 . 15 1 1 A 48 48 LYS HA H 47 3.828 4.276 -0.448 1
1 413 . 15 1 1 A 48 48 LYS C C 47 178.812 178.677 0.135 1
1 414 . 15 1 1 A 48 48 LYS CA C 47 58.953 58.445 0.508 1
1 415 . 15 1 1 A 48 48 LYS CB C 47 32.796 33.016 -0.220 1
1 419 . 15 1 1 A 48 48 LYS N N 47 117.852 119.699 -1.847 1
1 420 . 15 1 1 A 49 49 TYR H H 48 6.841 8.694 -1.853 1
1 421 . 15 1 1 A 49 49 TYR HA H 48 4.995 4.231 0.764 1
1 428 . 15 1 1 A 49 49 TYR C C 48 178.138 178.488 -0.350 1
1 429 . 15 1 1 A 49 49 TYR CA C 48 58.620 59.914 -1.294 1
1 430 . 15 1 1 A 49 49 TYR CB C 48 42.939 38.231 4.708 1
1 435 . 15 1 1 A 49 49 TYR N N 48 112.109 120.041 -7.932 1
1 436 . 15 1 1 A 50 50 TYR H H 49 8.491 8.295 0.196 1
1 437 . 15 1 1 A 50 50 TYR HA H 49 4.598 4.323 0.275 1
1 444 . 15 1 1 A 50 50 TYR C C 49 176.015 177.816 -1.801 1
1 445 . 15 1 1 A 50 50 TYR CA C 49 62.442 59.609 2.833 1
1 446 . 15 1 1 A 50 50 TYR CB C 49 36.588 37.161 -0.573 1
1 451 . 15 1 1 A 50 50 TYR N N 49 118.294 119.329 -1.035 1
1 452 . 15 1 1 A 51 51 LEU H H 50 7.512 7.660 -0.148 1
1 453 . 15 1 1 A 51 51 LEU HA H 50 3.878 3.530 0.348 1
1 463 . 15 1 1 A 51 51 LEU C C 50 178.625 178.347 0.278 1
1 464 . 15 1 1 A 51 51 LEU CA C 50 55.994 57.125 -1.131 1
1 465 . 15 1 1 A 51 51 LEU CB C 50 40.743 41.358 -0.615 1
1 469 . 15 1 1 A 51 51 LEU N N 50 118.478 121.853 -3.375 1
1 470 . 15 1 1 A 52 52 GLU H H 51 8.042 7.752 0.290 1
1 471 . 15 1 1 A 52 52 GLU HA H 51 4.197 3.841 0.356 1
1 476 . 15 1 1 A 52 52 GLU C C 51 177.629 177.582 0.047 1
1 477 . 15 1 1 A 52 52 GLU CA C 51 56.141 59.454 -3.313 1
1 478 . 15 1 1 A 52 52 GLU CB C 51 29.162 28.802 0.360 1
1 480 . 15 1 1 A 52 52 GLU N N 51 115.067 118.068 -3.001 1
1 481 . 15 1 1 A 53 53 PHE H H 52 7.465 7.750 -0.285 1
1 482 . 15 1 1 A 53 53 PHE HA H 52 4.431 4.417 0.014 1
1 490 . 15 1 1 A 53 53 PHE C C 52 174.325 175.197 -0.872 1
1 491 . 15 1 1 A 53 53 PHE CA C 52 58.986 57.163 1.823 1
1 492 . 15 1 1 A 53 53 PHE CB C 52 40.183 37.642 2.541 1
1 498 . 15 1 1 A 53 53 PHE N N 52 116.768 118.821 -2.053 1
1 499 . 15 1 1 A 54 54 GLU H H 53 7.484 8.638 -1.154 1
1 500 . 15 1 1 A 54 54 GLU HA H 53 4.583 4.899 -0.316 1
1 505 . 15 1 1 A 54 54 GLU C C 53 175.722 175.362 0.360 1
1 506 . 15 1 1 A 54 54 GLU CA C 53 54.248 54.616 -0.368 1
1 507 . 15 1 1 A 54 54 GLU CB C 53 34.409 32.447 1.962 1
1 509 . 15 1 1 A 54 54 GLU N N 53 118.844 123.718 -4.874 1
1 510 . 15 1 1 A 55 55 ASP H H 54 9.008 8.675 0.333 1
1 511 . 15 1 1 A 55 55 ASP HA H 54 4.735 4.865 -0.130 1
1 514 . 15 1 1 A 55 55 ASP C C 54 175.421 175.663 -0.242 1
1 515 . 15 1 1 A 55 55 ASP CA C 54 52.888 53.750 -0.862 1
1 516 . 15 1 1 A 55 55 ASP CB C 54 38.894 40.593 -1.699 1
1 517 . 15 1 1 A 55 55 ASP N N 54 123.654 124.219 -0.565 1
1 518 . 15 1 1 A 56 56 THR H H 55 7.819 8.022 -0.203 1
1 519 . 15 1 1 A 56 56 THR HA H 55 4.574 4.887 -0.313 1
1 524 . 15 1 1 A 56 56 THR C C 55 174.096 173.883 0.213 1
1 525 . 15 1 1 A 56 56 THR CA C 55 59.172 60.326 -1.154 1
1 526 . 15 1 1 A 56 56 THR CB C 55 71.889 71.885 0.004 1
1 528 . 15 1 1 A 56 56 THR N N 55 112.015 117.282 -5.267 1
1 529 . 15 1 1 A 57 57 GLU H H 56 8.527 8.599 -0.072 1
1 530 . 15 1 1 A 57 57 GLU HA H 56 4.217 4.532 -0.315 1
1 535 . 15 1 1 A 57 57 GLU C C 56 177.042 176.404 0.638 1
1 536 . 15 1 1 A 57 57 GLU CA C 56 56.869 56.624 0.245 1
1 537 . 15 1 1 A 57 57 GLU CB C 56 29.731 31.710 -1.979 1
1 539 . 15 1 1 A 57 57 GLU N N 56 117.531 119.293 -1.762 1
1 540 . 15 1 1 A 58 58 GLU H H 57 7.587 7.750 -0.163 1
1 541 . 15 1 1 A 58 58 GLU HA H 57 3.941 4.355 -0.414 1
1 546 . 15 1 1 A 58 58 GLU C C 57 176.849 175.735 1.114 1
1 547 . 15 1 1 A 58 58 GLU CA C 57 56.924 56.308 0.616 1
1 548 . 15 1 1 A 58 58 GLU CB C 57 30.251 30.785 -0.534 1
1 550 . 15 1 1 A 58 58 GLU N N 57 119.183 121.088 -1.905 1
1 551 . 15 1 1 A 59 59 ASN H H 58 9.120 8.662 0.458 1
1 552 . 15 1 1 A 59 59 ASN HA H 58 4.922 4.892 0.030 1
1 557 . 15 1 1 A 59 59 ASN C C 58 174.254 174.925 -0.671 1
1 558 . 15 1 1 A 59 59 ASN CA C 58 51.956 52.316 -0.360 1
1 559 . 15 1 1 A 59 59 ASN CB C 58 37.404 40.199 -2.795 1
1 560 . 15 1 1 A 59 59 ASN N N 58 126.767 124.291 2.476 1
1 562 . 15 1 1 A 60 60 LYS H H 59 5.892 8.878 -2.986 1
1 563 . 15 1 1 A 60 60 LYS HA H 59 3.798 4.564 -0.766 1
1 572 . 15 1 1 A 60 60 LYS C C 59 177.908 178.004 -0.096 1
1 573 . 15 1 1 A 60 60 LYS CA C 59 56.623 54.853 1.770 1
1 574 . 15 1 1 A 60 60 LYS CB C 59 32.279 33.745 -1.466 1
1 578 . 15 1 1 A 60 60 LYS N N 59 121.527 125.513 -3.986 1
1 579 . 15 1 1 A 61 61 LEU H H 60 8.473 8.880 -0.407 1
1 580 . 15 1 1 A 61 61 LEU HA H 60 3.891 4.202 -0.311 1
1 590 . 15 1 1 A 61 61 LEU C C 60 179.843 178.731 1.112 1
1 591 . 15 1 1 A 61 61 LEU CA C 60 58.301 56.734 1.567 1
1 592 . 15 1 1 A 61 61 LEU CB C 60 41.305 41.788 -0.483 1
1 596 . 15 1 1 A 61 61 LEU N N 60 125.639 122.891 2.748 1
1 597 . 15 1 1 A 62 62 ILE H H 61 7.698 7.944 -0.246 1
1 598 . 15 1 1 A 62 62 ILE HA H 61 3.952 3.944 0.008 1
1 608 . 15 1 1 A 62 62 ILE C C 61 175.392 177.242 -1.850 1
1 609 . 15 1 1 A 62 62 ILE CA C 61 61.743 63.401 -1.658 1
1 610 . 15 1 1 A 62 62 ILE CB C 61 39.108 37.818 1.290 1
1 614 . 15 1 1 A 62 62 ILE N N 61 114.111 119.746 -5.635 1
1 615 . 15 1 1 A 63 63 TYR H H 62 7.273 7.956 -0.683 1
1 616 . 15 1 1 A 63 63 TYR HA H 62 4.343 4.087 0.256 1
1 623 . 15 1 1 A 63 63 TYR C C 62 178.264 178.431 -0.167 1
1 624 . 15 1 1 A 63 63 TYR CA C 62 57.231 60.973 -3.742 1
1 625 . 15 1 1 A 63 63 TYR CB C 62 36.332 37.552 -1.220 1
1 630 . 15 1 1 A 63 63 TYR N N 62 117.689 121.396 -3.707 1
1 631 . 15 1 1 A 64 64 THR H H 63 7.747 8.039 -0.292 1
1 632 . 15 1 1 A 64 64 THR HA H 63 4.266 4.249 0.017 1
1 637 . 15 1 1 A 64 64 THR CA C 63 69.362 67.565 1.797 1
1 638 . 15 1 1 A 64 64 THR CB C 63 66.962 67.408 -0.446 1
1 640 . 15 1 1 A 64 64 THR N N 63 113.755 116.249 -2.494 1
1 641 . 15 1 1 A 65 65 PRO HA H 64 4.372 4.359 0.013 1
1 648 . 15 1 1 A 65 65 PRO C C 64 179.913 179.465 0.448 1
1 649 . 15 1 1 A 65 65 PRO CA C 64 66.011 66.335 -0.324 1
1 650 . 15 1 1 A 65 65 PRO CB C 64 30.642 30.745 -0.103 1
1 653 . 15 1 1 A 66 66 ILE H H 65 7.377 7.334 0.043 1
1 654 . 15 1 1 A 66 66 ILE HA H 65 3.530 3.820 -0.290 1
1 664 . 15 1 1 A 66 66 ILE C C 65 177.543 178.254 -0.711 1
1 665 . 15 1 1 A 66 66 ILE CA C 65 66.647 64.271 2.376 1
1 666 . 15 1 1 A 66 66 ILE CB C 65 38.029 37.744 0.285 1
1 670 . 15 1 1 A 66 66 ILE N N 65 118.353 116.576 1.777 1
1 671 . 15 1 1 A 67 67 PHE H H 66 8.480 8.483 -0.003 1
1 672 . 15 1 1 A 67 67 PHE HA H 66 4.115 4.371 -0.256 1
1 680 . 15 1 1 A 67 67 PHE C C 66 177.293 178.858 -1.565 1
1 681 . 15 1 1 A 67 67 PHE CA C 66 59.570 61.976 -2.406 1
1 682 . 15 1 1 A 67 67 PHE CB C 66 38.865 39.650 -0.785 1
1 688 . 15 1 1 A 67 67 PHE N N 66 122.420 120.453 1.967 1
1 689 . 15 1 1 A 68 68 ASN H H 67 8.595 8.422 0.173 1
1 690 . 15 1 1 A 68 68 ASN HA H 67 4.211 4.431 -0.220 1
1 695 . 15 1 1 A 68 68 ASN C C 67 178.697 178.262 0.435 1
1 696 . 15 1 1 A 68 68 ASN CA C 67 56.056 56.119 -0.063 1
1 697 . 15 1 1 A 68 68 ASN CB C 67 37.704 38.050 -0.346 1
1 698 . 15 1 1 A 68 68 ASN N N 67 115.573 117.428 -1.855 1
1 700 . 15 1 1 A 69 69 GLU H H 68 8.414 7.957 0.457 1
1 701 . 15 1 1 A 69 69 GLU HA H 68 4.102 4.156 -0.054 1
1 706 . 15 1 1 A 69 69 GLU C C 68 177.880 178.839 -0.959 1
1 707 . 15 1 1 A 69 69 GLU CA C 68 59.399 59.199 0.200 1
1 708 . 15 1 1 A 69 69 GLU CB C 68 29.855 29.228 0.627 1
1 710 . 15 1 1 A 69 69 GLU N N 68 123.510 120.043 3.467 1
1 711 . 15 1 1 A 70 70 TYR H H 69 8.659 8.076 0.583 1
1 712 . 15 1 1 A 70 70 TYR HA H 69 3.362 4.080 -0.718 1
1 719 . 15 1 1 A 70 70 TYR C C 69 178.143 176.988 1.155 1
1 720 . 15 1 1 A 70 70 TYR CA C 69 60.686 61.166 -0.480 1
1 721 . 15 1 1 A 70 70 TYR CB C 69 38.560 38.968 -0.408 1
1 726 . 15 1 1 A 70 70 TYR N N 69 122.130 121.132 0.998 1
1 727 . 15 1 1 A 71 71 ILE H H 70 8.031 7.580 0.451 1
1 728 . 15 1 1 A 71 71 ILE HA H 70 3.265 3.688 -0.423 1
1 738 . 15 1 1 A 71 71 ILE C C 70 178.056 177.821 0.235 1
1 739 . 15 1 1 A 71 71 ILE CA C 70 63.756 64.055 -0.299 1
1 740 . 15 1 1 A 71 71 ILE CB C 70 37.321 37.358 -0.037 1
1 744 . 15 1 1 A 71 71 ILE N N 70 118.906 120.413 -1.507 1
1 745 . 15 1 1 A 72 72 SER H H 71 7.803 7.794 0.009 1
1 746 . 15 1 1 A 72 72 SER HA H 71 4.029 4.223 -0.194 1
1 749 . 15 1 1 A 72 72 SER CA C 71 61.380 62.206 -0.826 1
1 750 . 15 1 1 A 72 72 SER CB C 71 63.288 63.093 0.195 1
1 751 . 15 1 1 A 72 72 SER N N 71 113.735 116.898 -3.163 1
1 752 . 15 1 1 A 73 73 LEU H H 72 7.952 7.865 0.087 1
1 753 . 15 1 1 A 73 73 LEU HA H 72 4.418 4.129 0.289 1
1 763 . 15 1 1 A 73 73 LEU C C 72 177.767 178.148 -0.381 1
1 764 . 15 1 1 A 73 73 LEU CA C 72 56.543 57.403 -0.860 1
1 765 . 15 1 1 A 73 73 LEU CB C 72 44.517 41.706 2.811 1
1 769 . 15 1 1 A 73 73 LEU N N 72 119.411 121.991 -2.580 1
1 770 . 15 1 1 A 74 74 VAL H H 73 8.021 7.665 0.356 1
1 771 . 15 1 1 A 74 74 VAL HA H 73 3.532 3.323 0.209 1
1 779 . 15 1 1 A 74 74 VAL C C 73 177.126 178.090 -0.964 1
1 780 . 15 1 1 A 74 74 VAL CA C 73 66.250 66.431 -0.181 1
1 781 . 15 1 1 A 74 74 VAL CB C 73 31.212 31.071 0.141 1
1 784 . 15 1 1 A 74 74 VAL N N 73 118.747 119.159 -0.412 1
1 785 . 15 1 1 A 75 75 GLU H H 74 7.232 7.903 -0.671 1
1 786 . 15 1 1 A 75 75 GLU HA H 74 3.013 4.128 -1.115 1
1 791 . 15 1 1 A 75 75 GLU C C 74 178.804 179.024 -0.220 1
1 792 . 15 1 1 A 75 75 GLU CA C 74 60.536 59.976 0.560 1
1 793 . 15 1 1 A 75 75 GLU CB C 74 27.009 29.023 -2.014 1
1 795 . 15 1 1 A 75 75 GLU N N 74 118.660 119.751 -1.091 1
1 796 . 15 1 1 A 76 76 LYS H H 75 7.051 7.446 -0.395 1
1 797 . 15 1 1 A 76 76 LYS HA H 75 3.765 4.054 -0.289 1
1 806 . 15 1 1 A 76 76 LYS C C 75 177.765 178.164 -0.399 1
1 807 . 15 1 1 A 76 76 LYS CA C 75 58.357 58.567 -0.210 1
1 808 . 15 1 1 A 76 76 LYS CB C 75 31.939 31.989 -0.050 1
1 812 . 15 1 1 A 76 76 LYS N N 75 116.112 120.104 -3.992 1
1 813 . 15 1 1 A 77 77 TYR H H 76 7.067 7.766 -0.699 1
1 814 . 15 1 1 A 77 77 TYR HA H 76 4.036 4.178 -0.142 1
1 821 . 15 1 1 A 77 77 TYR C C 76 177.752 177.185 0.567 1
1 822 . 15 1 1 A 77 77 TYR CA C 76 61.820 61.103 0.717 1
1 823 . 15 1 1 A 77 77 TYR CB C 76 38.480 38.547 -0.067 1
1 828 . 15 1 1 A 77 77 TYR N N 76 118.434 120.677 -2.243 1
1 829 . 15 1 1 A 78 78 ILE H H 77 7.554 8.454 -0.900 1
1 830 . 15 1 1 A 78 78 ILE HA H 77 3.159 3.765 -0.606 1
1 840 . 15 1 1 A 78 78 ILE C C 77 177.341 178.176 -0.835 1
1 841 . 15 1 1 A 78 78 ILE CA C 77 65.177 65.562 -0.385 1
1 842 . 15 1 1 A 78 78 ILE CB C 77 37.339 37.966 -0.627 1
1 846 . 15 1 1 A 78 78 ILE N N 77 117.672 121.292 -3.620 1
1 847 . 15 1 1 A 79 79 GLU H H 78 8.296 7.977 0.319 1
1 848 . 15 1 1 A 79 79 GLU HA H 78 3.557 3.881 -0.324 1
1 853 . 15 1 1 A 79 79 GLU C C 78 177.742 178.845 -1.103 1
1 854 . 15 1 1 A 79 79 GLU CA C 78 60.847 59.780 1.067 1
1 855 . 15 1 1 A 79 79 GLU CB C 78 29.594 29.046 0.548 1
1 857 . 15 1 1 A 79 79 GLU N N 78 118.701 120.538 -1.837 1
1 858 . 15 1 1 A 80 80 GLU H H 79 8.330 7.954 0.376 1
1 859 . 15 1 1 A 80 80 GLU HA H 79 3.774 4.047 -0.273 1
1 864 . 15 1 1 A 80 80 GLU C C 79 179.926 179.103 0.823 1
1 865 . 15 1 1 A 80 80 GLU CA C 79 59.581 58.456 1.125 1
1 866 . 15 1 1 A 80 80 GLU CB C 79 29.062 29.401 -0.339 1
1 868 . 15 1 1 A 80 80 GLU N N 79 116.767 119.219 -2.452 1
1 869 . 15 1 1 A 81 81 GLN H H 80 7.634 7.737 -0.103 1
1 870 . 15 1 1 A 81 81 GLN HA H 80 3.605 3.813 -0.208 1
1 877 . 15 1 1 A 81 81 GLN C C 80 179.681 178.693 0.988 1
1 878 . 15 1 1 A 81 81 GLN CA C 80 57.765 58.529 -0.764 1
1 879 . 15 1 1 A 81 81 GLN CB C 80 28.079 27.706 0.373 1
1 881 . 15 1 1 A 81 81 GLN N N 80 116.325 118.722 -2.397 1
1 883 . 15 1 1 A 82 82 LEU H H 81 8.156 7.435 0.721 1
1 884 . 15 1 1 A 82 82 LEU HA H 81 3.536 3.752 -0.216 1
1 894 . 15 1 1 A 82 82 LEU C C 81 178.945 179.139 -0.194 1
1 895 . 15 1 1 A 82 82 LEU CA C 81 57.761 57.003 0.758 1
1 896 . 15 1 1 A 82 82 LEU CB C 81 40.961 40.984 -0.023 1
1 900 . 15 1 1 A 82 82 LEU N N 81 121.546 120.004 1.542 1
1 901 . 15 1 1 A 83 83 LEU H H 82 8.326 8.185 0.141 1
1 902 . 15 1 1 A 83 83 LEU HA H 82 4.198 4.174 0.024 1
1 912 . 15 1 1 A 83 83 LEU C C 82 178.631 179.320 -0.689 1
1 913 . 15 1 1 A 83 83 LEU CA C 82 57.016 57.100 -0.084 1
1 914 . 15 1 1 A 83 83 LEU CB C 82 42.182 40.700 1.482 1
1 918 . 15 1 1 A 83 83 LEU N N 82 120.426 118.724 1.702 1
1 919 . 15 1 1 A 84 84 GLN H H 83 6.992 7.611 -0.619 1
1 920 . 15 1 1 A 84 84 GLN HA H 83 3.877 4.008 -0.131 1
1 927 . 15 1 1 A 84 84 GLN C C 83 177.008 176.905 0.103 1
1 928 . 15 1 1 A 84 84 GLN CA C 83 57.543 58.341 -0.798 1
1 929 . 15 1 1 A 84 84 GLN CB C 83 28.688 28.673 0.015 1
1 931 . 15 1 1 A 84 84 GLN N N 83 114.001 117.191 -3.190 1
1 933 . 15 1 1 A 85 85 ARG H H 84 7.072 7.556 -0.484 1
1 934 . 15 1 1 A 85 85 ARG HA H 84 4.047 4.369 -0.322 1
1 942 . 15 1 1 A 85 85 ARG C C 84 175.999 175.463 0.536 1
1 943 . 15 1 1 A 85 85 ARG CA C 84 56.764 55.934 0.830 1
1 944 . 15 1 1 A 85 85 ARG CB C 84 32.044 32.407 -0.363 1
1 947 . 15 1 1 A 85 85 ARG N N 84 115.827 116.716 -0.889 1
1 949 . 15 1 1 A 86 86 ILE H H 85 8.238 7.769 0.469 1
1 950 . 15 1 1 A 86 86 ILE HA H 85 4.389 4.525 -0.136 1
1 960 . 15 1 1 A 86 86 ILE CA C 85 58.007 57.849 0.158 1
1 961 . 15 1 1 A 86 86 ILE CB C 85 39.604 38.852 0.752 1
1 965 . 15 1 1 A 86 86 ILE N N 85 119.285 119.984 -0.699 1
1 966 . 15 1 1 A 87 87 PRO HA H 86 4.392 4.530 -0.138 1
1 973 . 15 1 1 A 87 87 PRO C C 86 177.622 177.376 0.246 1
1 974 . 15 1 1 A 87 87 PRO CA C 86 64.665 64.240 0.425 1
1 975 . 15 1 1 A 87 87 PRO CB C 86 32.020 31.640 0.380 1
1 978 . 15 1 1 A 88 88 GLU H H 87 8.312 8.574 -0.262 1
1 979 . 15 1 1 A 88 88 GLU HA H 87 4.208 4.368 -0.160 1
1 984 . 15 1 1 A 88 88 GLU C C 87 175.554 176.426 -0.872 1
1 985 . 15 1 1 A 88 88 GLU CA C 87 56.045 55.847 0.198 1
1 986 . 15 1 1 A 88 88 GLU CB C 87 28.654 29.280 -0.626 1
1 988 . 15 1 1 A 88 88 GLU N N 87 114.256 115.576 -1.320 1
1 989 . 15 1 1 A 89 89 PHE H H 88 7.946 7.624 0.322 1
1 990 . 15 1 1 A 89 89 PHE HA H 88 3.993 4.567 -0.574 1
1 998 . 15 1 1 A 89 89 PHE C C 88 173.460 174.292 -0.832 1
1 999 . 15 1 1 A 89 89 PHE CA C 88 60.119 58.935 1.184 1
1 1000 . 15 1 1 A 89 89 PHE CB C 88 39.994 39.904 0.090 1
1 1006 . 15 1 1 A 89 89 PHE N N 88 121.550 122.034 -0.484 1
1 1007 . 15 1 1 A 90 90 ASN H H 89 7.266 7.654 -0.388 1
1 1008 . 15 1 1 A 90 90 ASN HA H 89 4.454 4.967 -0.513 1
1 1013 . 15 1 1 A 90 90 ASN C C 89 173.921 175.208 -1.287 1
1 1014 . 15 1 1 A 90 90 ASN CA C 89 51.839 51.351 0.488 1
1 1015 . 15 1 1 A 90 90 ASN CB C 89 40.674 39.397 1.277 1
1 1016 . 15 1 1 A 90 90 ASN N N 89 125.344 124.749 0.595 1
1 1018 . 15 1 1 A 91 91 MET H H 90 8.968 8.690 0.278 1
1 1019 . 15 1 1 A 91 91 MET HA H 90 4.049 4.184 -0.135 1
1 1027 . 15 1 1 A 91 91 MET C C 90 177.475 178.019 -0.544 1
1 1028 . 15 1 1 A 91 91 MET CA C 90 57.758 58.052 -0.294 1
1 1029 . 15 1 1 A 91 91 MET CB C 90 32.250 32.430 -0.180 1
1 1032 . 15 1 1 A 91 91 MET N N 90 127.052 125.237 1.815 1
1 1033 . 15 1 1 A 92 92 ALA H H 91 8.292 8.050 0.242 1
1 1034 . 15 1 1 A 92 92 ALA HA H 91 4.059 4.124 -0.065 1
1 1038 . 15 1 1 A 92 92 ALA C C 91 180.412 179.633 0.779 1
1 1039 . 15 1 1 A 92 92 ALA CA C 91 55.368 54.871 0.497 1
1 1040 . 15 1 1 A 92 92 ALA CB C 91 17.527 18.838 -1.311 1
1 1041 . 15 1 1 A 92 92 ALA N N 91 123.752 121.381 2.371 1
1 1042 . 15 1 1 A 93 93 ALA H H 92 7.931 8.177 -0.246 1
1 1043 . 15 1 1 A 93 93 ALA HA H 92 4.054 4.246 -0.192 1
1 1047 . 15 1 1 A 93 93 ALA C C 92 180.482 180.008 0.474 1
1 1048 . 15 1 1 A 93 93 ALA CA C 92 54.614 55.047 -0.433 1
1 1049 . 15 1 1 A 93 93 ALA CB C 92 18.098 18.182 -0.084 1
1 1050 . 15 1 1 A 93 93 ALA N N 92 121.158 119.965 1.193 1
1 1051 . 15 1 1 A 94 94 PHE H H 93 8.110 7.774 0.336 1
1 1052 . 15 1 1 A 94 94 PHE HA H 93 4.304 4.146 0.158 1
1 1060 . 15 1 1 A 94 94 PHE C C 93 177.350 177.134 0.216 1
1 1061 . 15 1 1 A 94 94 PHE CA C 93 61.641 61.489 0.152 1
1 1062 . 15 1 1 A 94 94 PHE CB C 93 40.014 39.315 0.699 1
1 1068 . 15 1 1 A 94 94 PHE N N 93 119.807 119.713 0.094 1
1 1069 . 15 1 1 A 95 95 THR H H 94 8.726 8.198 0.528 1
1 1070 . 15 1 1 A 95 95 THR HA H 94 3.569 3.970 -0.401 1
1 1075 . 15 1 1 A 95 95 THR C C 94 176.932 176.554 0.378 1
1 1076 . 15 1 1 A 95 95 THR CA C 94 66.833 65.515 1.318 1
1 1077 . 15 1 1 A 95 95 THR CB C 94 68.445 68.353 0.092 1
1 1079 . 15 1 1 A 95 95 THR N N 94 113.074 112.157 0.917 1
1 1080 . 15 1 1 A 96 96 THR H H 95 7.657 7.898 -0.241 1
1 1081 . 15 1 1 A 96 96 THR HA H 95 3.945 4.097 -0.152 1
1 1086 . 15 1 1 A 96 96 THR C C 95 176.386 177.404 -1.018 1
1 1087 . 15 1 1 A 96 96 THR CA C 95 66.550 65.681 0.869 1
1 1088 . 15 1 1 A 96 96 THR CB C 95 68.583 67.944 0.639 1
1 1090 . 15 1 1 A 96 96 THR N N 95 117.927 113.873 4.054 1
1 1091 . 15 1 1 A 97 97 THR H H 96 7.699 7.777 -0.078 1
1 1092 . 15 1 1 A 97 97 THR HA H 96 3.905 4.089 -0.184 1
1 1097 . 15 1 1 A 97 97 THR C C 96 176.572 176.041 0.531 1
1 1098 . 15 1 1 A 97 97 THR CA C 96 65.979 66.639 -0.660 1
1 1099 . 15 1 1 A 97 97 THR CB C 96 68.553 68.173 0.380 1
1 1101 . 15 1 1 A 97 97 THR N N 96 118.518 117.509 1.009 1
1 1102 . 15 1 1 A 98 98 LEU H H 97 8.304 8.082 0.222 1
1 1103 . 15 1 1 A 98 98 LEU HA H 97 3.725 3.717 0.008 1
1 1113 . 15 1 1 A 98 98 LEU C C 97 178.490 178.420 0.070 1
1 1114 . 15 1 1 A 98 98 LEU CA C 97 58.517 57.864 0.653 1
1 1115 . 15 1 1 A 98 98 LEU CB C 97 41.697 41.022 0.675 1
1 1119 . 15 1 1 A 98 98 LEU N N 97 122.882 121.993 0.889 1
1 1120 . 15 1 1 A 99 99 GLN H H 98 7.639 7.815 -0.176 1
1 1121 . 15 1 1 A 99 99 GLN HA H 98 3.927 4.085 -0.158 1
1 1128 . 15 1 1 A 99 99 GLN C C 98 178.068 177.823 0.245 1
1 1129 . 15 1 1 A 99 99 GLN CA C 98 58.735 59.238 -0.503 1
1 1130 . 15 1 1 A 99 99 GLN CB C 98 27.986 28.331 -0.345 1
1 1132 . 15 1 1 A 99 99 GLN N N 98 114.302 118.175 -3.873 1
1 1134 . 15 1 1 A 100 100 HIS H H 99 7.575 7.935 -0.360 1
1 1135 . 15 1 1 A 100 100 HIS HA H 99 4.524 4.453 0.071 1
1 1139 . 15 1 1 A 100 100 HIS C C 99 174.789 177.296 -2.507 1
1 1140 . 15 1 1 A 100 100 HIS CA C 99 56.154 57.278 -1.124 1
1 1141 . 15 1 1 A 100 100 HIS CB C 99 28.946 29.805 -0.859 1
1 1143 . 15 1 1 A 100 100 HIS N N 99 114.778 116.900 -2.122 1
1 1144 . 15 1 1 A 101 101 HIS H H 100 7.773 7.586 0.187 1
1 1145 . 15 1 1 A 101 101 HIS HA H 100 4.704 3.939 0.765 1
1 1149 . 15 1 1 A 101 101 HIS C C 100 174.818 176.780 -1.962 1
1 1150 . 15 1 1 A 101 101 HIS CA C 100 54.830 58.210 -3.380 1
1 1151 . 15 1 1 A 101 101 HIS CB C 100 29.749 29.733 0.016 1
1 1153 . 15 1 1 A 101 101 HIS N N 100 117.397 119.921 -2.524 1
1 1154 . 15 1 1 A 102 102 LYS H H 101 7.324 8.023 -0.699 1
1 1155 . 15 1 1 A 102 102 LYS HA H 101 3.611 3.940 -0.329 1
1 1164 . 15 1 1 A 102 102 LYS C C 101 176.823 178.736 -1.913 1
1 1165 . 15 1 1 A 102 102 LYS CA C 101 59.915 59.435 0.480 1
1 1166 . 15 1 1 A 102 102 LYS CB C 101 32.825 32.255 0.570 1
1 1170 . 15 1 1 A 102 102 LYS N N 101 120.533 117.412 3.121 1
1 1171 . 15 1 1 A 103 103 ASP H H 102 8.361 8.733 -0.372 1
1 1172 . 15 1 1 A 103 103 ASP HA H 102 4.421 4.369 0.052 1
1 1175 . 15 1 1 A 103 103 ASP C C 102 176.793 176.994 -0.201 1
1 1176 . 15 1 1 A 103 103 ASP CA C 102 55.500 55.208 0.292 1
1 1177 . 15 1 1 A 103 103 ASP CB C 102 40.178 39.243 0.935 1
1 1178 . 15 1 1 A 103 103 ASP N N 102 114.814 118.436 -3.622 1
1 1179 . 15 1 1 A 104 104 GLU H H 103 7.858 8.262 -0.404 1
1 1180 . 15 1 1 A 104 104 GLU HA H 103 4.339 4.561 -0.222 1
1 1183 . 15 1 1 A 104 104 GLU C C 103 175.777 176.266 -0.489 1
1 1184 . 15 1 1 A 104 104 GLU CA C 103 56.356 57.873 -1.517 1
1 1185 . 15 1 1 A 104 104 GLU CB C 103 31.293 31.855 -0.562 1
1 1186 . 15 1 1 A 104 104 GLU N N 103 116.826 118.515 -1.689 1
1 1187 . 15 1 1 A 105 105 VAL H H 104 7.201 7.295 -0.094 1
1 1188 . 15 1 1 A 105 105 VAL HA H 104 4.296 4.132 0.164 1
1 1196 . 15 1 1 A 105 105 VAL C C 104 174.482 175.637 -1.155 1
1 1197 . 15 1 1 A 105 105 VAL CA C 104 60.370 62.706 -2.336 1
1 1198 . 15 1 1 A 105 105 VAL CB C 104 34.341 33.234 1.107 1
1 1201 . 15 1 1 A 105 105 VAL N N 104 116.422 119.969 -3.547 1
1 1202 . 15 1 1 A 106 106 ALA H H 105 8.487 8.464 0.023 1
1 1203 . 15 1 1 A 106 106 ALA HA H 105 4.172 4.473 -0.301 1
1 1207 . 15 1 1 A 106 106 ALA C C 105 179.030 179.002 0.028 1
1 1208 . 15 1 1 A 106 106 ALA CA C 105 52.966 52.618 0.348 1
1 1209 . 15 1 1 A 106 106 ALA CB C 105 19.371 19.766 -0.395 1
1 1210 . 15 1 1 A 106 106 ALA N N 105 128.313 128.788 -0.475 1
1 1211 . 15 1 1 A 107 107 GLY H H 106 8.738 8.818 -0.080 1
1 1212 . 15 1 1 A 107 107 GLY HA2 H 106 3.773 3.882 -0.109 1
1 1213 . 15 1 1 A 107 107 GLY HA3 H 106 3.998 3.951 0.047 1
1 1214 . 15 1 1 A 107 107 GLY C C 106 174.958 175.536 -0.578 1
1 1215 . 15 1 1 A 107 107 GLY CA C 106 47.449 47.169 0.280 1
1 1216 . 15 1 1 A 107 107 GLY N N 106 110.612 110.943 -0.331 1
1 1217 . 15 1 1 A 108 108 ASP H H 107 8.535 8.373 0.162 1
1 1218 . 15 1 1 A 108 108 ASP HA H 107 4.333 4.349 -0.016 1
1 1221 . 15 1 1 A 108 108 ASP C C 107 179.133 179.028 0.105 1
1 1222 . 15 1 1 A 108 108 ASP CA C 107 56.721 57.029 -0.308 1
1 1223 . 15 1 1 A 108 108 ASP CB C 107 39.336 41.126 -1.790 1
1 1224 . 15 1 1 A 108 108 ASP N N 107 117.474 121.430 -3.956 1
1 1225 . 15 1 1 A 109 109 ILE H H 108 7.459 7.927 -0.468 1
1 1226 . 15 1 1 A 109 109 ILE HA H 108 3.688 3.781 -0.093 1
1 1236 . 15 1 1 A 109 109 ILE C C 108 176.735 178.287 -1.552 1
1 1237 . 15 1 1 A 109 109 ILE CA C 108 63.474 65.582 -2.108 1
1 1238 . 15 1 1 A 109 109 ILE CB C 108 37.340 37.761 -0.421 1
1 1242 . 15 1 1 A 109 109 ILE N N 108 119.609 119.615 -0.006 1
1 1243 . 15 1 1 A 110 110 PHE H H 109 7.920 8.406 -0.486 1
1 1244 . 15 1 1 A 110 110 PHE HA H 109 3.759 4.079 -0.320 1
1 1252 . 15 1 1 A 110 110 PHE C C 109 177.132 177.387 -0.255 1
1 1253 . 15 1 1 A 110 110 PHE CA C 109 62.766 61.233 1.533 1
1 1254 . 15 1 1 A 110 110 PHE CB C 109 39.752 39.291 0.461 1
1 1260 . 15 1 1 A 110 110 PHE N N 109 120.906 120.464 0.442 1
1 1261 . 15 1 1 A 111 111 ASP H H 110 8.639 8.224 0.415 1
1 1262 . 15 1 1 A 111 111 ASP HA H 110 4.216 4.204 0.012 1
1 1265 . 15 1 1 A 111 111 ASP C C 110 178.900 178.415 0.485 1
1 1266 . 15 1 1 A 111 111 ASP CA C 110 57.105 57.227 -0.122 1
1 1267 . 15 1 1 A 111 111 ASP CB C 110 39.697 41.705 -2.008 1
1 1268 . 15 1 1 A 111 111 ASP N N 110 117.124 119.025 -1.901 1
1 1269 . 15 1 1 A 112 112 MET H H 111 7.331 7.540 -0.209 1
1 1270 . 15 1 1 A 112 112 MET HA H 111 4.081 4.126 -0.045 1
1 1278 . 15 1 1 A 112 112 MET C C 111 179.052 178.158 0.894 1
1 1279 . 15 1 1 A 112 112 MET CA C 111 58.202 58.124 0.078 1
1 1280 . 15 1 1 A 112 112 MET CB C 111 31.827 32.350 -0.523 1
1 1283 . 15 1 1 A 112 112 MET N N 111 118.061 119.445 -1.384 1
1 1284 . 15 1 1 A 113 113 LEU H H 112 8.001 8.015 -0.014 1
1 1285 . 15 1 1 A 113 113 LEU HA H 112 3.723 3.559 0.164 1
1 1295 . 15 1 1 A 113 113 LEU C C 112 179.747 178.596 1.151 1
1 1296 . 15 1 1 A 113 113 LEU CA C 112 57.371 57.360 0.011 1
1 1297 . 15 1 1 A 113 113 LEU CB C 112 40.671 41.100 -0.429 1
1 1301 . 15 1 1 A 113 113 LEU N N 112 120.426 119.664 0.762 1
1 1302 . 15 1 1 A 114 114 LEU H H 113 7.744 7.628 0.116 1
1 1303 . 15 1 1 A 114 114 LEU HA H 113 4.007 3.497 0.510 1
1 1313 . 15 1 1 A 114 114 LEU C C 113 179.358 178.489 0.869 1
1 1314 . 15 1 1 A 114 114 LEU CA C 113 57.202 57.502 -0.300 1
1 1315 . 15 1 1 A 114 114 LEU CB C 113 41.727 41.556 0.171 1
1 1319 . 15 1 1 A 114 114 LEU N N 113 119.584 119.612 -0.028 1
1 1320 . 15 1 1 A 115 115 THR H H 114 7.353 7.615 -0.262 1
1 1321 . 15 1 1 A 115 115 THR HA H 114 4.071 4.153 -0.082 1
1 1327 . 15 1 1 A 115 115 THR C C 114 173.591 176.466 -2.875 1
1 1328 . 15 1 1 A 115 115 THR CA C 114 65.332 64.264 1.068 1
1 1329 . 15 1 1 A 115 115 THR CB C 114 70.319 68.725 1.594 1
1 1331 . 15 1 1 A 115 115 THR N N 114 107.535 112.371 -4.836 1
1 1332 . 15 1 1 A 116 116 PHE H H 115 6.979 7.786 -0.807 1
1 1333 . 15 1 1 A 116 116 PHE HA H 115 5.022 4.287 0.735 1
1 1341 . 15 1 1 A 116 116 PHE C C 115 176.488 176.362 0.126 1
1 1342 . 15 1 1 A 116 116 PHE CA C 115 55.911 60.853 -4.942 1
1 1343 . 15 1 1 A 116 116 PHE CB C 115 38.521 39.248 -0.727 1
1 1349 . 15 1 1 A 116 116 PHE N N 115 112.366 120.075 -7.709 1
1 1350 . 15 1 1 A 117 117 THR H H 116 7.564 7.956 -0.392 1
1 1351 . 15 1 1 A 117 117 THR HA H 116 4.626 4.930 -0.304 1
1 1356 . 15 1 1 A 117 117 THR C C 116 174.085 174.453 -0.368 1
1 1357 . 15 1 1 A 117 117 THR CA C 116 61.636 62.502 -0.866 1
1 1358 . 15 1 1 A 117 117 THR CB C 116 70.915 72.234 -1.319 1
1 1360 . 15 1 1 A 117 117 THR N N 116 105.498 112.463 -6.965 1
1 1361 . 15 1 1 A 118 118 ASP H H 117 8.270 7.509 0.761 1
1 1362 . 15 1 1 A 118 118 ASP HA H 117 4.955 5.016 -0.061 1
1 1365 . 15 1 1 A 118 118 ASP C C 117 176.328 176.263 0.065 1
1 1366 . 15 1 1 A 118 118 ASP CA C 117 53.417 53.776 -0.359 1
1 1367 . 15 1 1 A 118 118 ASP CB C 117 43.388 39.097 4.291 1
1 1368 . 15 1 1 A 118 118 ASP N N 117 124.409 121.308 3.101 1
1 1369 . 15 1 1 A 119 119 PHE H H 118 8.973 8.738 0.235 1
1 1370 . 15 1 1 A 119 119 PHE HA H 118 3.506 4.168 -0.662 1
1 1378 . 15 1 1 A 119 119 PHE CA C 118 61.490 61.524 -0.034 1
1 1379 . 15 1 1 A 119 119 PHE CB C 118 39.246 39.462 -0.216 1
1 1385 . 15 1 1 A 119 119 PHE N N 118 126.688 125.623 1.065 1
1 1386 . 15 1 1 A 120 120 LEU H H 119 8.099 8.519 -0.420 1
1 1387 . 15 1 1 A 120 120 LEU HA H 119 3.842 3.912 -0.070 1
1 1397 . 15 1 1 A 120 120 LEU C C 119 179.601 179.457 0.144 1
1 1398 . 15 1 1 A 120 120 LEU CA C 119 58.174 57.909 0.265 1
1 1399 . 15 1 1 A 120 120 LEU CB C 119 40.315 41.300 -0.985 1
1 1403 . 15 1 1 A 120 120 LEU N N 119 117.930 119.944 -2.014 1
1 1404 . 15 1 1 A 121 121 ALA H H 120 7.729 7.586 0.143 1
1 1405 . 15 1 1 A 121 121 ALA HA H 120 3.996 4.089 -0.093 1
1 1409 . 15 1 1 A 121 121 ALA C C 120 180.995 179.589 1.406 1
1 1410 . 15 1 1 A 121 121 ALA CA C 120 54.832 54.704 0.128 1
1 1411 . 15 1 1 A 121 121 ALA CB C 120 17.706 18.343 -0.637 1
1 1412 . 15 1 1 A 121 121 ALA N N 120 123.195 121.346 1.849 1
1 1413 . 15 1 1 A 122 122 PHE H H 121 7.943 7.879 0.064 1
1 1414 . 15 1 1 A 122 122 PHE HA H 121 3.887 3.873 0.014 1
1 1419 . 15 1 1 A 122 122 PHE C C 121 175.410 176.768 -1.358 1
1 1420 . 15 1 1 A 122 122 PHE CA C 121 61.075 60.693 0.382 1
1 1421 . 15 1 1 A 122 122 PHE CB C 121 38.115 38.781 -0.666 1
1 1424 . 15 1 1 A 122 122 PHE N N 121 121.798 120.435 1.363 1
1 1425 . 15 1 1 A 123 123 LYS H H 122 8.468 7.947 0.521 1
1 1426 . 15 1 1 A 123 123 LYS HA H 122 3.077 3.543 -0.466 1
1 1435 . 15 1 1 A 123 123 LYS C C 122 178.453 178.866 -0.413 1
1 1436 . 15 1 1 A 123 123 LYS CA C 122 59.855 59.826 0.029 1
1 1437 . 15 1 1 A 123 123 LYS CB C 122 32.374 32.349 0.025 1
1 1441 . 15 1 1 A 123 123 LYS N N 122 120.614 118.321 2.293 1
1 1442 . 15 1 1 A 124 124 GLU H H 123 8.100 7.802 0.298 1
1 1443 . 15 1 1 A 124 124 GLU HA H 123 3.652 4.033 -0.381 1
1 1448 . 15 1 1 A 124 124 GLU C C 123 177.743 178.555 -0.812 1
1 1449 . 15 1 1 A 124 124 GLU CA C 123 59.406 59.392 0.014 1
1 1450 . 15 1 1 A 124 124 GLU CB C 123 28.811 29.401 -0.590 1
1 1452 . 15 1 1 A 124 124 GLU N N 123 117.404 118.738 -1.334 1
1 1453 . 15 1 1 A 125 125 MET H H 124 7.537 7.463 0.074 1
1 1454 . 15 1 1 A 125 125 MET HA H 124 3.860 3.919 -0.059 1
1 1462 . 15 1 1 A 125 125 MET C C 124 179.522 178.332 1.190 1
1 1463 . 15 1 1 A 125 125 MET CA C 124 58.832 58.445 0.387 1
1 1464 . 15 1 1 A 125 125 MET CB C 124 31.765 31.457 0.308 1
1 1467 . 15 1 1 A 125 125 MET N N 124 119.413 118.920 0.493 1
1 1468 . 15 1 1 A 126 126 PHE H H 125 7.148 7.501 -0.353 1
1 1469 . 15 1 1 A 126 126 PHE HA H 125 3.633 4.217 -0.584 1
1 1476 . 15 1 1 A 126 126 PHE C C 125 178.994 178.268 0.726 1
1 1477 . 15 1 1 A 126 126 PHE CA C 125 63.148 61.076 2.072 1
1 1478 . 15 1 1 A 126 126 PHE CB C 125 39.830 38.374 1.456 1
1 1483 . 15 1 1 A 126 126 PHE N N 125 120.013 118.437 1.576 1
1 1484 . 15 1 1 A 127 127 LEU H H 126 8.369 8.505 -0.136 1
1 1485 . 15 1 1 A 127 127 LEU HA H 126 3.972 4.006 -0.034 1
1 1495 . 15 1 1 A 127 127 LEU C C 126 180.621 179.445 1.176 1
1 1496 . 15 1 1 A 127 127 LEU CA C 126 57.944 57.830 0.114 1
1 1497 . 15 1 1 A 127 127 LEU CB C 126 40.543 40.856 -0.313 1
1 1501 . 15 1 1 A 127 127 LEU N N 126 119.692 119.617 0.075 1
1 1502 . 15 1 1 A 128 128 ASP H H 127 8.578 7.985 0.593 1
1 1503 . 15 1 1 A 128 128 ASP HA H 127 4.308 4.367 -0.059 1
1 1506 . 15 1 1 A 128 128 ASP C C 127 178.254 178.002 0.252 1
1 1507 . 15 1 1 A 128 128 ASP CA C 127 56.964 57.280 -0.316 1
1 1508 . 15 1 1 A 128 128 ASP CB C 127 39.735 41.022 -1.287 1
1 1509 . 15 1 1 A 128 128 ASP N N 127 121.926 120.042 1.884 1
1 1510 . 15 1 1 A 129 129 TYR H H 128 7.710 8.112 -0.402 1
1 1511 . 15 1 1 A 129 129 TYR HA H 128 3.908 4.035 -0.127 1
1 1518 . 15 1 1 A 129 129 TYR C C 128 177.633 177.659 -0.026 1
1 1519 . 15 1 1 A 129 129 TYR CA C 128 61.796 61.319 0.477 1
1 1520 . 15 1 1 A 129 129 TYR CB C 128 39.372 38.772 0.600 1
1 1525 . 15 1 1 A 129 129 TYR N N 128 122.548 120.412 2.136 1
1 1526 . 15 1 1 A 130 130 ARG H H 129 8.622 8.571 0.051 1
1 1527 . 15 1 1 A 130 130 ARG HA H 129 3.722 4.035 -0.313 1
1 1535 . 15 1 1 A 130 130 ARG CA C 129 60.084 59.523 0.561 1
1 1536 . 15 1 1 A 130 130 ARG CB C 129 29.902 29.941 -0.039 1
1 1539 . 15 1 1 A 130 130 ARG N N 129 118.302 119.297 -0.995 1
1 1541 . 15 1 1 A 131 131 ALA H H 130 7.936 8.062 -0.126 1
1 1542 . 15 1 1 A 131 131 ALA HA H 130 3.997 4.060 -0.063 1
1 1546 . 15 1 1 A 131 131 ALA C C 130 180.456 179.930 0.526 1
1 1547 . 15 1 1 A 131 131 ALA CA C 130 55.133 54.976 0.157 1
1 1548 . 15 1 1 A 131 131 ALA CB C 130 17.750 18.536 -0.786 1
1 1549 . 15 1 1 A 131 131 ALA N N 130 119.788 122.010 -2.222 1
1 1550 . 15 1 1 A 132 132 GLU H H 131 7.622 7.742 -0.120 1
1 1551 . 15 1 1 A 132 132 GLU HA H 131 3.862 3.957 -0.095 1
1 1556 . 15 1 1 A 132 132 GLU C C 131 179.528 179.355 0.173 1
1 1557 . 15 1 1 A 132 132 GLU CA C 131 58.849 59.389 -0.540 1
1 1558 . 15 1 1 A 132 132 GLU CB C 131 28.930 29.089 -0.159 1
1 1560 . 15 1 1 A 132 132 GLU N N 131 118.428 118.131 0.297 1
1 1561 . 15 1 1 A 133 133 LYS H H 132 7.853 7.758 0.095 1
1 1562 . 15 1 1 A 133 133 LYS HA H 132 3.722 4.003 -0.281 1
1 1571 . 15 1 1 A 133 133 LYS C C 132 175.725 178.354 -2.629 1
1 1572 . 15 1 1 A 133 133 LYS CA C 132 57.544 58.953 -1.409 1
1 1573 . 15 1 1 A 133 133 LYS CB C 132 31.770 31.812 -0.042 1
1 1577 . 15 1 1 A 133 133 LYS N N 132 119.473 119.359 0.114 1
1 1578 . 15 1 1 A 134 134 GLU H H 133 8.151 8.052 0.099 1
1 1579 . 15 1 1 A 134 134 GLU HA H 133 4.161 4.189 -0.028 1
1 1584 . 15 1 1 A 134 134 GLU C C 133 177.453 179.316 -1.863 1
1 1585 . 15 1 1 A 134 134 GLU CA C 133 57.222 58.353 -1.131 1
1 1586 . 15 1 1 A 134 134 GLU CB C 133 30.091 29.317 0.774 1
1 1588 . 15 1 1 A 134 134 GLU N N 133 116.525 118.948 -2.423 1
1 1589 . 15 1 1 A 135 135 GLY H H 134 7.702 8.066 -0.364 1
1 1590 . 15 1 1 A 135 135 GLY HA2 H 134 3.896 3.730 0.166 1
1 1591 . 15 1 1 A 135 135 GLY HA3 H 134 3.897 3.739 0.158 1
1 1592 . 15 1 1 A 135 135 GLY C C 134 174.538 174.538 0.000 1
1 1593 . 15 1 1 A 135 135 GLY CA C 134 45.975 46.900 -0.925 1
1 1594 . 15 1 1 A 135 135 GLY N N 134 107.924 108.803 -0.879 1
1 1595 . 15 1 1 A 136 136 ARG H H 135 8.045 7.878 0.167 1
1 1596 . 15 1 1 A 136 136 ARG HA H 135 4.323 4.468 -0.145 1
1 1604 . 15 1 1 A 136 136 ARG C C 135 175.864 175.837 0.027 1
1 1605 . 15 1 1 A 136 136 ARG CA C 135 56.016 55.583 0.433 1
1 1606 . 15 1 1 A 136 136 ARG CB C 135 30.987 32.550 -1.563 1
1 1609 . 15 1 1 A 136 136 ARG N N 135 119.708 117.987 1.721 1
1 1 . 16 1 1 A 14 14 PHE CA C 13 58.199 57.616 0.583 1
1 2 . 16 1 1 A 14 14 PHE CB C 13 39.717 39.413 0.304 1
1 3 . 16 1 1 A 15 15 SER H H 14 8.299 8.412 -0.113 1
1 4 . 16 1 1 A 15 15 SER HA H 14 4.359 4.743 -0.384 1
1 7 . 16 1 1 A 15 15 SER CA C 14 58.249 56.241 2.008 1
1 8 . 16 1 1 A 15 15 SER CB C 14 63.936 65.619 -1.683 1
1 9 . 16 1 1 A 15 15 SER N N 14 117.379 117.658 -0.279 1
1 10 . 16 1 1 A 16 16 SER H H 15 8.255 9.096 -0.841 1
1 11 . 16 1 1 A 16 16 SER HA H 15 3.729 4.346 -0.617 1
1 14 . 16 1 1 A 16 16 SER CA C 15 58.224 61.072 -2.848 1
1 15 . 16 1 1 A 16 16 SER CB C 15 63.886 63.341 0.545 1
1 16 . 16 1 1 A 16 16 SER N N 15 117.694 118.841 -1.147 1
1 17 . 16 1 1 A 17 17 ALA H H 16 8.333 8.289 0.044 1
1 18 . 16 1 1 A 17 17 ALA HA H 16 4.252 3.956 0.296 1
1 22 . 16 1 1 A 17 17 ALA CA C 16 53.377 55.185 -1.808 1
1 23 . 16 1 1 A 17 17 ALA CB C 16 18.896 18.558 0.338 1
1 24 . 16 1 1 A 17 17 ALA N N 16 125.462 125.583 -0.121 1
1 25 . 16 1 1 A 18 18 SER H H 17 8.219 7.808 0.411 1
1 26 . 16 1 1 A 18 18 SER HA H 17 4.332 4.465 -0.133 1
1 29 . 16 1 1 A 18 18 SER CA C 17 59.105 59.095 0.010 1
1 30 . 16 1 1 A 18 18 SER CB C 17 63.592 63.894 -0.302 1
1 31 . 16 1 1 A 18 18 SER N N 17 114.821 111.156 3.665 1
1 32 . 16 1 1 A 19 19 ASP H H 18 8.309 7.776 0.533 1
1 33 . 16 1 1 A 19 19 ASP HA H 18 4.554 4.772 -0.218 1
1 36 . 16 1 1 A 19 19 ASP C C 18 176.528 176.798 -0.270 1
1 37 . 16 1 1 A 19 19 ASP CA C 18 55.272 53.273 1.999 1
1 38 . 16 1 1 A 19 19 ASP CB C 18 40.883 43.105 -2.222 1
1 39 . 16 1 1 A 19 19 ASP N N 18 123.367 122.988 0.379 1
1 40 . 16 1 1 A 20 20 ALA H H 19 8.133 8.852 -0.719 1
1 41 . 16 1 1 A 20 20 ALA HA H 19 4.170 4.038 0.132 1
1 45 . 16 1 1 A 20 20 ALA C C 19 179.857 179.528 0.329 1
1 46 . 16 1 1 A 20 20 ALA CA C 19 54.341 55.118 -0.777 1
1 47 . 16 1 1 A 20 20 ALA CB C 19 18.660 18.357 0.303 1
1 48 . 16 1 1 A 20 20 ALA N N 19 123.350 126.897 -3.547 1
1 49 . 16 1 1 A 21 21 GLU H H 20 8.140 8.222 -0.082 1
1 50 . 16 1 1 A 21 21 GLU HA H 20 4.128 4.077 0.051 1
1 55 . 16 1 1 A 21 21 GLU C C 20 177.675 178.429 -0.754 1
1 56 . 16 1 1 A 21 21 GLU CA C 20 58.520 59.590 -1.070 1
1 57 . 16 1 1 A 21 21 GLU CB C 20 29.765 29.423 0.342 1
1 59 . 16 1 1 A 21 21 GLU N N 20 119.063 119.403 -0.340 1
1 60 . 16 1 1 A 22 22 PHE H H 21 8.009 7.906 0.103 1
1 61 . 16 1 1 A 22 22 PHE HA H 21 4.123 4.278 -0.155 1
1 68 . 16 1 1 A 22 22 PHE C C 21 176.410 177.511 -1.101 1
1 69 . 16 1 1 A 22 22 PHE CA C 21 62.202 60.970 1.232 1
1 70 . 16 1 1 A 22 22 PHE CB C 21 39.223 39.082 0.141 1
1 75 . 16 1 1 A 22 22 PHE N N 21 121.211 120.925 0.286 1
1 76 . 16 1 1 A 23 23 ASP H H 22 8.261 8.527 -0.266 1
1 77 . 16 1 1 A 23 23 ASP HA H 22 4.041 4.406 -0.365 1
1 80 . 16 1 1 A 23 23 ASP C C 22 179.078 178.133 0.945 1
1 81 . 16 1 1 A 23 23 ASP CA C 22 57.048 57.886 -0.838 1
1 82 . 16 1 1 A 23 23 ASP CB C 22 40.154 42.255 -2.101 1
1 83 . 16 1 1 A 23 23 ASP N N 22 116.876 119.355 -2.479 1
1 84 . 16 1 1 A 24 24 ALA H H 23 7.651 7.597 0.054 1
1 85 . 16 1 1 A 24 24 ALA HA H 23 3.785 3.824 -0.039 1
1 89 . 16 1 1 A 24 24 ALA C C 23 179.577 179.245 0.332 1
1 90 . 16 1 1 A 24 24 ALA CA C 23 54.341 54.877 -0.536 1
1 91 . 16 1 1 A 24 24 ALA CB C 23 17.762 18.293 -0.531 1
1 92 . 16 1 1 A 24 24 ALA N N 23 121.873 121.269 0.604 1
1 93 . 16 1 1 A 25 25 VAL H H 24 7.718 7.695 0.023 1
1 94 . 16 1 1 A 25 25 VAL HA H 24 3.216 3.557 -0.341 1
1 102 . 16 1 1 A 25 25 VAL C C 24 177.805 178.106 -0.301 1
1 103 . 16 1 1 A 25 25 VAL CA C 24 66.789 66.860 -0.071 1
1 104 . 16 1 1 A 25 25 VAL CB C 24 31.277 31.228 0.049 1
1 107 . 16 1 1 A 25 25 VAL N N 24 117.890 118.424 -0.534 1
1 108 . 16 1 1 A 26 26 VAL H H 25 7.867 7.682 0.185 1
1 109 . 16 1 1 A 26 26 VAL HA H 25 3.274 3.475 -0.201 1
1 117 . 16 1 1 A 26 26 VAL C C 25 177.788 177.650 0.138 1
1 118 . 16 1 1 A 26 26 VAL CA C 25 67.282 66.394 0.888 1
1 119 . 16 1 1 A 26 26 VAL CB C 25 31.266 31.393 -0.127 1
1 122 . 16 1 1 A 26 26 VAL N N 25 118.170 119.506 -1.336 1
1 123 . 16 1 1 A 27 27 GLY H H 26 7.544 7.588 -0.044 1
1 124 . 16 1 1 A 27 27 GLY HA2 H 26 3.592 3.520 0.072 1
1 125 . 16 1 1 A 27 27 GLY HA3 H 26 3.721 3.636 0.085 1
1 126 . 16 1 1 A 27 27 GLY C C 26 176.717 176.326 0.391 1
1 127 . 16 1 1 A 27 27 GLY CA C 26 47.085 47.181 -0.096 1
1 128 . 16 1 1 A 27 27 GLY N N 26 105.795 107.498 -1.703 1
1 129 . 16 1 1 A 28 28 TYR H H 27 7.625 7.432 0.193 1
1 130 . 16 1 1 A 28 28 TYR HA H 27 4.546 4.639 -0.093 1
1 137 . 16 1 1 A 28 28 TYR C C 27 178.991 178.107 0.884 1
1 138 . 16 1 1 A 28 28 TYR CA C 27 58.845 59.752 -0.907 1
1 139 . 16 1 1 A 28 28 TYR CB C 27 37.602 37.545 0.057 1
1 144 . 16 1 1 A 28 28 TYR N N 27 119.933 121.650 -1.717 1
1 145 . 16 1 1 A 29 29 LEU H H 28 8.517 8.307 0.210 1
1 146 . 16 1 1 A 29 29 LEU HA H 28 3.728 3.850 -0.122 1
1 156 . 16 1 1 A 29 29 LEU CA C 28 58.281 58.146 0.135 1
1 157 . 16 1 1 A 29 29 LEU CB C 28 41.948 41.524 0.424 1
1 161 . 16 1 1 A 29 29 LEU N N 28 119.669 120.270 -0.601 1
1 162 . 16 1 1 A 30 30 GLU H H 29 8.072 8.000 0.072 1
1 163 . 16 1 1 A 30 30 GLU HA H 29 3.722 3.902 -0.180 1
1 168 . 16 1 1 A 30 30 GLU C C 29 177.731 179.402 -1.671 1
1 169 . 16 1 1 A 30 30 GLU CA C 29 59.763 59.940 -0.177 1
1 170 . 16 1 1 A 30 30 GLU CB C 29 28.844 29.328 -0.484 1
1 172 . 16 1 1 A 30 30 GLU N N 29 117.666 117.714 -0.048 1
1 173 . 16 1 1 A 31 31 ASP H H 30 7.243 7.790 -0.547 1
1 174 . 16 1 1 A 31 31 ASP HA H 30 4.297 4.418 -0.121 1
1 177 . 16 1 1 A 31 31 ASP CA C 30 56.953 57.291 -0.338 1
1 178 . 16 1 1 A 31 31 ASP CB C 30 40.730 40.712 0.018 1
1 179 . 16 1 1 A 31 31 ASP N N 30 116.720 119.301 -2.581 1
1 180 . 16 1 1 A 32 32 ILE H H 31 7.940 7.564 0.376 1
1 181 . 16 1 1 A 32 32 ILE HA H 31 3.640 3.655 -0.015 1
1 191 . 16 1 1 A 32 32 ILE C C 31 177.980 177.917 0.063 1
1 192 . 16 1 1 A 32 32 ILE CA C 31 64.692 64.470 0.222 1
1 193 . 16 1 1 A 32 32 ILE CB C 31 38.938 37.424 1.514 1
1 197 . 16 1 1 A 32 32 ILE N N 31 119.728 120.044 -0.316 1
1 198 . 16 1 1 A 33 33 ILE H H 32 7.984 7.871 0.113 1
1 199 . 16 1 1 A 33 33 ILE HA H 32 3.598 3.321 0.277 1
1 209 . 16 1 1 A 33 33 ILE C C 32 176.723 176.968 -0.245 1
1 210 . 16 1 1 A 33 33 ILE CA C 32 63.241 64.487 -1.246 1
1 211 . 16 1 1 A 33 33 ILE CB C 32 37.580 37.692 -0.112 1
1 215 . 16 1 1 A 33 33 ILE N N 32 113.919 120.443 -6.524 1
1 216 . 16 1 1 A 34 34 MET H H 33 7.288 7.683 -0.395 1
1 217 . 16 1 1 A 34 34 MET HA H 33 4.496 4.700 -0.204 1
1 225 . 16 1 1 A 34 34 MET C C 33 176.423 175.778 0.645 1
1 226 . 16 1 1 A 34 34 MET CA C 33 54.634 54.276 0.358 1
1 227 . 16 1 1 A 34 34 MET CB C 33 31.934 31.881 0.053 1
1 230 . 16 1 1 A 34 34 MET N N 33 115.130 116.789 -1.659 1
1 231 . 16 1 1 A 35 35 ASP H H 34 7.405 7.641 -0.236 1
1 232 . 16 1 1 A 35 35 ASP HA H 34 4.484 4.515 -0.031 1
1 235 . 16 1 1 A 35 35 ASP C C 34 177.139 176.969 0.170 1
1 236 . 16 1 1 A 35 35 ASP CA C 34 54.625 54.844 -0.219 1
1 237 . 16 1 1 A 35 35 ASP CB C 34 43.554 42.520 1.034 1
1 238 . 16 1 1 A 35 35 ASP N N 34 121.814 121.883 -0.069 1
1 239 . 16 1 1 A 36 36 ASP H H 35 8.765 8.789 -0.024 1
1 240 . 16 1 1 A 36 36 ASP HA H 35 4.235 4.298 -0.063 1
1 243 . 16 1 1 A 36 36 ASP C C 35 178.320 178.452 -0.132 1
1 244 . 16 1 1 A 36 36 ASP CA C 35 57.832 58.014 -0.182 1
1 245 . 16 1 1 A 36 36 ASP CB C 35 40.914 40.455 0.459 1
1 246 . 16 1 1 A 36 36 ASP N N 35 125.883 125.313 0.570 1
1 247 . 16 1 1 A 37 37 GLU H H 36 8.905 8.320 0.585 1
1 248 . 16 1 1 A 37 37 GLU HA H 36 3.933 4.075 -0.142 1
1 253 . 16 1 1 A 37 37 GLU C C 36 179.304 178.981 0.323 1
1 254 . 16 1 1 A 37 37 GLU CA C 36 59.828 59.198 0.630 1
1 255 . 16 1 1 A 37 37 GLU CB C 36 29.380 29.317 0.063 1
1 257 . 16 1 1 A 37 37 GLU N N 36 119.077 120.546 -1.469 1
1 258 . 16 1 1 A 38 38 PHE H H 37 7.460 8.360 -0.900 1
1 259 . 16 1 1 A 38 38 PHE HA H 37 3.642 4.007 -0.365 1
1 267 . 16 1 1 A 38 38 PHE C C 37 176.483 178.149 -1.666 1
1 268 . 16 1 1 A 38 38 PHE CA C 37 61.411 61.237 0.174 1
1 269 . 16 1 1 A 38 38 PHE CB C 37 39.355 39.017 0.338 1
1 275 . 16 1 1 A 38 38 PHE N N 37 119.968 120.729 -0.761 1
1 276 . 16 1 1 A 39 39 GLN H H 38 7.968 8.015 -0.047 1
1 277 . 16 1 1 A 39 39 GLN HA H 38 3.712 3.794 -0.082 1
1 284 . 16 1 1 A 39 39 GLN CA C 38 59.153 58.938 0.215 1
1 285 . 16 1 1 A 39 39 GLN CB C 38 28.213 28.544 -0.331 1
1 287 . 16 1 1 A 39 39 GLN N N 38 116.433 118.621 -2.188 1
1 289 . 16 1 1 A 40 40 LEU H H 39 7.930 7.864 0.066 1
1 290 . 16 1 1 A 40 40 LEU HA H 39 3.916 4.030 -0.114 1
1 300 . 16 1 1 A 40 40 LEU C C 39 177.731 178.191 -0.460 1
1 301 . 16 1 1 A 40 40 LEU CA C 39 57.915 58.029 -0.114 1
1 302 . 16 1 1 A 40 40 LEU CB C 39 41.989 41.467 0.522 1
1 306 . 16 1 1 A 40 40 LEU N N 39 119.505 121.846 -2.341 1
1 307 . 16 1 1 A 41 41 LEU H H 40 7.174 7.992 -0.818 1
1 308 . 16 1 1 A 41 41 LEU HA H 40 3.835 4.031 -0.196 1
1 318 . 16 1 1 A 41 41 LEU C C 40 179.738 178.161 1.577 1
1 319 . 16 1 1 A 41 41 LEU CA C 40 58.266 58.136 0.130 1
1 320 . 16 1 1 A 41 41 LEU CB C 40 42.050 41.359 0.691 1
1 324 . 16 1 1 A 41 41 LEU N N 40 120.971 119.918 1.053 1
1 325 . 16 1 1 A 42 42 GLN H H 41 8.058 7.944 0.114 1
1 326 . 16 1 1 A 42 42 GLN HA H 41 3.556 3.724 -0.168 1
1 333 . 16 1 1 A 42 42 GLN C C 41 177.642 178.659 -1.017 1
1 334 . 16 1 1 A 42 42 GLN CA C 41 59.826 59.210 0.616 1
1 335 . 16 1 1 A 42 42 GLN CB C 41 28.762 27.899 0.863 1
1 337 . 16 1 1 A 42 42 GLN N N 41 117.899 118.069 -0.170 1
1 339 . 16 1 1 A 43 43 ARG H H 42 8.179 7.795 0.384 1
1 340 . 16 1 1 A 43 43 ARG HA H 42 3.655 4.030 -0.375 1
1 347 . 16 1 1 A 43 43 ARG C C 42 178.051 178.819 -0.768 1
1 348 . 16 1 1 A 43 43 ARG CA C 42 59.766 58.917 0.849 1
1 349 . 16 1 1 A 43 43 ARG CB C 42 29.941 29.582 0.359 1
1 352 . 16 1 1 A 43 43 ARG N N 42 119.392 118.931 0.461 1
1 353 . 16 1 1 A 44 44 ASN H H 43 8.525 7.864 0.661 1
1 354 . 16 1 1 A 44 44 ASN HA H 43 4.332 4.378 -0.046 1
1 359 . 16 1 1 A 44 44 ASN C C 43 178.150 177.713 0.437 1
1 360 . 16 1 1 A 44 44 ASN CA C 43 55.841 56.149 -0.308 1
1 361 . 16 1 1 A 44 44 ASN CB C 43 37.632 39.157 -1.525 1
1 362 . 16 1 1 A 44 44 ASN N N 43 116.214 117.570 -1.356 1
1 364 . 16 1 1 A 45 45 PHE H H 44 7.586 7.814 -0.228 1
1 365 . 16 1 1 A 45 45 PHE HA H 44 4.132 4.303 -0.171 1
1 372 . 16 1 1 A 45 45 PHE C C 44 176.691 178.421 -1.730 1
1 373 . 16 1 1 A 45 45 PHE CA C 44 62.333 60.540 1.793 1
1 374 . 16 1 1 A 45 45 PHE CB C 44 39.449 38.796 0.653 1
1 379 . 16 1 1 A 45 45 PHE N N 44 121.501 117.834 3.667 1
1 380 . 16 1 1 A 46 46 MET H H 45 8.190 8.308 -0.118 1
1 381 . 16 1 1 A 46 46 MET HA H 45 4.060 4.275 -0.215 1
1 389 . 16 1 1 A 46 46 MET C C 45 179.754 178.129 1.625 1
1 390 . 16 1 1 A 46 46 MET CA C 45 57.742 57.930 -0.188 1
1 391 . 16 1 1 A 46 46 MET CB C 45 29.912 31.166 -1.254 1
1 394 . 16 1 1 A 46 46 MET N N 45 116.727 117.552 -0.825 1
1 395 . 16 1 1 A 47 47 ASP H H 46 8.579 8.223 0.356 1
1 396 . 16 1 1 A 47 47 ASP HA H 46 4.804 4.596 0.208 1
1 399 . 16 1 1 A 47 47 ASP C C 46 177.854 178.492 -0.638 1
1 400 . 16 1 1 A 47 47 ASP CA C 46 57.277 57.314 -0.037 1
1 401 . 16 1 1 A 47 47 ASP CB C 46 40.776 41.493 -0.717 1
1 402 . 16 1 1 A 47 47 ASP N N 46 117.798 120.672 -2.874 1
1 403 . 16 1 1 A 48 48 LYS H H 47 7.339 7.809 -0.470 1
1 404 . 16 1 1 A 48 48 LYS HA H 47 3.828 4.194 -0.366 1
1 413 . 16 1 1 A 48 48 LYS C C 47 178.812 178.660 0.152 1
1 414 . 16 1 1 A 48 48 LYS CA C 47 58.953 58.439 0.514 1
1 415 . 16 1 1 A 48 48 LYS CB C 47 32.796 32.824 -0.028 1
1 419 . 16 1 1 A 48 48 LYS N N 47 117.852 119.715 -1.863 1
1 420 . 16 1 1 A 49 49 TYR H H 48 6.841 8.724 -1.883 1
1 421 . 16 1 1 A 49 49 TYR HA H 48 4.995 4.230 0.765 1
1 428 . 16 1 1 A 49 49 TYR C C 48 178.138 178.475 -0.337 1
1 429 . 16 1 1 A 49 49 TYR CA C 48 58.620 59.738 -1.118 1
1 430 . 16 1 1 A 49 49 TYR CB C 48 42.939 38.113 4.826 1
1 435 . 16 1 1 A 49 49 TYR N N 48 112.109 119.865 -7.756 1
1 436 . 16 1 1 A 50 50 TYR H H 49 8.491 8.022 0.469 1
1 437 . 16 1 1 A 50 50 TYR HA H 49 4.598 4.175 0.423 1
1 444 . 16 1 1 A 50 50 TYR C C 49 176.015 177.727 -1.712 1
1 445 . 16 1 1 A 50 50 TYR CA C 49 62.442 59.559 2.883 1
1 446 . 16 1 1 A 50 50 TYR CB C 49 36.588 37.085 -0.497 1
1 451 . 16 1 1 A 50 50 TYR N N 49 118.294 119.257 -0.963 1
1 452 . 16 1 1 A 51 51 LEU H H 50 7.512 7.559 -0.047 1
1 453 . 16 1 1 A 51 51 LEU HA H 50 3.878 3.516 0.362 1
1 463 . 16 1 1 A 51 51 LEU C C 50 178.625 178.630 -0.005 1
1 464 . 16 1 1 A 51 51 LEU CA C 50 55.994 57.130 -1.136 1
1 465 . 16 1 1 A 51 51 LEU CB C 50 40.743 41.453 -0.710 1
1 469 . 16 1 1 A 51 51 LEU N N 50 118.478 121.558 -3.080 1
1 470 . 16 1 1 A 52 52 GLU H H 51 8.042 7.819 0.223 1
1 471 . 16 1 1 A 52 52 GLU HA H 51 4.197 3.897 0.300 1
1 476 . 16 1 1 A 52 52 GLU C C 51 177.629 177.633 -0.004 1
1 477 . 16 1 1 A 52 52 GLU CA C 51 56.141 59.461 -3.320 1
1 478 . 16 1 1 A 52 52 GLU CB C 51 29.162 29.093 0.069 1
1 480 . 16 1 1 A 52 52 GLU N N 51 115.067 118.116 -3.049 1
1 481 . 16 1 1 A 53 53 PHE H H 52 7.465 7.824 -0.359 1
1 482 . 16 1 1 A 53 53 PHE HA H 52 4.431 4.468 -0.037 1
1 490 . 16 1 1 A 53 53 PHE C C 52 174.325 175.056 -0.731 1
1 491 . 16 1 1 A 53 53 PHE CA C 52 58.986 57.498 1.488 1
1 492 . 16 1 1 A 53 53 PHE CB C 52 40.183 37.805 2.378 1
1 498 . 16 1 1 A 53 53 PHE N N 52 116.768 119.053 -2.285 1
1 499 . 16 1 1 A 54 54 GLU H H 53 7.484 8.542 -1.058 1
1 500 . 16 1 1 A 54 54 GLU HA H 53 4.583 4.771 -0.188 1
1 505 . 16 1 1 A 54 54 GLU C C 53 175.722 175.815 -0.093 1
1 506 . 16 1 1 A 54 54 GLU CA C 53 54.248 55.480 -1.232 1
1 507 . 16 1 1 A 54 54 GLU CB C 53 34.409 31.128 3.281 1
1 509 . 16 1 1 A 54 54 GLU N N 53 118.844 125.340 -6.496 1
1 510 . 16 1 1 A 55 55 ASP H H 54 9.008 8.773 0.235 1
1 511 . 16 1 1 A 55 55 ASP HA H 54 4.735 4.915 -0.180 1
1 514 . 16 1 1 A 55 55 ASP C C 54 175.421 175.386 0.035 1
1 515 . 16 1 1 A 55 55 ASP CA C 54 52.888 53.473 -0.585 1
1 516 . 16 1 1 A 55 55 ASP CB C 54 38.894 40.814 -1.920 1
1 517 . 16 1 1 A 55 55 ASP N N 54 123.654 127.312 -3.658 1
1 518 . 16 1 1 A 56 56 THR H H 55 7.819 7.991 -0.172 1
1 519 . 16 1 1 A 56 56 THR HA H 55 4.574 4.854 -0.280 1
1 524 . 16 1 1 A 56 56 THR C C 55 174.096 173.896 0.200 1
1 525 . 16 1 1 A 56 56 THR CA C 55 59.172 60.698 -1.526 1
1 526 . 16 1 1 A 56 56 THR CB C 55 71.889 71.871 0.018 1
1 528 . 16 1 1 A 56 56 THR N N 55 112.015 117.379 -5.364 1
1 529 . 16 1 1 A 57 57 GLU H H 56 8.527 8.549 -0.022 1
1 530 . 16 1 1 A 57 57 GLU HA H 56 4.217 4.520 -0.303 1
1 535 . 16 1 1 A 57 57 GLU C C 56 177.042 175.877 1.165 1
1 536 . 16 1 1 A 57 57 GLU CA C 56 56.869 56.546 0.323 1
1 537 . 16 1 1 A 57 57 GLU CB C 56 29.731 31.291 -1.560 1
1 539 . 16 1 1 A 57 57 GLU N N 56 117.531 119.025 -1.494 1
1 540 . 16 1 1 A 58 58 GLU H H 57 7.587 7.751 -0.164 1
1 541 . 16 1 1 A 58 58 GLU HA H 57 3.941 4.548 -0.607 1
1 546 . 16 1 1 A 58 58 GLU C C 57 176.849 175.834 1.015 1
1 547 . 16 1 1 A 58 58 GLU CA C 57 56.924 56.183 0.741 1
1 548 . 16 1 1 A 58 58 GLU CB C 57 30.251 30.623 -0.372 1
1 550 . 16 1 1 A 58 58 GLU N N 57 119.183 121.206 -2.023 1
1 551 . 16 1 1 A 59 59 ASN H H 58 9.120 8.703 0.417 1
1 552 . 16 1 1 A 59 59 ASN HA H 58 4.922 4.891 0.031 1
1 557 . 16 1 1 A 59 59 ASN C C 58 174.254 174.774 -0.520 1
1 558 . 16 1 1 A 59 59 ASN CA C 58 51.956 53.000 -1.044 1
1 559 . 16 1 1 A 59 59 ASN CB C 58 37.404 39.356 -1.952 1
1 560 . 16 1 1 A 59 59 ASN N N 58 126.767 124.633 2.134 1
1 562 . 16 1 1 A 60 60 LYS H H 59 5.892 9.090 -3.198 1
1 563 . 16 1 1 A 60 60 LYS HA H 59 3.798 4.548 -0.750 1
1 572 . 16 1 1 A 60 60 LYS C C 59 177.908 177.864 0.044 1
1 573 . 16 1 1 A 60 60 LYS CA C 59 56.623 55.247 1.376 1
1 574 . 16 1 1 A 60 60 LYS CB C 59 32.279 33.703 -1.424 1
1 578 . 16 1 1 A 60 60 LYS N N 59 121.527 124.056 -2.529 1
1 579 . 16 1 1 A 61 61 LEU H H 60 8.473 8.830 -0.357 1
1 580 . 16 1 1 A 61 61 LEU HA H 60 3.891 4.236 -0.345 1
1 590 . 16 1 1 A 61 61 LEU C C 60 179.843 178.663 1.180 1
1 591 . 16 1 1 A 61 61 LEU CA C 60 58.301 56.432 1.869 1
1 592 . 16 1 1 A 61 61 LEU CB C 60 41.305 41.592 -0.287 1
1 596 . 16 1 1 A 61 61 LEU N N 60 125.639 122.994 2.645 1
1 597 . 16 1 1 A 62 62 ILE H H 61 7.698 7.970 -0.272 1
1 598 . 16 1 1 A 62 62 ILE HA H 61 3.952 3.875 0.077 1
1 608 . 16 1 1 A 62 62 ILE C C 61 175.392 177.297 -1.905 1
1 609 . 16 1 1 A 62 62 ILE CA C 61 61.743 63.274 -1.531 1
1 610 . 16 1 1 A 62 62 ILE CB C 61 39.108 37.775 1.333 1
1 614 . 16 1 1 A 62 62 ILE N N 61 114.111 119.832 -5.721 1
1 615 . 16 1 1 A 63 63 TYR H H 62 7.273 7.939 -0.666 1
1 616 . 16 1 1 A 63 63 TYR HA H 62 4.343 4.152 0.191 1
1 623 . 16 1 1 A 63 63 TYR C C 62 178.264 178.533 -0.269 1
1 624 . 16 1 1 A 63 63 TYR CA C 62 57.231 60.870 -3.639 1
1 625 . 16 1 1 A 63 63 TYR CB C 62 36.332 37.331 -0.999 1
1 630 . 16 1 1 A 63 63 TYR N N 62 117.689 121.298 -3.609 1
1 631 . 16 1 1 A 64 64 THR H H 63 7.747 7.885 -0.138 1
1 632 . 16 1 1 A 64 64 THR HA H 63 4.266 4.214 0.052 1
1 637 . 16 1 1 A 64 64 THR CA C 63 69.362 67.544 1.818 1
1 638 . 16 1 1 A 64 64 THR CB C 63 66.962 67.570 -0.608 1
1 640 . 16 1 1 A 64 64 THR N N 63 113.755 116.020 -2.265 1
1 641 . 16 1 1 A 65 65 PRO HA H 64 4.372 4.367 0.005 1
1 648 . 16 1 1 A 65 65 PRO C C 64 179.913 179.288 0.625 1
1 649 . 16 1 1 A 65 65 PRO CA C 64 66.011 66.110 -0.099 1
1 650 . 16 1 1 A 65 65 PRO CB C 64 30.642 30.666 -0.024 1
1 653 . 16 1 1 A 66 66 ILE H H 65 7.377 7.292 0.085 1
1 654 . 16 1 1 A 66 66 ILE HA H 65 3.530 3.833 -0.303 1
1 664 . 16 1 1 A 66 66 ILE C C 65 177.543 178.056 -0.513 1
1 665 . 16 1 1 A 66 66 ILE CA C 65 66.647 64.277 2.370 1
1 666 . 16 1 1 A 66 66 ILE CB C 65 38.029 37.646 0.383 1
1 670 . 16 1 1 A 66 66 ILE N N 65 118.353 116.599 1.754 1
1 671 . 16 1 1 A 67 67 PHE H H 66 8.480 8.441 0.039 1
1 672 . 16 1 1 A 67 67 PHE HA H 66 4.115 4.379 -0.264 1
1 680 . 16 1 1 A 67 67 PHE C C 66 177.293 178.384 -1.091 1
1 681 . 16 1 1 A 67 67 PHE CA C 66 59.570 61.582 -2.012 1
1 682 . 16 1 1 A 67 67 PHE CB C 66 38.865 39.363 -0.498 1
1 688 . 16 1 1 A 67 67 PHE N N 66 122.420 120.341 2.079 1
1 689 . 16 1 1 A 68 68 ASN H H 67 8.595 8.117 0.478 1
1 690 . 16 1 1 A 68 68 ASN HA H 67 4.211 4.351 -0.140 1
1 695 . 16 1 1 A 68 68 ASN C C 67 178.697 177.960 0.737 1
1 696 . 16 1 1 A 68 68 ASN CA C 67 56.056 56.352 -0.296 1
1 697 . 16 1 1 A 68 68 ASN CB C 67 37.704 37.923 -0.219 1
1 698 . 16 1 1 A 68 68 ASN N N 67 115.573 117.004 -1.431 1
1 700 . 16 1 1 A 69 69 GLU H H 68 8.414 7.966 0.448 1
1 701 . 16 1 1 A 69 69 GLU HA H 68 4.102 4.147 -0.045 1
1 706 . 16 1 1 A 69 69 GLU C C 68 177.880 178.804 -0.924 1
1 707 . 16 1 1 A 69 69 GLU CA C 68 59.399 59.243 0.156 1
1 708 . 16 1 1 A 69 69 GLU CB C 68 29.855 29.203 0.652 1
1 710 . 16 1 1 A 69 69 GLU N N 68 123.510 119.980 3.530 1
1 711 . 16 1 1 A 70 70 TYR H H 69 8.659 8.069 0.590 1
1 712 . 16 1 1 A 70 70 TYR HA H 69 3.362 4.102 -0.740 1
1 719 . 16 1 1 A 70 70 TYR C C 69 178.143 176.926 1.217 1
1 720 . 16 1 1 A 70 70 TYR CA C 69 60.686 61.268 -0.582 1
1 721 . 16 1 1 A 70 70 TYR CB C 69 38.560 38.826 -0.266 1
1 726 . 16 1 1 A 70 70 TYR N N 69 122.130 121.024 1.106 1
1 727 . 16 1 1 A 71 71 ILE H H 70 8.031 7.830 0.201 1
1 728 . 16 1 1 A 71 71 ILE HA H 70 3.265 3.706 -0.441 1
1 738 . 16 1 1 A 71 71 ILE C C 70 178.056 178.008 0.048 1
1 739 . 16 1 1 A 71 71 ILE CA C 70 63.756 63.974 -0.218 1
1 740 . 16 1 1 A 71 71 ILE CB C 70 37.321 36.523 0.798 1
1 744 . 16 1 1 A 71 71 ILE N N 70 118.906 120.417 -1.511 1
1 745 . 16 1 1 A 72 72 SER H H 71 7.803 7.614 0.189 1
1 746 . 16 1 1 A 72 72 SER HA H 71 4.029 4.288 -0.259 1
1 749 . 16 1 1 A 72 72 SER CA C 71 61.380 61.124 0.256 1
1 750 . 16 1 1 A 72 72 SER CB C 71 63.288 63.109 0.179 1
1 751 . 16 1 1 A 72 72 SER N N 71 113.735 117.014 -3.279 1
1 752 . 16 1 1 A 73 73 LEU H H 72 7.952 7.943 0.009 1
1 753 . 16 1 1 A 73 73 LEU HA H 72 4.418 4.118 0.300 1
1 763 . 16 1 1 A 73 73 LEU C C 72 177.767 178.311 -0.544 1
1 764 . 16 1 1 A 73 73 LEU CA C 72 56.543 57.422 -0.879 1
1 765 . 16 1 1 A 73 73 LEU CB C 72 44.517 41.669 2.848 1
1 769 . 16 1 1 A 73 73 LEU N N 72 119.411 122.433 -3.022 1
1 770 . 16 1 1 A 74 74 VAL H H 73 8.021 7.664 0.357 1
1 771 . 16 1 1 A 74 74 VAL HA H 73 3.532 3.341 0.191 1
1 779 . 16 1 1 A 74 74 VAL C C 73 177.126 177.957 -0.831 1
1 780 . 16 1 1 A 74 74 VAL CA C 73 66.250 66.423 -0.173 1
1 781 . 16 1 1 A 74 74 VAL CB C 73 31.212 31.147 0.065 1
1 784 . 16 1 1 A 74 74 VAL N N 73 118.747 119.226 -0.479 1
1 785 . 16 1 1 A 75 75 GLU H H 74 7.232 7.948 -0.716 1
1 786 . 16 1 1 A 75 75 GLU HA H 74 3.013 4.163 -1.150 1
1 791 . 16 1 1 A 75 75 GLU C C 74 178.804 179.255 -0.451 1
1 792 . 16 1 1 A 75 75 GLU CA C 74 60.536 60.026 0.510 1
1 793 . 16 1 1 A 75 75 GLU CB C 74 27.009 29.155 -2.146 1
1 795 . 16 1 1 A 75 75 GLU N N 74 118.660 119.784 -1.124 1
1 796 . 16 1 1 A 76 76 LYS H H 75 7.051 7.517 -0.466 1
1 797 . 16 1 1 A 76 76 LYS HA H 75 3.765 4.059 -0.294 1
1 806 . 16 1 1 A 76 76 LYS C C 75 177.765 178.012 -0.247 1
1 807 . 16 1 1 A 76 76 LYS CA C 75 58.357 58.461 -0.104 1
1 808 . 16 1 1 A 76 76 LYS CB C 75 31.939 32.259 -0.320 1
1 812 . 16 1 1 A 76 76 LYS N N 75 116.112 119.196 -3.084 1
1 813 . 16 1 1 A 77 77 TYR H H 76 7.067 7.659 -0.592 1
1 814 . 16 1 1 A 77 77 TYR HA H 76 4.036 4.213 -0.177 1
1 821 . 16 1 1 A 77 77 TYR C C 76 177.752 177.218 0.534 1
1 822 . 16 1 1 A 77 77 TYR CA C 76 61.820 61.285 0.535 1
1 823 . 16 1 1 A 77 77 TYR CB C 76 38.480 38.607 -0.127 1
1 828 . 16 1 1 A 77 77 TYR N N 76 118.434 121.350 -2.916 1
1 829 . 16 1 1 A 78 78 ILE H H 77 7.554 8.303 -0.749 1
1 830 . 16 1 1 A 78 78 ILE HA H 77 3.159 3.699 -0.540 1
1 840 . 16 1 1 A 78 78 ILE C C 77 177.341 178.041 -0.700 1
1 841 . 16 1 1 A 78 78 ILE CA C 77 65.177 65.460 -0.283 1
1 842 . 16 1 1 A 78 78 ILE CB C 77 37.339 37.914 -0.575 1
1 846 . 16 1 1 A 78 78 ILE N N 77 117.672 121.105 -3.433 1
1 847 . 16 1 1 A 79 79 GLU H H 78 8.296 8.003 0.293 1
1 848 . 16 1 1 A 79 79 GLU HA H 78 3.557 3.733 -0.176 1
1 853 . 16 1 1 A 79 79 GLU C C 78 177.742 178.775 -1.033 1
1 854 . 16 1 1 A 79 79 GLU CA C 78 60.847 60.064 0.783 1
1 855 . 16 1 1 A 79 79 GLU CB C 78 29.594 29.197 0.397 1
1 857 . 16 1 1 A 79 79 GLU N N 78 118.701 120.770 -2.069 1
1 858 . 16 1 1 A 80 80 GLU H H 79 8.330 8.383 -0.053 1
1 859 . 16 1 1 A 80 80 GLU HA H 79 3.774 3.971 -0.197 1
1 864 . 16 1 1 A 80 80 GLU C C 79 179.926 179.073 0.853 1
1 865 . 16 1 1 A 80 80 GLU CA C 79 59.581 59.001 0.580 1
1 866 . 16 1 1 A 80 80 GLU CB C 79 29.062 29.288 -0.226 1
1 868 . 16 1 1 A 80 80 GLU N N 79 116.767 117.889 -1.122 1
1 869 . 16 1 1 A 81 81 GLN H H 80 7.634 7.701 -0.067 1
1 870 . 16 1 1 A 81 81 GLN HA H 80 3.605 3.761 -0.156 1
1 877 . 16 1 1 A 81 81 GLN C C 80 179.681 178.597 1.084 1
1 878 . 16 1 1 A 81 81 GLN CA C 80 57.765 58.499 -0.734 1
1 879 . 16 1 1 A 81 81 GLN CB C 80 28.079 27.756 0.323 1
1 881 . 16 1 1 A 81 81 GLN N N 80 116.325 118.680 -2.355 1
1 883 . 16 1 1 A 82 82 LEU H H 81 8.156 7.476 0.680 1
1 884 . 16 1 1 A 82 82 LEU HA H 81 3.536 3.780 -0.244 1
1 894 . 16 1 1 A 82 82 LEU C C 81 178.945 179.443 -0.498 1
1 895 . 16 1 1 A 82 82 LEU CA C 81 57.761 56.784 0.977 1
1 896 . 16 1 1 A 82 82 LEU CB C 81 40.961 40.934 0.027 1
1 900 . 16 1 1 A 82 82 LEU N N 81 121.546 119.693 1.853 1
1 901 . 16 1 1 A 83 83 LEU H H 82 8.326 8.123 0.203 1
1 902 . 16 1 1 A 83 83 LEU HA H 82 4.198 4.230 -0.032 1
1 912 . 16 1 1 A 83 83 LEU C C 82 178.631 179.096 -0.465 1
1 913 . 16 1 1 A 83 83 LEU CA C 82 57.016 57.093 -0.077 1
1 914 . 16 1 1 A 83 83 LEU CB C 82 42.182 40.789 1.393 1
1 918 . 16 1 1 A 83 83 LEU N N 82 120.426 119.285 1.141 1
1 919 . 16 1 1 A 84 84 GLN H H 83 6.992 7.851 -0.859 1
1 920 . 16 1 1 A 84 84 GLN HA H 83 3.877 3.996 -0.119 1
1 927 . 16 1 1 A 84 84 GLN C C 83 177.008 176.502 0.506 1
1 928 . 16 1 1 A 84 84 GLN CA C 83 57.543 58.358 -0.815 1
1 929 . 16 1 1 A 84 84 GLN CB C 83 28.688 28.392 0.296 1
1 931 . 16 1 1 A 84 84 GLN N N 83 114.001 117.286 -3.285 1
1 933 . 16 1 1 A 85 85 ARG H H 84 7.072 7.692 -0.620 1
1 934 . 16 1 1 A 85 85 ARG HA H 84 4.047 4.540 -0.493 1
1 942 . 16 1 1 A 85 85 ARG C C 84 175.999 175.398 0.601 1
1 943 . 16 1 1 A 85 85 ARG CA C 84 56.764 56.799 -0.035 1
1 944 . 16 1 1 A 85 85 ARG CB C 84 32.044 32.852 -0.808 1
1 947 . 16 1 1 A 85 85 ARG N N 84 115.827 119.000 -3.173 1
1 949 . 16 1 1 A 86 86 ILE H H 85 8.238 7.698 0.540 1
1 950 . 16 1 1 A 86 86 ILE HA H 85 4.389 4.437 -0.048 1
1 960 . 16 1 1 A 86 86 ILE CA C 85 58.007 57.860 0.147 1
1 961 . 16 1 1 A 86 86 ILE CB C 85 39.604 38.499 1.105 1
1 965 . 16 1 1 A 86 86 ILE N N 85 119.285 118.380 0.905 1
1 966 . 16 1 1 A 87 87 PRO HA H 86 4.392 4.606 -0.214 1
1 973 . 16 1 1 A 87 87 PRO C C 86 177.622 176.393 1.229 1
1 974 . 16 1 1 A 87 87 PRO CA C 86 64.665 64.227 0.438 1
1 975 . 16 1 1 A 87 87 PRO CB C 86 32.020 31.701 0.319 1
1 978 . 16 1 1 A 88 88 GLU H H 87 8.312 8.219 0.093 1
1 979 . 16 1 1 A 88 88 GLU HA H 87 4.208 4.570 -0.362 1
1 984 . 16 1 1 A 88 88 GLU C C 87 175.554 175.709 -0.155 1
1 985 . 16 1 1 A 88 88 GLU CA C 87 56.045 56.209 -0.164 1
1 986 . 16 1 1 A 88 88 GLU CB C 87 28.654 30.581 -1.927 1
1 988 . 16 1 1 A 88 88 GLU N N 87 114.256 116.777 -2.521 1
1 989 . 16 1 1 A 89 89 PHE H H 88 7.946 7.377 0.569 1
1 990 . 16 1 1 A 89 89 PHE HA H 88 3.993 4.344 -0.351 1
1 998 . 16 1 1 A 89 89 PHE C C 88 173.460 174.699 -1.239 1
1 999 . 16 1 1 A 89 89 PHE CA C 88 60.119 59.576 0.543 1
1 1000 . 16 1 1 A 89 89 PHE CB C 88 39.994 39.640 0.354 1
1 1006 . 16 1 1 A 89 89 PHE N N 88 121.550 123.505 -1.955 1
1 1007 . 16 1 1 A 90 90 ASN H H 89 7.266 7.704 -0.438 1
1 1008 . 16 1 1 A 90 90 ASN HA H 89 4.454 5.079 -0.625 1
1 1013 . 16 1 1 A 90 90 ASN C C 89 173.921 175.223 -1.302 1
1 1014 . 16 1 1 A 90 90 ASN CA C 89 51.839 51.525 0.314 1
1 1015 . 16 1 1 A 90 90 ASN CB C 89 40.674 39.535 1.139 1
1 1016 . 16 1 1 A 90 90 ASN N N 89 125.344 125.095 0.249 1
1 1018 . 16 1 1 A 91 91 MET H H 90 8.968 8.844 0.124 1
1 1019 . 16 1 1 A 91 91 MET HA H 90 4.049 4.191 -0.142 1
1 1027 . 16 1 1 A 91 91 MET C C 90 177.475 178.102 -0.627 1
1 1028 . 16 1 1 A 91 91 MET CA C 90 57.758 58.461 -0.703 1
1 1029 . 16 1 1 A 91 91 MET CB C 90 32.250 32.158 0.092 1
1 1032 . 16 1 1 A 91 91 MET N N 90 127.052 125.081 1.971 1
1 1033 . 16 1 1 A 92 92 ALA H H 91 8.292 8.037 0.255 1
1 1034 . 16 1 1 A 92 92 ALA HA H 91 4.059 4.130 -0.071 1
1 1038 . 16 1 1 A 92 92 ALA C C 91 180.412 179.603 0.809 1
1 1039 . 16 1 1 A 92 92 ALA CA C 91 55.368 54.911 0.457 1
1 1040 . 16 1 1 A 92 92 ALA CB C 91 17.527 18.380 -0.853 1
1 1041 . 16 1 1 A 92 92 ALA N N 91 123.752 121.515 2.237 1
1 1042 . 16 1 1 A 93 93 ALA H H 92 7.931 8.063 -0.132 1
1 1043 . 16 1 1 A 93 93 ALA HA H 92 4.054 4.109 -0.055 1
1 1047 . 16 1 1 A 93 93 ALA C C 92 180.482 179.934 0.548 1
1 1048 . 16 1 1 A 93 93 ALA CA C 92 54.614 54.919 -0.305 1
1 1049 . 16 1 1 A 93 93 ALA CB C 92 18.098 18.207 -0.109 1
1 1050 . 16 1 1 A 93 93 ALA N N 92 121.158 120.341 0.817 1
1 1051 . 16 1 1 A 94 94 PHE H H 93 8.110 7.934 0.176 1
1 1052 . 16 1 1 A 94 94 PHE HA H 93 4.304 4.181 0.123 1
1 1060 . 16 1 1 A 94 94 PHE C C 93 177.350 177.056 0.294 1
1 1061 . 16 1 1 A 94 94 PHE CA C 93 61.641 61.541 0.100 1
1 1062 . 16 1 1 A 94 94 PHE CB C 93 40.014 39.229 0.785 1
1 1068 . 16 1 1 A 94 94 PHE N N 93 119.807 119.725 0.082 1
1 1069 . 16 1 1 A 95 95 THR H H 94 8.726 8.151 0.575 1
1 1070 . 16 1 1 A 95 95 THR HA H 94 3.569 3.868 -0.299 1
1 1075 . 16 1 1 A 95 95 THR C C 94 176.932 176.947 -0.015 1
1 1076 . 16 1 1 A 95 95 THR CA C 94 66.833 65.525 1.308 1
1 1077 . 16 1 1 A 95 95 THR CB C 94 68.445 68.259 0.186 1
1 1079 . 16 1 1 A 95 95 THR N N 94 113.074 111.991 1.083 1
1 1080 . 16 1 1 A 96 96 THR H H 95 7.657 7.954 -0.297 1
1 1081 . 16 1 1 A 96 96 THR HA H 95 3.945 4.014 -0.069 1
1 1086 . 16 1 1 A 96 96 THR C C 95 176.386 176.184 0.202 1
1 1087 . 16 1 1 A 96 96 THR CA C 95 66.550 66.084 0.466 1
1 1088 . 16 1 1 A 96 96 THR CB C 95 68.583 68.687 -0.104 1
1 1090 . 16 1 1 A 96 96 THR N N 95 117.927 116.567 1.360 1
1 1091 . 16 1 1 A 97 97 THR H H 96 7.699 7.706 -0.007 1
1 1092 . 16 1 1 A 97 97 THR HA H 96 3.905 4.208 -0.303 1
1 1097 . 16 1 1 A 97 97 THR C C 96 176.572 176.189 0.383 1
1 1098 . 16 1 1 A 97 97 THR CA C 96 65.979 66.368 -0.389 1
1 1099 . 16 1 1 A 97 97 THR CB C 96 68.553 68.364 0.189 1
1 1101 . 16 1 1 A 97 97 THR N N 96 118.518 116.936 1.582 1
1 1102 . 16 1 1 A 98 98 LEU H H 97 8.304 8.029 0.275 1
1 1103 . 16 1 1 A 98 98 LEU HA H 97 3.725 3.757 -0.032 1
1 1113 . 16 1 1 A 98 98 LEU C C 97 178.490 178.575 -0.085 1
1 1114 . 16 1 1 A 98 98 LEU CA C 97 58.517 57.848 0.669 1
1 1115 . 16 1 1 A 98 98 LEU CB C 97 41.697 40.971 0.726 1
1 1119 . 16 1 1 A 98 98 LEU N N 97 122.882 122.060 0.822 1
1 1120 . 16 1 1 A 99 99 GLN H H 98 7.639 7.856 -0.217 1
1 1121 . 16 1 1 A 99 99 GLN HA H 98 3.927 4.094 -0.167 1
1 1128 . 16 1 1 A 99 99 GLN C C 98 178.068 178.084 -0.016 1
1 1129 . 16 1 1 A 99 99 GLN CA C 98 58.735 58.992 -0.257 1
1 1130 . 16 1 1 A 99 99 GLN CB C 98 27.986 28.381 -0.395 1
1 1132 . 16 1 1 A 99 99 GLN N N 98 114.302 118.160 -3.858 1
1 1134 . 16 1 1 A 100 100 HIS H H 99 7.575 7.802 -0.227 1
1 1135 . 16 1 1 A 100 100 HIS HA H 99 4.524 4.580 -0.056 1
1 1139 . 16 1 1 A 100 100 HIS C C 99 174.789 177.375 -2.586 1
1 1140 . 16 1 1 A 100 100 HIS CA C 99 56.154 57.253 -1.099 1
1 1141 . 16 1 1 A 100 100 HIS CB C 99 28.946 30.551 -1.605 1
1 1143 . 16 1 1 A 100 100 HIS N N 99 114.778 117.006 -2.228 1
1 1144 . 16 1 1 A 101 101 HIS H H 100 7.773 7.445 0.328 1
1 1145 . 16 1 1 A 101 101 HIS HA H 100 4.704 3.983 0.721 1
1 1149 . 16 1 1 A 101 101 HIS C C 100 174.818 176.941 -2.123 1
1 1150 . 16 1 1 A 101 101 HIS CA C 100 54.830 58.068 -3.238 1
1 1151 . 16 1 1 A 101 101 HIS CB C 100 29.749 29.991 -0.242 1
1 1153 . 16 1 1 A 101 101 HIS N N 100 117.397 120.070 -2.673 1
1 1154 . 16 1 1 A 102 102 LYS H H 101 7.324 8.321 -0.997 1
1 1155 . 16 1 1 A 102 102 LYS HA H 101 3.611 4.106 -0.495 1
1 1164 . 16 1 1 A 102 102 LYS C C 101 176.823 178.571 -1.748 1
1 1165 . 16 1 1 A 102 102 LYS CA C 101 59.915 58.635 1.280 1
1 1166 . 16 1 1 A 102 102 LYS CB C 101 32.825 31.319 1.506 1
1 1170 . 16 1 1 A 102 102 LYS N N 101 120.533 117.328 3.205 1
1 1171 . 16 1 1 A 103 103 ASP H H 102 8.361 7.576 0.785 1
1 1172 . 16 1 1 A 103 103 ASP HA H 102 4.421 4.441 -0.020 1
1 1175 . 16 1 1 A 103 103 ASP C C 102 176.793 177.812 -1.019 1
1 1176 . 16 1 1 A 103 103 ASP CA C 102 55.500 56.676 -1.176 1
1 1177 . 16 1 1 A 103 103 ASP CB C 102 40.178 41.016 -0.838 1
1 1178 . 16 1 1 A 103 103 ASP N N 102 114.814 120.558 -5.744 1
1 1179 . 16 1 1 A 104 104 GLU H H 103 7.858 7.762 0.096 1
1 1180 . 16 1 1 A 104 104 GLU HA H 103 4.339 4.575 -0.236 1
1 1183 . 16 1 1 A 104 104 GLU C C 103 175.777 176.729 -0.952 1
1 1184 . 16 1 1 A 104 104 GLU CA C 103 56.356 57.523 -1.167 1
1 1185 . 16 1 1 A 104 104 GLU CB C 103 31.293 31.922 -0.629 1
1 1186 . 16 1 1 A 104 104 GLU N N 103 116.826 117.884 -1.058 1
1 1187 . 16 1 1 A 105 105 VAL H H 104 7.201 7.016 0.185 1
1 1188 . 16 1 1 A 105 105 VAL HA H 104 4.296 4.149 0.147 1
1 1196 . 16 1 1 A 105 105 VAL C C 104 174.482 175.602 -1.120 1
1 1197 . 16 1 1 A 105 105 VAL CA C 104 60.370 62.728 -2.358 1
1 1198 . 16 1 1 A 105 105 VAL CB C 104 34.341 32.589 1.752 1
1 1201 . 16 1 1 A 105 105 VAL N N 104 116.422 120.520 -4.098 1
1 1202 . 16 1 1 A 106 106 ALA H H 105 8.487 8.532 -0.045 1
1 1203 . 16 1 1 A 106 106 ALA HA H 105 4.172 4.436 -0.264 1
1 1207 . 16 1 1 A 106 106 ALA C C 105 179.030 178.926 0.104 1
1 1208 . 16 1 1 A 106 106 ALA CA C 105 52.966 52.603 0.363 1
1 1209 . 16 1 1 A 106 106 ALA CB C 105 19.371 19.312 0.059 1
1 1210 . 16 1 1 A 106 106 ALA N N 105 128.313 128.583 -0.270 1
1 1211 . 16 1 1 A 107 107 GLY H H 106 8.738 8.794 -0.056 1
1 1212 . 16 1 1 A 107 107 GLY HA2 H 106 3.773 3.877 -0.104 1
1 1213 . 16 1 1 A 107 107 GLY HA3 H 106 3.998 3.943 0.055 1
1 1214 . 16 1 1 A 107 107 GLY C C 106 174.958 175.546 -0.588 1
1 1215 . 16 1 1 A 107 107 GLY CA C 106 47.449 47.150 0.299 1
1 1216 . 16 1 1 A 107 107 GLY N N 106 110.612 110.838 -0.226 1
1 1217 . 16 1 1 A 108 108 ASP H H 107 8.535 8.298 0.237 1
1 1218 . 16 1 1 A 108 108 ASP HA H 107 4.333 4.375 -0.042 1
1 1221 . 16 1 1 A 108 108 ASP C C 107 179.133 179.021 0.112 1
1 1222 . 16 1 1 A 108 108 ASP CA C 107 56.721 57.065 -0.344 1
1 1223 . 16 1 1 A 108 108 ASP CB C 107 39.336 41.470 -2.134 1
1 1224 . 16 1 1 A 108 108 ASP N N 107 117.474 121.602 -4.128 1
1 1225 . 16 1 1 A 109 109 ILE H H 108 7.459 7.977 -0.518 1
1 1226 . 16 1 1 A 109 109 ILE HA H 108 3.688 3.762 -0.074 1
1 1236 . 16 1 1 A 109 109 ILE C C 108 176.735 178.275 -1.540 1
1 1237 . 16 1 1 A 109 109 ILE CA C 108 63.474 65.559 -2.085 1
1 1238 . 16 1 1 A 109 109 ILE CB C 108 37.340 37.811 -0.471 1
1 1242 . 16 1 1 A 109 109 ILE N N 108 119.609 119.700 -0.091 1
1 1243 . 16 1 1 A 110 110 PHE H H 109 7.920 8.310 -0.390 1
1 1244 . 16 1 1 A 110 110 PHE HA H 109 3.759 4.093 -0.334 1
1 1252 . 16 1 1 A 110 110 PHE C C 109 177.132 177.405 -0.273 1
1 1253 . 16 1 1 A 110 110 PHE CA C 109 62.766 61.245 1.521 1
1 1254 . 16 1 1 A 110 110 PHE CB C 109 39.752 39.299 0.453 1
1 1260 . 16 1 1 A 110 110 PHE N N 109 120.906 120.488 0.418 1
1 1261 . 16 1 1 A 111 111 ASP H H 110 8.639 8.302 0.337 1
1 1262 . 16 1 1 A 111 111 ASP HA H 110 4.216 4.214 0.002 1
1 1265 . 16 1 1 A 111 111 ASP C C 110 178.900 178.432 0.468 1
1 1266 . 16 1 1 A 111 111 ASP CA C 110 57.105 57.237 -0.132 1
1 1267 . 16 1 1 A 111 111 ASP CB C 110 39.697 41.691 -1.994 1
1 1268 . 16 1 1 A 111 111 ASP N N 110 117.124 119.037 -1.913 1
1 1269 . 16 1 1 A 112 112 MET H H 111 7.331 7.550 -0.219 1
1 1270 . 16 1 1 A 112 112 MET HA H 111 4.081 4.135 -0.054 1
1 1278 . 16 1 1 A 112 112 MET C C 111 179.052 178.180 0.872 1
1 1279 . 16 1 1 A 112 112 MET CA C 111 58.202 58.121 0.081 1
1 1280 . 16 1 1 A 112 112 MET CB C 111 31.827 32.374 -0.547 1
1 1283 . 16 1 1 A 112 112 MET N N 111 118.061 119.506 -1.445 1
1 1284 . 16 1 1 A 113 113 LEU H H 112 8.001 8.062 -0.061 1
1 1285 . 16 1 1 A 113 113 LEU HA H 112 3.723 3.597 0.126 1
1 1295 . 16 1 1 A 113 113 LEU C C 112 179.747 178.700 1.047 1
1 1296 . 16 1 1 A 113 113 LEU CA C 112 57.371 57.443 -0.072 1
1 1297 . 16 1 1 A 113 113 LEU CB C 112 40.671 41.148 -0.477 1
1 1301 . 16 1 1 A 113 113 LEU N N 112 120.426 119.846 0.580 1
1 1302 . 16 1 1 A 114 114 LEU H H 113 7.744 7.584 0.160 1
1 1303 . 16 1 1 A 114 114 LEU HA H 113 4.007 3.558 0.449 1
1 1313 . 16 1 1 A 114 114 LEU C C 113 179.358 178.539 0.819 1
1 1314 . 16 1 1 A 114 114 LEU CA C 113 57.202 57.531 -0.329 1
1 1315 . 16 1 1 A 114 114 LEU CB C 113 41.727 41.608 0.119 1
1 1319 . 16 1 1 A 114 114 LEU N N 113 119.584 119.660 -0.076 1
1 1320 . 16 1 1 A 115 115 THR H H 114 7.353 7.593 -0.240 1
1 1321 . 16 1 1 A 115 115 THR HA H 114 4.071 4.102 -0.031 1
1 1327 . 16 1 1 A 115 115 THR C C 114 173.591 176.282 -2.691 1
1 1328 . 16 1 1 A 115 115 THR CA C 114 65.332 64.534 0.798 1
1 1329 . 16 1 1 A 115 115 THR CB C 114 70.319 68.601 1.718 1
1 1331 . 16 1 1 A 115 115 THR N N 114 107.535 112.316 -4.781 1
1 1332 . 16 1 1 A 116 116 PHE H H 115 6.979 7.860 -0.881 1
1 1333 . 16 1 1 A 116 116 PHE HA H 115 5.022 4.435 0.587 1
1 1341 . 16 1 1 A 116 116 PHE C C 115 176.488 176.026 0.462 1
1 1342 . 16 1 1 A 116 116 PHE CA C 115 55.911 61.158 -5.247 1
1 1343 . 16 1 1 A 116 116 PHE CB C 115 38.521 38.906 -0.385 1
1 1349 . 16 1 1 A 116 116 PHE N N 115 112.366 119.946 -7.580 1
1 1350 . 16 1 1 A 117 117 THR H H 116 7.564 8.133 -0.569 1
1 1351 . 16 1 1 A 117 117 THR HA H 116 4.626 4.866 -0.240 1
1 1356 . 16 1 1 A 117 117 THR C C 116 174.085 174.081 0.004 1
1 1357 . 16 1 1 A 117 117 THR CA C 116 61.636 62.615 -0.979 1
1 1358 . 16 1 1 A 117 117 THR CB C 116 70.915 72.446 -1.531 1
1 1360 . 16 1 1 A 117 117 THR N N 116 105.498 112.709 -7.211 1
1 1361 . 16 1 1 A 118 118 ASP H H 117 8.270 7.788 0.482 1
1 1362 . 16 1 1 A 118 118 ASP HA H 117 4.955 4.694 0.261 1
1 1365 . 16 1 1 A 118 118 ASP C C 117 176.328 176.426 -0.098 1
1 1366 . 16 1 1 A 118 118 ASP CA C 117 53.417 53.127 0.290 1
1 1367 . 16 1 1 A 118 118 ASP CB C 117 43.388 39.946 3.442 1
1 1368 . 16 1 1 A 118 118 ASP N N 117 124.409 121.901 2.508 1
1 1369 . 16 1 1 A 119 119 PHE H H 118 8.973 8.796 0.177 1
1 1370 . 16 1 1 A 119 119 PHE HA H 118 3.506 4.236 -0.730 1
1 1378 . 16 1 1 A 119 119 PHE CA C 118 61.490 61.071 0.419 1
1 1379 . 16 1 1 A 119 119 PHE CB C 118 39.246 39.581 -0.335 1
1 1385 . 16 1 1 A 119 119 PHE N N 118 126.688 126.619 0.069 1
1 1386 . 16 1 1 A 120 120 LEU H H 119 8.099 8.276 -0.177 1
1 1387 . 16 1 1 A 120 120 LEU HA H 119 3.842 3.896 -0.054 1
1 1397 . 16 1 1 A 120 120 LEU C C 119 179.601 179.471 0.130 1
1 1398 . 16 1 1 A 120 120 LEU CA C 119 58.174 57.867 0.307 1
1 1399 . 16 1 1 A 120 120 LEU CB C 119 40.315 41.122 -0.807 1
1 1403 . 16 1 1 A 120 120 LEU N N 119 117.930 119.782 -1.852 1
1 1404 . 16 1 1 A 121 121 ALA H H 120 7.729 7.952 -0.223 1
1 1405 . 16 1 1 A 121 121 ALA HA H 120 3.996 4.099 -0.103 1
1 1409 . 16 1 1 A 121 121 ALA C C 120 180.995 179.602 1.393 1
1 1410 . 16 1 1 A 121 121 ALA CA C 120 54.832 54.648 0.184 1
1 1411 . 16 1 1 A 121 121 ALA CB C 120 17.706 18.342 -0.636 1
1 1412 . 16 1 1 A 121 121 ALA N N 120 123.195 121.601 1.594 1
1 1413 . 16 1 1 A 122 122 PHE H H 121 7.943 7.882 0.061 1
1 1414 . 16 1 1 A 122 122 PHE HA H 121 3.887 3.909 -0.022 1
1 1419 . 16 1 1 A 122 122 PHE C C 121 175.410 176.965 -1.555 1
1 1420 . 16 1 1 A 122 122 PHE CA C 121 61.075 60.761 0.314 1
1 1421 . 16 1 1 A 122 122 PHE CB C 121 38.115 38.860 -0.745 1
1 1424 . 16 1 1 A 122 122 PHE N N 121 121.798 120.478 1.320 1
1 1425 . 16 1 1 A 123 123 LYS H H 122 8.468 7.918 0.550 1
1 1426 . 16 1 1 A 123 123 LYS HA H 122 3.077 3.796 -0.719 1
1 1435 . 16 1 1 A 123 123 LYS C C 122 178.453 178.957 -0.504 1
1 1436 . 16 1 1 A 123 123 LYS CA C 122 59.855 60.015 -0.160 1
1 1437 . 16 1 1 A 123 123 LYS CB C 122 32.374 32.605 -0.231 1
1 1441 . 16 1 1 A 123 123 LYS N N 122 120.614 118.293 2.321 1
1 1442 . 16 1 1 A 124 124 GLU H H 123 8.100 7.768 0.332 1
1 1443 . 16 1 1 A 124 124 GLU HA H 123 3.652 4.037 -0.385 1
1 1448 . 16 1 1 A 124 124 GLU C C 123 177.743 178.515 -0.772 1
1 1449 . 16 1 1 A 124 124 GLU CA C 123 59.406 59.505 -0.099 1
1 1450 . 16 1 1 A 124 124 GLU CB C 123 28.811 29.248 -0.437 1
1 1452 . 16 1 1 A 124 124 GLU N N 123 117.404 118.763 -1.359 1
1 1453 . 16 1 1 A 125 125 MET H H 124 7.537 7.569 -0.032 1
1 1454 . 16 1 1 A 125 125 MET HA H 124 3.860 3.927 -0.067 1
1 1462 . 16 1 1 A 125 125 MET C C 124 179.522 178.437 1.085 1
1 1463 . 16 1 1 A 125 125 MET CA C 124 58.832 58.481 0.351 1
1 1464 . 16 1 1 A 125 125 MET CB C 124 31.765 31.296 0.469 1
1 1467 . 16 1 1 A 125 125 MET N N 124 119.413 118.940 0.473 1
1 1468 . 16 1 1 A 126 126 PHE H H 125 7.148 7.443 -0.295 1
1 1469 . 16 1 1 A 126 126 PHE HA H 125 3.633 4.213 -0.580 1
1 1476 . 16 1 1 A 126 126 PHE C C 125 178.994 178.335 0.659 1
1 1477 . 16 1 1 A 126 126 PHE CA C 125 63.148 61.007 2.141 1
1 1478 . 16 1 1 A 126 126 PHE CB C 125 39.830 38.371 1.459 1
1 1483 . 16 1 1 A 126 126 PHE N N 125 120.013 118.593 1.420 1
1 1484 . 16 1 1 A 127 127 LEU H H 126 8.369 8.436 -0.067 1
1 1485 . 16 1 1 A 127 127 LEU HA H 126 3.972 4.031 -0.059 1
1 1495 . 16 1 1 A 127 127 LEU C C 126 180.621 179.339 1.282 1
1 1496 . 16 1 1 A 127 127 LEU CA C 126 57.944 57.967 -0.023 1
1 1497 . 16 1 1 A 127 127 LEU CB C 126 40.543 41.250 -0.707 1
1 1501 . 16 1 1 A 127 127 LEU N N 126 119.692 119.743 -0.051 1
1 1502 . 16 1 1 A 128 128 ASP H H 127 8.578 8.198 0.380 1
1 1503 . 16 1 1 A 128 128 ASP HA H 127 4.308 4.350 -0.042 1
1 1506 . 16 1 1 A 128 128 ASP C C 127 178.254 178.063 0.191 1
1 1507 . 16 1 1 A 128 128 ASP CA C 127 56.964 57.139 -0.175 1
1 1508 . 16 1 1 A 128 128 ASP CB C 127 39.735 40.680 -0.945 1
1 1509 . 16 1 1 A 128 128 ASP N N 127 121.926 119.636 2.290 1
1 1510 . 16 1 1 A 129 129 TYR H H 128 7.710 8.030 -0.320 1
1 1511 . 16 1 1 A 129 129 TYR HA H 128 3.908 4.043 -0.135 1
1 1518 . 16 1 1 A 129 129 TYR C C 128 177.633 177.206 0.427 1
1 1519 . 16 1 1 A 129 129 TYR CA C 128 61.796 61.495 0.301 1
1 1520 . 16 1 1 A 129 129 TYR CB C 128 39.372 38.805 0.567 1
1 1525 . 16 1 1 A 129 129 TYR N N 128 122.548 120.446 2.102 1
1 1526 . 16 1 1 A 130 130 ARG H H 129 8.622 8.347 0.275 1
1 1527 . 16 1 1 A 130 130 ARG HA H 129 3.722 3.796 -0.074 1
1 1535 . 16 1 1 A 130 130 ARG CA C 129 60.084 60.181 -0.097 1
1 1536 . 16 1 1 A 130 130 ARG CB C 129 29.902 30.157 -0.255 1
1 1539 . 16 1 1 A 130 130 ARG N N 129 118.302 119.463 -1.161 1
1 1541 . 16 1 1 A 131 131 ALA H H 130 7.936 7.881 0.055 1
1 1542 . 16 1 1 A 131 131 ALA HA H 130 3.997 4.031 -0.034 1
1 1546 . 16 1 1 A 131 131 ALA C C 130 180.456 179.744 0.712 1
1 1547 . 16 1 1 A 131 131 ALA CA C 130 55.133 54.975 0.158 1
1 1548 . 16 1 1 A 131 131 ALA CB C 130 17.750 18.361 -0.611 1
1 1549 . 16 1 1 A 131 131 ALA N N 130 119.788 120.591 -0.803 1
1 1550 . 16 1 1 A 132 132 GLU H H 131 7.622 7.764 -0.142 1
1 1551 . 16 1 1 A 132 132 GLU HA H 131 3.862 3.977 -0.115 1
1 1556 . 16 1 1 A 132 132 GLU C C 131 179.528 179.122 0.406 1
1 1557 . 16 1 1 A 132 132 GLU CA C 131 58.849 58.981 -0.132 1
1 1558 . 16 1 1 A 132 132 GLU CB C 131 28.930 29.172 -0.242 1
1 1560 . 16 1 1 A 132 132 GLU N N 131 118.428 118.895 -0.467 1
1 1561 . 16 1 1 A 133 133 LYS H H 132 7.853 7.696 0.157 1
1 1562 . 16 1 1 A 133 133 LYS HA H 132 3.722 4.044 -0.322 1
1 1571 . 16 1 1 A 133 133 LYS C C 132 175.725 178.571 -2.846 1
1 1572 . 16 1 1 A 133 133 LYS CA C 132 57.544 59.119 -1.575 1
1 1573 . 16 1 1 A 133 133 LYS CB C 132 31.770 32.074 -0.304 1
1 1577 . 16 1 1 A 133 133 LYS N N 132 119.473 119.273 0.200 1
1 1578 . 16 1 1 A 134 134 GLU H H 133 8.151 7.389 0.762 1
1 1579 . 16 1 1 A 134 134 GLU HA H 133 4.161 4.344 -0.183 1
1 1584 . 16 1 1 A 134 134 GLU C C 133 177.453 176.941 0.512 1
1 1585 . 16 1 1 A 134 134 GLU CA C 133 57.222 56.219 1.003 1
1 1586 . 16 1 1 A 134 134 GLU CB C 133 30.091 29.909 0.182 1
1 1588 . 16 1 1 A 134 134 GLU N N 133 116.525 116.850 -0.325 1
1 1589 . 16 1 1 A 135 135 GLY H H 134 7.702 7.649 0.053 1
1 1590 . 16 1 1 A 135 135 GLY HA2 H 134 3.896 3.855 0.041 1
1 1591 . 16 1 1 A 135 135 GLY HA3 H 134 3.897 3.864 0.033 1
1 1592 . 16 1 1 A 135 135 GLY C C 134 174.538 174.231 0.307 1
1 1593 . 16 1 1 A 135 135 GLY CA C 134 45.975 46.909 -0.934 1
1 1594 . 16 1 1 A 135 135 GLY N N 134 107.924 109.930 -2.006 1
1 1595 . 16 1 1 A 136 136 ARG H H 135 8.045 7.963 0.082 1
1 1596 . 16 1 1 A 136 136 ARG HA H 135 4.323 4.076 0.247 1
1 1604 . 16 1 1 A 136 136 ARG C C 135 175.864 175.711 0.153 1
1 1605 . 16 1 1 A 136 136 ARG CA C 135 56.016 56.658 -0.642 1
1 1606 . 16 1 1 A 136 136 ARG CB C 135 30.987 29.068 1.919 1
1 1609 . 16 1 1 A 136 136 ARG N N 135 119.708 111.209 8.499 1
1 1 . 17 1 1 A 14 14 PHE CA C 13 58.199 60.313 -2.114 1
1 2 . 17 1 1 A 14 14 PHE CB C 13 39.717 38.865 0.852 1
1 3 . 17 1 1 A 15 15 SER H H 14 8.299 8.524 -0.225 1
1 4 . 17 1 1 A 15 15 SER HA H 14 4.359 4.911 -0.552 1
1 7 . 17 1 1 A 15 15 SER CA C 14 58.249 57.551 0.698 1
1 8 . 17 1 1 A 15 15 SER CB C 14 63.936 67.303 -3.367 1
1 9 . 17 1 1 A 15 15 SER N N 14 117.379 112.738 4.641 1
1 10 . 17 1 1 A 16 16 SER H H 15 8.255 8.561 -0.306 1
1 11 . 17 1 1 A 16 16 SER HA H 15 3.729 4.789 -1.060 1
1 14 . 17 1 1 A 16 16 SER CA C 15 58.224 60.334 -2.110 1
1 15 . 17 1 1 A 16 16 SER CB C 15 63.886 65.115 -1.229 1
1 16 . 17 1 1 A 16 16 SER N N 15 117.694 116.576 1.118 1
1 17 . 17 1 1 A 17 17 ALA H H 16 8.333 8.179 0.154 1
1 18 . 17 1 1 A 17 17 ALA HA H 16 4.252 4.483 -0.231 1
1 22 . 17 1 1 A 17 17 ALA CA C 16 53.377 53.756 -0.379 1
1 23 . 17 1 1 A 17 17 ALA CB C 16 18.896 18.405 0.491 1
1 24 . 17 1 1 A 17 17 ALA N N 16 125.462 124.129 1.333 1
1 25 . 17 1 1 A 18 18 SER H H 17 8.219 8.057 0.162 1
1 26 . 17 1 1 A 18 18 SER HA H 17 4.332 4.216 0.116 1
1 29 . 17 1 1 A 18 18 SER CA C 17 59.105 61.678 -2.573 1
1 30 . 17 1 1 A 18 18 SER CB C 17 63.592 63.822 -0.230 1
1 31 . 17 1 1 A 18 18 SER N N 17 114.821 114.705 0.116 1
1 32 . 17 1 1 A 19 19 ASP H H 18 8.309 8.429 -0.120 1
1 33 . 17 1 1 A 19 19 ASP HA H 18 4.554 4.929 -0.375 1
1 36 . 17 1 1 A 19 19 ASP C C 18 176.528 177.026 -0.498 1
1 37 . 17 1 1 A 19 19 ASP CA C 18 55.272 54.543 0.729 1
1 38 . 17 1 1 A 19 19 ASP CB C 18 40.883 43.159 -2.276 1
1 39 . 17 1 1 A 19 19 ASP N N 18 123.367 117.226 6.141 1
1 40 . 17 1 1 A 20 20 ALA H H 19 8.133 8.371 -0.238 1
1 41 . 17 1 1 A 20 20 ALA HA H 19 4.170 4.055 0.115 1
1 45 . 17 1 1 A 20 20 ALA C C 19 179.857 178.773 1.084 1
1 46 . 17 1 1 A 20 20 ALA CA C 19 54.341 55.613 -1.272 1
1 47 . 17 1 1 A 20 20 ALA CB C 19 18.660 18.590 0.070 1
1 48 . 17 1 1 A 20 20 ALA N N 19 123.350 123.009 0.341 1
1 49 . 17 1 1 A 21 21 GLU H H 20 8.140 8.180 -0.040 1
1 50 . 17 1 1 A 21 21 GLU HA H 20 4.128 4.171 -0.043 1
1 55 . 17 1 1 A 21 21 GLU C C 20 177.675 178.926 -1.251 1
1 56 . 17 1 1 A 21 21 GLU CA C 20 58.520 59.503 -0.983 1
1 57 . 17 1 1 A 21 21 GLU CB C 20 29.765 29.425 0.340 1
1 59 . 17 1 1 A 21 21 GLU N N 20 119.063 119.060 0.003 1
1 60 . 17 1 1 A 22 22 PHE H H 21 8.009 8.020 -0.011 1
1 61 . 17 1 1 A 22 22 PHE HA H 21 4.123 4.429 -0.306 1
1 68 . 17 1 1 A 22 22 PHE C C 21 176.410 177.102 -0.692 1
1 69 . 17 1 1 A 22 22 PHE CA C 21 62.202 61.764 0.438 1
1 70 . 17 1 1 A 22 22 PHE CB C 21 39.223 39.684 -0.461 1
1 75 . 17 1 1 A 22 22 PHE N N 21 121.211 121.181 0.030 1
1 76 . 17 1 1 A 23 23 ASP H H 22 8.261 8.451 -0.190 1
1 77 . 17 1 1 A 23 23 ASP HA H 22 4.041 4.472 -0.431 1
1 80 . 17 1 1 A 23 23 ASP C C 22 179.078 178.790 0.288 1
1 81 . 17 1 1 A 23 23 ASP CA C 22 57.048 57.349 -0.301 1
1 82 . 17 1 1 A 23 23 ASP CB C 22 40.154 40.059 0.095 1
1 83 . 17 1 1 A 23 23 ASP N N 22 116.876 118.672 -1.796 1
1 84 . 17 1 1 A 24 24 ALA H H 23 7.651 7.659 -0.008 1
1 85 . 17 1 1 A 24 24 ALA HA H 23 3.785 3.927 -0.142 1
1 89 . 17 1 1 A 24 24 ALA C C 23 179.577 179.827 -0.250 1
1 90 . 17 1 1 A 24 24 ALA CA C 23 54.341 55.264 -0.923 1
1 91 . 17 1 1 A 24 24 ALA CB C 23 17.762 18.376 -0.614 1
1 92 . 17 1 1 A 24 24 ALA N N 23 121.873 122.566 -0.693 1
1 93 . 17 1 1 A 25 25 VAL H H 24 7.718 8.048 -0.330 1
1 94 . 17 1 1 A 25 25 VAL HA H 24 3.216 3.646 -0.430 1
1 102 . 17 1 1 A 25 25 VAL C C 24 177.805 178.353 -0.548 1
1 103 . 17 1 1 A 25 25 VAL CA C 24 66.789 66.863 -0.074 1
1 104 . 17 1 1 A 25 25 VAL CB C 24 31.277 31.238 0.039 1
1 107 . 17 1 1 A 25 25 VAL N N 24 117.890 118.458 -0.568 1
1 108 . 17 1 1 A 26 26 VAL H H 25 7.867 7.726 0.141 1
1 109 . 17 1 1 A 26 26 VAL HA H 25 3.274 3.612 -0.338 1
1 117 . 17 1 1 A 26 26 VAL C C 25 177.788 177.817 -0.029 1
1 118 . 17 1 1 A 26 26 VAL CA C 25 67.282 66.397 0.885 1
1 119 . 17 1 1 A 26 26 VAL CB C 25 31.266 31.525 -0.259 1
1 122 . 17 1 1 A 26 26 VAL N N 25 118.170 119.927 -1.757 1
1 123 . 17 1 1 A 27 27 GLY H H 26 7.544 7.822 -0.278 1
1 124 . 17 1 1 A 27 27 GLY HA2 H 26 3.592 3.526 0.066 1
1 125 . 17 1 1 A 27 27 GLY HA3 H 26 3.721 3.638 0.083 1
1 126 . 17 1 1 A 27 27 GLY C C 26 176.717 176.250 0.467 1
1 127 . 17 1 1 A 27 27 GLY CA C 26 47.085 47.213 -0.128 1
1 128 . 17 1 1 A 27 27 GLY N N 26 105.795 107.683 -1.888 1
1 129 . 17 1 1 A 28 28 TYR H H 27 7.625 7.401 0.224 1
1 130 . 17 1 1 A 28 28 TYR HA H 27 4.546 4.675 -0.129 1
1 137 . 17 1 1 A 28 28 TYR C C 27 178.991 178.255 0.736 1
1 138 . 17 1 1 A 28 28 TYR CA C 27 58.845 59.817 -0.972 1
1 139 . 17 1 1 A 28 28 TYR CB C 27 37.602 37.546 0.056 1
1 144 . 17 1 1 A 28 28 TYR N N 27 119.933 121.505 -1.572 1
1 145 . 17 1 1 A 29 29 LEU H H 28 8.517 8.342 0.175 1
1 146 . 17 1 1 A 29 29 LEU HA H 28 3.728 3.849 -0.121 1
1 156 . 17 1 1 A 29 29 LEU CA C 28 58.281 58.093 0.188 1
1 157 . 17 1 1 A 29 29 LEU CB C 28 41.948 41.347 0.601 1
1 161 . 17 1 1 A 29 29 LEU N N 28 119.669 120.346 -0.677 1
1 162 . 17 1 1 A 30 30 GLU H H 29 8.072 8.000 0.072 1
1 163 . 17 1 1 A 30 30 GLU HA H 29 3.722 3.865 -0.143 1
1 168 . 17 1 1 A 30 30 GLU C C 29 177.731 179.308 -1.577 1
1 169 . 17 1 1 A 30 30 GLU CA C 29 59.763 60.008 -0.245 1
1 170 . 17 1 1 A 30 30 GLU CB C 29 28.844 29.230 -0.386 1
1 172 . 17 1 1 A 30 30 GLU N N 29 117.666 117.676 -0.010 1
1 173 . 17 1 1 A 31 31 ASP H H 30 7.243 7.828 -0.585 1
1 174 . 17 1 1 A 31 31 ASP HA H 30 4.297 4.422 -0.125 1
1 177 . 17 1 1 A 31 31 ASP CA C 30 56.953 57.318 -0.365 1
1 178 . 17 1 1 A 31 31 ASP CB C 30 40.730 40.529 0.201 1
1 179 . 17 1 1 A 31 31 ASP N N 30 116.720 119.473 -2.753 1
1 180 . 17 1 1 A 32 32 ILE H H 31 7.940 7.438 0.502 1
1 181 . 17 1 1 A 32 32 ILE HA H 31 3.640 3.635 0.005 1
1 191 . 17 1 1 A 32 32 ILE C C 31 177.980 177.976 0.004 1
1 192 . 17 1 1 A 32 32 ILE CA C 31 64.692 64.534 0.158 1
1 193 . 17 1 1 A 32 32 ILE CB C 31 38.938 37.459 1.479 1
1 197 . 17 1 1 A 32 32 ILE N N 31 119.728 120.134 -0.406 1
1 198 . 17 1 1 A 33 33 ILE H H 32 7.984 7.657 0.327 1
1 199 . 17 1 1 A 33 33 ILE HA H 32 3.598 2.979 0.619 1
1 209 . 17 1 1 A 33 33 ILE C C 32 176.723 176.931 -0.208 1
1 210 . 17 1 1 A 33 33 ILE CA C 32 63.241 64.487 -1.246 1
1 211 . 17 1 1 A 33 33 ILE CB C 32 37.580 37.635 -0.055 1
1 215 . 17 1 1 A 33 33 ILE N N 32 113.919 120.249 -6.330 1
1 216 . 17 1 1 A 34 34 MET H H 33 7.288 7.678 -0.390 1
1 217 . 17 1 1 A 34 34 MET HA H 33 4.496 4.718 -0.222 1
1 225 . 17 1 1 A 34 34 MET C C 33 176.423 175.777 0.646 1
1 226 . 17 1 1 A 34 34 MET CA C 33 54.634 54.233 0.401 1
1 227 . 17 1 1 A 34 34 MET CB C 33 31.934 31.551 0.383 1
1 230 . 17 1 1 A 34 34 MET N N 33 115.130 116.827 -1.697 1
1 231 . 17 1 1 A 35 35 ASP H H 34 7.405 7.544 -0.139 1
1 232 . 17 1 1 A 35 35 ASP HA H 34 4.484 4.625 -0.141 1
1 235 . 17 1 1 A 35 35 ASP C C 34 177.139 176.713 0.426 1
1 236 . 17 1 1 A 35 35 ASP CA C 34 54.625 54.543 0.082 1
1 237 . 17 1 1 A 35 35 ASP CB C 34 43.554 42.812 0.742 1
1 238 . 17 1 1 A 35 35 ASP N N 34 121.814 122.580 -0.766 1
1 239 . 17 1 1 A 36 36 ASP H H 35 8.765 8.866 -0.101 1
1 240 . 17 1 1 A 36 36 ASP HA H 35 4.235 4.323 -0.088 1
1 243 . 17 1 1 A 36 36 ASP C C 35 178.320 178.526 -0.206 1
1 244 . 17 1 1 A 36 36 ASP CA C 35 57.832 58.042 -0.210 1
1 245 . 17 1 1 A 36 36 ASP CB C 35 40.914 40.409 0.505 1
1 246 . 17 1 1 A 36 36 ASP N N 35 125.883 125.308 0.575 1
1 247 . 17 1 1 A 37 37 GLU H H 36 8.905 8.024 0.881 1
1 248 . 17 1 1 A 37 37 GLU HA H 36 3.933 4.056 -0.123 1
1 253 . 17 1 1 A 37 37 GLU C C 36 179.304 179.057 0.247 1
1 254 . 17 1 1 A 37 37 GLU CA C 36 59.828 59.187 0.641 1
1 255 . 17 1 1 A 37 37 GLU CB C 36 29.380 29.328 0.052 1
1 257 . 17 1 1 A 37 37 GLU N N 36 119.077 120.367 -1.290 1
1 258 . 17 1 1 A 38 38 PHE H H 37 7.460 8.270 -0.810 1
1 259 . 17 1 1 A 38 38 PHE HA H 37 3.642 4.057 -0.415 1
1 267 . 17 1 1 A 38 38 PHE C C 37 176.483 177.955 -1.472 1
1 268 . 17 1 1 A 38 38 PHE CA C 37 61.411 60.765 0.646 1
1 269 . 17 1 1 A 38 38 PHE CB C 37 39.355 39.078 0.277 1
1 275 . 17 1 1 A 38 38 PHE N N 37 119.968 120.722 -0.754 1
1 276 . 17 1 1 A 39 39 GLN H H 38 7.968 7.938 0.030 1
1 277 . 17 1 1 A 39 39 GLN HA H 38 3.712 3.835 -0.123 1
1 284 . 17 1 1 A 39 39 GLN CA C 38 59.153 58.981 0.172 1
1 285 . 17 1 1 A 39 39 GLN CB C 38 28.213 28.418 -0.205 1
1 287 . 17 1 1 A 39 39 GLN N N 38 116.433 118.724 -2.291 1
1 289 . 17 1 1 A 40 40 LEU H H 39 7.930 7.711 0.219 1
1 290 . 17 1 1 A 40 40 LEU HA H 39 3.916 4.051 -0.135 1
1 300 . 17 1 1 A 40 40 LEU C C 39 177.731 178.143 -0.412 1
1 301 . 17 1 1 A 40 40 LEU CA C 39 57.915 58.115 -0.200 1
1 302 . 17 1 1 A 40 40 LEU CB C 39 41.989 41.291 0.698 1
1 306 . 17 1 1 A 40 40 LEU N N 39 119.505 121.885 -2.380 1
1 307 . 17 1 1 A 41 41 LEU H H 40 7.174 7.977 -0.803 1
1 308 . 17 1 1 A 41 41 LEU HA H 40 3.835 4.020 -0.185 1
1 318 . 17 1 1 A 41 41 LEU C C 40 179.738 178.121 1.617 1
1 319 . 17 1 1 A 41 41 LEU CA C 40 58.266 58.155 0.111 1
1 320 . 17 1 1 A 41 41 LEU CB C 40 42.050 41.373 0.677 1
1 324 . 17 1 1 A 41 41 LEU N N 40 120.971 119.836 1.135 1
1 325 . 17 1 1 A 42 42 GLN H H 41 8.058 7.885 0.173 1
1 326 . 17 1 1 A 42 42 GLN HA H 41 3.556 3.715 -0.159 1
1 333 . 17 1 1 A 42 42 GLN C C 41 177.642 178.385 -0.743 1
1 334 . 17 1 1 A 42 42 GLN CA C 41 59.826 59.144 0.682 1
1 335 . 17 1 1 A 42 42 GLN CB C 41 28.762 28.046 0.716 1
1 337 . 17 1 1 A 42 42 GLN N N 41 117.899 118.254 -0.355 1
1 339 . 17 1 1 A 43 43 ARG H H 42 8.179 7.858 0.321 1
1 340 . 17 1 1 A 43 43 ARG HA H 42 3.655 3.993 -0.338 1
1 347 . 17 1 1 A 43 43 ARG C C 42 178.051 178.670 -0.619 1
1 348 . 17 1 1 A 43 43 ARG CA C 42 59.766 59.137 0.629 1
1 349 . 17 1 1 A 43 43 ARG CB C 42 29.941 29.932 0.009 1
1 352 . 17 1 1 A 43 43 ARG N N 42 119.392 118.693 0.699 1
1 353 . 17 1 1 A 44 44 ASN H H 43 8.525 8.016 0.509 1
1 354 . 17 1 1 A 44 44 ASN HA H 43 4.332 4.383 -0.051 1
1 359 . 17 1 1 A 44 44 ASN C C 43 178.150 178.444 -0.294 1
1 360 . 17 1 1 A 44 44 ASN CA C 43 55.841 56.277 -0.436 1
1 361 . 17 1 1 A 44 44 ASN CB C 43 37.632 38.298 -0.666 1
1 362 . 17 1 1 A 44 44 ASN N N 43 116.214 117.769 -1.555 1
1 364 . 17 1 1 A 45 45 PHE H H 44 7.586 7.874 -0.288 1
1 365 . 17 1 1 A 45 45 PHE HA H 44 4.132 4.291 -0.159 1
1 372 . 17 1 1 A 45 45 PHE C C 44 176.691 178.620 -1.929 1
1 373 . 17 1 1 A 45 45 PHE CA C 44 62.333 60.607 1.726 1
1 374 . 17 1 1 A 45 45 PHE CB C 44 39.449 38.857 0.592 1
1 379 . 17 1 1 A 45 45 PHE N N 44 121.501 118.708 2.793 1
1 380 . 17 1 1 A 46 46 MET H H 45 8.190 8.325 -0.135 1
1 381 . 17 1 1 A 46 46 MET HA H 45 4.060 4.334 -0.274 1
1 389 . 17 1 1 A 46 46 MET C C 45 179.754 178.266 1.488 1
1 390 . 17 1 1 A 46 46 MET CA C 45 57.742 58.022 -0.280 1
1 391 . 17 1 1 A 46 46 MET CB C 45 29.912 31.221 -1.309 1
1 394 . 17 1 1 A 46 46 MET N N 45 116.727 117.910 -1.183 1
1 395 . 17 1 1 A 47 47 ASP H H 46 8.579 8.267 0.312 1
1 396 . 17 1 1 A 47 47 ASP HA H 46 4.804 4.680 0.124 1
1 399 . 17 1 1 A 47 47 ASP C C 46 177.854 177.807 0.047 1
1 400 . 17 1 1 A 47 47 ASP CA C 46 57.277 57.391 -0.114 1
1 401 . 17 1 1 A 47 47 ASP CB C 46 40.776 41.439 -0.663 1
1 402 . 17 1 1 A 47 47 ASP N N 46 117.798 120.650 -2.852 1
1 403 . 17 1 1 A 48 48 LYS H H 47 7.339 7.930 -0.591 1
1 404 . 17 1 1 A 48 48 LYS HA H 47 3.828 4.324 -0.496 1
1 413 . 17 1 1 A 48 48 LYS C C 47 178.812 178.718 0.094 1
1 414 . 17 1 1 A 48 48 LYS CA C 47 58.953 57.907 1.046 1
1 415 . 17 1 1 A 48 48 LYS CB C 47 32.796 33.308 -0.512 1
1 419 . 17 1 1 A 48 48 LYS N N 47 117.852 118.604 -0.752 1
1 420 . 17 1 1 A 49 49 TYR H H 48 6.841 8.564 -1.723 1
1 421 . 17 1 1 A 49 49 TYR HA H 48 4.995 4.237 0.758 1
1 428 . 17 1 1 A 49 49 TYR C C 48 178.138 178.813 -0.675 1
1 429 . 17 1 1 A 49 49 TYR CA C 48 58.620 59.938 -1.318 1
1 430 . 17 1 1 A 49 49 TYR CB C 48 42.939 37.635 5.304 1
1 435 . 17 1 1 A 49 49 TYR N N 48 112.109 119.464 -7.355 1
1 436 . 17 1 1 A 50 50 TYR H H 49 8.491 8.073 0.418 1
1 437 . 17 1 1 A 50 50 TYR HA H 49 4.598 4.414 0.184 1
1 444 . 17 1 1 A 50 50 TYR C C 49 176.015 177.656 -1.641 1
1 445 . 17 1 1 A 50 50 TYR CA C 49 62.442 59.537 2.905 1
1 446 . 17 1 1 A 50 50 TYR CB C 49 36.588 36.966 -0.378 1
1 451 . 17 1 1 A 50 50 TYR N N 49 118.294 119.935 -1.641 1
1 452 . 17 1 1 A 51 51 LEU H H 50 7.512 7.507 0.005 1
1 453 . 17 1 1 A 51 51 LEU HA H 50 3.878 3.586 0.292 1
1 463 . 17 1 1 A 51 51 LEU C C 50 178.625 178.696 -0.071 1
1 464 . 17 1 1 A 51 51 LEU CA C 50 55.994 57.242 -1.248 1
1 465 . 17 1 1 A 51 51 LEU CB C 50 40.743 41.517 -0.774 1
1 469 . 17 1 1 A 51 51 LEU N N 50 118.478 121.931 -3.453 1
1 470 . 17 1 1 A 52 52 GLU H H 51 8.042 7.973 0.069 1
1 471 . 17 1 1 A 52 52 GLU HA H 51 4.197 4.010 0.187 1
1 476 . 17 1 1 A 52 52 GLU C C 51 177.629 177.778 -0.149 1
1 477 . 17 1 1 A 52 52 GLU CA C 51 56.141 59.611 -3.470 1
1 478 . 17 1 1 A 52 52 GLU CB C 51 29.162 29.334 -0.172 1
1 480 . 17 1 1 A 52 52 GLU N N 51 115.067 118.067 -3.000 1
1 481 . 17 1 1 A 53 53 PHE H H 52 7.465 8.062 -0.597 1
1 482 . 17 1 1 A 53 53 PHE HA H 52 4.431 4.725 -0.294 1
1 490 . 17 1 1 A 53 53 PHE C C 52 174.325 174.768 -0.443 1
1 491 . 17 1 1 A 53 53 PHE CA C 52 58.986 57.027 1.959 1
1 492 . 17 1 1 A 53 53 PHE CB C 52 40.183 37.435 2.748 1
1 498 . 17 1 1 A 53 53 PHE N N 52 116.768 118.928 -2.160 1
1 499 . 17 1 1 A 54 54 GLU H H 53 7.484 8.629 -1.145 1
1 500 . 17 1 1 A 54 54 GLU HA H 53 4.583 4.799 -0.216 1
1 505 . 17 1 1 A 54 54 GLU C C 53 175.722 175.708 0.014 1
1 506 . 17 1 1 A 54 54 GLU CA C 53 54.248 55.597 -1.349 1
1 507 . 17 1 1 A 54 54 GLU CB C 53 34.409 31.705 2.704 1
1 509 . 17 1 1 A 54 54 GLU N N 53 118.844 124.353 -5.509 1
1 510 . 17 1 1 A 55 55 ASP H H 54 9.008 8.633 0.375 1
1 511 . 17 1 1 A 55 55 ASP HA H 54 4.735 4.797 -0.062 1
1 514 . 17 1 1 A 55 55 ASP C C 54 175.421 175.960 -0.539 1
1 515 . 17 1 1 A 55 55 ASP CA C 54 52.888 53.947 -1.059 1
1 516 . 17 1 1 A 55 55 ASP CB C 54 38.894 40.340 -1.446 1
1 517 . 17 1 1 A 55 55 ASP N N 54 123.654 124.092 -0.438 1
1 518 . 17 1 1 A 56 56 THR H H 55 7.819 7.853 -0.034 1
1 519 . 17 1 1 A 56 56 THR HA H 55 4.574 4.904 -0.330 1
1 524 . 17 1 1 A 56 56 THR C C 55 174.096 174.645 -0.549 1
1 525 . 17 1 1 A 56 56 THR CA C 55 59.172 59.546 -0.374 1
1 526 . 17 1 1 A 56 56 THR CB C 55 71.889 72.241 -0.352 1
1 528 . 17 1 1 A 56 56 THR N N 55 112.015 115.252 -3.237 1
1 529 . 17 1 1 A 57 57 GLU H H 56 8.527 8.642 -0.115 1
1 530 . 17 1 1 A 57 57 GLU HA H 56 4.217 4.275 -0.058 1
1 535 . 17 1 1 A 57 57 GLU C C 56 177.042 177.187 -0.145 1
1 536 . 17 1 1 A 57 57 GLU CA C 56 56.869 58.384 -1.515 1
1 537 . 17 1 1 A 57 57 GLU CB C 56 29.731 30.222 -0.491 1
1 539 . 17 1 1 A 57 57 GLU N N 56 117.531 121.874 -4.343 1
1 540 . 17 1 1 A 58 58 GLU H H 57 7.587 7.880 -0.293 1
1 541 . 17 1 1 A 58 58 GLU HA H 57 3.941 4.418 -0.477 1
1 546 . 17 1 1 A 58 58 GLU C C 57 176.849 175.817 1.032 1
1 547 . 17 1 1 A 58 58 GLU CA C 57 56.924 56.460 0.464 1
1 548 . 17 1 1 A 58 58 GLU CB C 57 30.251 30.161 0.090 1
1 550 . 17 1 1 A 58 58 GLU N N 57 119.183 118.039 1.144 1
1 551 . 17 1 1 A 59 59 ASN H H 58 9.120 8.578 0.542 1
1 552 . 17 1 1 A 59 59 ASN HA H 58 4.922 5.351 -0.429 1
1 557 . 17 1 1 A 59 59 ASN C C 58 174.254 174.628 -0.374 1
1 558 . 17 1 1 A 59 59 ASN CA C 58 51.956 52.951 -0.995 1
1 559 . 17 1 1 A 59 59 ASN CB C 58 37.404 40.674 -3.270 1
1 560 . 17 1 1 A 59 59 ASN N N 58 126.767 122.006 4.761 1
1 562 . 17 1 1 A 60 60 LYS H H 59 5.892 8.593 -2.701 1
1 563 . 17 1 1 A 60 60 LYS HA H 59 3.798 4.746 -0.948 1
1 572 . 17 1 1 A 60 60 LYS C C 59 177.908 176.772 1.136 1
1 573 . 17 1 1 A 60 60 LYS CA C 59 56.623 54.644 1.979 1
1 574 . 17 1 1 A 60 60 LYS CB C 59 32.279 34.669 -2.390 1
1 578 . 17 1 1 A 60 60 LYS N N 59 121.527 122.471 -0.944 1
1 579 . 17 1 1 A 61 61 LEU H H 60 8.473 8.715 -0.242 1
1 580 . 17 1 1 A 61 61 LEU HA H 60 3.891 4.154 -0.263 1
1 590 . 17 1 1 A 61 61 LEU C C 60 179.843 178.303 1.540 1
1 591 . 17 1 1 A 61 61 LEU CA C 60 58.301 56.146 2.155 1
1 592 . 17 1 1 A 61 61 LEU CB C 60 41.305 41.405 -0.100 1
1 596 . 17 1 1 A 61 61 LEU N N 60 125.639 123.486 2.153 1
1 597 . 17 1 1 A 62 62 ILE H H 61 7.698 7.583 0.115 1
1 598 . 17 1 1 A 62 62 ILE HA H 61 3.952 3.857 0.095 1
1 608 . 17 1 1 A 62 62 ILE C C 61 175.392 177.041 -1.649 1
1 609 . 17 1 1 A 62 62 ILE CA C 61 61.743 63.257 -1.514 1
1 610 . 17 1 1 A 62 62 ILE CB C 61 39.108 37.662 1.446 1
1 614 . 17 1 1 A 62 62 ILE N N 61 114.111 119.846 -5.735 1
1 615 . 17 1 1 A 63 63 TYR H H 62 7.273 7.479 -0.206 1
1 616 . 17 1 1 A 63 63 TYR HA H 62 4.343 4.199 0.144 1
1 623 . 17 1 1 A 63 63 TYR C C 62 178.264 178.510 -0.246 1
1 624 . 17 1 1 A 63 63 TYR CA C 62 57.231 61.156 -3.925 1
1 625 . 17 1 1 A 63 63 TYR CB C 62 36.332 38.066 -1.734 1
1 630 . 17 1 1 A 63 63 TYR N N 62 117.689 121.323 -3.634 1
1 631 . 17 1 1 A 64 64 THR H H 63 7.747 7.945 -0.198 1
1 632 . 17 1 1 A 64 64 THR HA H 63 4.266 4.171 0.095 1
1 637 . 17 1 1 A 64 64 THR CA C 63 69.362 67.540 1.822 1
1 638 . 17 1 1 A 64 64 THR CB C 63 66.962 67.379 -0.417 1
1 640 . 17 1 1 A 64 64 THR N N 63 113.755 116.292 -2.537 1
1 641 . 17 1 1 A 65 65 PRO HA H 64 4.372 4.361 0.011 1
1 648 . 17 1 1 A 65 65 PRO C C 64 179.913 179.516 0.397 1
1 649 . 17 1 1 A 65 65 PRO CA C 64 66.011 66.340 -0.329 1
1 650 . 17 1 1 A 65 65 PRO CB C 64 30.642 30.758 -0.116 1
1 653 . 17 1 1 A 66 66 ILE H H 65 7.377 7.384 -0.007 1
1 654 . 17 1 1 A 66 66 ILE HA H 65 3.530 3.864 -0.334 1
1 664 . 17 1 1 A 66 66 ILE C C 65 177.543 178.419 -0.876 1
1 665 . 17 1 1 A 66 66 ILE CA C 65 66.647 64.161 2.486 1
1 666 . 17 1 1 A 66 66 ILE CB C 65 38.029 37.834 0.195 1
1 670 . 17 1 1 A 66 66 ILE N N 65 118.353 116.618 1.735 1
1 671 . 17 1 1 A 67 67 PHE H H 66 8.480 8.392 0.088 1
1 672 . 17 1 1 A 67 67 PHE HA H 66 4.115 4.126 -0.011 1
1 680 . 17 1 1 A 67 67 PHE C C 66 177.293 177.774 -0.481 1
1 681 . 17 1 1 A 67 67 PHE CA C 66 59.570 62.011 -2.441 1
1 682 . 17 1 1 A 67 67 PHE CB C 66 38.865 39.310 -0.445 1
1 688 . 17 1 1 A 67 67 PHE N N 66 122.420 120.930 1.490 1
1 689 . 17 1 1 A 68 68 ASN H H 67 8.595 8.259 0.336 1
1 690 . 17 1 1 A 68 68 ASN HA H 67 4.211 4.322 -0.111 1
1 695 . 17 1 1 A 68 68 ASN C C 67 178.697 177.880 0.817 1
1 696 . 17 1 1 A 68 68 ASN CA C 67 56.056 56.378 -0.322 1
1 697 . 17 1 1 A 68 68 ASN CB C 67 37.704 37.853 -0.149 1
1 698 . 17 1 1 A 68 68 ASN N N 67 115.573 117.357 -1.784 1
1 700 . 17 1 1 A 69 69 GLU H H 68 8.414 7.968 0.446 1
1 701 . 17 1 1 A 69 69 GLU HA H 68 4.102 4.139 -0.037 1
1 706 . 17 1 1 A 69 69 GLU C C 68 177.880 178.674 -0.794 1
1 707 . 17 1 1 A 69 69 GLU CA C 68 59.399 59.500 -0.101 1
1 708 . 17 1 1 A 69 69 GLU CB C 68 29.855 29.652 0.203 1
1 710 . 17 1 1 A 69 69 GLU N N 68 123.510 120.115 3.395 1
1 711 . 17 1 1 A 70 70 TYR H H 69 8.659 8.207 0.452 1
1 712 . 17 1 1 A 70 70 TYR HA H 69 3.362 4.069 -0.707 1
1 719 . 17 1 1 A 70 70 TYR C C 69 178.143 177.312 0.831 1
1 720 . 17 1 1 A 70 70 TYR CA C 69 60.686 61.090 -0.404 1
1 721 . 17 1 1 A 70 70 TYR CB C 69 38.560 38.962 -0.402 1
1 726 . 17 1 1 A 70 70 TYR N N 69 122.130 120.443 1.687 1
1 727 . 17 1 1 A 71 71 ILE H H 70 8.031 7.620 0.411 1
1 728 . 17 1 1 A 71 71 ILE HA H 70 3.265 3.699 -0.434 1
1 738 . 17 1 1 A 71 71 ILE C C 70 178.056 177.967 0.089 1
1 739 . 17 1 1 A 71 71 ILE CA C 70 63.756 64.298 -0.542 1
1 740 . 17 1 1 A 71 71 ILE CB C 70 37.321 37.682 -0.361 1
1 744 . 17 1 1 A 71 71 ILE N N 70 118.906 120.903 -1.997 1
1 745 . 17 1 1 A 72 72 SER H H 71 7.803 7.985 -0.182 1
1 746 . 17 1 1 A 72 72 SER HA H 71 4.029 4.232 -0.203 1
1 749 . 17 1 1 A 72 72 SER CA C 71 61.380 62.174 -0.794 1
1 750 . 17 1 1 A 72 72 SER CB C 71 63.288 62.868 0.420 1
1 751 . 17 1 1 A 72 72 SER N N 71 113.735 116.739 -3.004 1
1 752 . 17 1 1 A 73 73 LEU H H 72 7.952 7.857 0.095 1
1 753 . 17 1 1 A 73 73 LEU HA H 72 4.418 4.128 0.290 1
1 763 . 17 1 1 A 73 73 LEU C C 72 177.767 178.364 -0.597 1
1 764 . 17 1 1 A 73 73 LEU CA C 72 56.543 57.442 -0.899 1
1 765 . 17 1 1 A 73 73 LEU CB C 72 44.517 41.707 2.810 1
1 769 . 17 1 1 A 73 73 LEU N N 72 119.411 122.176 -2.765 1
1 770 . 17 1 1 A 74 74 VAL H H 73 8.021 7.746 0.275 1
1 771 . 17 1 1 A 74 74 VAL HA H 73 3.532 3.380 0.152 1
1 779 . 17 1 1 A 74 74 VAL C C 73 177.126 177.984 -0.858 1
1 780 . 17 1 1 A 74 74 VAL CA C 73 66.250 66.353 -0.103 1
1 781 . 17 1 1 A 74 74 VAL CB C 73 31.212 31.221 -0.009 1
1 784 . 17 1 1 A 74 74 VAL N N 73 118.747 119.135 -0.388 1
1 785 . 17 1 1 A 75 75 GLU H H 74 7.232 8.058 -0.826 1
1 786 . 17 1 1 A 75 75 GLU HA H 74 3.013 4.202 -1.189 1
1 791 . 17 1 1 A 75 75 GLU C C 74 178.804 179.065 -0.261 1
1 792 . 17 1 1 A 75 75 GLU CA C 74 60.536 59.857 0.679 1
1 793 . 17 1 1 A 75 75 GLU CB C 74 27.009 29.165 -2.156 1
1 795 . 17 1 1 A 75 75 GLU N N 74 118.660 119.982 -1.322 1
1 796 . 17 1 1 A 76 76 LYS H H 75 7.051 7.862 -0.811 1
1 797 . 17 1 1 A 76 76 LYS HA H 75 3.765 4.026 -0.261 1
1 806 . 17 1 1 A 76 76 LYS C C 75 177.765 178.741 -0.976 1
1 807 . 17 1 1 A 76 76 LYS CA C 75 58.357 58.926 -0.569 1
1 808 . 17 1 1 A 76 76 LYS CB C 75 31.939 31.830 0.109 1
1 812 . 17 1 1 A 76 76 LYS N N 75 116.112 119.527 -3.415 1
1 813 . 17 1 1 A 77 77 TYR H H 76 7.067 7.804 -0.737 1
1 814 . 17 1 1 A 77 77 TYR HA H 76 4.036 4.165 -0.129 1
1 821 . 17 1 1 A 77 77 TYR C C 76 177.752 177.125 0.627 1
1 822 . 17 1 1 A 77 77 TYR CA C 76 61.820 61.323 0.497 1
1 823 . 17 1 1 A 77 77 TYR CB C 76 38.480 38.749 -0.269 1
1 828 . 17 1 1 A 77 77 TYR N N 76 118.434 120.830 -2.396 1
1 829 . 17 1 1 A 78 78 ILE H H 77 7.554 8.361 -0.807 1
1 830 . 17 1 1 A 78 78 ILE HA H 77 3.159 3.498 -0.339 1
1 840 . 17 1 1 A 78 78 ILE C C 77 177.341 177.775 -0.434 1
1 841 . 17 1 1 A 78 78 ILE CA C 77 65.177 65.270 -0.093 1
1 842 . 17 1 1 A 78 78 ILE CB C 77 37.339 37.978 -0.639 1
1 846 . 17 1 1 A 78 78 ILE N N 77 117.672 121.821 -4.149 1
1 847 . 17 1 1 A 79 79 GLU H H 78 8.296 7.994 0.302 1
1 848 . 17 1 1 A 79 79 GLU HA H 78 3.557 3.699 -0.142 1
1 853 . 17 1 1 A 79 79 GLU C C 78 177.742 178.567 -0.825 1
1 854 . 17 1 1 A 79 79 GLU CA C 78 60.847 59.983 0.864 1
1 855 . 17 1 1 A 79 79 GLU CB C 78 29.594 29.063 0.531 1
1 857 . 17 1 1 A 79 79 GLU N N 78 118.701 120.837 -2.136 1
1 858 . 17 1 1 A 80 80 GLU H H 79 8.330 8.268 0.062 1
1 859 . 17 1 1 A 80 80 GLU HA H 79 3.774 3.972 -0.198 1
1 864 . 17 1 1 A 80 80 GLU C C 79 179.926 179.356 0.570 1
1 865 . 17 1 1 A 80 80 GLU CA C 79 59.581 58.911 0.670 1
1 866 . 17 1 1 A 80 80 GLU CB C 79 29.062 28.990 0.072 1
1 868 . 17 1 1 A 80 80 GLU N N 79 116.767 118.017 -1.250 1
1 869 . 17 1 1 A 81 81 GLN H H 80 7.634 7.606 0.028 1
1 870 . 17 1 1 A 81 81 GLN HA H 80 3.605 3.849 -0.244 1
1 877 . 17 1 1 A 81 81 GLN C C 80 179.681 178.400 1.281 1
1 878 . 17 1 1 A 81 81 GLN CA C 80 57.765 58.333 -0.568 1
1 879 . 17 1 1 A 81 81 GLN CB C 80 28.079 27.992 0.087 1
1 881 . 17 1 1 A 81 81 GLN N N 80 116.325 118.563 -2.238 1
1 883 . 17 1 1 A 82 82 LEU H H 81 8.156 7.458 0.698 1
1 884 . 17 1 1 A 82 82 LEU HA H 81 3.536 3.737 -0.201 1
1 894 . 17 1 1 A 82 82 LEU C C 81 178.945 179.335 -0.390 1
1 895 . 17 1 1 A 82 82 LEU CA C 81 57.761 56.734 1.027 1
1 896 . 17 1 1 A 82 82 LEU CB C 81 40.961 40.968 -0.007 1
1 900 . 17 1 1 A 82 82 LEU N N 81 121.546 120.206 1.340 1
1 901 . 17 1 1 A 83 83 LEU H H 82 8.326 8.037 0.289 1
1 902 . 17 1 1 A 83 83 LEU HA H 82 4.198 4.219 -0.021 1
1 912 . 17 1 1 A 83 83 LEU C C 82 178.631 179.179 -0.548 1
1 913 . 17 1 1 A 83 83 LEU CA C 82 57.016 56.912 0.104 1
1 914 . 17 1 1 A 83 83 LEU CB C 82 42.182 40.863 1.319 1
1 918 . 17 1 1 A 83 83 LEU N N 82 120.426 119.033 1.393 1
1 919 . 17 1 1 A 84 84 GLN H H 83 6.992 7.652 -0.660 1
1 920 . 17 1 1 A 84 84 GLN HA H 83 3.877 4.001 -0.124 1
1 927 . 17 1 1 A 84 84 GLN C C 83 177.008 176.562 0.446 1
1 928 . 17 1 1 A 84 84 GLN CA C 83 57.543 58.261 -0.718 1
1 929 . 17 1 1 A 84 84 GLN CB C 83 28.688 28.517 0.171 1
1 931 . 17 1 1 A 84 84 GLN N N 83 114.001 117.244 -3.243 1
1 933 . 17 1 1 A 85 85 ARG H H 84 7.072 7.593 -0.521 1
1 934 . 17 1 1 A 85 85 ARG HA H 84 4.047 4.426 -0.379 1
1 942 . 17 1 1 A 85 85 ARG C C 84 175.999 175.396 0.603 1
1 943 . 17 1 1 A 85 85 ARG CA C 84 56.764 56.516 0.248 1
1 944 . 17 1 1 A 85 85 ARG CB C 84 32.044 32.256 -0.212 1
1 947 . 17 1 1 A 85 85 ARG N N 84 115.827 118.792 -2.965 1
1 949 . 17 1 1 A 86 86 ILE H H 85 8.238 7.367 0.871 1
1 950 . 17 1 1 A 86 86 ILE HA H 85 4.389 4.536 -0.147 1
1 960 . 17 1 1 A 86 86 ILE CA C 85 58.007 57.801 0.206 1
1 961 . 17 1 1 A 86 86 ILE CB C 85 39.604 39.101 0.503 1
1 965 . 17 1 1 A 86 86 ILE N N 85 119.285 117.938 1.347 1
1 966 . 17 1 1 A 87 87 PRO HA H 86 4.392 4.554 -0.162 1
1 973 . 17 1 1 A 87 87 PRO C C 86 177.622 176.778 0.844 1
1 974 . 17 1 1 A 87 87 PRO CA C 86 64.665 64.243 0.422 1
1 975 . 17 1 1 A 87 87 PRO CB C 86 32.020 31.795 0.225 1
1 978 . 17 1 1 A 88 88 GLU H H 87 8.312 8.227 0.085 1
1 979 . 17 1 1 A 88 88 GLU HA H 87 4.208 4.552 -0.344 1
1 984 . 17 1 1 A 88 88 GLU C C 87 175.554 175.735 -0.181 1
1 985 . 17 1 1 A 88 88 GLU CA C 87 56.045 56.187 -0.142 1
1 986 . 17 1 1 A 88 88 GLU CB C 87 28.654 30.134 -1.480 1
1 988 . 17 1 1 A 88 88 GLU N N 87 114.256 117.024 -2.768 1
1 989 . 17 1 1 A 89 89 PHE H H 88 7.946 7.325 0.621 1
1 990 . 17 1 1 A 89 89 PHE HA H 88 3.993 4.358 -0.365 1
1 998 . 17 1 1 A 89 89 PHE C C 88 173.460 174.577 -1.117 1
1 999 . 17 1 1 A 89 89 PHE CA C 88 60.119 59.517 0.602 1
1 1000 . 17 1 1 A 89 89 PHE CB C 88 39.994 39.662 0.332 1
1 1006 . 17 1 1 A 89 89 PHE N N 88 121.550 123.480 -1.930 1
1 1007 . 17 1 1 A 90 90 ASN H H 89 7.266 7.846 -0.580 1
1 1008 . 17 1 1 A 90 90 ASN HA H 89 4.454 5.093 -0.639 1
1 1013 . 17 1 1 A 90 90 ASN C C 89 173.921 175.159 -1.238 1
1 1014 . 17 1 1 A 90 90 ASN CA C 89 51.839 51.691 0.148 1
1 1015 . 17 1 1 A 90 90 ASN CB C 89 40.674 39.680 0.994 1
1 1016 . 17 1 1 A 90 90 ASN N N 89 125.344 125.014 0.330 1
1 1018 . 17 1 1 A 91 91 MET H H 90 8.968 8.897 0.071 1
1 1019 . 17 1 1 A 91 91 MET HA H 90 4.049 4.066 -0.017 1
1 1027 . 17 1 1 A 91 91 MET C C 90 177.475 178.160 -0.685 1
1 1028 . 17 1 1 A 91 91 MET CA C 90 57.758 58.643 -0.885 1
1 1029 . 17 1 1 A 91 91 MET CB C 90 32.250 31.944 0.306 1
1 1032 . 17 1 1 A 91 91 MET N N 90 127.052 125.174 1.878 1
1 1033 . 17 1 1 A 92 92 ALA H H 91 8.292 8.028 0.264 1
1 1034 . 17 1 1 A 92 92 ALA HA H 91 4.059 4.133 -0.074 1
1 1038 . 17 1 1 A 92 92 ALA C C 91 180.412 179.727 0.685 1
1 1039 . 17 1 1 A 92 92 ALA CA C 91 55.368 54.853 0.515 1
1 1040 . 17 1 1 A 92 92 ALA CB C 91 17.527 18.741 -1.214 1
1 1041 . 17 1 1 A 92 92 ALA N N 91 123.752 121.548 2.204 1
1 1042 . 17 1 1 A 93 93 ALA H H 92 7.931 8.040 -0.109 1
1 1043 . 17 1 1 A 93 93 ALA HA H 92 4.054 4.091 -0.037 1
1 1047 . 17 1 1 A 93 93 ALA C C 92 180.482 179.851 0.631 1
1 1048 . 17 1 1 A 93 93 ALA CA C 92 54.614 54.903 -0.289 1
1 1049 . 17 1 1 A 93 93 ALA CB C 92 18.098 18.119 -0.021 1
1 1050 . 17 1 1 A 93 93 ALA N N 92 121.158 120.160 0.998 1
1 1051 . 17 1 1 A 94 94 PHE H H 93 8.110 7.929 0.181 1
1 1052 . 17 1 1 A 94 94 PHE HA H 93 4.304 4.098 0.206 1
1 1060 . 17 1 1 A 94 94 PHE C C 93 177.350 177.076 0.274 1
1 1061 . 17 1 1 A 94 94 PHE CA C 93 61.641 61.425 0.216 1
1 1062 . 17 1 1 A 94 94 PHE CB C 93 40.014 39.341 0.673 1
1 1068 . 17 1 1 A 94 94 PHE N N 93 119.807 119.711 0.096 1
1 1069 . 17 1 1 A 95 95 THR H H 94 8.726 8.122 0.604 1
1 1070 . 17 1 1 A 95 95 THR HA H 94 3.569 3.924 -0.355 1
1 1075 . 17 1 1 A 95 95 THR C C 94 176.932 176.851 0.081 1
1 1076 . 17 1 1 A 95 95 THR CA C 94 66.833 65.609 1.224 1
1 1077 . 17 1 1 A 95 95 THR CB C 94 68.445 68.274 0.171 1
1 1079 . 17 1 1 A 95 95 THR N N 94 113.074 112.035 1.039 1
1 1080 . 17 1 1 A 96 96 THR H H 95 7.657 7.854 -0.197 1
1 1081 . 17 1 1 A 96 96 THR HA H 95 3.945 4.099 -0.154 1
1 1086 . 17 1 1 A 96 96 THR C C 95 176.386 176.290 0.096 1
1 1087 . 17 1 1 A 96 96 THR CA C 95 66.550 65.980 0.570 1
1 1088 . 17 1 1 A 96 96 THR CB C 95 68.583 68.710 -0.127 1
1 1090 . 17 1 1 A 96 96 THR N N 95 117.927 116.661 1.266 1
1 1091 . 17 1 1 A 97 97 THR H H 96 7.699 7.762 -0.063 1
1 1092 . 17 1 1 A 97 97 THR HA H 96 3.905 4.022 -0.117 1
1 1097 . 17 1 1 A 97 97 THR C C 96 176.572 176.370 0.202 1
1 1098 . 17 1 1 A 97 97 THR CA C 96 65.979 66.278 -0.299 1
1 1099 . 17 1 1 A 97 97 THR CB C 96 68.553 68.337 0.216 1
1 1101 . 17 1 1 A 97 97 THR N N 96 118.518 116.530 1.988 1
1 1102 . 17 1 1 A 98 98 LEU H H 97 8.304 8.191 0.113 1
1 1103 . 17 1 1 A 98 98 LEU HA H 97 3.725 3.961 -0.236 1
1 1113 . 17 1 1 A 98 98 LEU C C 97 178.490 178.766 -0.276 1
1 1114 . 17 1 1 A 98 98 LEU CA C 97 58.517 58.039 0.478 1
1 1115 . 17 1 1 A 98 98 LEU CB C 97 41.697 41.179 0.518 1
1 1119 . 17 1 1 A 98 98 LEU N N 97 122.882 121.890 0.992 1
1 1120 . 17 1 1 A 99 99 GLN H H 98 7.639 7.802 -0.163 1
1 1121 . 17 1 1 A 99 99 GLN HA H 98 3.927 4.039 -0.112 1
1 1128 . 17 1 1 A 99 99 GLN C C 98 178.068 178.106 -0.038 1
1 1129 . 17 1 1 A 99 99 GLN CA C 98 58.735 59.016 -0.281 1
1 1130 . 17 1 1 A 99 99 GLN CB C 98 27.986 28.146 -0.160 1
1 1132 . 17 1 1 A 99 99 GLN N N 98 114.302 118.499 -4.197 1
1 1134 . 17 1 1 A 100 100 HIS H H 99 7.575 7.176 0.399 1
1 1135 . 17 1 1 A 100 100 HIS HA H 99 4.524 4.495 0.029 1
1 1139 . 17 1 1 A 100 100 HIS C C 99 174.789 177.521 -2.732 1
1 1140 . 17 1 1 A 100 100 HIS CA C 99 56.154 59.014 -2.860 1
1 1141 . 17 1 1 A 100 100 HIS CB C 99 28.946 31.051 -2.105 1
1 1143 . 17 1 1 A 100 100 HIS N N 99 114.778 118.529 -3.751 1
1 1144 . 17 1 1 A 101 101 HIS H H 100 7.773 8.266 -0.493 1
1 1145 . 17 1 1 A 101 101 HIS HA H 100 4.704 4.359 0.345 1
1 1149 . 17 1 1 A 101 101 HIS C C 100 174.818 177.214 -2.396 1
1 1150 . 17 1 1 A 101 101 HIS CA C 100 54.830 58.869 -4.039 1
1 1151 . 17 1 1 A 101 101 HIS CB C 100 29.749 28.575 1.174 1
1 1153 . 17 1 1 A 101 101 HIS N N 100 117.397 117.647 -0.250 1
1 1154 . 17 1 1 A 102 102 LYS H H 101 7.324 8.248 -0.924 1
1 1155 . 17 1 1 A 102 102 LYS HA H 101 3.611 4.049 -0.438 1
1 1164 . 17 1 1 A 102 102 LYS C C 101 176.823 178.737 -1.914 1
1 1165 . 17 1 1 A 102 102 LYS CA C 101 59.915 58.919 0.996 1
1 1166 . 17 1 1 A 102 102 LYS CB C 101 32.825 32.090 0.735 1
1 1170 . 17 1 1 A 102 102 LYS N N 101 120.533 121.835 -1.302 1
1 1171 . 17 1 1 A 103 103 ASP H H 102 8.361 7.836 0.525 1
1 1172 . 17 1 1 A 103 103 ASP HA H 102 4.421 4.440 -0.019 1
1 1175 . 17 1 1 A 103 103 ASP C C 102 176.793 177.989 -1.196 1
1 1176 . 17 1 1 A 103 103 ASP CA C 102 55.500 57.310 -1.810 1
1 1177 . 17 1 1 A 103 103 ASP CB C 102 40.178 41.634 -1.456 1
1 1178 . 17 1 1 A 103 103 ASP N N 102 114.814 119.483 -4.669 1
1 1179 . 17 1 1 A 104 104 GLU H H 103 7.858 7.663 0.195 1
1 1180 . 17 1 1 A 104 104 GLU HA H 103 4.339 4.416 -0.077 1
1 1183 . 17 1 1 A 104 104 GLU C C 103 175.777 177.036 -1.259 1
1 1184 . 17 1 1 A 104 104 GLU CA C 103 56.356 57.724 -1.368 1
1 1185 . 17 1 1 A 104 104 GLU CB C 103 31.293 31.012 0.281 1
1 1186 . 17 1 1 A 104 104 GLU N N 103 116.826 117.968 -1.142 1
1 1187 . 17 1 1 A 105 105 VAL H H 104 7.201 7.438 -0.237 1
1 1188 . 17 1 1 A 105 105 VAL HA H 104 4.296 4.082 0.214 1
1 1196 . 17 1 1 A 105 105 VAL C C 104 174.482 176.055 -1.573 1
1 1197 . 17 1 1 A 105 105 VAL CA C 104 60.370 63.120 -2.750 1
1 1198 . 17 1 1 A 105 105 VAL CB C 104 34.341 32.172 2.169 1
1 1201 . 17 1 1 A 105 105 VAL N N 104 116.422 119.511 -3.089 1
1 1202 . 17 1 1 A 106 106 ALA H H 105 8.487 8.468 0.019 1
1 1203 . 17 1 1 A 106 106 ALA HA H 105 4.172 4.416 -0.244 1
1 1207 . 17 1 1 A 106 106 ALA C C 105 179.030 178.904 0.126 1
1 1208 . 17 1 1 A 106 106 ALA CA C 105 52.966 52.617 0.349 1
1 1209 . 17 1 1 A 106 106 ALA CB C 105 19.371 19.714 -0.343 1
1 1210 . 17 1 1 A 106 106 ALA N N 105 128.313 128.423 -0.110 1
1 1211 . 17 1 1 A 107 107 GLY H H 106 8.738 8.802 -0.064 1
1 1212 . 17 1 1 A 107 107 GLY HA2 H 106 3.773 3.869 -0.096 1
1 1213 . 17 1 1 A 107 107 GLY HA3 H 106 3.998 3.935 0.063 1
1 1214 . 17 1 1 A 107 107 GLY C C 106 174.958 175.410 -0.452 1
1 1215 . 17 1 1 A 107 107 GLY CA C 106 47.449 47.187 0.262 1
1 1216 . 17 1 1 A 107 107 GLY N N 106 110.612 110.958 -0.346 1
1 1217 . 17 1 1 A 108 108 ASP H H 107 8.535 7.856 0.679 1
1 1218 . 17 1 1 A 108 108 ASP HA H 107 4.333 4.361 -0.028 1
1 1221 . 17 1 1 A 108 108 ASP C C 107 179.133 178.957 0.176 1
1 1222 . 17 1 1 A 108 108 ASP CA C 107 56.721 56.248 0.473 1
1 1223 . 17 1 1 A 108 108 ASP CB C 107 39.336 40.675 -1.339 1
1 1224 . 17 1 1 A 108 108 ASP N N 107 117.474 122.187 -4.713 1
1 1225 . 17 1 1 A 109 109 ILE H H 108 7.459 7.906 -0.447 1
1 1226 . 17 1 1 A 109 109 ILE HA H 108 3.688 3.841 -0.153 1
1 1236 . 17 1 1 A 109 109 ILE C C 108 176.735 178.499 -1.764 1
1 1237 . 17 1 1 A 109 109 ILE CA C 108 63.474 65.381 -1.907 1
1 1238 . 17 1 1 A 109 109 ILE CB C 108 37.340 37.783 -0.443 1
1 1242 . 17 1 1 A 109 109 ILE N N 108 119.609 119.734 -0.125 1
1 1243 . 17 1 1 A 110 110 PHE H H 109 7.920 8.357 -0.437 1
1 1244 . 17 1 1 A 110 110 PHE HA H 109 3.759 4.090 -0.331 1
1 1252 . 17 1 1 A 110 110 PHE C C 109 177.132 177.272 -0.140 1
1 1253 . 17 1 1 A 110 110 PHE CA C 109 62.766 61.232 1.534 1
1 1254 . 17 1 1 A 110 110 PHE CB C 109 39.752 39.316 0.436 1
1 1260 . 17 1 1 A 110 110 PHE N N 109 120.906 120.424 0.482 1
1 1261 . 17 1 1 A 111 111 ASP H H 110 8.639 8.292 0.347 1
1 1262 . 17 1 1 A 111 111 ASP HA H 110 4.216 4.225 -0.009 1
1 1265 . 17 1 1 A 111 111 ASP C C 110 178.900 178.421 0.479 1
1 1266 . 17 1 1 A 111 111 ASP CA C 110 57.105 57.308 -0.203 1
1 1267 . 17 1 1 A 111 111 ASP CB C 110 39.697 42.038 -2.341 1
1 1268 . 17 1 1 A 111 111 ASP N N 110 117.124 118.763 -1.639 1
1 1269 . 17 1 1 A 112 112 MET H H 111 7.331 7.596 -0.265 1
1 1270 . 17 1 1 A 112 112 MET HA H 111 4.081 4.121 -0.040 1
1 1278 . 17 1 1 A 112 112 MET C C 111 179.052 178.134 0.918 1
1 1279 . 17 1 1 A 112 112 MET CA C 111 58.202 57.971 0.231 1
1 1280 . 17 1 1 A 112 112 MET CB C 111 31.827 32.363 -0.536 1
1 1283 . 17 1 1 A 112 112 MET N N 111 118.061 119.392 -1.331 1
1 1284 . 17 1 1 A 113 113 LEU H H 112 8.001 8.011 -0.010 1
1 1285 . 17 1 1 A 113 113 LEU HA H 112 3.723 3.637 0.086 1
1 1295 . 17 1 1 A 113 113 LEU C C 112 179.747 178.814 0.933 1
1 1296 . 17 1 1 A 113 113 LEU CA C 112 57.371 57.462 -0.091 1
1 1297 . 17 1 1 A 113 113 LEU CB C 112 40.671 41.085 -0.414 1
1 1301 . 17 1 1 A 113 113 LEU N N 112 120.426 119.836 0.590 1
1 1302 . 17 1 1 A 114 114 LEU H H 113 7.744 7.406 0.338 1
1 1303 . 17 1 1 A 114 114 LEU HA H 113 4.007 3.636 0.371 1
1 1313 . 17 1 1 A 114 114 LEU C C 113 179.358 178.928 0.430 1
1 1314 . 17 1 1 A 114 114 LEU CA C 113 57.202 57.458 -0.256 1
1 1315 . 17 1 1 A 114 114 LEU CB C 113 41.727 41.129 0.598 1
1 1319 . 17 1 1 A 114 114 LEU N N 113 119.584 118.384 1.200 1
1 1320 . 17 1 1 A 115 115 THR H H 114 7.353 7.764 -0.411 1
1 1321 . 17 1 1 A 115 115 THR HA H 114 4.071 4.162 -0.091 1
1 1327 . 17 1 1 A 115 115 THR C C 114 173.591 176.694 -3.103 1
1 1328 . 17 1 1 A 115 115 THR CA C 114 65.332 64.873 0.459 1
1 1329 . 17 1 1 A 115 115 THR CB C 114 70.319 68.617 1.702 1
1 1331 . 17 1 1 A 115 115 THR N N 114 107.535 111.116 -3.581 1
1 1332 . 17 1 1 A 116 116 PHE H H 115 6.979 7.964 -0.985 1
1 1333 . 17 1 1 A 116 116 PHE HA H 115 5.022 4.398 0.624 1
1 1341 . 17 1 1 A 116 116 PHE C C 115 176.488 176.556 -0.068 1
1 1342 . 17 1 1 A 116 116 PHE CA C 115 55.911 60.954 -5.043 1
1 1343 . 17 1 1 A 116 116 PHE CB C 115 38.521 39.156 -0.635 1
1 1349 . 17 1 1 A 116 116 PHE N N 115 112.366 119.994 -7.628 1
1 1350 . 17 1 1 A 117 117 THR H H 116 7.564 7.703 -0.139 1
1 1351 . 17 1 1 A 117 117 THR HA H 116 4.626 4.847 -0.221 1
1 1356 . 17 1 1 A 117 117 THR C C 116 174.085 174.320 -0.235 1
1 1357 . 17 1 1 A 117 117 THR CA C 116 61.636 62.097 -0.461 1
1 1358 . 17 1 1 A 117 117 THR CB C 116 70.915 70.903 0.012 1
1 1360 . 17 1 1 A 117 117 THR N N 116 105.498 106.143 -0.645 1
1 1361 . 17 1 1 A 118 118 ASP H H 117 8.270 7.989 0.281 1
1 1362 . 17 1 1 A 118 118 ASP HA H 117 4.955 4.678 0.277 1
1 1365 . 17 1 1 A 118 118 ASP C C 117 176.328 176.408 -0.080 1
1 1366 . 17 1 1 A 118 118 ASP CA C 117 53.417 53.395 0.022 1
1 1367 . 17 1 1 A 118 118 ASP CB C 117 43.388 40.442 2.946 1
1 1368 . 17 1 1 A 118 118 ASP N N 117 124.409 122.021 2.388 1
1 1369 . 17 1 1 A 119 119 PHE H H 118 8.973 8.782 0.191 1
1 1370 . 17 1 1 A 119 119 PHE HA H 118 3.506 4.119 -0.613 1
1 1378 . 17 1 1 A 119 119 PHE CA C 118 61.490 61.073 0.417 1
1 1379 . 17 1 1 A 119 119 PHE CB C 118 39.246 39.469 -0.223 1
1 1385 . 17 1 1 A 119 119 PHE N N 118 126.688 126.389 0.299 1
1 1386 . 17 1 1 A 120 120 LEU H H 119 8.099 8.278 -0.179 1
1 1387 . 17 1 1 A 120 120 LEU HA H 119 3.842 3.954 -0.112 1
1 1397 . 17 1 1 A 120 120 LEU C C 119 179.601 179.435 0.166 1
1 1398 . 17 1 1 A 120 120 LEU CA C 119 58.174 57.914 0.260 1
1 1399 . 17 1 1 A 120 120 LEU CB C 119 40.315 41.027 -0.712 1
1 1403 . 17 1 1 A 120 120 LEU N N 119 117.930 119.817 -1.887 1
1 1404 . 17 1 1 A 121 121 ALA H H 120 7.729 7.964 -0.235 1
1 1405 . 17 1 1 A 121 121 ALA HA H 120 3.996 4.130 -0.134 1
1 1409 . 17 1 1 A 121 121 ALA C C 120 180.995 179.589 1.406 1
1 1410 . 17 1 1 A 121 121 ALA CA C 120 54.832 54.634 0.198 1
1 1411 . 17 1 1 A 121 121 ALA CB C 120 17.706 18.282 -0.576 1
1 1412 . 17 1 1 A 121 121 ALA N N 120 123.195 121.293 1.902 1
1 1413 . 17 1 1 A 122 122 PHE H H 121 7.943 7.817 0.126 1
1 1414 . 17 1 1 A 122 122 PHE HA H 121 3.887 3.998 -0.111 1
1 1419 . 17 1 1 A 122 122 PHE C C 121 175.410 177.155 -1.745 1
1 1420 . 17 1 1 A 122 122 PHE CA C 121 61.075 60.783 0.292 1
1 1421 . 17 1 1 A 122 122 PHE CB C 121 38.115 38.797 -0.682 1
1 1424 . 17 1 1 A 122 122 PHE N N 121 121.798 120.196 1.602 1
1 1425 . 17 1 1 A 123 123 LYS H H 122 8.468 7.676 0.792 1
1 1426 . 17 1 1 A 123 123 LYS HA H 122 3.077 3.727 -0.650 1
1 1435 . 17 1 1 A 123 123 LYS C C 122 178.453 178.318 0.135 1
1 1436 . 17 1 1 A 123 123 LYS CA C 122 59.855 59.736 0.119 1
1 1437 . 17 1 1 A 123 123 LYS CB C 122 32.374 31.974 0.400 1
1 1441 . 17 1 1 A 123 123 LYS N N 122 120.614 118.929 1.685 1
1 1442 . 17 1 1 A 124 124 GLU H H 123 8.100 7.747 0.353 1
1 1443 . 17 1 1 A 124 124 GLU HA H 123 3.652 4.074 -0.422 1
1 1448 . 17 1 1 A 124 124 GLU C C 123 177.743 178.636 -0.893 1
1 1449 . 17 1 1 A 124 124 GLU CA C 123 59.406 59.268 0.138 1
1 1450 . 17 1 1 A 124 124 GLU CB C 123 28.811 29.160 -0.349 1
1 1452 . 17 1 1 A 124 124 GLU N N 123 117.404 119.028 -1.624 1
1 1453 . 17 1 1 A 125 125 MET H H 124 7.537 7.752 -0.215 1
1 1454 . 17 1 1 A 125 125 MET HA H 124 3.860 3.968 -0.108 1
1 1462 . 17 1 1 A 125 125 MET C C 124 179.522 178.318 1.204 1
1 1463 . 17 1 1 A 125 125 MET CA C 124 58.832 58.321 0.511 1
1 1464 . 17 1 1 A 125 125 MET CB C 124 31.765 31.583 0.182 1
1 1467 . 17 1 1 A 125 125 MET N N 124 119.413 119.173 0.240 1
1 1468 . 17 1 1 A 126 126 PHE H H 125 7.148 7.639 -0.491 1
1 1469 . 17 1 1 A 126 126 PHE HA H 125 3.633 4.171 -0.538 1
1 1476 . 17 1 1 A 126 126 PHE C C 125 178.994 178.196 0.798 1
1 1477 . 17 1 1 A 126 126 PHE CA C 125 63.148 60.850 2.298 1
1 1478 . 17 1 1 A 126 126 PHE CB C 125 39.830 38.415 1.415 1
1 1483 . 17 1 1 A 126 126 PHE N N 125 120.013 118.386 1.627 1
1 1484 . 17 1 1 A 127 127 LEU H H 126 8.369 8.523 -0.154 1
1 1485 . 17 1 1 A 127 127 LEU HA H 126 3.972 4.067 -0.095 1
1 1495 . 17 1 1 A 127 127 LEU C C 126 180.621 178.285 2.336 1
1 1496 . 17 1 1 A 127 127 LEU CA C 126 57.944 58.222 -0.278 1
1 1497 . 17 1 1 A 127 127 LEU CB C 126 40.543 41.333 -0.790 1
1 1501 . 17 1 1 A 127 127 LEU N N 126 119.692 120.599 -0.907 1
1 1502 . 17 1 1 A 128 128 ASP H H 127 8.578 8.063 0.515 1
1 1503 . 17 1 1 A 128 128 ASP HA H 127 4.308 4.355 -0.047 1
1 1506 . 17 1 1 A 128 128 ASP C C 127 178.254 178.053 0.201 1
1 1507 . 17 1 1 A 128 128 ASP CA C 127 56.964 57.180 -0.216 1
1 1508 . 17 1 1 A 128 128 ASP CB C 127 39.735 40.622 -0.887 1
1 1509 . 17 1 1 A 128 128 ASP N N 127 121.926 118.692 3.234 1
1 1510 . 17 1 1 A 129 129 TYR H H 128 7.710 8.057 -0.347 1
1 1511 . 17 1 1 A 129 129 TYR HA H 128 3.908 4.005 -0.097 1
1 1518 . 17 1 1 A 129 129 TYR C C 128 177.633 177.742 -0.109 1
1 1519 . 17 1 1 A 129 129 TYR CA C 128 61.796 61.652 0.144 1
1 1520 . 17 1 1 A 129 129 TYR CB C 128 39.372 38.801 0.571 1
1 1525 . 17 1 1 A 129 129 TYR N N 128 122.548 120.354 2.194 1
1 1526 . 17 1 1 A 130 130 ARG H H 129 8.622 8.327 0.295 1
1 1527 . 17 1 1 A 130 130 ARG HA H 129 3.722 3.953 -0.231 1
1 1535 . 17 1 1 A 130 130 ARG CA C 129 60.084 59.439 0.645 1
1 1536 . 17 1 1 A 130 130 ARG CB C 129 29.902 29.989 -0.087 1
1 1539 . 17 1 1 A 130 130 ARG N N 129 118.302 119.598 -1.296 1
1 1541 . 17 1 1 A 131 131 ALA H H 130 7.936 7.987 -0.051 1
1 1542 . 17 1 1 A 131 131 ALA HA H 130 3.997 4.032 -0.035 1
1 1546 . 17 1 1 A 131 131 ALA C C 130 180.456 179.725 0.731 1
1 1547 . 17 1 1 A 131 131 ALA CA C 130 55.133 54.951 0.182 1
1 1548 . 17 1 1 A 131 131 ALA CB C 130 17.750 18.187 -0.437 1
1 1549 . 17 1 1 A 131 131 ALA N N 130 119.788 121.709 -1.921 1
1 1550 . 17 1 1 A 132 132 GLU H H 131 7.622 7.695 -0.073 1
1 1551 . 17 1 1 A 132 132 GLU HA H 131 3.862 4.012 -0.150 1
1 1556 . 17 1 1 A 132 132 GLU C C 131 179.528 177.966 1.562 1
1 1557 . 17 1 1 A 132 132 GLU CA C 131 58.849 58.723 0.126 1
1 1558 . 17 1 1 A 132 132 GLU CB C 131 28.930 29.132 -0.202 1
1 1560 . 17 1 1 A 132 132 GLU N N 131 118.428 117.841 0.587 1
1 1561 . 17 1 1 A 133 133 LYS H H 132 7.853 7.593 0.260 1
1 1562 . 17 1 1 A 133 133 LYS HA H 132 3.722 4.090 -0.368 1
1 1571 . 17 1 1 A 133 133 LYS C C 132 175.725 177.654 -1.929 1
1 1572 . 17 1 1 A 133 133 LYS CA C 132 57.544 58.321 -0.777 1
1 1573 . 17 1 1 A 133 133 LYS CB C 132 31.770 31.996 -0.226 1
1 1577 . 17 1 1 A 133 133 LYS N N 132 119.473 118.904 0.569 1
1 1578 . 17 1 1 A 134 134 GLU H H 133 8.151 7.989 0.162 1
1 1579 . 17 1 1 A 134 134 GLU HA H 133 4.161 4.448 -0.287 1
1 1584 . 17 1 1 A 134 134 GLU C C 133 177.453 177.991 -0.538 1
1 1585 . 17 1 1 A 134 134 GLU CA C 133 57.222 56.743 0.479 1
1 1586 . 17 1 1 A 134 134 GLU CB C 133 30.091 30.219 -0.128 1
1 1588 . 17 1 1 A 134 134 GLU N N 133 116.525 118.448 -1.923 1
1 1589 . 17 1 1 A 135 135 GLY H H 134 7.702 8.108 -0.406 1
1 1590 . 17 1 1 A 135 135 GLY HA2 H 134 3.896 3.681 0.215 1
1 1591 . 17 1 1 A 135 135 GLY HA3 H 134 3.897 3.691 0.206 1
1 1592 . 17 1 1 A 135 135 GLY C C 134 174.538 175.586 -1.048 1
1 1593 . 17 1 1 A 135 135 GLY CA C 134 45.975 47.021 -1.046 1
1 1594 . 17 1 1 A 135 135 GLY N N 134 107.924 109.867 -1.943 1
1 1595 . 17 1 1 A 136 136 ARG H H 135 8.045 7.915 0.130 1
1 1596 . 17 1 1 A 136 136 ARG HA H 135 4.323 4.267 0.056 1
1 1604 . 17 1 1 A 136 136 ARG C C 135 175.864 176.901 -1.037 1
1 1605 . 17 1 1 A 136 136 ARG CA C 135 56.016 55.399 0.617 1
1 1606 . 17 1 1 A 136 136 ARG CB C 135 30.987 29.630 1.357 1
1 1609 . 17 1 1 A 136 136 ARG N N 135 119.708 118.051 1.657 1
1 1 . 18 1 1 A 14 14 PHE CA C 13 58.199 56.760 1.439 1
1 2 . 18 1 1 A 14 14 PHE CB C 13 39.717 40.949 -1.232 1
1 3 . 18 1 1 A 15 15 SER H H 14 8.299 8.917 -0.618 1
1 4 . 18 1 1 A 15 15 SER HA H 14 4.359 4.845 -0.486 1
1 7 . 18 1 1 A 15 15 SER CA C 14 58.249 59.602 -1.353 1
1 8 . 18 1 1 A 15 15 SER CB C 14 63.936 65.332 -1.396 1
1 9 . 18 1 1 A 15 15 SER N N 14 117.379 119.753 -2.374 1
1 10 . 18 1 1 A 16 16 SER H H 15 8.255 8.742 -0.487 1
1 11 . 18 1 1 A 16 16 SER HA H 15 3.729 4.505 -0.776 1
1 14 . 18 1 1 A 16 16 SER CA C 15 58.224 61.483 -3.259 1
1 15 . 18 1 1 A 16 16 SER CB C 15 63.886 63.627 0.259 1
1 16 . 18 1 1 A 16 16 SER N N 15 117.694 118.350 -0.656 1
1 17 . 18 1 1 A 17 17 ALA H H 16 8.333 7.948 0.385 1
1 18 . 18 1 1 A 17 17 ALA HA H 16 4.252 4.178 0.074 1
1 22 . 18 1 1 A 17 17 ALA CA C 16 53.377 55.110 -1.733 1
1 23 . 18 1 1 A 17 17 ALA CB C 16 18.896 18.411 0.485 1
1 24 . 18 1 1 A 17 17 ALA N N 16 125.462 123.625 1.837 1
1 25 . 18 1 1 A 18 18 SER H H 17 8.219 7.677 0.542 1
1 26 . 18 1 1 A 18 18 SER HA H 17 4.332 4.422 -0.090 1
1 29 . 18 1 1 A 18 18 SER CA C 17 59.105 58.571 0.534 1
1 30 . 18 1 1 A 18 18 SER CB C 17 63.592 64.156 -0.564 1
1 31 . 18 1 1 A 18 18 SER N N 17 114.821 113.031 1.790 1
1 32 . 18 1 1 A 19 19 ASP H H 18 8.309 8.945 -0.636 1
1 33 . 18 1 1 A 19 19 ASP HA H 18 4.554 4.477 0.077 1
1 36 . 18 1 1 A 19 19 ASP C C 18 176.528 178.592 -2.064 1
1 37 . 18 1 1 A 19 19 ASP CA C 18 55.272 57.076 -1.804 1
1 38 . 18 1 1 A 19 19 ASP CB C 18 40.883 40.355 0.528 1
1 39 . 18 1 1 A 19 19 ASP N N 18 123.367 127.810 -4.443 1
1 40 . 18 1 1 A 20 20 ALA H H 19 8.133 7.908 0.225 1
1 41 . 18 1 1 A 20 20 ALA HA H 19 4.170 4.026 0.144 1
1 45 . 18 1 1 A 20 20 ALA C C 19 179.857 179.089 0.768 1
1 46 . 18 1 1 A 20 20 ALA CA C 19 54.341 55.561 -1.220 1
1 47 . 18 1 1 A 20 20 ALA CB C 19 18.660 18.651 0.009 1
1 48 . 18 1 1 A 20 20 ALA N N 19 123.350 122.909 0.441 1
1 49 . 18 1 1 A 21 21 GLU H H 20 8.140 8.136 0.004 1
1 50 . 18 1 1 A 21 21 GLU HA H 20 4.128 4.094 0.034 1
1 55 . 18 1 1 A 21 21 GLU C C 20 177.675 178.540 -0.865 1
1 56 . 18 1 1 A 21 21 GLU CA C 20 58.520 59.442 -0.922 1
1 57 . 18 1 1 A 21 21 GLU CB C 20 29.765 29.668 0.097 1
1 59 . 18 1 1 A 21 21 GLU N N 20 119.063 118.847 0.216 1
1 60 . 18 1 1 A 22 22 PHE H H 21 8.009 8.378 -0.369 1
1 61 . 18 1 1 A 22 22 PHE HA H 21 4.123 4.218 -0.095 1
1 68 . 18 1 1 A 22 22 PHE C C 21 176.410 176.844 -0.434 1
1 69 . 18 1 1 A 22 22 PHE CA C 21 62.202 61.930 0.272 1
1 70 . 18 1 1 A 22 22 PHE CB C 21 39.223 39.125 0.098 1
1 75 . 18 1 1 A 22 22 PHE N N 21 121.211 121.037 0.174 1
1 76 . 18 1 1 A 23 23 ASP H H 22 8.261 8.318 -0.057 1
1 77 . 18 1 1 A 23 23 ASP HA H 22 4.041 4.288 -0.247 1
1 80 . 18 1 1 A 23 23 ASP C C 22 179.078 178.079 0.999 1
1 81 . 18 1 1 A 23 23 ASP CA C 22 57.048 57.788 -0.740 1
1 82 . 18 1 1 A 23 23 ASP CB C 22 40.154 41.915 -1.761 1
1 83 . 18 1 1 A 23 23 ASP N N 22 116.876 119.330 -2.454 1
1 84 . 18 1 1 A 24 24 ALA H H 23 7.651 7.626 0.025 1
1 85 . 18 1 1 A 24 24 ALA HA H 23 3.785 3.836 -0.051 1
1 89 . 18 1 1 A 24 24 ALA C C 23 179.577 179.891 -0.314 1
1 90 . 18 1 1 A 24 24 ALA CA C 23 54.341 55.259 -0.918 1
1 91 . 18 1 1 A 24 24 ALA CB C 23 17.762 18.074 -0.312 1
1 92 . 18 1 1 A 24 24 ALA N N 23 121.873 121.667 0.206 1
1 93 . 18 1 1 A 25 25 VAL H H 24 7.718 8.083 -0.365 1
1 94 . 18 1 1 A 25 25 VAL HA H 24 3.216 3.593 -0.377 1
1 102 . 18 1 1 A 25 25 VAL C C 24 177.805 178.326 -0.521 1
1 103 . 18 1 1 A 25 25 VAL CA C 24 66.789 66.805 -0.016 1
1 104 . 18 1 1 A 25 25 VAL CB C 24 31.277 31.257 0.020 1
1 107 . 18 1 1 A 25 25 VAL N N 24 117.890 118.613 -0.723 1
1 108 . 18 1 1 A 26 26 VAL H H 25 7.867 7.612 0.255 1
1 109 . 18 1 1 A 26 26 VAL HA H 25 3.274 3.519 -0.245 1
1 117 . 18 1 1 A 26 26 VAL C C 25 177.788 177.690 0.098 1
1 118 . 18 1 1 A 26 26 VAL CA C 25 67.282 66.434 0.848 1
1 119 . 18 1 1 A 26 26 VAL CB C 25 31.266 31.419 -0.153 1
1 122 . 18 1 1 A 26 26 VAL N N 25 118.170 119.975 -1.805 1
1 123 . 18 1 1 A 27 27 GLY H H 26 7.544 7.600 -0.056 1
1 124 . 18 1 1 A 27 27 GLY HA2 H 26 3.592 3.501 0.091 1
1 125 . 18 1 1 A 27 27 GLY HA3 H 26 3.721 3.621 0.100 1
1 126 . 18 1 1 A 27 27 GLY C C 26 176.717 176.225 0.492 1
1 127 . 18 1 1 A 27 27 GLY CA C 26 47.085 47.169 -0.084 1
1 128 . 18 1 1 A 27 27 GLY N N 26 105.795 107.549 -1.754 1
1 129 . 18 1 1 A 28 28 TYR H H 27 7.625 7.296 0.329 1
1 130 . 18 1 1 A 28 28 TYR HA H 27 4.546 4.587 -0.041 1
1 137 . 18 1 1 A 28 28 TYR C C 27 178.991 178.128 0.863 1
1 138 . 18 1 1 A 28 28 TYR CA C 27 58.845 59.785 -0.940 1
1 139 . 18 1 1 A 28 28 TYR CB C 27 37.602 37.584 0.018 1
1 144 . 18 1 1 A 28 28 TYR N N 27 119.933 121.516 -1.583 1
1 145 . 18 1 1 A 29 29 LEU H H 28 8.517 8.450 0.067 1
1 146 . 18 1 1 A 29 29 LEU HA H 28 3.728 3.855 -0.127 1
1 156 . 18 1 1 A 29 29 LEU CA C 28 58.281 58.109 0.172 1
1 157 . 18 1 1 A 29 29 LEU CB C 28 41.948 41.471 0.477 1
1 161 . 18 1 1 A 29 29 LEU N N 28 119.669 120.237 -0.568 1
1 162 . 18 1 1 A 30 30 GLU H H 29 8.072 7.988 0.084 1
1 163 . 18 1 1 A 30 30 GLU HA H 29 3.722 3.878 -0.156 1
1 168 . 18 1 1 A 30 30 GLU C C 29 177.731 178.784 -1.053 1
1 169 . 18 1 1 A 30 30 GLU CA C 29 59.763 59.982 -0.219 1
1 170 . 18 1 1 A 30 30 GLU CB C 29 28.844 29.126 -0.282 1
1 172 . 18 1 1 A 30 30 GLU N N 29 117.666 117.685 -0.019 1
1 173 . 18 1 1 A 31 31 ASP H H 30 7.243 7.925 -0.682 1
1 174 . 18 1 1 A 31 31 ASP HA H 30 4.297 4.413 -0.116 1
1 177 . 18 1 1 A 31 31 ASP CA C 30 56.953 57.029 -0.076 1
1 178 . 18 1 1 A 31 31 ASP CB C 30 40.730 41.577 -0.847 1
1 179 . 18 1 1 A 31 31 ASP N N 30 116.720 119.035 -2.315 1
1 180 . 18 1 1 A 32 32 ILE H H 31 7.940 7.621 0.319 1
1 181 . 18 1 1 A 32 32 ILE HA H 31 3.640 3.703 -0.063 1
1 191 . 18 1 1 A 32 32 ILE C C 31 177.980 178.257 -0.277 1
1 192 . 18 1 1 A 32 32 ILE CA C 31 64.692 64.139 0.553 1
1 193 . 18 1 1 A 32 32 ILE CB C 31 38.938 37.080 1.858 1
1 197 . 18 1 1 A 32 32 ILE N N 31 119.728 118.774 0.954 1
1 198 . 18 1 1 A 33 33 ILE H H 32 7.984 7.986 -0.002 1
1 199 . 18 1 1 A 33 33 ILE HA H 32 3.598 3.157 0.441 1
1 209 . 18 1 1 A 33 33 ILE C C 32 176.723 177.223 -0.500 1
1 210 . 18 1 1 A 33 33 ILE CA C 32 63.241 64.623 -1.382 1
1 211 . 18 1 1 A 33 33 ILE CB C 32 37.580 37.964 -0.384 1
1 215 . 18 1 1 A 33 33 ILE N N 32 113.919 120.862 -6.943 1
1 216 . 18 1 1 A 34 34 MET H H 33 7.288 7.755 -0.467 1
1 217 . 18 1 1 A 34 34 MET HA H 33 4.496 4.645 -0.149 1
1 225 . 18 1 1 A 34 34 MET C C 33 176.423 175.642 0.781 1
1 226 . 18 1 1 A 34 34 MET CA C 33 54.634 54.567 0.067 1
1 227 . 18 1 1 A 34 34 MET CB C 33 31.934 31.139 0.795 1
1 230 . 18 1 1 A 34 34 MET N N 33 115.130 116.839 -1.709 1
1 231 . 18 1 1 A 35 35 ASP H H 34 7.405 7.437 -0.032 1
1 232 . 18 1 1 A 35 35 ASP HA H 34 4.484 4.489 -0.005 1
1 235 . 18 1 1 A 35 35 ASP C C 34 177.139 176.868 0.271 1
1 236 . 18 1 1 A 35 35 ASP CA C 34 54.625 54.915 -0.290 1
1 237 . 18 1 1 A 35 35 ASP CB C 34 43.554 42.560 0.994 1
1 238 . 18 1 1 A 35 35 ASP N N 34 121.814 122.219 -0.405 1
1 239 . 18 1 1 A 36 36 ASP H H 35 8.765 9.045 -0.280 1
1 240 . 18 1 1 A 36 36 ASP HA H 35 4.235 4.337 -0.102 1
1 243 . 18 1 1 A 36 36 ASP C C 35 178.320 178.425 -0.105 1
1 244 . 18 1 1 A 36 36 ASP CA C 35 57.832 57.127 0.705 1
1 245 . 18 1 1 A 36 36 ASP CB C 35 40.914 39.886 1.028 1
1 246 . 18 1 1 A 36 36 ASP N N 35 125.883 126.528 -0.645 1
1 247 . 18 1 1 A 37 37 GLU H H 36 8.905 7.821 1.084 1
1 248 . 18 1 1 A 37 37 GLU HA H 36 3.933 4.162 -0.229 1
1 253 . 18 1 1 A 37 37 GLU C C 36 179.304 179.032 0.272 1
1 254 . 18 1 1 A 37 37 GLU CA C 36 59.828 59.091 0.737 1
1 255 . 18 1 1 A 37 37 GLU CB C 36 29.380 29.167 0.213 1
1 257 . 18 1 1 A 37 37 GLU N N 36 119.077 120.782 -1.705 1
1 258 . 18 1 1 A 38 38 PHE H H 37 7.460 8.286 -0.826 1
1 259 . 18 1 1 A 38 38 PHE HA H 37 3.642 3.963 -0.321 1
1 267 . 18 1 1 A 38 38 PHE C C 37 176.483 177.849 -1.366 1
1 268 . 18 1 1 A 38 38 PHE CA C 37 61.411 61.085 0.326 1
1 269 . 18 1 1 A 38 38 PHE CB C 37 39.355 39.129 0.226 1
1 275 . 18 1 1 A 38 38 PHE N N 37 119.968 120.821 -0.853 1
1 276 . 18 1 1 A 39 39 GLN H H 38 7.968 8.270 -0.302 1
1 277 . 18 1 1 A 39 39 GLN HA H 38 3.712 3.856 -0.144 1
1 284 . 18 1 1 A 39 39 GLN CA C 38 59.153 58.746 0.407 1
1 285 . 18 1 1 A 39 39 GLN CB C 38 28.213 28.306 -0.093 1
1 287 . 18 1 1 A 39 39 GLN N N 38 116.433 118.370 -1.937 1
1 289 . 18 1 1 A 40 40 LEU H H 39 7.930 7.386 0.544 1
1 290 . 18 1 1 A 40 40 LEU HA H 39 3.916 4.027 -0.111 1
1 300 . 18 1 1 A 40 40 LEU C C 39 177.731 178.149 -0.418 1
1 301 . 18 1 1 A 40 40 LEU CA C 39 57.915 57.945 -0.030 1
1 302 . 18 1 1 A 40 40 LEU CB C 39 41.989 41.527 0.462 1
1 306 . 18 1 1 A 40 40 LEU N N 39 119.505 121.506 -2.001 1
1 307 . 18 1 1 A 41 41 LEU H H 40 7.174 7.866 -0.692 1
1 308 . 18 1 1 A 41 41 LEU HA H 40 3.835 4.031 -0.196 1
1 318 . 18 1 1 A 41 41 LEU C C 40 179.738 178.280 1.458 1
1 319 . 18 1 1 A 41 41 LEU CA C 40 58.266 58.254 0.012 1
1 320 . 18 1 1 A 41 41 LEU CB C 40 42.050 41.604 0.446 1
1 324 . 18 1 1 A 41 41 LEU N N 40 120.971 119.810 1.161 1
1 325 . 18 1 1 A 42 42 GLN H H 41 8.058 7.900 0.158 1
1 326 . 18 1 1 A 42 42 GLN HA H 41 3.556 3.701 -0.145 1
1 333 . 18 1 1 A 42 42 GLN C C 41 177.642 178.478 -0.836 1
1 334 . 18 1 1 A 42 42 GLN CA C 41 59.826 59.204 0.622 1
1 335 . 18 1 1 A 42 42 GLN CB C 41 28.762 28.356 0.406 1
1 337 . 18 1 1 A 42 42 GLN N N 41 117.899 118.026 -0.127 1
1 339 . 18 1 1 A 43 43 ARG H H 42 8.179 7.828 0.351 1
1 340 . 18 1 1 A 43 43 ARG HA H 42 3.655 3.956 -0.301 1
1 347 . 18 1 1 A 43 43 ARG C C 42 178.051 178.236 -0.185 1
1 348 . 18 1 1 A 43 43 ARG CA C 42 59.766 58.682 1.084 1
1 349 . 18 1 1 A 43 43 ARG CB C 42 29.941 29.950 -0.009 1
1 352 . 18 1 1 A 43 43 ARG N N 42 119.392 119.605 -0.213 1
1 353 . 18 1 1 A 44 44 ASN H H 43 8.525 7.978 0.547 1
1 354 . 18 1 1 A 44 44 ASN HA H 43 4.332 4.383 -0.051 1
1 359 . 18 1 1 A 44 44 ASN C C 43 178.150 177.788 0.362 1
1 360 . 18 1 1 A 44 44 ASN CA C 43 55.841 56.206 -0.365 1
1 361 . 18 1 1 A 44 44 ASN CB C 43 37.632 39.285 -1.653 1
1 362 . 18 1 1 A 44 44 ASN N N 43 116.214 117.687 -1.473 1
1 364 . 18 1 1 A 45 45 PHE H H 44 7.586 7.988 -0.402 1
1 365 . 18 1 1 A 45 45 PHE HA H 44 4.132 4.304 -0.172 1
1 372 . 18 1 1 A 45 45 PHE C C 44 176.691 178.612 -1.921 1
1 373 . 18 1 1 A 45 45 PHE CA C 44 62.333 60.560 1.773 1
1 374 . 18 1 1 A 45 45 PHE CB C 44 39.449 38.810 0.639 1
1 379 . 18 1 1 A 45 45 PHE N N 44 121.501 117.404 4.097 1
1 380 . 18 1 1 A 46 46 MET H H 45 8.190 8.301 -0.111 1
1 381 . 18 1 1 A 46 46 MET HA H 45 4.060 4.171 -0.111 1
1 389 . 18 1 1 A 46 46 MET C C 45 179.754 178.181 1.573 1
1 390 . 18 1 1 A 46 46 MET CA C 45 57.742 58.413 -0.671 1
1 391 . 18 1 1 A 46 46 MET CB C 45 29.912 31.785 -1.873 1
1 394 . 18 1 1 A 46 46 MET N N 45 116.727 117.630 -0.903 1
1 395 . 18 1 1 A 47 47 ASP H H 46 8.579 8.266 0.313 1
1 396 . 18 1 1 A 47 47 ASP HA H 46 4.804 4.643 0.161 1
1 399 . 18 1 1 A 47 47 ASP C C 46 177.854 178.356 -0.502 1
1 400 . 18 1 1 A 47 47 ASP CA C 46 57.277 57.247 0.030 1
1 401 . 18 1 1 A 47 47 ASP CB C 46 40.776 41.620 -0.844 1
1 402 . 18 1 1 A 47 47 ASP N N 46 117.798 120.604 -2.806 1
1 403 . 18 1 1 A 48 48 LYS H H 47 7.339 8.004 -0.665 1
1 404 . 18 1 1 A 48 48 LYS HA H 47 3.828 4.218 -0.390 1
1 413 . 18 1 1 A 48 48 LYS C C 47 178.812 178.809 0.003 1
1 414 . 18 1 1 A 48 48 LYS CA C 47 58.953 58.443 0.510 1
1 415 . 18 1 1 A 48 48 LYS CB C 47 32.796 32.749 0.047 1
1 419 . 18 1 1 A 48 48 LYS N N 47 117.852 119.702 -1.850 1
1 420 . 18 1 1 A 49 49 TYR H H 48 6.841 8.621 -1.780 1
1 421 . 18 1 1 A 49 49 TYR HA H 48 4.995 4.241 0.754 1
1 428 . 18 1 1 A 49 49 TYR C C 48 178.138 178.529 -0.391 1
1 429 . 18 1 1 A 49 49 TYR CA C 48 58.620 59.797 -1.177 1
1 430 . 18 1 1 A 49 49 TYR CB C 48 42.939 38.260 4.679 1
1 435 . 18 1 1 A 49 49 TYR N N 48 112.109 119.685 -7.576 1
1 436 . 18 1 1 A 50 50 TYR H H 49 8.491 8.201 0.290 1
1 437 . 18 1 1 A 50 50 TYR HA H 49 4.598 4.186 0.412 1
1 444 . 18 1 1 A 50 50 TYR C C 49 176.015 177.690 -1.675 1
1 445 . 18 1 1 A 50 50 TYR CA C 49 62.442 59.552 2.890 1
1 446 . 18 1 1 A 50 50 TYR CB C 49 36.588 36.835 -0.247 1
1 451 . 18 1 1 A 50 50 TYR N N 49 118.294 118.851 -0.557 1
1 452 . 18 1 1 A 51 51 LEU H H 50 7.512 7.460 0.052 1
1 453 . 18 1 1 A 51 51 LEU HA H 50 3.878 3.560 0.318 1
1 463 . 18 1 1 A 51 51 LEU C C 50 178.625 178.892 -0.267 1
1 464 . 18 1 1 A 51 51 LEU CA C 50 55.994 57.154 -1.160 1
1 465 . 18 1 1 A 51 51 LEU CB C 50 40.743 41.479 -0.736 1
1 469 . 18 1 1 A 51 51 LEU N N 50 118.478 121.831 -3.353 1
1 470 . 18 1 1 A 52 52 GLU H H 51 8.042 8.002 0.040 1
1 471 . 18 1 1 A 52 52 GLU HA H 51 4.197 4.029 0.168 1
1 476 . 18 1 1 A 52 52 GLU C C 51 177.629 177.547 0.082 1
1 477 . 18 1 1 A 52 52 GLU CA C 51 56.141 58.989 -2.848 1
1 478 . 18 1 1 A 52 52 GLU CB C 51 29.162 29.682 -0.520 1
1 480 . 18 1 1 A 52 52 GLU N N 51 115.067 118.023 -2.956 1
1 481 . 18 1 1 A 53 53 PHE H H 52 7.465 7.940 -0.475 1
1 482 . 18 1 1 A 53 53 PHE HA H 52 4.431 4.761 -0.330 1
1 490 . 18 1 1 A 53 53 PHE C C 52 174.325 174.954 -0.629 1
1 491 . 18 1 1 A 53 53 PHE CA C 52 58.986 57.026 1.960 1
1 492 . 18 1 1 A 53 53 PHE CB C 52 40.183 37.214 2.969 1
1 498 . 18 1 1 A 53 53 PHE N N 52 116.768 118.307 -1.539 1
1 499 . 18 1 1 A 54 54 GLU H H 53 7.484 8.487 -1.003 1
1 500 . 18 1 1 A 54 54 GLU HA H 53 4.583 4.785 -0.202 1
1 505 . 18 1 1 A 54 54 GLU C C 53 175.722 175.823 -0.101 1
1 506 . 18 1 1 A 54 54 GLU CA C 53 54.248 55.387 -1.139 1
1 507 . 18 1 1 A 54 54 GLU CB C 53 34.409 31.061 3.348 1
1 509 . 18 1 1 A 54 54 GLU N N 53 118.844 125.348 -6.504 1
1 510 . 18 1 1 A 55 55 ASP H H 54 9.008 8.595 0.413 1
1 511 . 18 1 1 A 55 55 ASP HA H 54 4.735 4.799 -0.064 1
1 514 . 18 1 1 A 55 55 ASP C C 54 175.421 176.062 -0.641 1
1 515 . 18 1 1 A 55 55 ASP CA C 54 52.888 54.060 -1.172 1
1 516 . 18 1 1 A 55 55 ASP CB C 54 38.894 40.505 -1.611 1
1 517 . 18 1 1 A 55 55 ASP N N 54 123.654 125.120 -1.466 1
1 518 . 18 1 1 A 56 56 THR H H 55 7.819 7.919 -0.100 1
1 519 . 18 1 1 A 56 56 THR HA H 55 4.574 4.887 -0.313 1
1 524 . 18 1 1 A 56 56 THR C C 55 174.096 173.987 0.109 1
1 525 . 18 1 1 A 56 56 THR CA C 55 59.172 59.855 -0.683 1
1 526 . 18 1 1 A 56 56 THR CB C 55 71.889 72.026 -0.137 1
1 528 . 18 1 1 A 56 56 THR N N 55 112.015 115.098 -3.083 1
1 529 . 18 1 1 A 57 57 GLU H H 56 8.527 8.784 -0.257 1
1 530 . 18 1 1 A 57 57 GLU HA H 56 4.217 4.577 -0.360 1
1 535 . 18 1 1 A 57 57 GLU C C 56 177.042 176.390 0.652 1
1 536 . 18 1 1 A 57 57 GLU CA C 56 56.869 57.275 -0.406 1
1 537 . 18 1 1 A 57 57 GLU CB C 56 29.731 31.407 -1.676 1
1 539 . 18 1 1 A 57 57 GLU N N 56 117.531 118.454 -0.923 1
1 540 . 18 1 1 A 58 58 GLU H H 57 7.587 7.842 -0.255 1
1 541 . 18 1 1 A 58 58 GLU HA H 57 3.941 4.416 -0.475 1
1 546 . 18 1 1 A 58 58 GLU C C 57 176.849 176.060 0.789 1
1 547 . 18 1 1 A 58 58 GLU CA C 57 56.924 56.274 0.650 1
1 548 . 18 1 1 A 58 58 GLU CB C 57 30.251 30.358 -0.107 1
1 550 . 18 1 1 A 58 58 GLU N N 57 119.183 120.449 -1.266 1
1 551 . 18 1 1 A 59 59 ASN H H 58 9.120 8.623 0.497 1
1 552 . 18 1 1 A 59 59 ASN HA H 58 4.922 4.903 0.019 1
1 557 . 18 1 1 A 59 59 ASN C C 58 174.254 175.150 -0.896 1
1 558 . 18 1 1 A 59 59 ASN CA C 58 51.956 53.090 -1.134 1
1 559 . 18 1 1 A 59 59 ASN CB C 58 37.404 38.788 -1.384 1
1 560 . 18 1 1 A 59 59 ASN N N 58 126.767 123.570 3.197 1
1 562 . 18 1 1 A 60 60 LYS H H 59 5.892 9.236 -3.344 1
1 563 . 18 1 1 A 60 60 LYS HA H 59 3.798 4.649 -0.851 1
1 572 . 18 1 1 A 60 60 LYS C C 59 177.908 177.537 0.371 1
1 573 . 18 1 1 A 60 60 LYS CA C 59 56.623 54.742 1.881 1
1 574 . 18 1 1 A 60 60 LYS CB C 59 32.279 34.571 -2.292 1
1 578 . 18 1 1 A 60 60 LYS N N 59 121.527 122.548 -1.021 1
1 579 . 18 1 1 A 61 61 LEU H H 60 8.473 8.798 -0.325 1
1 580 . 18 1 1 A 61 61 LEU HA H 60 3.891 4.171 -0.280 1
1 590 . 18 1 1 A 61 61 LEU C C 60 179.843 178.807 1.036 1
1 591 . 18 1 1 A 61 61 LEU CA C 60 58.301 56.636 1.665 1
1 592 . 18 1 1 A 61 61 LEU CB C 60 41.305 41.468 -0.163 1
1 596 . 18 1 1 A 61 61 LEU N N 60 125.639 123.206 2.433 1
1 597 . 18 1 1 A 62 62 ILE H H 61 7.698 7.839 -0.141 1
1 598 . 18 1 1 A 62 62 ILE HA H 61 3.952 3.816 0.136 1
1 608 . 18 1 1 A 62 62 ILE C C 61 175.392 177.266 -1.874 1
1 609 . 18 1 1 A 62 62 ILE CA C 61 61.743 63.148 -1.405 1
1 610 . 18 1 1 A 62 62 ILE CB C 61 39.108 37.714 1.394 1
1 614 . 18 1 1 A 62 62 ILE N N 61 114.111 119.460 -5.349 1
1 615 . 18 1 1 A 63 63 TYR H H 62 7.273 7.775 -0.502 1
1 616 . 18 1 1 A 63 63 TYR HA H 62 4.343 4.368 -0.025 1
1 623 . 18 1 1 A 63 63 TYR C C 62 178.264 178.519 -0.255 1
1 624 . 18 1 1 A 63 63 TYR CA C 62 57.231 61.049 -3.818 1
1 625 . 18 1 1 A 63 63 TYR CB C 62 36.332 37.322 -0.990 1
1 630 . 18 1 1 A 63 63 TYR N N 62 117.689 121.315 -3.626 1
1 631 . 18 1 1 A 64 64 THR H H 63 7.747 7.923 -0.176 1
1 632 . 18 1 1 A 64 64 THR HA H 63 4.266 4.221 0.045 1
1 637 . 18 1 1 A 64 64 THR CA C 63 69.362 67.547 1.815 1
1 638 . 18 1 1 A 64 64 THR CB C 63 66.962 67.926 -0.964 1
1 640 . 18 1 1 A 64 64 THR N N 63 113.755 116.251 -2.496 1
1 641 . 18 1 1 A 65 65 PRO HA H 64 4.372 4.391 -0.019 1
1 648 . 18 1 1 A 65 65 PRO C C 64 179.913 179.368 0.545 1
1 649 . 18 1 1 A 65 65 PRO CA C 64 66.011 65.996 0.015 1
1 650 . 18 1 1 A 65 65 PRO CB C 64 30.642 30.638 0.004 1
1 653 . 18 1 1 A 66 66 ILE H H 65 7.377 7.261 0.116 1
1 654 . 18 1 1 A 66 66 ILE HA H 65 3.530 3.919 -0.389 1
1 664 . 18 1 1 A 66 66 ILE C C 65 177.543 178.325 -0.782 1
1 665 . 18 1 1 A 66 66 ILE CA C 65 66.647 64.264 2.383 1
1 666 . 18 1 1 A 66 66 ILE CB C 65 38.029 37.734 0.295 1
1 670 . 18 1 1 A 66 66 ILE N N 65 118.353 116.843 1.510 1
1 671 . 18 1 1 A 67 67 PHE H H 66 8.480 8.434 0.046 1
1 672 . 18 1 1 A 67 67 PHE HA H 66 4.115 4.423 -0.308 1
1 680 . 18 1 1 A 67 67 PHE C C 66 177.293 178.123 -0.830 1
1 681 . 18 1 1 A 67 67 PHE CA C 66 59.570 61.772 -2.202 1
1 682 . 18 1 1 A 67 67 PHE CB C 66 38.865 39.556 -0.691 1
1 688 . 18 1 1 A 67 67 PHE N N 66 122.420 120.367 2.053 1
1 689 . 18 1 1 A 68 68 ASN H H 67 8.595 8.060 0.535 1
1 690 . 18 1 1 A 68 68 ASN HA H 67 4.211 4.372 -0.161 1
1 695 . 18 1 1 A 68 68 ASN C C 67 178.697 178.160 0.537 1
1 696 . 18 1 1 A 68 68 ASN CA C 67 56.056 56.303 -0.247 1
1 697 . 18 1 1 A 68 68 ASN CB C 67 37.704 37.967 -0.263 1
1 698 . 18 1 1 A 68 68 ASN N N 67 115.573 117.572 -1.999 1
1 700 . 18 1 1 A 69 69 GLU H H 68 8.414 7.976 0.438 1
1 701 . 18 1 1 A 69 69 GLU HA H 68 4.102 4.392 -0.290 1
1 706 . 18 1 1 A 69 69 GLU C C 68 177.880 178.803 -0.923 1
1 707 . 18 1 1 A 69 69 GLU CA C 68 59.399 59.461 -0.062 1
1 708 . 18 1 1 A 69 69 GLU CB C 68 29.855 29.444 0.411 1
1 710 . 18 1 1 A 69 69 GLU N N 68 123.510 120.078 3.432 1
1 711 . 18 1 1 A 70 70 TYR H H 69 8.659 8.074 0.585 1
1 712 . 18 1 1 A 70 70 TYR HA H 69 3.362 4.146 -0.784 1
1 719 . 18 1 1 A 70 70 TYR C C 69 178.143 176.936 1.207 1
1 720 . 18 1 1 A 70 70 TYR CA C 69 60.686 61.358 -0.672 1
1 721 . 18 1 1 A 70 70 TYR CB C 69 38.560 38.620 -0.060 1
1 726 . 18 1 1 A 70 70 TYR N N 69 122.130 120.870 1.260 1
1 727 . 18 1 1 A 71 71 ILE H H 70 8.031 7.887 0.144 1
1 728 . 18 1 1 A 71 71 ILE HA H 70 3.265 3.704 -0.439 1
1 738 . 18 1 1 A 71 71 ILE C C 70 178.056 178.186 -0.130 1
1 739 . 18 1 1 A 71 71 ILE CA C 70 63.756 64.253 -0.497 1
1 740 . 18 1 1 A 71 71 ILE CB C 70 37.321 36.547 0.774 1
1 744 . 18 1 1 A 71 71 ILE N N 70 118.906 120.687 -1.781 1
1 745 . 18 1 1 A 72 72 SER H H 71 7.803 8.067 -0.264 1
1 746 . 18 1 1 A 72 72 SER HA H 71 4.029 4.239 -0.210 1
1 749 . 18 1 1 A 72 72 SER CA C 71 61.380 61.330 0.050 1
1 750 . 18 1 1 A 72 72 SER CB C 71 63.288 62.878 0.410 1
1 751 . 18 1 1 A 72 72 SER N N 71 113.735 114.834 -1.099 1
1 752 . 18 1 1 A 73 73 LEU H H 72 7.952 7.890 0.062 1
1 753 . 18 1 1 A 73 73 LEU HA H 72 4.418 4.161 0.257 1
1 763 . 18 1 1 A 73 73 LEU C C 72 177.767 178.270 -0.503 1
1 764 . 18 1 1 A 73 73 LEU CA C 72 56.543 57.464 -0.921 1
1 765 . 18 1 1 A 73 73 LEU CB C 72 44.517 41.791 2.726 1
1 769 . 18 1 1 A 73 73 LEU N N 72 119.411 123.378 -3.967 1
1 770 . 18 1 1 A 74 74 VAL H H 73 8.021 7.492 0.529 1
1 771 . 18 1 1 A 74 74 VAL HA H 73 3.532 3.316 0.216 1
1 779 . 18 1 1 A 74 74 VAL C C 73 177.126 177.944 -0.818 1
1 780 . 18 1 1 A 74 74 VAL CA C 73 66.250 66.630 -0.380 1
1 781 . 18 1 1 A 74 74 VAL CB C 73 31.212 30.971 0.241 1
1 784 . 18 1 1 A 74 74 VAL N N 73 118.747 119.306 -0.559 1
1 785 . 18 1 1 A 75 75 GLU H H 74 7.232 7.967 -0.735 1
1 786 . 18 1 1 A 75 75 GLU HA H 74 3.013 4.148 -1.135 1
1 791 . 18 1 1 A 75 75 GLU C C 74 178.804 179.503 -0.699 1
1 792 . 18 1 1 A 75 75 GLU CA C 74 60.536 59.996 0.540 1
1 793 . 18 1 1 A 75 75 GLU CB C 74 27.009 29.103 -2.094 1
1 795 . 18 1 1 A 75 75 GLU N N 74 118.660 119.766 -1.106 1
1 796 . 18 1 1 A 76 76 LYS H H 75 7.051 7.922 -0.871 1
1 797 . 18 1 1 A 76 76 LYS HA H 75 3.765 4.108 -0.343 1
1 806 . 18 1 1 A 76 76 LYS C C 75 177.765 178.066 -0.301 1
1 807 . 18 1 1 A 76 76 LYS CA C 75 58.357 58.579 -0.222 1
1 808 . 18 1 1 A 76 76 LYS CB C 75 31.939 32.255 -0.316 1
1 812 . 18 1 1 A 76 76 LYS N N 75 116.112 119.059 -2.947 1
1 813 . 18 1 1 A 77 77 TYR H H 76 7.067 7.983 -0.916 1
1 814 . 18 1 1 A 77 77 TYR HA H 76 4.036 4.207 -0.171 1
1 821 . 18 1 1 A 77 77 TYR C C 76 177.752 177.148 0.604 1
1 822 . 18 1 1 A 77 77 TYR CA C 76 61.820 61.330 0.490 1
1 823 . 18 1 1 A 77 77 TYR CB C 76 38.480 38.611 -0.131 1
1 828 . 18 1 1 A 77 77 TYR N N 76 118.434 121.881 -3.447 1
1 829 . 18 1 1 A 78 78 ILE H H 77 7.554 8.329 -0.775 1
1 830 . 18 1 1 A 78 78 ILE HA H 77 3.159 3.677 -0.518 1
1 840 . 18 1 1 A 78 78 ILE C C 77 177.341 177.870 -0.529 1
1 841 . 18 1 1 A 78 78 ILE CA C 77 65.177 65.381 -0.204 1
1 842 . 18 1 1 A 78 78 ILE CB C 77 37.339 38.036 -0.697 1
1 846 . 18 1 1 A 78 78 ILE N N 77 117.672 121.350 -3.678 1
1 847 . 18 1 1 A 79 79 GLU H H 78 8.296 8.054 0.242 1
1 848 . 18 1 1 A 79 79 GLU HA H 78 3.557 3.761 -0.204 1
1 853 . 18 1 1 A 79 79 GLU C C 78 177.742 178.764 -1.022 1
1 854 . 18 1 1 A 79 79 GLU CA C 78 60.847 60.091 0.756 1
1 855 . 18 1 1 A 79 79 GLU CB C 78 29.594 29.200 0.394 1
1 857 . 18 1 1 A 79 79 GLU N N 78 118.701 120.991 -2.290 1
1 858 . 18 1 1 A 80 80 GLU H H 79 8.330 8.395 -0.065 1
1 859 . 18 1 1 A 80 80 GLU HA H 79 3.774 3.998 -0.224 1
1 864 . 18 1 1 A 80 80 GLU C C 79 179.926 179.267 0.659 1
1 865 . 18 1 1 A 80 80 GLU CA C 79 59.581 58.950 0.631 1
1 866 . 18 1 1 A 80 80 GLU CB C 79 29.062 28.999 0.063 1
1 868 . 18 1 1 A 80 80 GLU N N 79 116.767 118.027 -1.260 1
1 869 . 18 1 1 A 81 81 GLN H H 80 7.634 7.721 -0.087 1
1 870 . 18 1 1 A 81 81 GLN HA H 80 3.605 4.174 -0.569 1
1 877 . 18 1 1 A 81 81 GLN C C 80 179.681 178.497 1.184 1
1 878 . 18 1 1 A 81 81 GLN CA C 80 57.765 58.461 -0.696 1
1 879 . 18 1 1 A 81 81 GLN CB C 80 28.079 28.165 -0.086 1
1 881 . 18 1 1 A 81 81 GLN N N 80 116.325 118.770 -2.445 1
1 883 . 18 1 1 A 82 82 LEU H H 81 8.156 7.540 0.616 1
1 884 . 18 1 1 A 82 82 LEU HA H 81 3.536 3.813 -0.277 1
1 894 . 18 1 1 A 82 82 LEU C C 81 178.945 179.313 -0.368 1
1 895 . 18 1 1 A 82 82 LEU CA C 81 57.761 56.800 0.961 1
1 896 . 18 1 1 A 82 82 LEU CB C 81 40.961 41.022 -0.061 1
1 900 . 18 1 1 A 82 82 LEU N N 81 121.546 120.439 1.107 1
1 901 . 18 1 1 A 83 83 LEU H H 82 8.326 8.085 0.241 1
1 902 . 18 1 1 A 83 83 LEU HA H 82 4.198 4.210 -0.012 1
1 912 . 18 1 1 A 83 83 LEU C C 82 178.631 179.280 -0.649 1
1 913 . 18 1 1 A 83 83 LEU CA C 82 57.016 57.029 -0.013 1
1 914 . 18 1 1 A 83 83 LEU CB C 82 42.182 40.798 1.384 1
1 918 . 18 1 1 A 83 83 LEU N N 82 120.426 119.064 1.362 1
1 919 . 18 1 1 A 84 84 GLN H H 83 6.992 7.567 -0.575 1
1 920 . 18 1 1 A 84 84 GLN HA H 83 3.877 4.016 -0.139 1
1 927 . 18 1 1 A 84 84 GLN C C 83 177.008 176.927 0.081 1
1 928 . 18 1 1 A 84 84 GLN CA C 83 57.543 58.287 -0.744 1
1 929 . 18 1 1 A 84 84 GLN CB C 83 28.688 28.567 0.121 1
1 931 . 18 1 1 A 84 84 GLN N N 83 114.001 117.256 -3.255 1
1 933 . 18 1 1 A 85 85 ARG H H 84 7.072 7.348 -0.276 1
1 934 . 18 1 1 A 85 85 ARG HA H 84 4.047 4.367 -0.320 1
1 942 . 18 1 1 A 85 85 ARG C C 84 175.999 174.992 1.007 1
1 943 . 18 1 1 A 85 85 ARG CA C 84 56.764 55.748 1.016 1
1 944 . 18 1 1 A 85 85 ARG CB C 84 32.044 32.235 -0.191 1
1 947 . 18 1 1 A 85 85 ARG N N 84 115.827 116.760 -0.933 1
1 949 . 18 1 1 A 86 86 ILE H H 85 8.238 7.322 0.916 1
1 950 . 18 1 1 A 86 86 ILE HA H 85 4.389 4.529 -0.140 1
1 960 . 18 1 1 A 86 86 ILE CA C 85 58.007 57.801 0.206 1
1 961 . 18 1 1 A 86 86 ILE CB C 85 39.604 39.311 0.293 1
1 965 . 18 1 1 A 86 86 ILE N N 85 119.285 119.269 0.016 1
1 966 . 18 1 1 A 87 87 PRO HA H 86 4.392 4.599 -0.207 1
1 973 . 18 1 1 A 87 87 PRO C C 86 177.622 176.529 1.093 1
1 974 . 18 1 1 A 87 87 PRO CA C 86 64.665 64.224 0.441 1
1 975 . 18 1 1 A 87 87 PRO CB C 86 32.020 31.755 0.265 1
1 978 . 18 1 1 A 88 88 GLU H H 87 8.312 8.218 0.094 1
1 979 . 18 1 1 A 88 88 GLU HA H 87 4.208 4.527 -0.319 1
1 984 . 18 1 1 A 88 88 GLU C C 87 175.554 175.729 -0.175 1
1 985 . 18 1 1 A 88 88 GLU CA C 87 56.045 56.203 -0.158 1
1 986 . 18 1 1 A 88 88 GLU CB C 87 28.654 30.340 -1.686 1
1 988 . 18 1 1 A 88 88 GLU N N 87 114.256 117.012 -2.756 1
1 989 . 18 1 1 A 89 89 PHE H H 88 7.946 7.358 0.588 1
1 990 . 18 1 1 A 89 89 PHE HA H 88 3.993 4.373 -0.380 1
1 998 . 18 1 1 A 89 89 PHE C C 88 173.460 174.520 -1.060 1
1 999 . 18 1 1 A 89 89 PHE CA C 88 60.119 59.547 0.572 1
1 1000 . 18 1 1 A 89 89 PHE CB C 88 39.994 39.666 0.328 1
1 1006 . 18 1 1 A 89 89 PHE N N 88 121.550 123.483 -1.933 1
1 1007 . 18 1 1 A 90 90 ASN H H 89 7.266 8.004 -0.738 1
1 1008 . 18 1 1 A 90 90 ASN HA H 89 4.454 5.351 -0.897 1
1 1013 . 18 1 1 A 90 90 ASN C C 89 173.921 174.954 -1.033 1
1 1014 . 18 1 1 A 90 90 ASN CA C 89 51.839 51.388 0.451 1
1 1015 . 18 1 1 A 90 90 ASN CB C 89 40.674 38.962 1.712 1
1 1016 . 18 1 1 A 90 90 ASN N N 89 125.344 123.103 2.241 1
1 1018 . 18 1 1 A 91 91 MET H H 90 8.968 8.623 0.345 1
1 1019 . 18 1 1 A 91 91 MET HA H 90 4.049 4.249 -0.200 1
1 1027 . 18 1 1 A 91 91 MET C C 90 177.475 178.006 -0.531 1
1 1028 . 18 1 1 A 91 91 MET CA C 90 57.758 57.667 0.091 1
1 1029 . 18 1 1 A 91 91 MET CB C 90 32.250 32.462 -0.212 1
1 1032 . 18 1 1 A 91 91 MET N N 90 127.052 122.851 4.201 1
1 1033 . 18 1 1 A 92 92 ALA H H 91 8.292 8.002 0.290 1
1 1034 . 18 1 1 A 92 92 ALA HA H 91 4.059 4.144 -0.085 1
1 1038 . 18 1 1 A 92 92 ALA C C 91 180.412 179.715 0.697 1
1 1039 . 18 1 1 A 92 92 ALA CA C 91 55.368 54.940 0.428 1
1 1040 . 18 1 1 A 92 92 ALA CB C 91 17.527 18.734 -1.207 1
1 1041 . 18 1 1 A 92 92 ALA N N 91 123.752 120.987 2.765 1
1 1042 . 18 1 1 A 93 93 ALA H H 92 7.931 7.947 -0.016 1
1 1043 . 18 1 1 A 93 93 ALA HA H 92 4.054 4.234 -0.180 1
1 1047 . 18 1 1 A 93 93 ALA C C 92 180.482 179.918 0.564 1
1 1048 . 18 1 1 A 93 93 ALA CA C 92 54.614 54.825 -0.211 1
1 1049 . 18 1 1 A 93 93 ALA CB C 92 18.098 18.156 -0.058 1
1 1050 . 18 1 1 A 93 93 ALA N N 92 121.158 119.974 1.184 1
1 1051 . 18 1 1 A 94 94 PHE H H 93 8.110 7.750 0.360 1
1 1052 . 18 1 1 A 94 94 PHE HA H 93 4.304 4.199 0.105 1
1 1060 . 18 1 1 A 94 94 PHE C C 93 177.350 177.174 0.176 1
1 1061 . 18 1 1 A 94 94 PHE CA C 93 61.641 61.498 0.143 1
1 1062 . 18 1 1 A 94 94 PHE CB C 93 40.014 39.410 0.604 1
1 1068 . 18 1 1 A 94 94 PHE N N 93 119.807 119.798 0.009 1
1 1069 . 18 1 1 A 95 95 THR H H 94 8.726 8.301 0.425 1
1 1070 . 18 1 1 A 95 95 THR HA H 94 3.569 4.031 -0.462 1
1 1075 . 18 1 1 A 95 95 THR C C 94 176.932 176.589 0.343 1
1 1076 . 18 1 1 A 95 95 THR CA C 94 66.833 65.548 1.285 1
1 1077 . 18 1 1 A 95 95 THR CB C 94 68.445 68.188 0.257 1
1 1079 . 18 1 1 A 95 95 THR N N 94 113.074 112.275 0.799 1
1 1080 . 18 1 1 A 96 96 THR H H 95 7.657 7.775 -0.118 1
1 1081 . 18 1 1 A 96 96 THR HA H 95 3.945 4.090 -0.145 1
1 1086 . 18 1 1 A 96 96 THR C C 95 176.386 177.412 -1.026 1
1 1087 . 18 1 1 A 96 96 THR CA C 95 66.550 65.683 0.867 1
1 1088 . 18 1 1 A 96 96 THR CB C 95 68.583 67.936 0.647 1
1 1090 . 18 1 1 A 96 96 THR N N 95 117.927 113.996 3.931 1
1 1091 . 18 1 1 A 97 97 THR H H 96 7.699 7.929 -0.230 1
1 1092 . 18 1 1 A 97 97 THR HA H 96 3.905 3.962 -0.057 1
1 1097 . 18 1 1 A 97 97 THR C C 96 176.572 176.386 0.186 1
1 1098 . 18 1 1 A 97 97 THR CA C 96 65.979 66.720 -0.741 1
1 1099 . 18 1 1 A 97 97 THR CB C 96 68.553 68.054 0.499 1
1 1101 . 18 1 1 A 97 97 THR N N 96 118.518 117.509 1.009 1
1 1102 . 18 1 1 A 98 98 LEU H H 97 8.304 8.184 0.120 1
1 1103 . 18 1 1 A 98 98 LEU HA H 97 3.725 3.766 -0.041 1
1 1113 . 18 1 1 A 98 98 LEU C C 97 178.490 178.773 -0.283 1
1 1114 . 18 1 1 A 98 98 LEU CA C 97 58.517 57.974 0.543 1
1 1115 . 18 1 1 A 98 98 LEU CB C 97 41.697 41.162 0.535 1
1 1119 . 18 1 1 A 98 98 LEU N N 97 122.882 122.161 0.721 1
1 1120 . 18 1 1 A 99 99 GLN H H 98 7.639 8.037 -0.398 1
1 1121 . 18 1 1 A 99 99 GLN HA H 98 3.927 4.154 -0.227 1
1 1128 . 18 1 1 A 99 99 GLN C C 98 178.068 178.512 -0.444 1
1 1129 . 18 1 1 A 99 99 GLN CA C 98 58.735 58.990 -0.255 1
1 1130 . 18 1 1 A 99 99 GLN CB C 98 27.986 28.335 -0.349 1
1 1132 . 18 1 1 A 99 99 GLN N N 98 114.302 117.558 -3.256 1
1 1134 . 18 1 1 A 100 100 HIS H H 99 7.575 8.203 -0.628 1
1 1135 . 18 1 1 A 100 100 HIS HA H 99 4.524 4.331 0.193 1
1 1139 . 18 1 1 A 100 100 HIS C C 99 174.789 177.533 -2.744 1
1 1140 . 18 1 1 A 100 100 HIS CA C 99 56.154 59.094 -2.940 1
1 1141 . 18 1 1 A 100 100 HIS CB C 99 28.946 29.925 -0.979 1
1 1143 . 18 1 1 A 100 100 HIS N N 99 114.778 121.330 -6.552 1
1 1144 . 18 1 1 A 101 101 HIS H H 100 7.773 8.315 -0.542 1
1 1145 . 18 1 1 A 101 101 HIS HA H 100 4.704 4.171 0.533 1
1 1149 . 18 1 1 A 101 101 HIS C C 100 174.818 177.234 -2.416 1
1 1150 . 18 1 1 A 101 101 HIS CA C 100 54.830 58.695 -3.865 1
1 1151 . 18 1 1 A 101 101 HIS CB C 100 29.749 28.605 1.144 1
1 1153 . 18 1 1 A 101 101 HIS N N 100 117.397 116.453 0.944 1
1 1154 . 18 1 1 A 102 102 LYS H H 101 7.324 8.047 -0.723 1
1 1155 . 18 1 1 A 102 102 LYS HA H 101 3.611 4.068 -0.457 1
1 1164 . 18 1 1 A 102 102 LYS C C 101 176.823 178.366 -1.543 1
1 1165 . 18 1 1 A 102 102 LYS CA C 101 59.915 58.900 1.015 1
1 1166 . 18 1 1 A 102 102 LYS CB C 101 32.825 32.060 0.765 1
1 1170 . 18 1 1 A 102 102 LYS N N 101 120.533 122.043 -1.510 1
1 1171 . 18 1 1 A 103 103 ASP H H 102 8.361 8.665 -0.304 1
1 1172 . 18 1 1 A 103 103 ASP HA H 102 4.421 4.388 0.033 1
1 1175 . 18 1 1 A 103 103 ASP C C 102 176.793 177.459 -0.666 1
1 1176 . 18 1 1 A 103 103 ASP CA C 102 55.500 55.249 0.251 1
1 1177 . 18 1 1 A 103 103 ASP CB C 102 40.178 38.848 1.330 1
1 1178 . 18 1 1 A 103 103 ASP N N 102 114.814 116.713 -1.899 1
1 1179 . 18 1 1 A 104 104 GLU H H 103 7.858 8.159 -0.301 1
1 1180 . 18 1 1 A 104 104 GLU HA H 103 4.339 4.514 -0.175 1
1 1183 . 18 1 1 A 104 104 GLU C C 103 175.777 176.091 -0.314 1
1 1184 . 18 1 1 A 104 104 GLU CA C 103 56.356 58.007 -1.651 1
1 1185 . 18 1 1 A 104 104 GLU CB C 103 31.293 31.647 -0.354 1
1 1186 . 18 1 1 A 104 104 GLU N N 103 116.826 118.594 -1.768 1
1 1187 . 18 1 1 A 105 105 VAL H H 104 7.201 7.515 -0.314 1
1 1188 . 18 1 1 A 105 105 VAL HA H 104 4.296 4.164 0.132 1
1 1196 . 18 1 1 A 105 105 VAL C C 104 174.482 175.692 -1.210 1
1 1197 . 18 1 1 A 105 105 VAL CA C 104 60.370 61.731 -1.361 1
1 1198 . 18 1 1 A 105 105 VAL CB C 104 34.341 33.186 1.155 1
1 1201 . 18 1 1 A 105 105 VAL N N 104 116.422 116.683 -0.261 1
1 1202 . 18 1 1 A 106 106 ALA H H 105 8.487 8.452 0.035 1
1 1203 . 18 1 1 A 106 106 ALA HA H 105 4.172 4.350 -0.178 1
1 1207 . 18 1 1 A 106 106 ALA C C 105 179.030 178.701 0.329 1
1 1208 . 18 1 1 A 106 106 ALA CA C 105 52.966 52.394 0.572 1
1 1209 . 18 1 1 A 106 106 ALA CB C 105 19.371 19.091 0.280 1
1 1210 . 18 1 1 A 106 106 ALA N N 105 128.313 125.868 2.445 1
1 1211 . 18 1 1 A 107 107 GLY H H 106 8.738 8.767 -0.029 1
1 1212 . 18 1 1 A 107 107 GLY HA2 H 106 3.773 3.861 -0.088 1
1 1213 . 18 1 1 A 107 107 GLY HA3 H 106 3.998 3.921 0.077 1
1 1214 . 18 1 1 A 107 107 GLY C C 106 174.958 175.460 -0.502 1
1 1215 . 18 1 1 A 107 107 GLY CA C 106 47.449 47.135 0.314 1
1 1216 . 18 1 1 A 107 107 GLY N N 106 110.612 110.791 -0.179 1
1 1217 . 18 1 1 A 108 108 ASP H H 107 8.535 7.823 0.712 1
1 1218 . 18 1 1 A 108 108 ASP HA H 107 4.333 4.358 -0.025 1
1 1221 . 18 1 1 A 108 108 ASP C C 107 179.133 179.042 0.091 1
1 1222 . 18 1 1 A 108 108 ASP CA C 107 56.721 56.436 0.285 1
1 1223 . 18 1 1 A 108 108 ASP CB C 107 39.336 40.530 -1.194 1
1 1224 . 18 1 1 A 108 108 ASP N N 107 117.474 122.141 -4.667 1
1 1225 . 18 1 1 A 109 109 ILE H H 108 7.459 7.878 -0.419 1
1 1226 . 18 1 1 A 109 109 ILE HA H 108 3.688 3.801 -0.113 1
1 1236 . 18 1 1 A 109 109 ILE C C 108 176.735 178.422 -1.687 1
1 1237 . 18 1 1 A 109 109 ILE CA C 108 63.474 65.449 -1.975 1
1 1238 . 18 1 1 A 109 109 ILE CB C 108 37.340 37.664 -0.324 1
1 1242 . 18 1 1 A 109 109 ILE N N 108 119.609 119.796 -0.187 1
1 1243 . 18 1 1 A 110 110 PHE H H 109 7.920 8.353 -0.433 1
1 1244 . 18 1 1 A 110 110 PHE HA H 109 3.759 4.077 -0.318 1
1 1252 . 18 1 1 A 110 110 PHE C C 109 177.132 177.332 -0.200 1
1 1253 . 18 1 1 A 110 110 PHE CA C 109 62.766 61.232 1.534 1
1 1254 . 18 1 1 A 110 110 PHE CB C 109 39.752 39.297 0.455 1
1 1260 . 18 1 1 A 110 110 PHE N N 109 120.906 120.465 0.441 1
1 1261 . 18 1 1 A 111 111 ASP H H 110 8.639 8.197 0.442 1
1 1262 . 18 1 1 A 111 111 ASP HA H 110 4.216 4.231 -0.015 1
1 1265 . 18 1 1 A 111 111 ASP C C 110 178.900 178.372 0.528 1
1 1266 . 18 1 1 A 111 111 ASP CA C 110 57.105 57.296 -0.191 1
1 1267 . 18 1 1 A 111 111 ASP CB C 110 39.697 41.863 -2.166 1
1 1268 . 18 1 1 A 111 111 ASP N N 110 117.124 118.756 -1.632 1
1 1269 . 18 1 1 A 112 112 MET H H 111 7.331 7.543 -0.212 1
1 1270 . 18 1 1 A 112 112 MET HA H 111 4.081 4.139 -0.058 1
1 1278 . 18 1 1 A 112 112 MET C C 111 179.052 178.137 0.915 1
1 1279 . 18 1 1 A 112 112 MET CA C 111 58.202 58.087 0.115 1
1 1280 . 18 1 1 A 112 112 MET CB C 111 31.827 32.435 -0.608 1
1 1283 . 18 1 1 A 112 112 MET N N 111 118.061 119.408 -1.347 1
1 1284 . 18 1 1 A 113 113 LEU H H 112 8.001 8.020 -0.019 1
1 1285 . 18 1 1 A 113 113 LEU HA H 112 3.723 3.540 0.183 1
1 1295 . 18 1 1 A 113 113 LEU C C 112 179.747 178.567 1.180 1
1 1296 . 18 1 1 A 113 113 LEU CA C 112 57.371 57.357 0.014 1
1 1297 . 18 1 1 A 113 113 LEU CB C 112 40.671 41.044 -0.373 1
1 1301 . 18 1 1 A 113 113 LEU N N 112 120.426 119.651 0.775 1
1 1302 . 18 1 1 A 114 114 LEU H H 113 7.744 7.672 0.072 1
1 1303 . 18 1 1 A 114 114 LEU HA H 113 4.007 3.527 0.480 1
1 1313 . 18 1 1 A 114 114 LEU C C 113 179.358 178.524 0.834 1
1 1314 . 18 1 1 A 114 114 LEU CA C 113 57.202 57.512 -0.310 1
1 1315 . 18 1 1 A 114 114 LEU CB C 113 41.727 41.622 0.105 1
1 1319 . 18 1 1 A 114 114 LEU N N 113 119.584 119.600 -0.016 1
1 1320 . 18 1 1 A 115 115 THR H H 114 7.353 7.569 -0.216 1
1 1321 . 18 1 1 A 115 115 THR HA H 114 4.071 4.113 -0.042 1
1 1327 . 18 1 1 A 115 115 THR C C 114 173.591 176.480 -2.889 1
1 1328 . 18 1 1 A 115 115 THR CA C 114 65.332 64.483 0.849 1
1 1329 . 18 1 1 A 115 115 THR CB C 114 70.319 68.638 1.681 1
1 1331 . 18 1 1 A 115 115 THR N N 114 107.535 112.329 -4.794 1
1 1332 . 18 1 1 A 116 116 PHE H H 115 6.979 7.825 -0.846 1
1 1333 . 18 1 1 A 116 116 PHE HA H 115 5.022 4.308 0.714 1
1 1341 . 18 1 1 A 116 116 PHE C C 115 176.488 176.235 0.253 1
1 1342 . 18 1 1 A 116 116 PHE CA C 115 55.911 60.957 -5.046 1
1 1343 . 18 1 1 A 116 116 PHE CB C 115 38.521 39.136 -0.615 1
1 1349 . 18 1 1 A 116 116 PHE N N 115 112.366 119.989 -7.623 1
1 1350 . 18 1 1 A 117 117 THR H H 116 7.564 8.078 -0.514 1
1 1351 . 18 1 1 A 117 117 THR HA H 116 4.626 4.886 -0.260 1
1 1356 . 18 1 1 A 117 117 THR C C 116 174.085 174.163 -0.078 1
1 1357 . 18 1 1 A 117 117 THR CA C 116 61.636 62.896 -1.260 1
1 1358 . 18 1 1 A 117 117 THR CB C 116 70.915 72.340 -1.425 1
1 1360 . 18 1 1 A 117 117 THR N N 116 105.498 112.421 -6.923 1
1 1361 . 18 1 1 A 118 118 ASP H H 117 8.270 7.783 0.487 1
1 1362 . 18 1 1 A 118 118 ASP HA H 117 4.955 4.688 0.267 1
1 1365 . 18 1 1 A 118 118 ASP C C 117 176.328 176.390 -0.062 1
1 1366 . 18 1 1 A 118 118 ASP CA C 117 53.417 53.527 -0.110 1
1 1367 . 18 1 1 A 118 118 ASP CB C 117 43.388 40.737 2.651 1
1 1368 . 18 1 1 A 118 118 ASP N N 117 124.409 121.918 2.491 1
1 1369 . 18 1 1 A 119 119 PHE H H 118 8.973 8.689 0.284 1
1 1370 . 18 1 1 A 119 119 PHE HA H 118 3.506 4.182 -0.676 1
1 1378 . 18 1 1 A 119 119 PHE CA C 118 61.490 61.206 0.284 1
1 1379 . 18 1 1 A 119 119 PHE CB C 118 39.246 39.527 -0.281 1
1 1385 . 18 1 1 A 119 119 PHE N N 118 126.688 126.569 0.119 1
1 1386 . 18 1 1 A 120 120 LEU H H 119 8.099 8.285 -0.186 1
1 1387 . 18 1 1 A 120 120 LEU HA H 119 3.842 3.921 -0.079 1
1 1397 . 18 1 1 A 120 120 LEU C C 119 179.601 179.480 0.121 1
1 1398 . 18 1 1 A 120 120 LEU CA C 119 58.174 57.903 0.271 1
1 1399 . 18 1 1 A 120 120 LEU CB C 119 40.315 41.026 -0.711 1
1 1403 . 18 1 1 A 120 120 LEU N N 119 117.930 119.813 -1.883 1
1 1404 . 18 1 1 A 121 121 ALA H H 120 7.729 7.958 -0.229 1
1 1405 . 18 1 1 A 121 121 ALA HA H 120 3.996 4.117 -0.121 1
1 1409 . 18 1 1 A 121 121 ALA C C 120 180.995 179.721 1.274 1
1 1410 . 18 1 1 A 121 121 ALA CA C 120 54.832 54.622 0.210 1
1 1411 . 18 1 1 A 121 121 ALA CB C 120 17.706 18.316 -0.610 1
1 1412 . 18 1 1 A 121 121 ALA N N 120 123.195 121.229 1.966 1
1 1413 . 18 1 1 A 122 122 PHE H H 121 7.943 7.755 0.188 1
1 1414 . 18 1 1 A 122 122 PHE HA H 121 3.887 3.833 0.054 1
1 1419 . 18 1 1 A 122 122 PHE C C 121 175.410 176.860 -1.450 1
1 1420 . 18 1 1 A 122 122 PHE CA C 121 61.075 60.725 0.350 1
1 1421 . 18 1 1 A 122 122 PHE CB C 121 38.115 39.001 -0.886 1
1 1424 . 18 1 1 A 122 122 PHE N N 121 121.798 120.115 1.683 1
1 1425 . 18 1 1 A 123 123 LYS H H 122 8.468 7.846 0.622 1
1 1426 . 18 1 1 A 123 123 LYS HA H 122 3.077 3.928 -0.851 1
1 1435 . 18 1 1 A 123 123 LYS C C 122 178.453 178.786 -0.333 1
1 1436 . 18 1 1 A 123 123 LYS CA C 122 59.855 59.885 -0.030 1
1 1437 . 18 1 1 A 123 123 LYS CB C 122 32.374 32.008 0.366 1
1 1441 . 18 1 1 A 123 123 LYS N N 122 120.614 118.640 1.974 1
1 1442 . 18 1 1 A 124 124 GLU H H 123 8.100 7.852 0.248 1
1 1443 . 18 1 1 A 124 124 GLU HA H 123 3.652 4.012 -0.360 1
1 1448 . 18 1 1 A 124 124 GLU C C 123 177.743 178.464 -0.721 1
1 1449 . 18 1 1 A 124 124 GLU CA C 123 59.406 59.523 -0.117 1
1 1450 . 18 1 1 A 124 124 GLU CB C 123 28.811 29.381 -0.570 1
1 1452 . 18 1 1 A 124 124 GLU N N 123 117.404 119.121 -1.717 1
1 1453 . 18 1 1 A 125 125 MET H H 124 7.537 7.483 0.054 1
1 1454 . 18 1 1 A 125 125 MET HA H 124 3.860 3.969 -0.109 1
1 1462 . 18 1 1 A 125 125 MET C C 124 179.522 178.248 1.274 1
1 1463 . 18 1 1 A 125 125 MET CA C 124 58.832 58.354 0.478 1
1 1464 . 18 1 1 A 125 125 MET CB C 124 31.765 31.564 0.201 1
1 1467 . 18 1 1 A 125 125 MET N N 124 119.413 119.131 0.282 1
1 1468 . 18 1 1 A 126 126 PHE H H 125 7.148 7.416 -0.268 1
1 1469 . 18 1 1 A 126 126 PHE HA H 125 3.633 4.182 -0.549 1
1 1476 . 18 1 1 A 126 126 PHE C C 125 178.994 178.293 0.701 1
1 1477 . 18 1 1 A 126 126 PHE CA C 125 63.148 60.937 2.211 1
1 1478 . 18 1 1 A 126 126 PHE CB C 125 39.830 38.317 1.513 1
1 1483 . 18 1 1 A 126 126 PHE N N 125 120.013 119.125 0.888 1
1 1484 . 18 1 1 A 127 127 LEU H H 126 8.369 8.599 -0.230 1
1 1485 . 18 1 1 A 127 127 LEU HA H 126 3.972 4.045 -0.073 1
1 1495 . 18 1 1 A 127 127 LEU C C 126 180.621 179.138 1.483 1
1 1496 . 18 1 1 A 127 127 LEU CA C 126 57.944 57.731 0.213 1
1 1497 . 18 1 1 A 127 127 LEU CB C 126 40.543 40.979 -0.436 1
1 1501 . 18 1 1 A 127 127 LEU N N 126 119.692 119.595 0.097 1
1 1502 . 18 1 1 A 128 128 ASP H H 127 8.578 7.996 0.582 1
1 1503 . 18 1 1 A 128 128 ASP HA H 127 4.308 4.348 -0.040 1
1 1506 . 18 1 1 A 128 128 ASP C C 127 178.254 178.115 0.139 1
1 1507 . 18 1 1 A 128 128 ASP CA C 127 56.964 57.141 -0.177 1
1 1508 . 18 1 1 A 128 128 ASP CB C 127 39.735 40.673 -0.938 1
1 1509 . 18 1 1 A 128 128 ASP N N 127 121.926 119.598 2.328 1
1 1510 . 18 1 1 A 129 129 TYR H H 128 7.710 8.100 -0.390 1
1 1511 . 18 1 1 A 129 129 TYR HA H 128 3.908 4.079 -0.171 1
1 1518 . 18 1 1 A 129 129 TYR C C 128 177.633 177.752 -0.119 1
1 1519 . 18 1 1 A 129 129 TYR CA C 128 61.796 61.429 0.367 1
1 1520 . 18 1 1 A 129 129 TYR CB C 128 39.372 38.754 0.618 1
1 1525 . 18 1 1 A 129 129 TYR N N 128 122.548 120.673 1.875 1
1 1526 . 18 1 1 A 130 130 ARG H H 129 8.622 8.267 0.355 1
1 1527 . 18 1 1 A 130 130 ARG HA H 129 3.722 4.051 -0.329 1
1 1535 . 18 1 1 A 130 130 ARG CA C 129 60.084 59.469 0.615 1
1 1536 . 18 1 1 A 130 130 ARG CB C 129 29.902 29.980 -0.078 1
1 1539 . 18 1 1 A 130 130 ARG N N 129 118.302 119.305 -1.003 1
1 1541 . 18 1 1 A 131 131 ALA H H 130 7.936 8.023 -0.087 1
1 1542 . 18 1 1 A 131 131 ALA HA H 130 3.997 4.013 -0.016 1
1 1546 . 18 1 1 A 131 131 ALA C C 130 180.456 180.080 0.376 1
1 1547 . 18 1 1 A 131 131 ALA CA C 130 55.133 54.963 0.170 1
1 1548 . 18 1 1 A 131 131 ALA CB C 130 17.750 18.227 -0.477 1
1 1549 . 18 1 1 A 131 131 ALA N N 130 119.788 121.862 -2.074 1
1 1550 . 18 1 1 A 132 132 GLU H H 131 7.622 7.731 -0.109 1
1 1551 . 18 1 1 A 132 132 GLU HA H 131 3.862 3.943 -0.081 1
1 1556 . 18 1 1 A 132 132 GLU C C 131 179.528 179.535 -0.007 1
1 1557 . 18 1 1 A 132 132 GLU CA C 131 58.849 59.309 -0.460 1
1 1558 . 18 1 1 A 132 132 GLU CB C 131 28.930 29.008 -0.078 1
1 1560 . 18 1 1 A 132 132 GLU N N 131 118.428 117.873 0.555 1
1 1561 . 18 1 1 A 133 133 LYS H H 132 7.853 7.559 0.294 1
1 1562 . 18 1 1 A 133 133 LYS HA H 132 3.722 4.036 -0.314 1
1 1571 . 18 1 1 A 133 133 LYS C C 132 175.725 178.299 -2.574 1
1 1572 . 18 1 1 A 133 133 LYS CA C 132 57.544 58.783 -1.239 1
1 1573 . 18 1 1 A 133 133 LYS CB C 132 31.770 31.980 -0.210 1
1 1577 . 18 1 1 A 133 133 LYS N N 132 119.473 119.929 -0.456 1
1 1578 . 18 1 1 A 134 134 GLU H H 133 8.151 7.735 0.416 1
1 1579 . 18 1 1 A 134 134 GLU HA H 133 4.161 4.439 -0.278 1
1 1584 . 18 1 1 A 134 134 GLU C C 133 177.453 177.949 -0.496 1
1 1585 . 18 1 1 A 134 134 GLU CA C 133 57.222 56.812 0.410 1
1 1586 . 18 1 1 A 134 134 GLU CB C 133 30.091 30.233 -0.142 1
1 1588 . 18 1 1 A 134 134 GLU N N 133 116.525 118.250 -1.725 1
1 1589 . 18 1 1 A 135 135 GLY H H 134 7.702 8.068 -0.366 1
1 1590 . 18 1 1 A 135 135 GLY HA2 H 134 3.896 3.735 0.161 1
1 1591 . 18 1 1 A 135 135 GLY HA3 H 134 3.897 3.746 0.151 1
1 1592 . 18 1 1 A 135 135 GLY C C 134 174.538 174.228 0.310 1
1 1593 . 18 1 1 A 135 135 GLY CA C 134 45.975 47.004 -1.029 1
1 1594 . 18 1 1 A 135 135 GLY N N 134 107.924 108.602 -0.678 1
1 1595 . 18 1 1 A 136 136 ARG H H 135 8.045 7.917 0.128 1
1 1596 . 18 1 1 A 136 136 ARG HA H 135 4.323 4.656 -0.333 1
1 1604 . 18 1 1 A 136 136 ARG C C 135 175.864 177.196 -1.332 1
1 1605 . 18 1 1 A 136 136 ARG CA C 135 56.016 54.325 1.691 1
1 1606 . 18 1 1 A 136 136 ARG CB C 135 30.987 31.680 -0.693 1
1 1609 . 18 1 1 A 136 136 ARG N N 135 119.708 118.665 1.043 1
1 1 . 19 1 1 A 14 14 PHE CA C 13 58.199 57.581 0.618 1
1 2 . 19 1 1 A 14 14 PHE CB C 13 39.717 41.178 -1.461 1
1 3 . 19 1 1 A 15 15 SER H H 14 8.299 9.135 -0.836 1
1 4 . 19 1 1 A 15 15 SER HA H 14 4.359 4.874 -0.515 1
1 7 . 19 1 1 A 15 15 SER CA C 14 58.249 57.327 0.922 1
1 8 . 19 1 1 A 15 15 SER CB C 14 63.936 63.940 -0.004 1
1 9 . 19 1 1 A 15 15 SER N N 14 117.379 116.705 0.674 1
1 10 . 19 1 1 A 16 16 SER H H 15 8.255 8.733 -0.478 1
1 11 . 19 1 1 A 16 16 SER HA H 15 3.729 4.820 -1.091 1
1 14 . 19 1 1 A 16 16 SER CA C 15 58.224 59.848 -1.624 1
1 15 . 19 1 1 A 16 16 SER CB C 15 63.886 65.565 -1.679 1
1 16 . 19 1 1 A 16 16 SER N N 15 117.694 118.756 -1.062 1
1 17 . 19 1 1 A 17 17 ALA H H 16 8.333 8.054 0.279 1
1 18 . 19 1 1 A 17 17 ALA HA H 16 4.252 4.281 -0.029 1
1 22 . 19 1 1 A 17 17 ALA CA C 16 53.377 53.304 0.073 1
1 23 . 19 1 1 A 17 17 ALA CB C 16 18.896 18.544 0.352 1
1 24 . 19 1 1 A 17 17 ALA N N 16 125.462 123.991 1.471 1
1 25 . 19 1 1 A 18 18 SER H H 17 8.219 7.982 0.237 1
1 26 . 19 1 1 A 18 18 SER HA H 17 4.332 4.125 0.207 1
1 29 . 19 1 1 A 18 18 SER CA C 17 59.105 61.669 -2.564 1
1 30 . 19 1 1 A 18 18 SER CB C 17 63.592 63.656 -0.064 1
1 31 . 19 1 1 A 18 18 SER N N 17 114.821 114.750 0.071 1
1 32 . 19 1 1 A 19 19 ASP H H 18 8.309 8.358 -0.049 1
1 33 . 19 1 1 A 19 19 ASP HA H 18 4.554 4.978 -0.424 1
1 36 . 19 1 1 A 19 19 ASP C C 18 176.528 177.010 -0.482 1
1 37 . 19 1 1 A 19 19 ASP CA C 18 55.272 54.627 0.645 1
1 38 . 19 1 1 A 19 19 ASP CB C 18 40.883 43.203 -2.320 1
1 39 . 19 1 1 A 19 19 ASP N N 18 123.367 117.219 6.148 1
1 40 . 19 1 1 A 20 20 ALA H H 19 8.133 8.352 -0.219 1
1 41 . 19 1 1 A 20 20 ALA HA H 19 4.170 4.026 0.144 1
1 45 . 19 1 1 A 20 20 ALA C C 19 179.857 180.033 -0.176 1
1 46 . 19 1 1 A 20 20 ALA CA C 19 54.341 55.599 -1.258 1
1 47 . 19 1 1 A 20 20 ALA CB C 19 18.660 18.565 0.095 1
1 48 . 19 1 1 A 20 20 ALA N N 19 123.350 123.099 0.251 1
1 49 . 19 1 1 A 21 21 GLU H H 20 8.140 8.124 0.016 1
1 50 . 19 1 1 A 21 21 GLU HA H 20 4.128 4.074 0.054 1
1 55 . 19 1 1 A 21 21 GLU C C 20 177.675 179.110 -1.435 1
1 56 . 19 1 1 A 21 21 GLU CA C 20 58.520 59.148 -0.628 1
1 57 . 19 1 1 A 21 21 GLU CB C 20 29.765 29.706 0.059 1
1 59 . 19 1 1 A 21 21 GLU N N 20 119.063 117.690 1.373 1
1 60 . 19 1 1 A 22 22 PHE H H 21 8.009 8.100 -0.091 1
1 61 . 19 1 1 A 22 22 PHE HA H 21 4.123 4.241 -0.118 1
1 68 . 19 1 1 A 22 22 PHE C C 21 176.410 177.158 -0.748 1
1 69 . 19 1 1 A 22 22 PHE CA C 21 62.202 61.409 0.793 1
1 70 . 19 1 1 A 22 22 PHE CB C 21 39.223 39.487 -0.264 1
1 75 . 19 1 1 A 22 22 PHE N N 21 121.211 121.768 -0.557 1
1 76 . 19 1 1 A 23 23 ASP H H 22 8.261 8.325 -0.064 1
1 77 . 19 1 1 A 23 23 ASP HA H 22 4.041 4.297 -0.256 1
1 80 . 19 1 1 A 23 23 ASP C C 22 179.078 178.177 0.901 1
1 81 . 19 1 1 A 23 23 ASP CA C 22 57.048 57.666 -0.618 1
1 82 . 19 1 1 A 23 23 ASP CB C 22 40.154 41.146 -0.992 1
1 83 . 19 1 1 A 23 23 ASP N N 22 116.876 118.827 -1.951 1
1 84 . 19 1 1 A 24 24 ALA H H 23 7.651 7.694 -0.043 1
1 85 . 19 1 1 A 24 24 ALA HA H 23 3.785 3.874 -0.089 1
1 89 . 19 1 1 A 24 24 ALA C C 23 179.577 180.018 -0.441 1
1 90 . 19 1 1 A 24 24 ALA CA C 23 54.341 55.316 -0.975 1
1 91 . 19 1 1 A 24 24 ALA CB C 23 17.762 18.145 -0.383 1
1 92 . 19 1 1 A 24 24 ALA N N 23 121.873 121.609 0.264 1
1 93 . 19 1 1 A 25 25 VAL H H 24 7.718 8.171 -0.453 1
1 94 . 19 1 1 A 25 25 VAL HA H 24 3.216 3.612 -0.396 1
1 102 . 19 1 1 A 25 25 VAL C C 24 177.805 178.364 -0.559 1
1 103 . 19 1 1 A 25 25 VAL CA C 24 66.789 66.841 -0.052 1
1 104 . 19 1 1 A 25 25 VAL CB C 24 31.277 31.329 -0.052 1
1 107 . 19 1 1 A 25 25 VAL N N 24 117.890 118.634 -0.744 1
1 108 . 19 1 1 A 26 26 VAL H H 25 7.867 7.603 0.264 1
1 109 . 19 1 1 A 26 26 VAL HA H 25 3.274 3.464 -0.190 1
1 117 . 19 1 1 A 26 26 VAL C C 25 177.788 177.398 0.390 1
1 118 . 19 1 1 A 26 26 VAL CA C 25 67.282 66.395 0.887 1
1 119 . 19 1 1 A 26 26 VAL CB C 25 31.266 31.354 -0.088 1
1 122 . 19 1 1 A 26 26 VAL N N 25 118.170 119.904 -1.734 1
1 123 . 19 1 1 A 27 27 GLY H H 26 7.544 7.620 -0.076 1
1 124 . 19 1 1 A 27 27 GLY HA2 H 26 3.592 3.452 0.140 1
1 125 . 19 1 1 A 27 27 GLY HA3 H 26 3.721 3.575 0.146 1
1 126 . 19 1 1 A 27 27 GLY C C 26 176.717 176.146 0.571 1
1 127 . 19 1 1 A 27 27 GLY CA C 26 47.085 47.150 -0.065 1
1 128 . 19 1 1 A 27 27 GLY N N 26 105.795 107.677 -1.882 1
1 129 . 19 1 1 A 28 28 TYR H H 27 7.625 7.293 0.332 1
1 130 . 19 1 1 A 28 28 TYR HA H 27 4.546 4.557 -0.011 1
1 137 . 19 1 1 A 28 28 TYR C C 27 178.991 178.095 0.896 1
1 138 . 19 1 1 A 28 28 TYR CA C 27 58.845 59.784 -0.939 1
1 139 . 19 1 1 A 28 28 TYR CB C 27 37.602 37.653 -0.051 1
1 144 . 19 1 1 A 28 28 TYR N N 27 119.933 121.437 -1.504 1
1 145 . 19 1 1 A 29 29 LEU H H 28 8.517 8.444 0.073 1
1 146 . 19 1 1 A 29 29 LEU HA H 28 3.728 3.781 -0.053 1
1 156 . 19 1 1 A 29 29 LEU CA C 28 58.281 57.905 0.376 1
1 157 . 19 1 1 A 29 29 LEU CB C 28 41.948 41.183 0.765 1
1 161 . 19 1 1 A 29 29 LEU N N 28 119.669 119.966 -0.297 1
1 162 . 19 1 1 A 30 30 GLU H H 29 8.072 7.983 0.089 1
1 163 . 19 1 1 A 30 30 GLU HA H 29 3.722 3.880 -0.158 1
1 168 . 19 1 1 A 30 30 GLU C C 29 177.731 179.201 -1.470 1
1 169 . 19 1 1 A 30 30 GLU CA C 29 59.763 59.948 -0.185 1
1 170 . 19 1 1 A 30 30 GLU CB C 29 28.844 29.416 -0.572 1
1 172 . 19 1 1 A 30 30 GLU N N 29 117.666 118.284 -0.618 1
1 173 . 19 1 1 A 31 31 ASP H H 30 7.243 7.861 -0.618 1
1 174 . 19 1 1 A 31 31 ASP HA H 30 4.297 4.374 -0.077 1
1 177 . 19 1 1 A 31 31 ASP CA C 30 56.953 57.352 -0.399 1
1 178 . 19 1 1 A 31 31 ASP CB C 30 40.730 40.576 0.154 1
1 179 . 19 1 1 A 31 31 ASP N N 30 116.720 119.460 -2.740 1
1 180 . 19 1 1 A 32 32 ILE H H 31 7.940 7.490 0.450 1
1 181 . 19 1 1 A 32 32 ILE HA H 31 3.640 3.703 -0.063 1
1 191 . 19 1 1 A 32 32 ILE C C 31 177.980 178.049 -0.069 1
1 192 . 19 1 1 A 32 32 ILE CA C 31 64.692 64.395 0.297 1
1 193 . 19 1 1 A 32 32 ILE CB C 31 38.938 37.980 0.958 1
1 197 . 19 1 1 A 32 32 ILE N N 31 119.728 120.070 -0.342 1
1 198 . 19 1 1 A 33 33 ILE H H 32 7.984 7.887 0.097 1
1 199 . 19 1 1 A 33 33 ILE HA H 32 3.598 2.765 0.833 1
1 209 . 19 1 1 A 33 33 ILE C C 32 176.723 176.925 -0.202 1
1 210 . 19 1 1 A 33 33 ILE CA C 32 63.241 64.396 -1.155 1
1 211 . 19 1 1 A 33 33 ILE CB C 32 37.580 37.686 -0.106 1
1 215 . 19 1 1 A 33 33 ILE N N 32 113.919 119.947 -6.028 1
1 216 . 19 1 1 A 34 34 MET H H 33 7.288 7.786 -0.498 1
1 217 . 19 1 1 A 34 34 MET HA H 33 4.496 4.655 -0.159 1
1 225 . 19 1 1 A 34 34 MET C C 33 176.423 175.731 0.692 1
1 226 . 19 1 1 A 34 34 MET CA C 33 54.634 54.160 0.474 1
1 227 . 19 1 1 A 34 34 MET CB C 33 31.934 31.575 0.359 1
1 230 . 19 1 1 A 34 34 MET N N 33 115.130 116.918 -1.788 1
1 231 . 19 1 1 A 35 35 ASP H H 34 7.405 7.631 -0.226 1
1 232 . 19 1 1 A 35 35 ASP HA H 34 4.484 4.697 -0.213 1
1 235 . 19 1 1 A 35 35 ASP C C 34 177.139 176.141 0.998 1
1 236 . 19 1 1 A 35 35 ASP CA C 34 54.625 54.443 0.182 1
1 237 . 19 1 1 A 35 35 ASP CB C 34 43.554 43.110 0.444 1
1 238 . 19 1 1 A 35 35 ASP N N 34 121.814 122.524 -0.710 1
1 239 . 19 1 1 A 36 36 ASP H H 35 8.765 9.212 -0.447 1
1 240 . 19 1 1 A 36 36 ASP HA H 35 4.235 4.216 0.019 1
1 243 . 19 1 1 A 36 36 ASP C C 35 178.320 178.002 0.318 1
1 244 . 19 1 1 A 36 36 ASP CA C 35 57.832 58.639 -0.807 1
1 245 . 19 1 1 A 36 36 ASP CB C 35 40.914 41.266 -0.352 1
1 246 . 19 1 1 A 36 36 ASP N N 35 125.883 127.395 -1.512 1
1 247 . 19 1 1 A 37 37 GLU H H 36 8.905 8.399 0.506 1
1 248 . 19 1 1 A 37 37 GLU HA H 36 3.933 4.106 -0.173 1
1 253 . 19 1 1 A 37 37 GLU C C 36 179.304 179.046 0.258 1
1 254 . 19 1 1 A 37 37 GLU CA C 36 59.828 58.958 0.870 1
1 255 . 19 1 1 A 37 37 GLU CB C 36 29.380 29.488 -0.108 1
1 257 . 19 1 1 A 37 37 GLU N N 36 119.077 118.213 0.864 1
1 258 . 19 1 1 A 38 38 PHE H H 37 7.460 8.552 -1.092 1
1 259 . 19 1 1 A 38 38 PHE HA H 37 3.642 3.976 -0.334 1
1 267 . 19 1 1 A 38 38 PHE C C 37 176.483 177.745 -1.262 1
1 268 . 19 1 1 A 38 38 PHE CA C 37 61.411 61.091 0.320 1
1 269 . 19 1 1 A 38 38 PHE CB C 37 39.355 39.164 0.191 1
1 275 . 19 1 1 A 38 38 PHE N N 37 119.968 122.874 -2.906 1
1 276 . 19 1 1 A 39 39 GLN H H 38 7.968 7.998 -0.030 1
1 277 . 19 1 1 A 39 39 GLN HA H 38 3.712 3.824 -0.112 1
1 284 . 19 1 1 A 39 39 GLN CA C 38 59.153 59.011 0.142 1
1 285 . 19 1 1 A 39 39 GLN CB C 38 28.213 28.499 -0.286 1
1 287 . 19 1 1 A 39 39 GLN N N 38 116.433 118.530 -2.097 1
1 289 . 19 1 1 A 40 40 LEU H H 39 7.930 7.971 -0.041 1
1 290 . 19 1 1 A 40 40 LEU HA H 39 3.916 4.044 -0.128 1
1 300 . 19 1 1 A 40 40 LEU C C 39 177.731 178.206 -0.475 1
1 301 . 19 1 1 A 40 40 LEU CA C 39 57.915 58.161 -0.246 1
1 302 . 19 1 1 A 40 40 LEU CB C 39 41.989 41.348 0.641 1
1 306 . 19 1 1 A 40 40 LEU N N 39 119.505 121.960 -2.455 1
1 307 . 19 1 1 A 41 41 LEU H H 40 7.174 7.859 -0.685 1
1 308 . 19 1 1 A 41 41 LEU HA H 40 3.835 4.007 -0.172 1
1 318 . 19 1 1 A 41 41 LEU C C 40 179.738 178.187 1.551 1
1 319 . 19 1 1 A 41 41 LEU CA C 40 58.266 58.290 -0.024 1
1 320 . 19 1 1 A 41 41 LEU CB C 40 42.050 41.600 0.450 1
1 324 . 19 1 1 A 41 41 LEU N N 40 120.971 119.700 1.271 1
1 325 . 19 1 1 A 42 42 GLN H H 41 8.058 7.980 0.078 1
1 326 . 19 1 1 A 42 42 GLN HA H 41 3.556 3.740 -0.184 1
1 333 . 19 1 1 A 42 42 GLN C C 41 177.642 178.611 -0.969 1
1 334 . 19 1 1 A 42 42 GLN CA C 41 59.826 59.177 0.649 1
1 335 . 19 1 1 A 42 42 GLN CB C 41 28.762 28.116 0.646 1
1 337 . 19 1 1 A 42 42 GLN N N 41 117.899 118.286 -0.387 1
1 339 . 19 1 1 A 43 43 ARG H H 42 8.179 7.809 0.370 1
1 340 . 19 1 1 A 43 43 ARG HA H 42 3.655 4.000 -0.345 1
1 347 . 19 1 1 A 43 43 ARG C C 42 178.051 178.863 -0.812 1
1 348 . 19 1 1 A 43 43 ARG CA C 42 59.766 58.936 0.830 1
1 349 . 19 1 1 A 43 43 ARG CB C 42 29.941 29.618 0.323 1
1 352 . 19 1 1 A 43 43 ARG N N 42 119.392 118.683 0.709 1
1 353 . 19 1 1 A 44 44 ASN H H 43 8.525 8.148 0.377 1
1 354 . 19 1 1 A 44 44 ASN HA H 43 4.332 4.351 -0.019 1
1 359 . 19 1 1 A 44 44 ASN C C 43 178.150 177.798 0.352 1
1 360 . 19 1 1 A 44 44 ASN CA C 43 55.841 56.145 -0.304 1
1 361 . 19 1 1 A 44 44 ASN CB C 43 37.632 39.266 -1.634 1
1 362 . 19 1 1 A 44 44 ASN N N 43 116.214 117.581 -1.367 1
1 364 . 19 1 1 A 45 45 PHE H H 44 7.586 7.764 -0.178 1
1 365 . 19 1 1 A 45 45 PHE HA H 44 4.132 4.278 -0.146 1
1 372 . 19 1 1 A 45 45 PHE C C 44 176.691 178.638 -1.947 1
1 373 . 19 1 1 A 45 45 PHE CA C 44 62.333 60.743 1.590 1
1 374 . 19 1 1 A 45 45 PHE CB C 44 39.449 38.890 0.559 1
1 379 . 19 1 1 A 45 45 PHE N N 44 121.501 117.378 4.123 1
1 380 . 19 1 1 A 46 46 MET H H 45 8.190 8.297 -0.107 1
1 381 . 19 1 1 A 46 46 MET HA H 45 4.060 4.295 -0.235 1
1 389 . 19 1 1 A 46 46 MET C C 45 179.754 178.177 1.577 1
1 390 . 19 1 1 A 46 46 MET CA C 45 57.742 58.013 -0.271 1
1 391 . 19 1 1 A 46 46 MET CB C 45 29.912 31.280 -1.368 1
1 394 . 19 1 1 A 46 46 MET N N 45 116.727 118.012 -1.285 1
1 395 . 19 1 1 A 47 47 ASP H H 46 8.579 8.297 0.282 1
1 396 . 19 1 1 A 47 47 ASP HA H 46 4.804 4.660 0.144 1
1 399 . 19 1 1 A 47 47 ASP C C 46 177.854 178.437 -0.583 1
1 400 . 19 1 1 A 47 47 ASP CA C 46 57.277 57.280 -0.003 1
1 401 . 19 1 1 A 47 47 ASP CB C 46 40.776 41.669 -0.893 1
1 402 . 19 1 1 A 47 47 ASP N N 46 117.798 120.702 -2.904 1
1 403 . 19 1 1 A 48 48 LYS H H 47 7.339 7.878 -0.539 1
1 404 . 19 1 1 A 48 48 LYS HA H 47 3.828 4.244 -0.416 1
1 413 . 19 1 1 A 48 48 LYS C C 47 178.812 178.682 0.130 1
1 414 . 19 1 1 A 48 48 LYS CA C 47 58.953 58.450 0.503 1
1 415 . 19 1 1 A 48 48 LYS CB C 47 32.796 32.996 -0.200 1
1 419 . 19 1 1 A 48 48 LYS N N 47 117.852 119.744 -1.892 1
1 420 . 19 1 1 A 49 49 TYR H H 48 6.841 8.609 -1.768 1
1 421 . 19 1 1 A 49 49 TYR HA H 48 4.995 4.232 0.763 1
1 428 . 19 1 1 A 49 49 TYR C C 48 178.138 178.524 -0.386 1
1 429 . 19 1 1 A 49 49 TYR CA C 48 58.620 59.729 -1.109 1
1 430 . 19 1 1 A 49 49 TYR CB C 48 42.939 38.044 4.895 1
1 435 . 19 1 1 A 49 49 TYR N N 48 112.109 119.708 -7.599 1
1 436 . 19 1 1 A 50 50 TYR H H 49 8.491 8.110 0.381 1
1 437 . 19 1 1 A 50 50 TYR HA H 49 4.598 4.087 0.511 1
1 444 . 19 1 1 A 50 50 TYR C C 49 176.015 177.531 -1.516 1
1 445 . 19 1 1 A 50 50 TYR CA C 49 62.442 59.440 3.002 1
1 446 . 19 1 1 A 50 50 TYR CB C 49 36.588 36.931 -0.343 1
1 451 . 19 1 1 A 50 50 TYR N N 49 118.294 119.807 -1.513 1
1 452 . 19 1 1 A 51 51 LEU H H 50 7.512 7.769 -0.257 1
1 453 . 19 1 1 A 51 51 LEU HA H 50 3.878 3.562 0.316 1
1 463 . 19 1 1 A 51 51 LEU C C 50 178.625 178.433 0.192 1
1 464 . 19 1 1 A 51 51 LEU CA C 50 55.994 57.176 -1.182 1
1 465 . 19 1 1 A 51 51 LEU CB C 50 40.743 41.474 -0.731 1
1 469 . 19 1 1 A 51 51 LEU N N 50 118.478 121.883 -3.405 1
1 470 . 19 1 1 A 52 52 GLU H H 51 8.042 7.976 0.066 1
1 471 . 19 1 1 A 52 52 GLU HA H 51 4.197 3.949 0.248 1
1 476 . 19 1 1 A 52 52 GLU C C 51 177.629 177.829 -0.200 1
1 477 . 19 1 1 A 52 52 GLU CA C 51 56.141 59.616 -3.475 1
1 478 . 19 1 1 A 52 52 GLU CB C 51 29.162 29.209 -0.047 1
1 480 . 19 1 1 A 52 52 GLU N N 51 115.067 118.250 -3.183 1
1 481 . 19 1 1 A 53 53 PHE H H 52 7.465 8.076 -0.611 1
1 482 . 19 1 1 A 53 53 PHE HA H 52 4.431 4.681 -0.250 1
1 490 . 19 1 1 A 53 53 PHE C C 52 174.325 174.947 -0.622 1
1 491 . 19 1 1 A 53 53 PHE CA C 52 58.986 56.983 2.003 1
1 492 . 19 1 1 A 53 53 PHE CB C 52 40.183 37.312 2.871 1
1 498 . 19 1 1 A 53 53 PHE N N 52 116.768 118.767 -1.999 1
1 499 . 19 1 1 A 54 54 GLU H H 53 7.484 8.639 -1.155 1
1 500 . 19 1 1 A 54 54 GLU HA H 53 4.583 4.890 -0.307 1
1 505 . 19 1 1 A 54 54 GLU C C 53 175.722 175.360 0.362 1
1 506 . 19 1 1 A 54 54 GLU CA C 53 54.248 55.121 -0.873 1
1 507 . 19 1 1 A 54 54 GLU CB C 53 34.409 32.158 2.251 1
1 509 . 19 1 1 A 54 54 GLU N N 53 118.844 123.577 -4.733 1
1 510 . 19 1 1 A 55 55 ASP H H 54 9.008 8.594 0.414 1
1 511 . 19 1 1 A 55 55 ASP HA H 54 4.735 4.901 -0.166 1
1 514 . 19 1 1 A 55 55 ASP C C 54 175.421 175.528 -0.107 1
1 515 . 19 1 1 A 55 55 ASP CA C 54 52.888 53.452 -0.564 1
1 516 . 19 1 1 A 55 55 ASP CB C 54 38.894 40.804 -1.910 1
1 517 . 19 1 1 A 55 55 ASP N N 54 123.654 123.508 0.146 1
1 518 . 19 1 1 A 56 56 THR H H 55 7.819 7.948 -0.129 1
1 519 . 19 1 1 A 56 56 THR HA H 55 4.574 4.905 -0.331 1
1 524 . 19 1 1 A 56 56 THR C C 55 174.096 174.169 -0.073 1
1 525 . 19 1 1 A 56 56 THR CA C 55 59.172 60.201 -1.029 1
1 526 . 19 1 1 A 56 56 THR CB C 55 71.889 72.205 -0.316 1
1 528 . 19 1 1 A 56 56 THR N N 55 112.015 117.246 -5.231 1
1 529 . 19 1 1 A 57 57 GLU H H 56 8.527 8.693 -0.166 1
1 530 . 19 1 1 A 57 57 GLU HA H 56 4.217 4.480 -0.263 1
1 535 . 19 1 1 A 57 57 GLU C C 56 177.042 176.177 0.865 1
1 536 . 19 1 1 A 57 57 GLU CA C 56 56.869 56.007 0.862 1
1 537 . 19 1 1 A 57 57 GLU CB C 56 29.731 29.707 0.024 1
1 539 . 19 1 1 A 57 57 GLU N N 56 117.531 118.425 -0.894 1
1 540 . 19 1 1 A 58 58 GLU H H 57 7.587 7.916 -0.329 1
1 541 . 19 1 1 A 58 58 GLU HA H 57 3.941 4.750 -0.809 1
1 546 . 19 1 1 A 58 58 GLU C C 57 176.849 175.721 1.128 1
1 547 . 19 1 1 A 58 58 GLU CA C 57 56.924 55.008 1.916 1
1 548 . 19 1 1 A 58 58 GLU CB C 57 30.251 31.403 -1.152 1
1 550 . 19 1 1 A 58 58 GLU N N 57 119.183 120.422 -1.239 1
1 551 . 19 1 1 A 59 59 ASN H H 58 9.120 8.810 0.310 1
1 552 . 19 1 1 A 59 59 ASN HA H 58 4.922 5.430 -0.508 1
1 557 . 19 1 1 A 59 59 ASN C C 58 174.254 174.154 0.100 1
1 558 . 19 1 1 A 59 59 ASN CA C 58 51.956 53.093 -1.137 1
1 559 . 19 1 1 A 59 59 ASN CB C 58 37.404 41.344 -3.940 1
1 560 . 19 1 1 A 59 59 ASN N N 58 126.767 121.425 5.342 1
1 562 . 19 1 1 A 60 60 LYS H H 59 5.892 9.062 -3.170 1
1 563 . 19 1 1 A 60 60 LYS HA H 59 3.798 4.582 -0.784 1
1 572 . 19 1 1 A 60 60 LYS C C 59 177.908 177.790 0.118 1
1 573 . 19 1 1 A 60 60 LYS CA C 59 56.623 54.486 2.137 1
1 574 . 19 1 1 A 60 60 LYS CB C 59 32.279 34.207 -1.928 1
1 578 . 19 1 1 A 60 60 LYS N N 59 121.527 126.528 -5.001 1
1 579 . 19 1 1 A 61 61 LEU H H 60 8.473 8.826 -0.353 1
1 580 . 19 1 1 A 61 61 LEU HA H 60 3.891 4.316 -0.425 1
1 590 . 19 1 1 A 61 61 LEU C C 60 179.843 178.015 1.828 1
1 591 . 19 1 1 A 61 61 LEU CA C 60 58.301 56.915 1.386 1
1 592 . 19 1 1 A 61 61 LEU CB C 60 41.305 42.362 -1.057 1
1 596 . 19 1 1 A 61 61 LEU N N 60 125.639 124.816 0.823 1
1 597 . 19 1 1 A 62 62 ILE H H 61 7.698 7.645 0.053 1
1 598 . 19 1 1 A 62 62 ILE HA H 61 3.952 3.864 0.088 1
1 608 . 19 1 1 A 62 62 ILE C C 61 175.392 176.942 -1.550 1
1 609 . 19 1 1 A 62 62 ILE CA C 61 61.743 63.413 -1.670 1
1 610 . 19 1 1 A 62 62 ILE CB C 61 39.108 37.774 1.334 1
1 614 . 19 1 1 A 62 62 ILE N N 61 114.111 119.037 -4.926 1
1 615 . 19 1 1 A 63 63 TYR H H 62 7.273 7.627 -0.354 1
1 616 . 19 1 1 A 63 63 TYR HA H 62 4.343 4.194 0.149 1
1 623 . 19 1 1 A 63 63 TYR C C 62 178.264 178.528 -0.264 1
1 624 . 19 1 1 A 63 63 TYR CA C 62 57.231 61.052 -3.821 1
1 625 . 19 1 1 A 63 63 TYR CB C 62 36.332 37.843 -1.511 1
1 630 . 19 1 1 A 63 63 TYR N N 62 117.689 121.403 -3.714 1
1 631 . 19 1 1 A 64 64 THR H H 63 7.747 8.119 -0.372 1
1 632 . 19 1 1 A 64 64 THR HA H 63 4.266 4.238 0.028 1
1 637 . 19 1 1 A 64 64 THR CA C 63 69.362 67.580 1.782 1
1 638 . 19 1 1 A 64 64 THR CB C 63 66.962 67.442 -0.480 1
1 640 . 19 1 1 A 64 64 THR N N 63 113.755 116.411 -2.656 1
1 641 . 19 1 1 A 65 65 PRO HA H 64 4.372 4.359 0.013 1
1 648 . 19 1 1 A 65 65 PRO C C 64 179.913 179.461 0.452 1
1 649 . 19 1 1 A 65 65 PRO CA C 64 66.011 66.304 -0.293 1
1 650 . 19 1 1 A 65 65 PRO CB C 64 30.642 30.737 -0.095 1
1 653 . 19 1 1 A 66 66 ILE H H 65 7.377 7.409 -0.032 1
1 654 . 19 1 1 A 66 66 ILE HA H 65 3.530 3.913 -0.383 1
1 664 . 19 1 1 A 66 66 ILE C C 65 177.543 178.420 -0.877 1
1 665 . 19 1 1 A 66 66 ILE CA C 65 66.647 64.302 2.345 1
1 666 . 19 1 1 A 66 66 ILE CB C 65 38.029 37.769 0.260 1
1 670 . 19 1 1 A 66 66 ILE N N 65 118.353 116.689 1.664 1
1 671 . 19 1 1 A 67 67 PHE H H 66 8.480 8.398 0.082 1
1 672 . 19 1 1 A 67 67 PHE HA H 66 4.115 4.282 -0.167 1
1 680 . 19 1 1 A 67 67 PHE C C 66 177.293 177.609 -0.316 1
1 681 . 19 1 1 A 67 67 PHE CA C 66 59.570 62.364 -2.794 1
1 682 . 19 1 1 A 67 67 PHE CB C 66 38.865 39.324 -0.459 1
1 688 . 19 1 1 A 67 67 PHE N N 66 122.420 120.485 1.935 1
1 689 . 19 1 1 A 68 68 ASN H H 67 8.595 8.299 0.296 1
1 690 . 19 1 1 A 68 68 ASN HA H 67 4.211 4.291 -0.080 1
1 695 . 19 1 1 A 68 68 ASN C C 67 178.697 177.989 0.708 1
1 696 . 19 1 1 A 68 68 ASN CA C 67 56.056 56.311 -0.255 1
1 697 . 19 1 1 A 68 68 ASN CB C 67 37.704 38.056 -0.352 1
1 698 . 19 1 1 A 68 68 ASN N N 67 115.573 117.509 -1.936 1
1 700 . 19 1 1 A 69 69 GLU H H 68 8.414 8.010 0.404 1
1 701 . 19 1 1 A 69 69 GLU HA H 68 4.102 4.115 -0.013 1
1 706 . 19 1 1 A 69 69 GLU C C 68 177.880 178.626 -0.746 1
1 707 . 19 1 1 A 69 69 GLU CA C 68 59.399 59.495 -0.096 1
1 708 . 19 1 1 A 69 69 GLU CB C 68 29.855 29.697 0.158 1
1 710 . 19 1 1 A 69 69 GLU N N 68 123.510 120.069 3.441 1
1 711 . 19 1 1 A 70 70 TYR H H 69 8.659 8.173 0.486 1
1 712 . 19 1 1 A 70 70 TYR HA H 69 3.362 3.982 -0.620 1
1 719 . 19 1 1 A 70 70 TYR C C 69 178.143 177.262 0.881 1
1 720 . 19 1 1 A 70 70 TYR CA C 69 60.686 60.902 -0.216 1
1 721 . 19 1 1 A 70 70 TYR CB C 69 38.560 38.814 -0.254 1
1 726 . 19 1 1 A 70 70 TYR N N 69 122.130 120.525 1.605 1
1 727 . 19 1 1 A 71 71 ILE H H 70 8.031 7.571 0.460 1
1 728 . 19 1 1 A 71 71 ILE HA H 70 3.265 3.650 -0.385 1
1 738 . 19 1 1 A 71 71 ILE C C 70 178.056 177.964 0.092 1
1 739 . 19 1 1 A 71 71 ILE CA C 70 63.756 64.167 -0.411 1
1 740 . 19 1 1 A 71 71 ILE CB C 70 37.321 37.677 -0.356 1
1 744 . 19 1 1 A 71 71 ILE N N 70 118.906 120.817 -1.911 1
1 745 . 19 1 1 A 72 72 SER H H 71 7.803 8.015 -0.212 1
1 746 . 19 1 1 A 72 72 SER HA H 71 4.029 4.245 -0.216 1
1 749 . 19 1 1 A 72 72 SER CA C 71 61.380 62.090 -0.710 1
1 750 . 19 1 1 A 72 72 SER CB C 71 63.288 62.933 0.355 1
1 751 . 19 1 1 A 72 72 SER N N 71 113.735 116.677 -2.942 1
1 752 . 19 1 1 A 73 73 LEU H H 72 7.952 7.848 0.104 1
1 753 . 19 1 1 A 73 73 LEU HA H 72 4.418 4.127 0.291 1
1 763 . 19 1 1 A 73 73 LEU C C 72 177.767 178.134 -0.367 1
1 764 . 19 1 1 A 73 73 LEU CA C 72 56.543 57.427 -0.884 1
1 765 . 19 1 1 A 73 73 LEU CB C 72 44.517 41.821 2.696 1
1 769 . 19 1 1 A 73 73 LEU N N 72 119.411 122.023 -2.612 1
1 770 . 19 1 1 A 74 74 VAL H H 73 8.021 7.731 0.290 1
1 771 . 19 1 1 A 74 74 VAL HA H 73 3.532 3.317 0.215 1
1 779 . 19 1 1 A 74 74 VAL C C 73 177.126 177.961 -0.835 1
1 780 . 19 1 1 A 74 74 VAL CA C 73 66.250 66.309 -0.059 1
1 781 . 19 1 1 A 74 74 VAL CB C 73 31.212 31.160 0.052 1
1 784 . 19 1 1 A 74 74 VAL N N 73 118.747 119.092 -0.345 1
1 785 . 19 1 1 A 75 75 GLU H H 74 7.232 7.949 -0.717 1
1 786 . 19 1 1 A 75 75 GLU HA H 74 3.013 4.240 -1.227 1
1 791 . 19 1 1 A 75 75 GLU C C 74 178.804 179.075 -0.271 1
1 792 . 19 1 1 A 75 75 GLU CA C 74 60.536 59.895 0.641 1
1 793 . 19 1 1 A 75 75 GLU CB C 74 27.009 29.090 -2.081 1
1 795 . 19 1 1 A 75 75 GLU N N 74 118.660 119.851 -1.191 1
1 796 . 19 1 1 A 76 76 LYS H H 75 7.051 7.902 -0.851 1
1 797 . 19 1 1 A 76 76 LYS HA H 75 3.765 4.008 -0.243 1
1 806 . 19 1 1 A 76 76 LYS C C 75 177.765 178.494 -0.729 1
1 807 . 19 1 1 A 76 76 LYS CA C 75 58.357 58.939 -0.582 1
1 808 . 19 1 1 A 76 76 LYS CB C 75 31.939 31.878 0.061 1
1 812 . 19 1 1 A 76 76 LYS N N 75 116.112 119.602 -3.490 1
1 813 . 19 1 1 A 77 77 TYR H H 76 7.067 7.752 -0.685 1
1 814 . 19 1 1 A 77 77 TYR HA H 76 4.036 4.170 -0.134 1
1 821 . 19 1 1 A 77 77 TYR C C 76 177.752 177.185 0.567 1
1 822 . 19 1 1 A 77 77 TYR CA C 76 61.820 61.298 0.522 1
1 823 . 19 1 1 A 77 77 TYR CB C 76 38.480 38.715 -0.235 1
1 828 . 19 1 1 A 77 77 TYR N N 76 118.434 120.788 -2.354 1
1 829 . 19 1 1 A 78 78 ILE H H 77 7.554 8.296 -0.742 1
1 830 . 19 1 1 A 78 78 ILE HA H 77 3.159 3.569 -0.410 1
1 840 . 19 1 1 A 78 78 ILE C C 77 177.341 177.878 -0.537 1
1 841 . 19 1 1 A 78 78 ILE CA C 77 65.177 65.189 -0.012 1
1 842 . 19 1 1 A 78 78 ILE CB C 77 37.339 37.807 -0.468 1
1 846 . 19 1 1 A 78 78 ILE N N 77 117.672 121.562 -3.890 1
1 847 . 19 1 1 A 79 79 GLU H H 78 8.296 7.988 0.308 1
1 848 . 19 1 1 A 79 79 GLU HA H 78 3.557 3.812 -0.255 1
1 853 . 19 1 1 A 79 79 GLU C C 78 177.742 178.835 -1.093 1
1 854 . 19 1 1 A 79 79 GLU CA C 78 60.847 59.994 0.853 1
1 855 . 19 1 1 A 79 79 GLU CB C 78 29.594 29.107 0.487 1
1 857 . 19 1 1 A 79 79 GLU N N 78 118.701 120.623 -1.922 1
1 858 . 19 1 1 A 80 80 GLU H H 79 8.330 8.157 0.173 1
1 859 . 19 1 1 A 80 80 GLU HA H 79 3.774 4.011 -0.237 1
1 864 . 19 1 1 A 80 80 GLU C C 79 179.926 179.148 0.778 1
1 865 . 19 1 1 A 80 80 GLU CA C 79 59.581 58.927 0.654 1
1 866 . 19 1 1 A 80 80 GLU CB C 79 29.062 29.201 -0.139 1
1 868 . 19 1 1 A 80 80 GLU N N 79 116.767 118.673 -1.906 1
1 869 . 19 1 1 A 81 81 GLN H H 80 7.634 7.662 -0.028 1
1 870 . 19 1 1 A 81 81 GLN HA H 80 3.605 3.851 -0.246 1
1 877 . 19 1 1 A 81 81 GLN C C 80 179.681 178.499 1.182 1
1 878 . 19 1 1 A 81 81 GLN CA C 80 57.765 58.361 -0.596 1
1 879 . 19 1 1 A 81 81 GLN CB C 80 28.079 28.012 0.067 1
1 881 . 19 1 1 A 81 81 GLN N N 80 116.325 118.693 -2.368 1
1 883 . 19 1 1 A 82 82 LEU H H 81 8.156 7.531 0.625 1
1 884 . 19 1 1 A 82 82 LEU HA H 81 3.536 3.740 -0.204 1
1 894 . 19 1 1 A 82 82 LEU C C 81 178.945 179.414 -0.469 1
1 895 . 19 1 1 A 82 82 LEU CA C 81 57.761 56.796 0.965 1
1 896 . 19 1 1 A 82 82 LEU CB C 81 40.961 40.764 0.197 1
1 900 . 19 1 1 A 82 82 LEU N N 81 121.546 120.584 0.962 1
1 901 . 19 1 1 A 83 83 LEU H H 82 8.326 7.822 0.504 1
1 902 . 19 1 1 A 83 83 LEU HA H 82 4.198 4.141 0.057 1
1 912 . 19 1 1 A 83 83 LEU C C 82 178.631 179.166 -0.535 1
1 913 . 19 1 1 A 83 83 LEU CA C 82 57.016 57.320 -0.304 1
1 914 . 19 1 1 A 83 83 LEU CB C 82 42.182 40.792 1.390 1
1 918 . 19 1 1 A 83 83 LEU N N 82 120.426 119.519 0.907 1
1 919 . 19 1 1 A 84 84 GLN H H 83 6.992 7.515 -0.523 1
1 920 . 19 1 1 A 84 84 GLN HA H 83 3.877 3.999 -0.122 1
1 927 . 19 1 1 A 84 84 GLN C C 83 177.008 176.591 0.417 1
1 928 . 19 1 1 A 84 84 GLN CA C 83 57.543 58.275 -0.732 1
1 929 . 19 1 1 A 84 84 GLN CB C 83 28.688 28.584 0.104 1
1 931 . 19 1 1 A 84 84 GLN N N 83 114.001 117.447 -3.446 1
1 933 . 19 1 1 A 85 85 ARG H H 84 7.072 7.610 -0.538 1
1 934 . 19 1 1 A 85 85 ARG HA H 84 4.047 4.430 -0.383 1
1 942 . 19 1 1 A 85 85 ARG C C 84 175.999 175.540 0.459 1
1 943 . 19 1 1 A 85 85 ARG CA C 84 56.764 56.638 0.126 1
1 944 . 19 1 1 A 85 85 ARG CB C 84 32.044 32.093 -0.049 1
1 947 . 19 1 1 A 85 85 ARG N N 84 115.827 118.886 -3.059 1
1 949 . 19 1 1 A 86 86 ILE H H 85 8.238 7.748 0.490 1
1 950 . 19 1 1 A 86 86 ILE HA H 85 4.389 4.460 -0.071 1
1 960 . 19 1 1 A 86 86 ILE CA C 85 58.007 57.827 0.180 1
1 961 . 19 1 1 A 86 86 ILE CB C 85 39.604 38.882 0.722 1
1 965 . 19 1 1 A 86 86 ILE N N 85 119.285 117.560 1.725 1
1 966 . 19 1 1 A 87 87 PRO HA H 86 4.392 4.445 -0.053 1
1 973 . 19 1 1 A 87 87 PRO C C 86 177.622 176.351 1.271 1
1 974 . 19 1 1 A 87 87 PRO CA C 86 64.665 64.260 0.405 1
1 975 . 19 1 1 A 87 87 PRO CB C 86 32.020 31.754 0.266 1
1 978 . 19 1 1 A 88 88 GLU H H 87 8.312 8.092 0.220 1
1 979 . 19 1 1 A 88 88 GLU HA H 87 4.208 4.249 -0.041 1
1 984 . 19 1 1 A 88 88 GLU C C 87 175.554 175.630 -0.076 1
1 985 . 19 1 1 A 88 88 GLU CA C 87 56.045 55.990 0.055 1
1 986 . 19 1 1 A 88 88 GLU CB C 87 28.654 30.400 -1.746 1
1 988 . 19 1 1 A 88 88 GLU N N 87 114.256 116.568 -2.312 1
1 989 . 19 1 1 A 89 89 PHE H H 88 7.946 7.691 0.255 1
1 990 . 19 1 1 A 89 89 PHE HA H 88 3.993 4.474 -0.481 1
1 998 . 19 1 1 A 89 89 PHE C C 88 173.460 174.750 -1.290 1
1 999 . 19 1 1 A 89 89 PHE CA C 88 60.119 59.027 1.092 1
1 1000 . 19 1 1 A 89 89 PHE CB C 88 39.994 39.841 0.153 1
1 1006 . 19 1 1 A 89 89 PHE N N 88 121.550 123.055 -1.505 1
1 1007 . 19 1 1 A 90 90 ASN H H 89 7.266 7.738 -0.472 1
1 1008 . 19 1 1 A 90 90 ASN HA H 89 4.454 4.960 -0.506 1
1 1013 . 19 1 1 A 90 90 ASN C C 89 173.921 175.090 -1.169 1
1 1014 . 19 1 1 A 90 90 ASN CA C 89 51.839 51.573 0.266 1
1 1015 . 19 1 1 A 90 90 ASN CB C 89 40.674 39.500 1.174 1
1 1016 . 19 1 1 A 90 90 ASN N N 89 125.344 124.533 0.811 1
1 1018 . 19 1 1 A 91 91 MET H H 90 8.968 8.783 0.185 1
1 1019 . 19 1 1 A 91 91 MET HA H 90 4.049 4.239 -0.190 1
1 1027 . 19 1 1 A 91 91 MET C C 90 177.475 177.996 -0.521 1
1 1028 . 19 1 1 A 91 91 MET CA C 90 57.758 58.195 -0.437 1
1 1029 . 19 1 1 A 91 91 MET CB C 90 32.250 32.457 -0.207 1
1 1032 . 19 1 1 A 91 91 MET N N 90 127.052 125.287 1.765 1
1 1033 . 19 1 1 A 92 92 ALA H H 91 8.292 8.126 0.166 1
1 1034 . 19 1 1 A 92 92 ALA HA H 91 4.059 4.103 -0.044 1
1 1038 . 19 1 1 A 92 92 ALA C C 91 180.412 180.119 0.293 1
1 1039 . 19 1 1 A 92 92 ALA CA C 91 55.368 55.150 0.218 1
1 1040 . 19 1 1 A 92 92 ALA CB C 91 17.527 18.430 -0.903 1
1 1041 . 19 1 1 A 92 92 ALA N N 91 123.752 121.456 2.296 1
1 1042 . 19 1 1 A 93 93 ALA H H 92 7.931 8.121 -0.190 1
1 1043 . 19 1 1 A 93 93 ALA HA H 92 4.054 4.100 -0.046 1
1 1047 . 19 1 1 A 93 93 ALA C C 92 180.482 179.874 0.608 1
1 1048 . 19 1 1 A 93 93 ALA CA C 92 54.614 54.850 -0.236 1
1 1049 . 19 1 1 A 93 93 ALA CB C 92 18.098 18.203 -0.105 1
1 1050 . 19 1 1 A 93 93 ALA N N 92 121.158 119.952 1.206 1
1 1051 . 19 1 1 A 94 94 PHE H H 93 8.110 7.773 0.337 1
1 1052 . 19 1 1 A 94 94 PHE HA H 93 4.304 4.162 0.142 1
1 1060 . 19 1 1 A 94 94 PHE C C 93 177.350 177.311 0.039 1
1 1061 . 19 1 1 A 94 94 PHE CA C 93 61.641 61.484 0.157 1
1 1062 . 19 1 1 A 94 94 PHE CB C 93 40.014 39.465 0.549 1
1 1068 . 19 1 1 A 94 94 PHE N N 93 119.807 119.782 0.025 1
1 1069 . 19 1 1 A 95 95 THR H H 94 8.726 8.428 0.298 1
1 1070 . 19 1 1 A 95 95 THR HA H 94 3.569 4.041 -0.472 1
1 1075 . 19 1 1 A 95 95 THR C C 94 176.932 176.947 -0.015 1
1 1076 . 19 1 1 A 95 95 THR CA C 94 66.833 65.484 1.349 1
1 1077 . 19 1 1 A 95 95 THR CB C 94 68.445 68.374 0.071 1
1 1079 . 19 1 1 A 95 95 THR N N 94 113.074 112.351 0.723 1
1 1080 . 19 1 1 A 96 96 THR H H 95 7.657 7.844 -0.187 1
1 1081 . 19 1 1 A 96 96 THR HA H 95 3.945 4.049 -0.104 1
1 1086 . 19 1 1 A 96 96 THR C C 95 176.386 176.373 0.013 1
1 1087 . 19 1 1 A 96 96 THR CA C 95 66.550 66.110 0.440 1
1 1088 . 19 1 1 A 96 96 THR CB C 95 68.583 68.520 0.063 1
1 1090 . 19 1 1 A 96 96 THR N N 95 117.927 116.998 0.929 1
1 1091 . 19 1 1 A 97 97 THR H H 96 7.699 7.679 0.020 1
1 1092 . 19 1 1 A 97 97 THR HA H 96 3.905 4.104 -0.199 1
1 1097 . 19 1 1 A 97 97 THR C C 96 176.572 176.482 0.090 1
1 1098 . 19 1 1 A 97 97 THR CA C 96 65.979 66.349 -0.370 1
1 1099 . 19 1 1 A 97 97 THR CB C 96 68.553 68.354 0.199 1
1 1101 . 19 1 1 A 97 97 THR N N 96 118.518 117.207 1.311 1
1 1102 . 19 1 1 A 98 98 LEU H H 97 8.304 8.147 0.157 1
1 1103 . 19 1 1 A 98 98 LEU HA H 97 3.725 3.827 -0.102 1
1 1113 . 19 1 1 A 98 98 LEU C C 97 178.490 178.447 0.043 1
1 1114 . 19 1 1 A 98 98 LEU CA C 97 58.517 58.033 0.484 1
1 1115 . 19 1 1 A 98 98 LEU CB C 97 41.697 41.091 0.606 1
1 1119 . 19 1 1 A 98 98 LEU N N 97 122.882 121.998 0.884 1
1 1120 . 19 1 1 A 99 99 GLN H H 98 7.639 8.066 -0.427 1
1 1121 . 19 1 1 A 99 99 GLN HA H 98 3.927 4.180 -0.253 1
1 1128 . 19 1 1 A 99 99 GLN C C 98 178.068 177.523 0.545 1
1 1129 . 19 1 1 A 99 99 GLN CA C 98 58.735 58.068 0.667 1
1 1130 . 19 1 1 A 99 99 GLN CB C 98 27.986 28.271 -0.285 1
1 1132 . 19 1 1 A 99 99 GLN N N 98 114.302 116.714 -2.412 1
1 1134 . 19 1 1 A 100 100 HIS H H 99 7.575 7.452 0.123 1
1 1135 . 19 1 1 A 100 100 HIS HA H 99 4.524 4.395 0.129 1
1 1139 . 19 1 1 A 100 100 HIS C C 99 174.789 177.964 -3.175 1
1 1140 . 19 1 1 A 100 100 HIS CA C 99 56.154 59.874 -3.720 1
1 1141 . 19 1 1 A 100 100 HIS CB C 99 28.946 30.651 -1.705 1
1 1143 . 19 1 1 A 100 100 HIS N N 99 114.778 117.966 -3.188 1
1 1144 . 19 1 1 A 101 101 HIS H H 100 7.773 8.136 -0.363 1
1 1145 . 19 1 1 A 101 101 HIS HA H 100 4.704 4.373 0.331 1
1 1149 . 19 1 1 A 101 101 HIS C C 100 174.818 177.245 -2.427 1
1 1150 . 19 1 1 A 101 101 HIS CA C 100 54.830 59.124 -4.294 1
1 1151 . 19 1 1 A 101 101 HIS CB C 100 29.749 28.634 1.115 1
1 1153 . 19 1 1 A 101 101 HIS N N 100 117.397 117.267 0.130 1
1 1154 . 19 1 1 A 102 102 LYS H H 101 7.324 8.077 -0.753 1
1 1155 . 19 1 1 A 102 102 LYS HA H 101 3.611 4.054 -0.443 1
1 1164 . 19 1 1 A 102 102 LYS C C 101 176.823 179.277 -2.454 1
1 1165 . 19 1 1 A 102 102 LYS CA C 101 59.915 59.099 0.816 1
1 1166 . 19 1 1 A 102 102 LYS CB C 101 32.825 32.241 0.584 1
1 1170 . 19 1 1 A 102 102 LYS N N 101 120.533 120.285 0.248 1
1 1171 . 19 1 1 A 103 103 ASP H H 102 8.361 7.743 0.618 1
1 1172 . 19 1 1 A 103 103 ASP HA H 102 4.421 4.467 -0.046 1
1 1175 . 19 1 1 A 103 103 ASP C C 102 176.793 177.661 -0.868 1
1 1176 . 19 1 1 A 103 103 ASP CA C 102 55.500 56.149 -0.649 1
1 1177 . 19 1 1 A 103 103 ASP CB C 102 40.178 40.613 -0.435 1
1 1178 . 19 1 1 A 103 103 ASP N N 102 114.814 119.571 -4.757 1
1 1179 . 19 1 1 A 104 104 GLU H H 103 7.858 8.293 -0.435 1
1 1180 . 19 1 1 A 104 104 GLU HA H 103 4.339 4.690 -0.351 1
1 1183 . 19 1 1 A 104 104 GLU C C 103 175.777 176.912 -1.135 1
1 1184 . 19 1 1 A 104 104 GLU CA C 103 56.356 57.619 -1.263 1
1 1185 . 19 1 1 A 104 104 GLU CB C 103 31.293 32.933 -1.640 1
1 1186 . 19 1 1 A 104 104 GLU N N 103 116.826 118.541 -1.715 1
1 1187 . 19 1 1 A 105 105 VAL H H 104 7.201 7.889 -0.688 1
1 1188 . 19 1 1 A 105 105 VAL HA H 104 4.296 4.107 0.189 1
1 1196 . 19 1 1 A 105 105 VAL C C 104 174.482 176.095 -1.613 1
1 1197 . 19 1 1 A 105 105 VAL CA C 104 60.370 63.241 -2.871 1
1 1198 . 19 1 1 A 105 105 VAL CB C 104 34.341 32.183 2.158 1
1 1201 . 19 1 1 A 105 105 VAL N N 104 116.422 120.127 -3.705 1
1 1202 . 19 1 1 A 106 106 ALA H H 105 8.487 8.455 0.032 1
1 1203 . 19 1 1 A 106 106 ALA HA H 105 4.172 4.425 -0.253 1
1 1207 . 19 1 1 A 106 106 ALA C C 105 179.030 178.898 0.132 1
1 1208 . 19 1 1 A 106 106 ALA CA C 105 52.966 52.605 0.361 1
1 1209 . 19 1 1 A 106 106 ALA CB C 105 19.371 19.694 -0.323 1
1 1210 . 19 1 1 A 106 106 ALA N N 105 128.313 127.860 0.453 1
1 1211 . 19 1 1 A 107 107 GLY H H 106 8.738 8.797 -0.059 1
1 1212 . 19 1 1 A 107 107 GLY HA2 H 106 3.773 3.876 -0.103 1
1 1213 . 19 1 1 A 107 107 GLY HA3 H 106 3.998 3.944 0.054 1
1 1214 . 19 1 1 A 107 107 GLY C C 106 174.958 175.537 -0.579 1
1 1215 . 19 1 1 A 107 107 GLY CA C 106 47.449 47.121 0.328 1
1 1216 . 19 1 1 A 107 107 GLY N N 106 110.612 111.023 -0.411 1
1 1217 . 19 1 1 A 108 108 ASP H H 107 8.535 7.856 0.679 1
1 1218 . 19 1 1 A 108 108 ASP HA H 107 4.333 4.357 -0.024 1
1 1221 . 19 1 1 A 108 108 ASP C C 107 179.133 178.888 0.245 1
1 1222 . 19 1 1 A 108 108 ASP CA C 107 56.721 56.624 0.097 1
1 1223 . 19 1 1 A 108 108 ASP CB C 107 39.336 40.984 -1.648 1
1 1224 . 19 1 1 A 108 108 ASP N N 107 117.474 122.755 -5.281 1
1 1225 . 19 1 1 A 109 109 ILE H H 108 7.459 7.923 -0.464 1
1 1226 . 19 1 1 A 109 109 ILE HA H 108 3.688 3.652 0.036 1
1 1236 . 19 1 1 A 109 109 ILE C C 108 176.735 178.133 -1.398 1
1 1237 . 19 1 1 A 109 109 ILE CA C 108 63.474 65.572 -2.098 1
1 1238 . 19 1 1 A 109 109 ILE CB C 108 37.340 37.986 -0.646 1
1 1242 . 19 1 1 A 109 109 ILE N N 108 119.609 119.583 0.026 1
1 1243 . 19 1 1 A 110 110 PHE H H 109 7.920 8.366 -0.446 1
1 1244 . 19 1 1 A 110 110 PHE HA H 109 3.759 4.086 -0.327 1
1 1252 . 19 1 1 A 110 110 PHE C C 109 177.132 177.258 -0.126 1
1 1253 . 19 1 1 A 110 110 PHE CA C 109 62.766 61.199 1.567 1
1 1254 . 19 1 1 A 110 110 PHE CB C 109 39.752 39.284 0.468 1
1 1260 . 19 1 1 A 110 110 PHE N N 109 120.906 120.294 0.612 1
1 1261 . 19 1 1 A 111 111 ASP H H 110 8.639 8.249 0.390 1
1 1262 . 19 1 1 A 111 111 ASP HA H 110 4.216 4.154 0.062 1
1 1265 . 19 1 1 A 111 111 ASP C C 110 178.900 178.299 0.601 1
1 1266 . 19 1 1 A 111 111 ASP CA C 110 57.105 57.559 -0.454 1
1 1267 . 19 1 1 A 111 111 ASP CB C 110 39.697 42.045 -2.348 1
1 1268 . 19 1 1 A 111 111 ASP N N 110 117.124 118.784 -1.660 1
1 1269 . 19 1 1 A 112 112 MET H H 111 7.331 7.646 -0.315 1
1 1270 . 19 1 1 A 112 112 MET HA H 111 4.081 4.136 -0.055 1
1 1278 . 19 1 1 A 112 112 MET C C 111 179.052 178.148 0.904 1
1 1279 . 19 1 1 A 112 112 MET CA C 111 58.202 57.997 0.205 1
1 1280 . 19 1 1 A 112 112 MET CB C 111 31.827 32.227 -0.400 1
1 1283 . 19 1 1 A 112 112 MET N N 111 118.061 119.241 -1.180 1
1 1284 . 19 1 1 A 113 113 LEU H H 112 8.001 7.972 0.029 1
1 1285 . 19 1 1 A 113 113 LEU HA H 112 3.723 3.627 0.096 1
1 1295 . 19 1 1 A 113 113 LEU C C 112 179.747 178.783 0.964 1
1 1296 . 19 1 1 A 113 113 LEU CA C 112 57.371 57.462 -0.091 1
1 1297 . 19 1 1 A 113 113 LEU CB C 112 40.671 40.979 -0.308 1
1 1301 . 19 1 1 A 113 113 LEU N N 112 120.426 119.683 0.743 1
1 1302 . 19 1 1 A 114 114 LEU H H 113 7.744 7.504 0.240 1
1 1303 . 19 1 1 A 114 114 LEU HA H 113 4.007 3.624 0.383 1
1 1313 . 19 1 1 A 114 114 LEU C C 113 179.358 178.657 0.701 1
1 1314 . 19 1 1 A 114 114 LEU CA C 113 57.202 57.447 -0.245 1
1 1315 . 19 1 1 A 114 114 LEU CB C 113 41.727 41.155 0.572 1
1 1319 . 19 1 1 A 114 114 LEU N N 113 119.584 118.210 1.374 1
1 1320 . 19 1 1 A 115 115 THR H H 114 7.353 7.668 -0.315 1
1 1321 . 19 1 1 A 115 115 THR HA H 114 4.071 4.114 -0.043 1
1 1327 . 19 1 1 A 115 115 THR C C 114 173.591 176.591 -3.000 1
1 1328 . 19 1 1 A 115 115 THR CA C 114 65.332 64.722 0.610 1
1 1329 . 19 1 1 A 115 115 THR CB C 114 70.319 68.629 1.690 1
1 1331 . 19 1 1 A 115 115 THR N N 114 107.535 110.759 -3.224 1
1 1332 . 19 1 1 A 116 116 PHE H H 115 6.979 7.835 -0.856 1
1 1333 . 19 1 1 A 116 116 PHE HA H 115 5.022 4.338 0.684 1
1 1341 . 19 1 1 A 116 116 PHE C C 115 176.488 176.032 0.456 1
1 1342 . 19 1 1 A 116 116 PHE CA C 115 55.911 61.025 -5.114 1
1 1343 . 19 1 1 A 116 116 PHE CB C 115 38.521 39.133 -0.612 1
1 1349 . 19 1 1 A 116 116 PHE N N 115 112.366 120.002 -7.636 1
1 1350 . 19 1 1 A 117 117 THR H H 116 7.564 8.172 -0.608 1
1 1351 . 19 1 1 A 117 117 THR HA H 116 4.626 5.040 -0.414 1
1 1356 . 19 1 1 A 117 117 THR C C 116 174.085 174.033 0.052 1
1 1357 . 19 1 1 A 117 117 THR CA C 116 61.636 63.058 -1.422 1
1 1358 . 19 1 1 A 117 117 THR CB C 116 70.915 72.475 -1.560 1
1 1360 . 19 1 1 A 117 117 THR N N 116 105.498 112.648 -7.150 1
1 1361 . 19 1 1 A 118 118 ASP H H 117 8.270 7.803 0.467 1
1 1362 . 19 1 1 A 118 118 ASP HA H 117 4.955 4.663 0.292 1
1 1365 . 19 1 1 A 118 118 ASP C C 117 176.328 176.364 -0.036 1
1 1366 . 19 1 1 A 118 118 ASP CA C 117 53.417 53.358 0.059 1
1 1367 . 19 1 1 A 118 118 ASP CB C 117 43.388 40.418 2.970 1
1 1368 . 19 1 1 A 118 118 ASP N N 117 124.409 121.391 3.018 1
1 1369 . 19 1 1 A 119 119 PHE H H 118 8.973 8.768 0.205 1
1 1370 . 19 1 1 A 119 119 PHE HA H 118 3.506 4.113 -0.607 1
1 1378 . 19 1 1 A 119 119 PHE CA C 118 61.490 61.241 0.249 1
1 1379 . 19 1 1 A 119 119 PHE CB C 118 39.246 39.489 -0.243 1
1 1385 . 19 1 1 A 119 119 PHE N N 118 126.688 126.685 0.003 1
1 1386 . 19 1 1 A 120 120 LEU H H 119 8.099 8.306 -0.207 1
1 1387 . 19 1 1 A 120 120 LEU HA H 119 3.842 4.049 -0.207 1
1 1397 . 19 1 1 A 120 120 LEU C C 119 179.601 178.599 1.002 1
1 1398 . 19 1 1 A 120 120 LEU CA C 119 58.174 58.051 0.123 1
1 1399 . 19 1 1 A 120 120 LEU CB C 119 40.315 41.272 -0.957 1
1 1403 . 19 1 1 A 120 120 LEU N N 119 117.930 120.446 -2.516 1
1 1404 . 19 1 1 A 121 121 ALA H H 120 7.729 7.933 -0.204 1
1 1405 . 19 1 1 A 121 121 ALA HA H 120 3.996 4.121 -0.125 1
1 1409 . 19 1 1 A 121 121 ALA C C 120 180.995 179.582 1.413 1
1 1410 . 19 1 1 A 121 121 ALA CA C 120 54.832 54.623 0.209 1
1 1411 . 19 1 1 A 121 121 ALA CB C 120 17.706 18.330 -0.624 1
1 1412 . 19 1 1 A 121 121 ALA N N 120 123.195 121.025 2.170 1
1 1413 . 19 1 1 A 122 122 PHE H H 121 7.943 7.837 0.106 1
1 1414 . 19 1 1 A 122 122 PHE HA H 121 3.887 3.903 -0.016 1
1 1419 . 19 1 1 A 122 122 PHE C C 121 175.410 176.931 -1.521 1
1 1420 . 19 1 1 A 122 122 PHE CA C 121 61.075 60.756 0.319 1
1 1421 . 19 1 1 A 122 122 PHE CB C 121 38.115 38.823 -0.708 1
1 1424 . 19 1 1 A 122 122 PHE N N 121 121.798 120.216 1.582 1
1 1425 . 19 1 1 A 123 123 LYS H H 122 8.468 7.855 0.613 1
1 1426 . 19 1 1 A 123 123 LYS HA H 122 3.077 3.861 -0.784 1
1 1435 . 19 1 1 A 123 123 LYS C C 122 178.453 178.798 -0.345 1
1 1436 . 19 1 1 A 123 123 LYS CA C 122 59.855 59.876 -0.021 1
1 1437 . 19 1 1 A 123 123 LYS CB C 122 32.374 31.984 0.390 1
1 1441 . 19 1 1 A 123 123 LYS N N 122 120.614 118.530 2.084 1
1 1442 . 19 1 1 A 124 124 GLU H H 123 8.100 7.811 0.289 1
1 1443 . 19 1 1 A 124 124 GLU HA H 123 3.652 4.018 -0.366 1
1 1448 . 19 1 1 A 124 124 GLU C C 123 177.743 178.572 -0.829 1
1 1449 . 19 1 1 A 124 124 GLU CA C 123 59.406 59.453 -0.047 1
1 1450 . 19 1 1 A 124 124 GLU CB C 123 28.811 29.391 -0.580 1
1 1452 . 19 1 1 A 124 124 GLU N N 123 117.404 119.113 -1.709 1
1 1453 . 19 1 1 A 125 125 MET H H 124 7.537 7.520 0.017 1
1 1454 . 19 1 1 A 125 125 MET HA H 124 3.860 4.003 -0.143 1
1 1462 . 19 1 1 A 125 125 MET C C 124 179.522 178.243 1.279 1
1 1463 . 19 1 1 A 125 125 MET CA C 124 58.832 58.256 0.576 1
1 1464 . 19 1 1 A 125 125 MET CB C 124 31.765 31.601 0.164 1
1 1467 . 19 1 1 A 125 125 MET N N 124 119.413 119.154 0.259 1
1 1468 . 19 1 1 A 126 126 PHE H H 125 7.148 7.507 -0.359 1
1 1469 . 19 1 1 A 126 126 PHE HA H 125 3.633 4.216 -0.583 1
1 1476 . 19 1 1 A 126 126 PHE C C 125 178.994 178.336 0.658 1
1 1477 . 19 1 1 A 126 126 PHE CA C 125 63.148 61.038 2.110 1
1 1478 . 19 1 1 A 126 126 PHE CB C 125 39.830 38.540 1.290 1
1 1483 . 19 1 1 A 126 126 PHE N N 125 120.013 118.928 1.085 1
1 1484 . 19 1 1 A 127 127 LEU H H 126 8.369 8.624 -0.255 1
1 1485 . 19 1 1 A 127 127 LEU HA H 126 3.972 4.044 -0.072 1
1 1495 . 19 1 1 A 127 127 LEU C C 126 180.621 179.171 1.450 1
1 1496 . 19 1 1 A 127 127 LEU CA C 126 57.944 57.952 -0.008 1
1 1497 . 19 1 1 A 127 127 LEU CB C 126 40.543 41.257 -0.714 1
1 1501 . 19 1 1 A 127 127 LEU N N 126 119.692 119.872 -0.180 1
1 1502 . 19 1 1 A 128 128 ASP H H 127 8.578 7.989 0.589 1
1 1503 . 19 1 1 A 128 128 ASP HA H 127 4.308 4.355 -0.047 1
1 1506 . 19 1 1 A 128 128 ASP C C 127 178.254 178.193 0.061 1
1 1507 . 19 1 1 A 128 128 ASP CA C 127 56.964 57.195 -0.231 1
1 1508 . 19 1 1 A 128 128 ASP CB C 127 39.735 40.786 -1.051 1
1 1509 . 19 1 1 A 128 128 ASP N N 127 121.926 119.617 2.309 1
1 1510 . 19 1 1 A 129 129 TYR H H 128 7.710 8.197 -0.487 1
1 1511 . 19 1 1 A 129 129 TYR HA H 128 3.908 4.009 -0.101 1
1 1518 . 19 1 1 A 129 129 TYR C C 128 177.633 177.577 0.056 1
1 1519 . 19 1 1 A 129 129 TYR CA C 128 61.796 61.164 0.632 1
1 1520 . 19 1 1 A 129 129 TYR CB C 128 39.372 38.412 0.960 1
1 1525 . 19 1 1 A 129 129 TYR N N 128 122.548 120.102 2.446 1
1 1526 . 19 1 1 A 130 130 ARG H H 129 8.622 8.566 0.056 1
1 1527 . 19 1 1 A 130 130 ARG HA H 129 3.722 4.020 -0.298 1
1 1535 . 19 1 1 A 130 130 ARG CA C 129 60.084 59.840 0.244 1
1 1536 . 19 1 1 A 130 130 ARG CB C 129 29.902 29.952 -0.050 1
1 1539 . 19 1 1 A 130 130 ARG N N 129 118.302 119.232 -0.930 1
1 1541 . 19 1 1 A 131 131 ALA H H 130 7.936 7.896 0.040 1
1 1542 . 19 1 1 A 131 131 ALA HA H 130 3.997 4.056 -0.059 1
1 1546 . 19 1 1 A 131 131 ALA C C 130 180.456 180.451 0.005 1
1 1547 . 19 1 1 A 131 131 ALA CA C 130 55.133 55.028 0.105 1
1 1548 . 19 1 1 A 131 131 ALA CB C 130 17.750 18.165 -0.415 1
1 1549 . 19 1 1 A 131 131 ALA N N 130 119.788 120.682 -0.894 1
1 1550 . 19 1 1 A 132 132 GLU H H 131 7.622 7.650 -0.028 1
1 1551 . 19 1 1 A 132 132 GLU HA H 131 3.862 3.967 -0.105 1
1 1556 . 19 1 1 A 132 132 GLU C C 131 179.528 178.984 0.544 1
1 1557 . 19 1 1 A 132 132 GLU CA C 131 58.849 58.886 -0.037 1
1 1558 . 19 1 1 A 132 132 GLU CB C 131 28.930 29.362 -0.432 1
1 1560 . 19 1 1 A 132 132 GLU N N 131 118.428 119.101 -0.673 1
1 1561 . 19 1 1 A 133 133 LYS H H 132 7.853 7.607 0.246 1
1 1562 . 19 1 1 A 133 133 LYS HA H 132 3.722 4.014 -0.292 1
1 1571 . 19 1 1 A 133 133 LYS C C 132 175.725 178.837 -3.112 1
1 1572 . 19 1 1 A 133 133 LYS CA C 132 57.544 59.684 -2.140 1
1 1573 . 19 1 1 A 133 133 LYS CB C 132 31.770 32.063 -0.293 1
1 1577 . 19 1 1 A 133 133 LYS N N 132 119.473 119.280 0.193 1
1 1578 . 19 1 1 A 134 134 GLU H H 133 8.151 7.915 0.236 1
1 1579 . 19 1 1 A 134 134 GLU HA H 133 4.161 4.346 -0.185 1
1 1584 . 19 1 1 A 134 134 GLU C C 133 177.453 176.663 0.790 1
1 1585 . 19 1 1 A 134 134 GLU CA C 133 57.222 56.199 1.023 1
1 1586 . 19 1 1 A 134 134 GLU CB C 133 30.091 29.773 0.318 1
1 1588 . 19 1 1 A 134 134 GLU N N 133 116.525 116.356 0.169 1
1 1589 . 19 1 1 A 135 135 GLY H H 134 7.702 8.594 -0.892 1
1 1590 . 19 1 1 A 135 135 GLY HA2 H 134 3.896 3.995 -0.099 1
1 1591 . 19 1 1 A 135 135 GLY HA3 H 134 3.897 4.007 -0.110 1
1 1592 . 19 1 1 A 135 135 GLY C C 134 174.538 173.371 1.167 1
1 1593 . 19 1 1 A 135 135 GLY CA C 134 45.975 45.522 0.453 1
1 1594 . 19 1 1 A 135 135 GLY N N 134 107.924 107.674 0.250 1
1 1595 . 19 1 1 A 136 136 ARG H H 135 8.045 8.050 -0.005 1
1 1596 . 19 1 1 A 136 136 ARG HA H 135 4.323 4.638 -0.315 1
1 1604 . 19 1 1 A 136 136 ARG C C 135 175.864 175.902 -0.038 1
1 1605 . 19 1 1 A 136 136 ARG CA C 135 56.016 57.382 -1.366 1
1 1606 . 19 1 1 A 136 136 ARG CB C 135 30.987 32.601 -1.614 1
1 1609 . 19 1 1 A 136 136 ARG N N 135 119.708 120.752 -1.044 1
1 1 . 20 1 1 A 14 14 PHE CA C 13 58.199 57.189 1.010 1
1 2 . 20 1 1 A 14 14 PHE CB C 13 39.717 40.259 -0.542 1
1 3 . 20 1 1 A 15 15 SER H H 14 8.299 7.307 0.992 1
1 4 . 20 1 1 A 15 15 SER HA H 14 4.359 4.876 -0.517 1
1 7 . 20 1 1 A 15 15 SER CA C 14 58.249 58.371 -0.122 1
1 8 . 20 1 1 A 15 15 SER CB C 14 63.936 63.353 0.583 1
1 9 . 20 1 1 A 15 15 SER N N 14 117.379 116.496 0.883 1
1 10 . 20 1 1 A 16 16 SER H H 15 8.255 8.884 -0.629 1
1 11 . 20 1 1 A 16 16 SER HA H 15 3.729 4.769 -1.040 1
1 14 . 20 1 1 A 16 16 SER CA C 15 58.224 59.669 -1.445 1
1 15 . 20 1 1 A 16 16 SER CB C 15 63.886 66.038 -2.152 1
1 16 . 20 1 1 A 16 16 SER N N 15 117.694 121.397 -3.703 1
1 17 . 20 1 1 A 17 17 ALA H H 16 8.333 8.238 0.095 1
1 18 . 20 1 1 A 17 17 ALA HA H 16 4.252 4.189 0.063 1
1 22 . 20 1 1 A 17 17 ALA CA C 16 53.377 55.211 -1.834 1
1 23 . 20 1 1 A 17 17 ALA CB C 16 18.896 18.494 0.402 1
1 24 . 20 1 1 A 17 17 ALA N N 16 125.462 123.656 1.806 1
1 25 . 20 1 1 A 18 18 SER H H 17 8.219 7.907 0.312 1
1 26 . 20 1 1 A 18 18 SER HA H 17 4.332 4.542 -0.210 1
1 29 . 20 1 1 A 18 18 SER CA C 17 59.105 57.725 1.380 1
1 30 . 20 1 1 A 18 18 SER CB C 17 63.592 63.599 -0.007 1
1 31 . 20 1 1 A 18 18 SER N N 17 114.821 112.047 2.774 1
1 32 . 20 1 1 A 19 19 ASP H H 18 8.309 7.812 0.497 1
1 33 . 20 1 1 A 19 19 ASP HA H 18 4.554 4.916 -0.362 1
1 36 . 20 1 1 A 19 19 ASP C C 18 176.528 176.823 -0.295 1
1 37 . 20 1 1 A 19 19 ASP CA C 18 55.272 52.212 3.060 1
1 38 . 20 1 1 A 19 19 ASP CB C 18 40.883 43.706 -2.823 1
1 39 . 20 1 1 A 19 19 ASP N N 18 123.367 122.284 1.083 1
1 40 . 20 1 1 A 20 20 ALA H H 19 8.133 8.814 -0.681 1
1 41 . 20 1 1 A 20 20 ALA HA H 19 4.170 4.451 -0.281 1
1 45 . 20 1 1 A 20 20 ALA C C 19 179.857 179.833 0.024 1
1 46 . 20 1 1 A 20 20 ALA CA C 19 54.341 55.149 -0.808 1
1 47 . 20 1 1 A 20 20 ALA CB C 19 18.660 18.368 0.292 1
1 48 . 20 1 1 A 20 20 ALA N N 19 123.350 126.092 -2.742 1
1 49 . 20 1 1 A 21 21 GLU H H 20 8.140 7.931 0.209 1
1 50 . 20 1 1 A 21 21 GLU HA H 20 4.128 4.025 0.103 1
1 55 . 20 1 1 A 21 21 GLU C C 20 177.675 178.963 -1.288 1
1 56 . 20 1 1 A 21 21 GLU CA C 20 58.520 59.553 -1.033 1
1 57 . 20 1 1 A 21 21 GLU CB C 20 29.765 29.697 0.068 1
1 59 . 20 1 1 A 21 21 GLU N N 20 119.063 118.563 0.500 1
1 60 . 20 1 1 A 22 22 PHE H H 21 8.009 8.008 0.001 1
1 61 . 20 1 1 A 22 22 PHE HA H 21 4.123 4.423 -0.300 1
1 68 . 20 1 1 A 22 22 PHE C C 21 176.410 177.333 -0.923 1
1 69 . 20 1 1 A 22 22 PHE CA C 21 62.202 61.745 0.457 1
1 70 . 20 1 1 A 22 22 PHE CB C 21 39.223 39.676 -0.453 1
1 75 . 20 1 1 A 22 22 PHE N N 21 121.211 121.311 -0.100 1
1 76 . 20 1 1 A 23 23 ASP H H 22 8.261 8.826 -0.565 1
1 77 . 20 1 1 A 23 23 ASP HA H 22 4.041 4.367 -0.326 1
1 80 . 20 1 1 A 23 23 ASP C C 22 179.078 178.014 1.064 1
1 81 . 20 1 1 A 23 23 ASP CA C 22 57.048 56.837 0.211 1
1 82 . 20 1 1 A 23 23 ASP CB C 22 40.154 39.741 0.413 1
1 83 . 20 1 1 A 23 23 ASP N N 22 116.876 118.604 -1.728 1
1 84 . 20 1 1 A 24 24 ALA H H 23 7.651 7.904 -0.253 1
1 85 . 20 1 1 A 24 24 ALA HA H 23 3.785 3.839 -0.054 1
1 89 . 20 1 1 A 24 24 ALA C C 23 179.577 179.434 0.143 1
1 90 . 20 1 1 A 24 24 ALA CA C 23 54.341 54.965 -0.624 1
1 91 . 20 1 1 A 24 24 ALA CB C 23 17.762 18.241 -0.479 1
1 92 . 20 1 1 A 24 24 ALA N N 23 121.873 122.141 -0.268 1
1 93 . 20 1 1 A 25 25 VAL H H 24 7.718 8.024 -0.306 1
1 94 . 20 1 1 A 25 25 VAL HA H 24 3.216 3.426 -0.210 1
1 102 . 20 1 1 A 25 25 VAL C C 24 177.805 177.738 0.067 1
1 103 . 20 1 1 A 25 25 VAL CA C 24 66.789 66.663 0.126 1
1 104 . 20 1 1 A 25 25 VAL CB C 24 31.277 31.134 0.143 1
1 107 . 20 1 1 A 25 25 VAL N N 24 117.890 117.808 0.082 1
1 108 . 20 1 1 A 26 26 VAL H H 25 7.867 8.047 -0.180 1
1 109 . 20 1 1 A 26 26 VAL HA H 25 3.274 3.720 -0.446 1
1 117 . 20 1 1 A 26 26 VAL C C 25 177.788 177.871 -0.083 1
1 118 . 20 1 1 A 26 26 VAL CA C 25 67.282 65.821 1.461 1
1 119 . 20 1 1 A 26 26 VAL CB C 25 31.266 30.802 0.464 1
1 122 . 20 1 1 A 26 26 VAL N N 25 118.170 120.319 -2.149 1
1 123 . 20 1 1 A 27 27 GLY H H 26 7.544 7.717 -0.173 1
1 124 . 20 1 1 A 27 27 GLY HA2 H 26 3.592 3.499 0.093 1
1 125 . 20 1 1 A 27 27 GLY HA3 H 26 3.721 3.606 0.115 1
1 126 . 20 1 1 A 27 27 GLY C C 26 176.717 176.609 0.108 1
1 127 . 20 1 1 A 27 27 GLY CA C 26 47.085 47.172 -0.087 1
1 128 . 20 1 1 A 27 27 GLY N N 26 105.795 108.725 -2.930 1
1 129 . 20 1 1 A 28 28 TYR H H 27 7.625 7.470 0.155 1
1 130 . 20 1 1 A 28 28 TYR HA H 27 4.546 4.565 -0.019 1
1 137 . 20 1 1 A 28 28 TYR C C 27 178.991 178.114 0.877 1
1 138 . 20 1 1 A 28 28 TYR CA C 27 58.845 59.659 -0.814 1
1 139 . 20 1 1 A 28 28 TYR CB C 27 37.602 37.616 -0.014 1
1 144 . 20 1 1 A 28 28 TYR N N 27 119.933 121.789 -1.856 1
1 145 . 20 1 1 A 29 29 LEU H H 28 8.517 8.417 0.100 1
1 146 . 20 1 1 A 29 29 LEU HA H 28 3.728 3.864 -0.136 1
1 156 . 20 1 1 A 29 29 LEU CA C 28 58.281 57.961 0.320 1
1 157 . 20 1 1 A 29 29 LEU CB C 28 41.948 41.410 0.538 1
1 161 . 20 1 1 A 29 29 LEU N N 28 119.669 120.194 -0.525 1
1 162 . 20 1 1 A 30 30 GLU H H 29 8.072 7.944 0.128 1
1 163 . 20 1 1 A 30 30 GLU HA H 29 3.722 3.867 -0.145 1
1 168 . 20 1 1 A 30 30 GLU C C 29 177.731 178.845 -1.114 1
1 169 . 20 1 1 A 30 30 GLU CA C 29 59.763 59.906 -0.143 1
1 170 . 20 1 1 A 30 30 GLU CB C 29 28.844 29.260 -0.416 1
1 172 . 20 1 1 A 30 30 GLU N N 29 117.666 117.764 -0.098 1
1 173 . 20 1 1 A 31 31 ASP H H 30 7.243 8.085 -0.842 1
1 174 . 20 1 1 A 31 31 ASP HA H 30 4.297 4.363 -0.066 1
1 177 . 20 1 1 A 31 31 ASP CA C 30 56.953 57.358 -0.405 1
1 178 . 20 1 1 A 31 31 ASP CB C 30 40.730 42.303 -1.573 1
1 179 . 20 1 1 A 31 31 ASP N N 30 116.720 119.021 -2.301 1
1 180 . 20 1 1 A 32 32 ILE H H 31 7.940 7.596 0.344 1
1 181 . 20 1 1 A 32 32 ILE HA H 31 3.640 3.749 -0.109 1
1 191 . 20 1 1 A 32 32 ILE C C 31 177.980 178.138 -0.158 1
1 192 . 20 1 1 A 32 32 ILE CA C 31 64.692 64.110 0.582 1
1 193 . 20 1 1 A 32 32 ILE CB C 31 38.938 37.167 1.771 1
1 197 . 20 1 1 A 32 32 ILE N N 31 119.728 118.616 1.112 1
1 198 . 20 1 1 A 33 33 ILE H H 32 7.984 7.778 0.206 1
1 199 . 20 1 1 A 33 33 ILE HA H 32 3.598 2.768 0.830 1
1 209 . 20 1 1 A 33 33 ILE C C 32 176.723 176.991 -0.268 1
1 210 . 20 1 1 A 33 33 ILE CA C 32 63.241 64.291 -1.050 1
1 211 . 20 1 1 A 33 33 ILE CB C 32 37.580 37.797 -0.217 1
1 215 . 20 1 1 A 33 33 ILE N N 32 113.919 120.574 -6.655 1
1 216 . 20 1 1 A 34 34 MET H H 33 7.288 7.537 -0.249 1
1 217 . 20 1 1 A 34 34 MET HA H 33 4.496 4.668 -0.172 1
1 225 . 20 1 1 A 34 34 MET C C 33 176.423 175.706 0.717 1
1 226 . 20 1 1 A 34 34 MET CA C 33 54.634 54.121 0.513 1
1 227 . 20 1 1 A 34 34 MET CB C 33 31.934 32.100 -0.166 1
1 230 . 20 1 1 A 34 34 MET N N 33 115.130 116.898 -1.768 1
1 231 . 20 1 1 A 35 35 ASP H H 34 7.405 7.721 -0.316 1
1 232 . 20 1 1 A 35 35 ASP HA H 34 4.484 4.686 -0.202 1
1 235 . 20 1 1 A 35 35 ASP C C 34 177.139 176.512 0.627 1
1 236 . 20 1 1 A 35 35 ASP CA C 34 54.625 54.501 0.124 1
1 237 . 20 1 1 A 35 35 ASP CB C 34 43.554 43.007 0.547 1
1 238 . 20 1 1 A 35 35 ASP N N 34 121.814 122.529 -0.715 1
1 239 . 20 1 1 A 36 36 ASP H H 35 8.765 8.813 -0.048 1
1 240 . 20 1 1 A 36 36 ASP HA H 35 4.235 4.324 -0.089 1
1 243 . 20 1 1 A 36 36 ASP C C 35 178.320 178.418 -0.098 1
1 244 . 20 1 1 A 36 36 ASP CA C 35 57.832 57.944 -0.112 1
1 245 . 20 1 1 A 36 36 ASP CB C 35 40.914 40.393 0.521 1
1 246 . 20 1 1 A 36 36 ASP N N 35 125.883 125.201 0.682 1
1 247 . 20 1 1 A 37 37 GLU H H 36 8.905 8.220 0.685 1
1 248 . 20 1 1 A 37 37 GLU HA H 36 3.933 4.084 -0.151 1
1 253 . 20 1 1 A 37 37 GLU C C 36 179.304 178.996 0.308 1
1 254 . 20 1 1 A 37 37 GLU CA C 36 59.828 59.229 0.599 1
1 255 . 20 1 1 A 37 37 GLU CB C 36 29.380 29.333 0.047 1
1 257 . 20 1 1 A 37 37 GLU N N 36 119.077 120.126 -1.049 1
1 258 . 20 1 1 A 38 38 PHE H H 37 7.460 8.323 -0.863 1
1 259 . 20 1 1 A 38 38 PHE HA H 37 3.642 4.059 -0.417 1
1 267 . 20 1 1 A 38 38 PHE C C 37 176.483 177.902 -1.419 1
1 268 . 20 1 1 A 38 38 PHE CA C 37 61.411 61.188 0.223 1
1 269 . 20 1 1 A 38 38 PHE CB C 37 39.355 39.032 0.323 1
1 275 . 20 1 1 A 38 38 PHE N N 37 119.968 120.782 -0.814 1
1 276 . 20 1 1 A 39 39 GLN H H 38 7.968 8.093 -0.125 1
1 277 . 20 1 1 A 39 39 GLN HA H 38 3.712 3.801 -0.089 1
1 284 . 20 1 1 A 39 39 GLN CA C 38 59.153 58.828 0.325 1
1 285 . 20 1 1 A 39 39 GLN CB C 38 28.213 28.215 -0.002 1
1 287 . 20 1 1 A 39 39 GLN N N 38 116.433 118.094 -1.661 1
1 289 . 20 1 1 A 40 40 LEU H H 39 7.930 7.576 0.354 1
1 290 . 20 1 1 A 40 40 LEU HA H 39 3.916 4.020 -0.104 1
1 300 . 20 1 1 A 40 40 LEU C C 39 177.731 178.144 -0.413 1
1 301 . 20 1 1 A 40 40 LEU CA C 39 57.915 57.962 -0.047 1
1 302 . 20 1 1 A 40 40 LEU CB C 39 41.989 41.585 0.404 1
1 306 . 20 1 1 A 40 40 LEU N N 39 119.505 121.028 -1.523 1
1 307 . 20 1 1 A 41 41 LEU H H 40 7.174 7.739 -0.565 1
1 308 . 20 1 1 A 41 41 LEU HA H 40 3.835 4.007 -0.172 1
1 318 . 20 1 1 A 41 41 LEU C C 40 179.738 178.213 1.525 1
1 319 . 20 1 1 A 41 41 LEU CA C 40 58.266 58.275 -0.009 1
1 320 . 20 1 1 A 41 41 LEU CB C 40 42.050 41.471 0.579 1
1 324 . 20 1 1 A 41 41 LEU N N 40 120.971 119.699 1.272 1
1 325 . 20 1 1 A 42 42 GLN H H 41 8.058 7.969 0.089 1
1 326 . 20 1 1 A 42 42 GLN HA H 41 3.556 3.641 -0.085 1
1 333 . 20 1 1 A 42 42 GLN C C 41 177.642 178.457 -0.815 1
1 334 . 20 1 1 A 42 42 GLN CA C 41 59.826 59.121 0.705 1
1 335 . 20 1 1 A 42 42 GLN CB C 41 28.762 27.727 1.035 1
1 337 . 20 1 1 A 42 42 GLN N N 41 117.899 117.691 0.208 1
1 339 . 20 1 1 A 43 43 ARG H H 42 8.179 7.834 0.345 1
1 340 . 20 1 1 A 43 43 ARG HA H 42 3.655 3.927 -0.272 1
1 347 . 20 1 1 A 43 43 ARG C C 42 178.051 178.320 -0.269 1
1 348 . 20 1 1 A 43 43 ARG CA C 42 59.766 58.708 1.058 1
1 349 . 20 1 1 A 43 43 ARG CB C 42 29.941 29.941 0.000 1
1 352 . 20 1 1 A 43 43 ARG N N 42 119.392 119.817 -0.425 1
1 353 . 20 1 1 A 44 44 ASN H H 43 8.525 8.130 0.395 1
1 354 . 20 1 1 A 44 44 ASN HA H 43 4.332 4.393 -0.061 1
1 359 . 20 1 1 A 44 44 ASN C C 43 178.150 177.792 0.358 1
1 360 . 20 1 1 A 44 44 ASN CA C 43 55.841 56.206 -0.365 1
1 361 . 20 1 1 A 44 44 ASN CB C 43 37.632 39.270 -1.638 1
1 362 . 20 1 1 A 44 44 ASN N N 43 116.214 117.860 -1.646 1
1 364 . 20 1 1 A 45 45 PHE H H 44 7.586 7.900 -0.314 1
1 365 . 20 1 1 A 45 45 PHE HA H 44 4.132 4.229 -0.097 1
1 372 . 20 1 1 A 45 45 PHE C C 44 176.691 178.769 -2.078 1
1 373 . 20 1 1 A 45 45 PHE CA C 44 62.333 60.487 1.846 1
1 374 . 20 1 1 A 45 45 PHE CB C 44 39.449 38.736 0.713 1
1 379 . 20 1 1 A 45 45 PHE N N 44 121.501 117.802 3.699 1
1 380 . 20 1 1 A 46 46 MET H H 45 8.190 8.209 -0.019 1
1 381 . 20 1 1 A 46 46 MET HA H 45 4.060 4.231 -0.171 1
1 389 . 20 1 1 A 46 46 MET C C 45 179.754 177.929 1.825 1
1 390 . 20 1 1 A 46 46 MET CA C 45 57.742 57.625 0.117 1
1 391 . 20 1 1 A 46 46 MET CB C 45 29.912 32.215 -2.303 1
1 394 . 20 1 1 A 46 46 MET N N 45 116.727 119.272 -2.545 1
1 395 . 20 1 1 A 47 47 ASP H H 46 8.579 8.234 0.345 1
1 396 . 20 1 1 A 47 47 ASP HA H 46 4.804 4.665 0.139 1
1 399 . 20 1 1 A 47 47 ASP C C 46 177.854 177.756 0.098 1
1 400 . 20 1 1 A 47 47 ASP CA C 46 57.277 57.263 0.014 1
1 401 . 20 1 1 A 47 47 ASP CB C 46 40.776 41.742 -0.966 1
1 402 . 20 1 1 A 47 47 ASP N N 46 117.798 120.627 -2.829 1
1 403 . 20 1 1 A 48 48 LYS H H 47 7.339 7.724 -0.385 1
1 404 . 20 1 1 A 48 48 LYS HA H 47 3.828 4.163 -0.335 1
1 413 . 20 1 1 A 48 48 LYS C C 47 178.812 178.840 -0.028 1
1 414 . 20 1 1 A 48 48 LYS CA C 47 58.953 57.961 0.992 1
1 415 . 20 1 1 A 48 48 LYS CB C 47 32.796 33.355 -0.559 1
1 419 . 20 1 1 A 48 48 LYS N N 47 117.852 118.842 -0.990 1
1 420 . 20 1 1 A 49 49 TYR H H 48 6.841 8.373 -1.532 1
1 421 . 20 1 1 A 49 49 TYR HA H 48 4.995 4.209 0.786 1
1 428 . 20 1 1 A 49 49 TYR C C 48 178.138 178.371 -0.233 1
1 429 . 20 1 1 A 49 49 TYR CA C 48 58.620 59.709 -1.089 1
1 430 . 20 1 1 A 49 49 TYR CB C 48 42.939 38.072 4.867 1
1 435 . 20 1 1 A 49 49 TYR N N 48 112.109 119.240 -7.131 1
1 436 . 20 1 1 A 50 50 TYR H H 49 8.491 8.135 0.356 1
1 437 . 20 1 1 A 50 50 TYR HA H 49 4.598 4.164 0.434 1
1 444 . 20 1 1 A 50 50 TYR C C 49 176.015 178.215 -2.200 1
1 445 . 20 1 1 A 50 50 TYR CA C 49 62.442 59.541 2.901 1
1 446 . 20 1 1 A 50 50 TYR CB C 49 36.588 36.988 -0.400 1
1 451 . 20 1 1 A 50 50 TYR N N 49 118.294 118.975 -0.681 1
1 452 . 20 1 1 A 51 51 LEU H H 50 7.512 7.428 0.084 1
1 453 . 20 1 1 A 51 51 LEU HA H 50 3.878 3.485 0.393 1
1 463 . 20 1 1 A 51 51 LEU C C 50 178.625 178.597 0.028 1
1 464 . 20 1 1 A 51 51 LEU CA C 50 55.994 57.438 -1.444 1
1 465 . 20 1 1 A 51 51 LEU CB C 50 40.743 41.404 -0.661 1
1 469 . 20 1 1 A 51 51 LEU N N 50 118.478 121.607 -3.129 1
1 470 . 20 1 1 A 52 52 GLU H H 51 8.042 7.866 0.176 1
1 471 . 20 1 1 A 52 52 GLU HA H 51 4.197 3.967 0.230 1
1 476 . 20 1 1 A 52 52 GLU C C 51 177.629 177.600 0.029 1
1 477 . 20 1 1 A 52 52 GLU CA C 51 56.141 59.381 -3.240 1
1 478 . 20 1 1 A 52 52 GLU CB C 51 29.162 29.221 -0.059 1
1 480 . 20 1 1 A 52 52 GLU N N 51 115.067 117.499 -2.432 1
1 481 . 20 1 1 A 53 53 PHE H H 52 7.465 7.972 -0.507 1
1 482 . 20 1 1 A 53 53 PHE HA H 52 4.431 4.584 -0.153 1
1 490 . 20 1 1 A 53 53 PHE C C 52 174.325 174.566 -0.241 1
1 491 . 20 1 1 A 53 53 PHE CA C 52 58.986 56.944 2.042 1
1 492 . 20 1 1 A 53 53 PHE CB C 52 40.183 37.442 2.741 1
1 498 . 20 1 1 A 53 53 PHE N N 52 116.768 118.893 -2.125 1
1 499 . 20 1 1 A 54 54 GLU H H 53 7.484 7.816 -0.332 1
1 500 . 20 1 1 A 54 54 GLU HA H 53 4.583 4.962 -0.379 1
1 505 . 20 1 1 A 54 54 GLU C C 53 175.722 175.164 0.558 1
1 506 . 20 1 1 A 54 54 GLU CA C 53 54.248 55.308 -1.060 1
1 507 . 20 1 1 A 54 54 GLU CB C 53 34.409 31.761 2.648 1
1 509 . 20 1 1 A 54 54 GLU N N 53 118.844 122.079 -3.235 1
1 510 . 20 1 1 A 55 55 ASP H H 54 9.008 8.655 0.353 1
1 511 . 20 1 1 A 55 55 ASP HA H 54 4.735 4.901 -0.166 1
1 514 . 20 1 1 A 55 55 ASP C C 54 175.421 175.891 -0.470 1
1 515 . 20 1 1 A 55 55 ASP CA C 54 52.888 53.734 -0.846 1
1 516 . 20 1 1 A 55 55 ASP CB C 54 38.894 40.905 -2.011 1
1 517 . 20 1 1 A 55 55 ASP N N 54 123.654 123.751 -0.097 1
1 518 . 20 1 1 A 56 56 THR H H 55 7.819 8.413 -0.594 1
1 519 . 20 1 1 A 56 56 THR HA H 55 4.574 4.982 -0.408 1
1 524 . 20 1 1 A 56 56 THR C C 55 174.096 174.323 -0.227 1
1 525 . 20 1 1 A 56 56 THR CA C 55 59.172 59.301 -0.129 1
1 526 . 20 1 1 A 56 56 THR CB C 55 71.889 72.347 -0.458 1
1 528 . 20 1 1 A 56 56 THR N N 55 112.015 117.130 -5.115 1
1 529 . 20 1 1 A 57 57 GLU H H 56 8.527 8.793 -0.266 1
1 530 . 20 1 1 A 57 57 GLU HA H 56 4.217 4.394 -0.177 1
1 535 . 20 1 1 A 57 57 GLU C C 56 177.042 175.513 1.529 1
1 536 . 20 1 1 A 57 57 GLU CA C 56 56.869 56.147 0.722 1
1 537 . 20 1 1 A 57 57 GLU CB C 56 29.731 29.630 0.101 1
1 539 . 20 1 1 A 57 57 GLU N N 56 117.531 119.022 -1.491 1
1 540 . 20 1 1 A 58 58 GLU H H 57 7.587 7.601 -0.014 1
1 541 . 20 1 1 A 58 58 GLU HA H 57 3.941 4.953 -1.012 1
1 546 . 20 1 1 A 58 58 GLU C C 57 176.849 174.810 2.039 1
1 547 . 20 1 1 A 58 58 GLU CA C 57 56.924 54.988 1.936 1
1 548 . 20 1 1 A 58 58 GLU CB C 57 30.251 32.822 -2.571 1
1 550 . 20 1 1 A 58 58 GLU N N 57 119.183 121.763 -2.580 1
1 551 . 20 1 1 A 59 59 ASN H H 58 9.120 8.746 0.374 1
1 552 . 20 1 1 A 59 59 ASN HA H 58 4.922 5.382 -0.460 1
1 557 . 20 1 1 A 59 59 ASN C C 58 174.254 174.312 -0.058 1
1 558 . 20 1 1 A 59 59 ASN CA C 58 51.956 51.925 0.031 1
1 559 . 20 1 1 A 59 59 ASN CB C 58 37.404 41.156 -3.752 1
1 560 . 20 1 1 A 59 59 ASN N N 58 126.767 124.205 2.562 1
1 562 . 20 1 1 A 60 60 LYS H H 59 5.892 8.603 -2.711 1
1 563 . 20 1 1 A 60 60 LYS HA H 59 3.798 4.804 -1.006 1
1 572 . 20 1 1 A 60 60 LYS C C 59 177.908 177.126 0.782 1
1 573 . 20 1 1 A 60 60 LYS CA C 59 56.623 54.601 2.022 1
1 574 . 20 1 1 A 60 60 LYS CB C 59 32.279 35.317 -3.038 1
1 578 . 20 1 1 A 60 60 LYS N N 59 121.527 121.197 0.330 1
1 579 . 20 1 1 A 61 61 LEU H H 60 8.473 8.857 -0.384 1
1 580 . 20 1 1 A 61 61 LEU HA H 60 3.891 4.257 -0.366 1
1 590 . 20 1 1 A 61 61 LEU C C 60 179.843 178.721 1.122 1
1 591 . 20 1 1 A 61 61 LEU CA C 60 58.301 56.666 1.635 1
1 592 . 20 1 1 A 61 61 LEU CB C 60 41.305 41.752 -0.447 1
1 596 . 20 1 1 A 61 61 LEU N N 60 125.639 123.454 2.185 1
1 597 . 20 1 1 A 62 62 ILE H H 61 7.698 7.982 -0.284 1
1 598 . 20 1 1 A 62 62 ILE HA H 61 3.952 3.904 0.048 1
1 608 . 20 1 1 A 62 62 ILE C C 61 175.392 177.319 -1.927 1
1 609 . 20 1 1 A 62 62 ILE CA C 61 61.743 63.272 -1.529 1
1 610 . 20 1 1 A 62 62 ILE CB C 61 39.108 37.783 1.325 1
1 614 . 20 1 1 A 62 62 ILE N N 61 114.111 119.655 -5.544 1
1 615 . 20 1 1 A 63 63 TYR H H 62 7.273 7.954 -0.681 1
1 616 . 20 1 1 A 63 63 TYR HA H 62 4.343 4.196 0.147 1
1 623 . 20 1 1 A 63 63 TYR C C 62 178.264 178.568 -0.304 1
1 624 . 20 1 1 A 63 63 TYR CA C 62 57.231 60.927 -3.696 1
1 625 . 20 1 1 A 63 63 TYR CB C 62 36.332 37.580 -1.248 1
1 630 . 20 1 1 A 63 63 TYR N N 62 117.689 121.306 -3.617 1
1 631 . 20 1 1 A 64 64 THR H H 63 7.747 7.944 -0.197 1
1 632 . 20 1 1 A 64 64 THR HA H 63 4.266 4.255 0.011 1
1 637 . 20 1 1 A 64 64 THR CA C 63 69.362 67.577 1.785 1
1 638 . 20 1 1 A 64 64 THR CB C 63 66.962 67.673 -0.711 1
1 640 . 20 1 1 A 64 64 THR N N 63 113.755 116.157 -2.402 1
1 641 . 20 1 1 A 65 65 PRO HA H 64 4.372 4.387 -0.015 1
1 648 . 20 1 1 A 65 65 PRO C C 64 179.913 179.469 0.444 1
1 649 . 20 1 1 A 65 65 PRO CA C 64 66.011 66.316 -0.305 1
1 650 . 20 1 1 A 65 65 PRO CB C 64 30.642 30.783 -0.141 1
1 653 . 20 1 1 A 66 66 ILE H H 65 7.377 7.349 0.028 1
1 654 . 20 1 1 A 66 66 ILE HA H 65 3.530 3.876 -0.346 1
1 664 . 20 1 1 A 66 66 ILE C C 65 177.543 178.338 -0.795 1
1 665 . 20 1 1 A 66 66 ILE CA C 65 66.647 64.233 2.414 1
1 666 . 20 1 1 A 66 66 ILE CB C 65 38.029 37.658 0.371 1
1 670 . 20 1 1 A 66 66 ILE N N 65 118.353 116.608 1.745 1
1 671 . 20 1 1 A 67 67 PHE H H 66 8.480 8.438 0.042 1
1 672 . 20 1 1 A 67 67 PHE HA H 66 4.115 4.350 -0.235 1
1 680 . 20 1 1 A 67 67 PHE C C 66 177.293 178.539 -1.246 1
1 681 . 20 1 1 A 67 67 PHE CA C 66 59.570 61.845 -2.275 1
1 682 . 20 1 1 A 67 67 PHE CB C 66 38.865 39.639 -0.774 1
1 688 . 20 1 1 A 67 67 PHE N N 66 122.420 120.286 2.134 1
1 689 . 20 1 1 A 68 68 ASN H H 67 8.595 8.229 0.366 1
1 690 . 20 1 1 A 68 68 ASN HA H 67 4.211 4.456 -0.245 1
1 695 . 20 1 1 A 68 68 ASN C C 67 178.697 178.171 0.526 1
1 696 . 20 1 1 A 68 68 ASN CA C 67 56.056 56.144 -0.088 1
1 697 . 20 1 1 A 68 68 ASN CB C 67 37.704 37.928 -0.224 1
1 698 . 20 1 1 A 68 68 ASN N N 67 115.573 117.240 -1.667 1
1 700 . 20 1 1 A 69 69 GLU H H 68 8.414 8.029 0.385 1
1 701 . 20 1 1 A 69 69 GLU HA H 68 4.102 4.172 -0.070 1
1 706 . 20 1 1 A 69 69 GLU C C 68 177.880 178.834 -0.954 1
1 707 . 20 1 1 A 69 69 GLU CA C 68 59.399 59.306 0.093 1
1 708 . 20 1 1 A 69 69 GLU CB C 68 29.855 29.280 0.575 1
1 710 . 20 1 1 A 69 69 GLU N N 68 123.510 120.030 3.480 1
1 711 . 20 1 1 A 70 70 TYR H H 69 8.659 8.037 0.622 1
1 712 . 20 1 1 A 70 70 TYR HA H 69 3.362 4.142 -0.780 1
1 719 . 20 1 1 A 70 70 TYR C C 69 178.143 176.998 1.145 1
1 720 . 20 1 1 A 70 70 TYR CA C 69 60.686 61.163 -0.477 1
1 721 . 20 1 1 A 70 70 TYR CB C 69 38.560 38.787 -0.227 1
1 726 . 20 1 1 A 70 70 TYR N N 69 122.130 120.837 1.293 1
1 727 . 20 1 1 A 71 71 ILE H H 70 8.031 7.781 0.250 1
1 728 . 20 1 1 A 71 71 ILE HA H 70 3.265 3.747 -0.482 1
1 738 . 20 1 1 A 71 71 ILE C C 70 178.056 178.089 -0.033 1
1 739 . 20 1 1 A 71 71 ILE CA C 70 63.756 63.986 -0.230 1
1 740 . 20 1 1 A 71 71 ILE CB C 70 37.321 36.499 0.822 1
1 744 . 20 1 1 A 71 71 ILE N N 70 118.906 120.361 -1.455 1
1 745 . 20 1 1 A 72 72 SER H H 71 7.803 7.764 0.039 1
1 746 . 20 1 1 A 72 72 SER HA H 71 4.029 4.308 -0.279 1
1 749 . 20 1 1 A 72 72 SER CA C 71 61.380 61.100 0.280 1
1 750 . 20 1 1 A 72 72 SER CB C 71 63.288 63.027 0.261 1
1 751 . 20 1 1 A 72 72 SER N N 71 113.735 117.039 -3.304 1
1 752 . 20 1 1 A 73 73 LEU H H 72 7.952 8.018 -0.066 1
1 753 . 20 1 1 A 73 73 LEU HA H 72 4.418 4.156 0.262 1
1 763 . 20 1 1 A 73 73 LEU C C 72 177.767 178.369 -0.602 1
1 764 . 20 1 1 A 73 73 LEU CA C 72 56.543 57.458 -0.915 1
1 765 . 20 1 1 A 73 73 LEU CB C 72 44.517 41.761 2.756 1
1 769 . 20 1 1 A 73 73 LEU N N 72 119.411 122.692 -3.281 1
1 770 . 20 1 1 A 74 74 VAL H H 73 8.021 7.410 0.611 1
1 771 . 20 1 1 A 74 74 VAL HA H 73 3.532 3.319 0.213 1
1 779 . 20 1 1 A 74 74 VAL C C 73 177.126 178.137 -1.011 1
1 780 . 20 1 1 A 74 74 VAL CA C 73 66.250 66.655 -0.405 1
1 781 . 20 1 1 A 74 74 VAL CB C 73 31.212 31.034 0.178 1
1 784 . 20 1 1 A 74 74 VAL N N 73 118.747 119.285 -0.538 1
1 785 . 20 1 1 A 75 75 GLU H H 74 7.232 8.028 -0.796 1
1 786 . 20 1 1 A 75 75 GLU HA H 74 3.013 4.248 -1.235 1
1 791 . 20 1 1 A 75 75 GLU C C 74 178.804 179.779 -0.975 1
1 792 . 20 1 1 A 75 75 GLU CA C 74 60.536 60.031 0.505 1
1 793 . 20 1 1 A 75 75 GLU CB C 74 27.009 29.137 -2.128 1
1 795 . 20 1 1 A 75 75 GLU N N 74 118.660 119.803 -1.143 1
1 796 . 20 1 1 A 76 76 LYS H H 75 7.051 8.027 -0.976 1
1 797 . 20 1 1 A 76 76 LYS HA H 75 3.765 4.136 -0.371 1
1 806 . 20 1 1 A 76 76 LYS C C 75 177.765 178.043 -0.278 1
1 807 . 20 1 1 A 76 76 LYS CA C 75 58.357 58.469 -0.112 1
1 808 . 20 1 1 A 76 76 LYS CB C 75 31.939 32.162 -0.223 1
1 812 . 20 1 1 A 76 76 LYS N N 75 116.112 119.360 -3.248 1
1 813 . 20 1 1 A 77 77 TYR H H 76 7.067 7.987 -0.920 1
1 814 . 20 1 1 A 77 77 TYR HA H 76 4.036 4.182 -0.146 1
1 821 . 20 1 1 A 77 77 TYR C C 76 177.752 177.114 0.638 1
1 822 . 20 1 1 A 77 77 TYR CA C 76 61.820 61.333 0.487 1
1 823 . 20 1 1 A 77 77 TYR CB C 76 38.480 38.789 -0.309 1
1 828 . 20 1 1 A 77 77 TYR N N 76 118.434 121.952 -3.518 1
1 829 . 20 1 1 A 78 78 ILE H H 77 7.554 8.336 -0.782 1
1 830 . 20 1 1 A 78 78 ILE HA H 77 3.159 3.634 -0.475 1
1 840 . 20 1 1 A 78 78 ILE C C 77 177.341 177.872 -0.531 1
1 841 . 20 1 1 A 78 78 ILE CA C 77 65.177 64.797 0.380 1
1 842 . 20 1 1 A 78 78 ILE CB C 77 37.339 37.245 0.094 1
1 846 . 20 1 1 A 78 78 ILE N N 77 117.672 121.443 -3.771 1
1 847 . 20 1 1 A 79 79 GLU H H 78 8.296 8.097 0.199 1
1 848 . 20 1 1 A 79 79 GLU HA H 78 3.557 3.924 -0.367 1
1 853 . 20 1 1 A 79 79 GLU C C 78 177.742 178.985 -1.243 1
1 854 . 20 1 1 A 79 79 GLU CA C 78 60.847 60.195 0.652 1
1 855 . 20 1 1 A 79 79 GLU CB C 78 29.594 29.278 0.316 1
1 857 . 20 1 1 A 79 79 GLU N N 78 118.701 120.908 -2.207 1
1 858 . 20 1 1 A 80 80 GLU H H 79 8.330 8.411 -0.081 1
1 859 . 20 1 1 A 80 80 GLU HA H 79 3.774 4.061 -0.287 1
1 864 . 20 1 1 A 80 80 GLU C C 79 179.926 179.303 0.623 1
1 865 . 20 1 1 A 80 80 GLU CA C 79 59.581 59.008 0.573 1
1 866 . 20 1 1 A 80 80 GLU CB C 79 29.062 29.091 -0.029 1
1 868 . 20 1 1 A 80 80 GLU N N 79 116.767 117.925 -1.158 1
1 869 . 20 1 1 A 81 81 GLN H H 80 7.634 7.693 -0.059 1
1 870 . 20 1 1 A 81 81 GLN HA H 80 3.605 3.895 -0.290 1
1 877 . 20 1 1 A 81 81 GLN C C 80 179.681 178.613 1.068 1
1 878 . 20 1 1 A 81 81 GLN CA C 80 57.765 58.561 -0.796 1
1 879 . 20 1 1 A 81 81 GLN CB C 80 28.079 28.194 -0.115 1
1 881 . 20 1 1 A 81 81 GLN N N 80 116.325 118.782 -2.457 1
1 883 . 20 1 1 A 82 82 LEU H H 81 8.156 7.741 0.415 1
1 884 . 20 1 1 A 82 82 LEU HA H 81 3.536 3.862 -0.326 1
1 894 . 20 1 1 A 82 82 LEU C C 81 178.945 179.540 -0.595 1
1 895 . 20 1 1 A 82 82 LEU CA C 81 57.761 56.961 0.800 1
1 896 . 20 1 1 A 82 82 LEU CB C 81 40.961 41.105 -0.144 1
1 900 . 20 1 1 A 82 82 LEU N N 81 121.546 120.320 1.226 1
1 901 . 20 1 1 A 83 83 LEU H H 82 8.326 8.205 0.121 1
1 902 . 20 1 1 A 83 83 LEU HA H 82 4.198 4.297 -0.099 1
1 912 . 20 1 1 A 83 83 LEU C C 82 178.631 179.258 -0.627 1
1 913 . 20 1 1 A 83 83 LEU CA C 82 57.016 57.242 -0.226 1
1 914 . 20 1 1 A 83 83 LEU CB C 82 42.182 40.687 1.495 1
1 918 . 20 1 1 A 83 83 LEU N N 82 120.426 119.791 0.635 1
1 919 . 20 1 1 A 84 84 GLN H H 83 6.992 7.796 -0.804 1
1 920 . 20 1 1 A 84 84 GLN HA H 83 3.877 4.002 -0.125 1
1 927 . 20 1 1 A 84 84 GLN C C 83 177.008 176.976 0.032 1
1 928 . 20 1 1 A 84 84 GLN CA C 83 57.543 58.650 -1.107 1
1 929 . 20 1 1 A 84 84 GLN CB C 83 28.688 28.546 0.142 1
1 931 . 20 1 1 A 84 84 GLN N N 83 114.001 117.158 -3.157 1
1 933 . 20 1 1 A 85 85 ARG H H 84 7.072 7.410 -0.338 1
1 934 . 20 1 1 A 85 85 ARG HA H 84 4.047 4.392 -0.345 1
1 942 . 20 1 1 A 85 85 ARG C C 84 175.999 175.773 0.226 1
1 943 . 20 1 1 A 85 85 ARG CA C 84 56.764 56.144 0.620 1
1 944 . 20 1 1 A 85 85 ARG CB C 84 32.044 32.602 -0.558 1
1 947 . 20 1 1 A 85 85 ARG N N 84 115.827 116.658 -0.831 1
1 949 . 20 1 1 A 86 86 ILE H H 85 8.238 7.731 0.507 1
1 950 . 20 1 1 A 86 86 ILE HA H 85 4.389 4.536 -0.147 1
1 960 . 20 1 1 A 86 86 ILE CA C 85 58.007 57.815 0.192 1
1 961 . 20 1 1 A 86 86 ILE CB C 85 39.604 38.786 0.818 1
1 965 . 20 1 1 A 86 86 ILE N N 85 119.285 120.252 -0.967 1
1 966 . 20 1 1 A 87 87 PRO HA H 86 4.392 4.530 -0.138 1
1 973 . 20 1 1 A 87 87 PRO C C 86 177.622 176.440 1.182 1
1 974 . 20 1 1 A 87 87 PRO CA C 86 64.665 64.318 0.347 1
1 975 . 20 1 1 A 87 87 PRO CB C 86 32.020 31.770 0.250 1
1 978 . 20 1 1 A 88 88 GLU H H 87 8.312 8.227 0.085 1
1 979 . 20 1 1 A 88 88 GLU HA H 87 4.208 4.590 -0.382 1
1 984 . 20 1 1 A 88 88 GLU C C 87 175.554 175.815 -0.261 1
1 985 . 20 1 1 A 88 88 GLU CA C 87 56.045 56.219 -0.174 1
1 986 . 20 1 1 A 88 88 GLU CB C 87 28.654 30.551 -1.897 1
1 988 . 20 1 1 A 88 88 GLU N N 87 114.256 116.773 -2.517 1
1 989 . 20 1 1 A 89 89 PHE H H 88 7.946 7.667 0.279 1
1 990 . 20 1 1 A 89 89 PHE HA H 88 3.993 4.450 -0.457 1
1 998 . 20 1 1 A 89 89 PHE C C 88 173.460 174.585 -1.125 1
1 999 . 20 1 1 A 89 89 PHE CA C 88 60.119 59.235 0.884 1
1 1000 . 20 1 1 A 89 89 PHE CB C 88 39.994 39.711 0.283 1
1 1006 . 20 1 1 A 89 89 PHE N N 88 121.550 123.156 -1.606 1
1 1007 . 20 1 1 A 90 90 ASN H H 89 7.266 7.711 -0.445 1
1 1008 . 20 1 1 A 90 90 ASN HA H 89 4.454 5.127 -0.673 1
1 1013 . 20 1 1 A 90 90 ASN C C 89 173.921 174.652 -0.731 1
1 1014 . 20 1 1 A 90 90 ASN CA C 89 51.839 51.102 0.737 1
1 1015 . 20 1 1 A 90 90 ASN CB C 89 40.674 39.204 1.470 1
1 1016 . 20 1 1 A 90 90 ASN N N 89 125.344 121.925 3.419 1
1 1018 . 20 1 1 A 91 91 MET H H 90 8.968 8.379 0.589 1
1 1019 . 20 1 1 A 91 91 MET HA H 90 4.049 3.999 0.050 1
1 1027 . 20 1 1 A 91 91 MET C C 90 177.475 177.979 -0.504 1
1 1028 . 20 1 1 A 91 91 MET CA C 90 57.758 57.882 -0.124 1
1 1029 . 20 1 1 A 91 91 MET CB C 90 32.250 32.456 -0.206 1
1 1032 . 20 1 1 A 91 91 MET N N 90 127.052 122.472 4.580 1
1 1033 . 20 1 1 A 92 92 ALA H H 91 8.292 7.980 0.312 1
1 1034 . 20 1 1 A 92 92 ALA HA H 91 4.059 4.116 -0.057 1
1 1038 . 20 1 1 A 92 92 ALA C C 91 180.412 179.640 0.772 1
1 1039 . 20 1 1 A 92 92 ALA CA C 91 55.368 54.858 0.510 1
1 1040 . 20 1 1 A 92 92 ALA CB C 91 17.527 18.413 -0.886 1
1 1041 . 20 1 1 A 92 92 ALA N N 91 123.752 121.144 2.608 1
1 1042 . 20 1 1 A 93 93 ALA H H 92 7.931 7.861 0.070 1
1 1043 . 20 1 1 A 93 93 ALA HA H 92 4.054 4.067 -0.013 1
1 1047 . 20 1 1 A 93 93 ALA C C 92 180.482 179.937 0.545 1
1 1048 . 20 1 1 A 93 93 ALA CA C 92 54.614 54.954 -0.340 1
1 1049 . 20 1 1 A 93 93 ALA CB C 92 18.098 18.354 -0.256 1
1 1050 . 20 1 1 A 93 93 ALA N N 92 121.158 120.789 0.369 1
1 1051 . 20 1 1 A 94 94 PHE H H 93 8.110 7.793 0.317 1
1 1052 . 20 1 1 A 94 94 PHE HA H 93 4.304 4.167 0.137 1
1 1060 . 20 1 1 A 94 94 PHE C C 93 177.350 177.513 -0.163 1
1 1061 . 20 1 1 A 94 94 PHE CA C 93 61.641 61.466 0.175 1
1 1062 . 20 1 1 A 94 94 PHE CB C 93 40.014 39.343 0.671 1
1 1068 . 20 1 1 A 94 94 PHE N N 93 119.807 120.039 -0.232 1
1 1069 . 20 1 1 A 95 95 THR H H 94 8.726 8.063 0.663 1
1 1070 . 20 1 1 A 95 95 THR HA H 94 3.569 4.031 -0.462 1
1 1075 . 20 1 1 A 95 95 THR C C 94 176.932 176.954 -0.022 1
1 1076 . 20 1 1 A 95 95 THR CA C 94 66.833 65.453 1.380 1
1 1077 . 20 1 1 A 95 95 THR CB C 94 68.445 68.250 0.195 1
1 1079 . 20 1 1 A 95 95 THR N N 94 113.074 112.757 0.317 1
1 1080 . 20 1 1 A 96 96 THR H H 95 7.657 7.833 -0.176 1
1 1081 . 20 1 1 A 96 96 THR HA H 95 3.945 4.055 -0.110 1
1 1086 . 20 1 1 A 96 96 THR C C 95 176.386 176.634 -0.248 1
1 1087 . 20 1 1 A 96 96 THR CA C 95 66.550 66.059 0.491 1
1 1088 . 20 1 1 A 96 96 THR CB C 95 68.583 68.474 0.109 1
1 1090 . 20 1 1 A 96 96 THR N N 95 117.927 117.021 0.906 1
1 1091 . 20 1 1 A 97 97 THR H H 96 7.699 7.622 0.077 1
1 1092 . 20 1 1 A 97 97 THR HA H 96 3.905 4.071 -0.166 1
1 1097 . 20 1 1 A 97 97 THR C C 96 176.572 176.528 0.044 1
1 1098 . 20 1 1 A 97 97 THR CA C 96 65.979 66.291 -0.312 1
1 1099 . 20 1 1 A 97 97 THR CB C 96 68.553 68.368 0.185 1
1 1101 . 20 1 1 A 97 97 THR N N 96 118.518 117.368 1.150 1
1 1102 . 20 1 1 A 98 98 LEU H H 97 8.304 8.134 0.170 1
1 1103 . 20 1 1 A 98 98 LEU HA H 97 3.725 3.762 -0.037 1
1 1113 . 20 1 1 A 98 98 LEU C C 97 178.490 178.487 0.003 1
1 1114 . 20 1 1 A 98 98 LEU CA C 97 58.517 57.882 0.635 1
1 1115 . 20 1 1 A 98 98 LEU CB C 97 41.697 41.067 0.630 1
1 1119 . 20 1 1 A 98 98 LEU N N 97 122.882 121.996 0.886 1
1 1120 . 20 1 1 A 99 99 GLN H H 98 7.639 7.914 -0.275 1
1 1121 . 20 1 1 A 99 99 GLN HA H 98 3.927 4.320 -0.393 1
1 1128 . 20 1 1 A 99 99 GLN C C 98 178.068 178.561 -0.493 1
1 1129 . 20 1 1 A 99 99 GLN CA C 98 58.735 59.361 -0.626 1
1 1130 . 20 1 1 A 99 99 GLN CB C 98 27.986 28.296 -0.310 1
1 1132 . 20 1 1 A 99 99 GLN N N 98 114.302 118.664 -4.362 1
1 1134 . 20 1 1 A 100 100 HIS H H 99 7.575 8.224 -0.649 1
1 1135 . 20 1 1 A 100 100 HIS HA H 99 4.524 4.339 0.185 1
1 1139 . 20 1 1 A 100 100 HIS C C 99 174.789 177.625 -2.836 1
1 1140 . 20 1 1 A 100 100 HIS CA C 99 56.154 59.041 -2.887 1
1 1141 . 20 1 1 A 100 100 HIS CB C 99 28.946 29.860 -0.914 1
1 1143 . 20 1 1 A 100 100 HIS N N 99 114.778 120.945 -6.167 1
1 1144 . 20 1 1 A 101 101 HIS H H 100 7.773 8.213 -0.440 1
1 1145 . 20 1 1 A 101 101 HIS HA H 100 4.704 4.049 0.655 1
1 1149 . 20 1 1 A 101 101 HIS C C 100 174.818 177.234 -2.416 1
1 1150 . 20 1 1 A 101 101 HIS CA C 100 54.830 58.659 -3.829 1
1 1151 . 20 1 1 A 101 101 HIS CB C 100 29.749 28.686 1.063 1
1 1153 . 20 1 1 A 101 101 HIS N N 100 117.397 116.235 1.162 1
1 1154 . 20 1 1 A 102 102 LYS H H 101 7.324 8.091 -0.767 1
1 1155 . 20 1 1 A 102 102 LYS HA H 101 3.611 4.109 -0.498 1
1 1164 . 20 1 1 A 102 102 LYS C C 101 176.823 178.399 -1.576 1
1 1165 . 20 1 1 A 102 102 LYS CA C 101 59.915 58.901 1.014 1
1 1166 . 20 1 1 A 102 102 LYS CB C 101 32.825 32.181 0.644 1
1 1170 . 20 1 1 A 102 102 LYS N N 101 120.533 122.114 -1.581 1
1 1171 . 20 1 1 A 103 103 ASP H H 102 8.361 7.651 0.710 1
1 1172 . 20 1 1 A 103 103 ASP HA H 102 4.421 4.405 0.016 1
1 1175 . 20 1 1 A 103 103 ASP C C 102 176.793 177.788 -0.995 1
1 1176 . 20 1 1 A 103 103 ASP CA C 102 55.500 56.293 -0.793 1
1 1177 . 20 1 1 A 103 103 ASP CB C 102 40.178 40.808 -0.630 1
1 1178 . 20 1 1 A 103 103 ASP N N 102 114.814 119.312 -4.498 1
1 1179 . 20 1 1 A 104 104 GLU H H 103 7.858 7.962 -0.104 1
1 1180 . 20 1 1 A 104 104 GLU HA H 103 4.339 4.405 -0.066 1
1 1183 . 20 1 1 A 104 104 GLU C C 103 175.777 176.776 -0.999 1
1 1184 . 20 1 1 A 104 104 GLU CA C 103 56.356 57.902 -1.546 1
1 1185 . 20 1 1 A 104 104 GLU CB C 103 31.293 31.065 0.228 1
1 1186 . 20 1 1 A 104 104 GLU N N 103 116.826 118.581 -1.755 1
1 1187 . 20 1 1 A 105 105 VAL H H 104 7.201 7.767 -0.566 1
1 1188 . 20 1 1 A 105 105 VAL HA H 104 4.296 4.114 0.182 1
1 1196 . 20 1 1 A 105 105 VAL C C 104 174.482 175.537 -1.055 1
1 1197 . 20 1 1 A 105 105 VAL CA C 104 60.370 62.669 -2.299 1
1 1198 . 20 1 1 A 105 105 VAL CB C 104 34.341 32.777 1.564 1
1 1201 . 20 1 1 A 105 105 VAL N N 104 116.422 119.760 -3.338 1
1 1202 . 20 1 1 A 106 106 ALA H H 105 8.487 8.440 0.047 1
1 1203 . 20 1 1 A 106 106 ALA HA H 105 4.172 4.378 -0.206 1
1 1207 . 20 1 1 A 106 106 ALA C C 105 179.030 178.709 0.321 1
1 1208 . 20 1 1 A 106 106 ALA CA C 105 52.966 52.407 0.559 1
1 1209 . 20 1 1 A 106 106 ALA CB C 105 19.371 19.282 0.089 1
1 1210 . 20 1 1 A 106 106 ALA N N 105 128.313 128.719 -0.406 1
1 1211 . 20 1 1 A 107 107 GLY H H 106 8.738 8.777 -0.039 1
1 1212 . 20 1 1 A 107 107 GLY HA2 H 106 3.773 3.873 -0.100 1
1 1213 . 20 1 1 A 107 107 GLY HA3 H 106 3.998 3.938 0.060 1
1 1214 . 20 1 1 A 107 107 GLY C C 106 174.958 175.545 -0.587 1
1 1215 . 20 1 1 A 107 107 GLY CA C 106 47.449 47.096 0.353 1
1 1216 . 20 1 1 A 107 107 GLY N N 106 110.612 110.797 -0.185 1
1 1217 . 20 1 1 A 108 108 ASP H H 107 8.535 8.328 0.207 1
1 1218 . 20 1 1 A 108 108 ASP HA H 107 4.333 4.372 -0.039 1
1 1221 . 20 1 1 A 108 108 ASP C C 107 179.133 178.885 0.248 1
1 1222 . 20 1 1 A 108 108 ASP CA C 107 56.721 57.111 -0.390 1
1 1223 . 20 1 1 A 108 108 ASP CB C 107 39.336 41.672 -2.336 1
1 1224 . 20 1 1 A 108 108 ASP N N 107 117.474 121.610 -4.136 1
1 1225 . 20 1 1 A 109 109 ILE H H 108 7.459 7.879 -0.420 1
1 1226 . 20 1 1 A 109 109 ILE HA H 108 3.688 3.794 -0.106 1
1 1236 . 20 1 1 A 109 109 ILE C C 108 176.735 178.376 -1.641 1
1 1237 . 20 1 1 A 109 109 ILE CA C 108 63.474 65.514 -2.040 1
1 1238 . 20 1 1 A 109 109 ILE CB C 108 37.340 37.736 -0.396 1
1 1242 . 20 1 1 A 109 109 ILE N N 108 119.609 119.674 -0.065 1
1 1243 . 20 1 1 A 110 110 PHE H H 109 7.920 8.290 -0.370 1
1 1244 . 20 1 1 A 110 110 PHE HA H 109 3.759 4.078 -0.319 1
1 1252 . 20 1 1 A 110 110 PHE C C 109 177.132 177.266 -0.134 1
1 1253 . 20 1 1 A 110 110 PHE CA C 109 62.766 61.194 1.572 1
1 1254 . 20 1 1 A 110 110 PHE CB C 109 39.752 39.288 0.464 1
1 1260 . 20 1 1 A 110 110 PHE N N 109 120.906 120.285 0.621 1
1 1261 . 20 1 1 A 111 111 ASP H H 110 8.639 8.329 0.310 1
1 1262 . 20 1 1 A 111 111 ASP HA H 110 4.216 4.210 0.006 1
1 1265 . 20 1 1 A 111 111 ASP C C 110 178.900 178.347 0.553 1
1 1266 . 20 1 1 A 111 111 ASP CA C 110 57.105 57.329 -0.224 1
1 1267 . 20 1 1 A 111 111 ASP CB C 110 39.697 42.127 -2.430 1
1 1268 . 20 1 1 A 111 111 ASP N N 110 117.124 118.763 -1.639 1
1 1269 . 20 1 1 A 112 112 MET H H 111 7.331 7.619 -0.288 1
1 1270 . 20 1 1 A 112 112 MET HA H 111 4.081 4.161 -0.080 1
1 1278 . 20 1 1 A 112 112 MET C C 111 179.052 178.160 0.892 1
1 1279 . 20 1 1 A 112 112 MET CA C 111 58.202 57.979 0.223 1
1 1280 . 20 1 1 A 112 112 MET CB C 111 31.827 32.402 -0.575 1
1 1283 . 20 1 1 A 112 112 MET N N 111 118.061 119.399 -1.338 1
1 1284 . 20 1 1 A 113 113 LEU H H 112 8.001 8.044 -0.043 1
1 1285 . 20 1 1 A 113 113 LEU HA H 112 3.723 3.638 0.085 1
1 1295 . 20 1 1 A 113 113 LEU C C 112 179.747 178.863 0.884 1
1 1296 . 20 1 1 A 113 113 LEU CA C 112 57.371 57.502 -0.131 1
1 1297 . 20 1 1 A 113 113 LEU CB C 112 40.671 41.069 -0.398 1
1 1301 . 20 1 1 A 113 113 LEU N N 112 120.426 119.858 0.568 1
1 1302 . 20 1 1 A 114 114 LEU H H 113 7.744 7.535 0.209 1
1 1303 . 20 1 1 A 114 114 LEU HA H 113 4.007 3.642 0.365 1
1 1313 . 20 1 1 A 114 114 LEU C C 113 179.358 178.608 0.750 1
1 1314 . 20 1 1 A 114 114 LEU CA C 113 57.202 57.465 -0.263 1
1 1315 . 20 1 1 A 114 114 LEU CB C 113 41.727 41.143 0.584 1
1 1319 . 20 1 1 A 114 114 LEU N N 113 119.584 118.423 1.161 1
1 1320 . 20 1 1 A 115 115 THR H H 114 7.353 7.644 -0.291 1
1 1321 . 20 1 1 A 115 115 THR HA H 114 4.071 4.085 -0.014 1
1 1327 . 20 1 1 A 115 115 THR C C 114 173.591 176.712 -3.121 1
1 1328 . 20 1 1 A 115 115 THR CA C 114 65.332 64.642 0.690 1
1 1329 . 20 1 1 A 115 115 THR CB C 114 70.319 68.588 1.731 1
1 1331 . 20 1 1 A 115 115 THR N N 114 107.535 110.496 -2.961 1
1 1332 . 20 1 1 A 116 116 PHE H H 115 6.979 7.827 -0.848 1
1 1333 . 20 1 1 A 116 116 PHE HA H 115 5.022 4.283 0.739 1
1 1341 . 20 1 1 A 116 116 PHE C C 115 176.488 176.575 -0.087 1
1 1342 . 20 1 1 A 116 116 PHE CA C 115 55.911 60.849 -4.938 1
1 1343 . 20 1 1 A 116 116 PHE CB C 115 38.521 39.183 -0.662 1
1 1349 . 20 1 1 A 116 116 PHE N N 115 112.366 120.005 -7.639 1
1 1350 . 20 1 1 A 117 117 THR H H 116 7.564 7.493 0.071 1
1 1351 . 20 1 1 A 117 117 THR HA H 116 4.626 4.840 -0.214 1
1 1356 . 20 1 1 A 117 117 THR C C 116 174.085 174.348 -0.263 1
1 1357 . 20 1 1 A 117 117 THR CA C 116 61.636 61.908 -0.272 1
1 1358 . 20 1 1 A 117 117 THR CB C 116 70.915 70.994 -0.079 1
1 1360 . 20 1 1 A 117 117 THR N N 116 105.498 105.645 -0.147 1
1 1361 . 20 1 1 A 118 118 ASP H H 117 8.270 7.764 0.506 1
1 1362 . 20 1 1 A 118 118 ASP HA H 117 4.955 4.682 0.273 1
1 1365 . 20 1 1 A 118 118 ASP C C 117 176.328 176.370 -0.042 1
1 1366 . 20 1 1 A 118 118 ASP CA C 117 53.417 53.367 0.050 1
1 1367 . 20 1 1 A 118 118 ASP CB C 117 43.388 40.404 2.984 1
1 1368 . 20 1 1 A 118 118 ASP N N 117 124.409 122.238 2.171 1
1 1369 . 20 1 1 A 119 119 PHE H H 118 8.973 8.846 0.127 1
1 1370 . 20 1 1 A 119 119 PHE HA H 118 3.506 4.223 -0.717 1
1 1378 . 20 1 1 A 119 119 PHE CA C 118 61.490 61.141 0.349 1
1 1379 . 20 1 1 A 119 119 PHE CB C 118 39.246 39.548 -0.302 1
1 1385 . 20 1 1 A 119 119 PHE N N 118 126.688 126.449 0.239 1
1 1386 . 20 1 1 A 120 120 LEU H H 119 8.099 8.365 -0.266 1
1 1387 . 20 1 1 A 120 120 LEU HA H 119 3.842 4.004 -0.162 1
1 1397 . 20 1 1 A 120 120 LEU C C 119 179.601 179.491 0.110 1
1 1398 . 20 1 1 A 120 120 LEU CA C 119 58.174 57.966 0.208 1
1 1399 . 20 1 1 A 120 120 LEU CB C 119 40.315 41.323 -1.008 1
1 1403 . 20 1 1 A 120 120 LEU N N 119 117.930 119.936 -2.006 1
1 1404 . 20 1 1 A 121 121 ALA H H 120 7.729 7.985 -0.256 1
1 1405 . 20 1 1 A 121 121 ALA HA H 120 3.996 4.114 -0.118 1
1 1409 . 20 1 1 A 121 121 ALA C C 120 180.995 179.580 1.415 1
1 1410 . 20 1 1 A 121 121 ALA CA C 120 54.832 54.637 0.195 1
1 1411 . 20 1 1 A 121 121 ALA CB C 120 17.706 18.351 -0.645 1
1 1412 . 20 1 1 A 121 121 ALA N N 120 123.195 121.186 2.009 1
1 1413 . 20 1 1 A 122 122 PHE H H 121 7.943 7.787 0.156 1
1 1414 . 20 1 1 A 122 122 PHE HA H 121 3.887 3.740 0.147 1
1 1419 . 20 1 1 A 122 122 PHE C C 121 175.410 176.697 -1.287 1
1 1420 . 20 1 1 A 122 122 PHE CA C 121 61.075 60.629 0.446 1
1 1421 . 20 1 1 A 122 122 PHE CB C 121 38.115 38.662 -0.547 1
1 1424 . 20 1 1 A 122 122 PHE N N 121 121.798 120.186 1.612 1
1 1425 . 20 1 1 A 123 123 LYS H H 122 8.468 7.977 0.491 1
1 1426 . 20 1 1 A 123 123 LYS HA H 122 3.077 3.901 -0.824 1
1 1435 . 20 1 1 A 123 123 LYS C C 122 178.453 179.050 -0.597 1
1 1436 . 20 1 1 A 123 123 LYS CA C 122 59.855 60.018 -0.163 1
1 1437 . 20 1 1 A 123 123 LYS CB C 122 32.374 32.480 -0.106 1
1 1441 . 20 1 1 A 123 123 LYS N N 122 120.614 118.411 2.203 1
1 1442 . 20 1 1 A 124 124 GLU H H 123 8.100 7.916 0.184 1
1 1443 . 20 1 1 A 124 124 GLU HA H 123 3.652 3.975 -0.323 1
1 1448 . 20 1 1 A 124 124 GLU C C 123 177.743 178.946 -1.203 1
1 1449 . 20 1 1 A 124 124 GLU CA C 123 59.406 59.652 -0.246 1
1 1450 . 20 1 1 A 124 124 GLU CB C 123 28.811 29.157 -0.346 1
1 1452 . 20 1 1 A 124 124 GLU N N 123 117.404 119.373 -1.969 1
1 1453 . 20 1 1 A 125 125 MET H H 124 7.537 7.623 -0.086 1
1 1454 . 20 1 1 A 125 125 MET HA H 124 3.860 3.958 -0.098 1
1 1462 . 20 1 1 A 125 125 MET C C 124 179.522 178.283 1.239 1
1 1463 . 20 1 1 A 125 125 MET CA C 124 58.832 58.489 0.343 1
1 1464 . 20 1 1 A 125 125 MET CB C 124 31.765 31.531 0.234 1
1 1467 . 20 1 1 A 125 125 MET N N 124 119.413 119.660 -0.247 1
1 1468 . 20 1 1 A 126 126 PHE H H 125 7.148 7.410 -0.262 1
1 1469 . 20 1 1 A 126 126 PHE HA H 125 3.633 4.212 -0.579 1
1 1476 . 20 1 1 A 126 126 PHE C C 125 178.994 178.298 0.696 1
1 1477 . 20 1 1 A 126 126 PHE CA C 125 63.148 60.807 2.341 1
1 1478 . 20 1 1 A 126 126 PHE CB C 125 39.830 38.928 0.902 1
1 1483 . 20 1 1 A 126 126 PHE N N 125 120.013 119.322 0.691 1
1 1484 . 20 1 1 A 127 127 LEU H H 126 8.369 8.363 0.006 1
1 1485 . 20 1 1 A 127 127 LEU HA H 126 3.972 4.078 -0.106 1
1 1495 . 20 1 1 A 127 127 LEU C C 126 180.621 179.293 1.328 1
1 1496 . 20 1 1 A 127 127 LEU CA C 126 57.944 57.712 0.232 1
1 1497 . 20 1 1 A 127 127 LEU CB C 126 40.543 40.952 -0.409 1
1 1501 . 20 1 1 A 127 127 LEU N N 126 119.692 119.653 0.039 1
1 1502 . 20 1 1 A 128 128 ASP H H 127 8.578 8.061 0.517 1
1 1503 . 20 1 1 A 128 128 ASP HA H 127 4.308 4.319 -0.011 1
1 1506 . 20 1 1 A 128 128 ASP C C 127 178.254 177.967 0.287 1
1 1507 . 20 1 1 A 128 128 ASP CA C 127 56.964 57.315 -0.351 1
1 1508 . 20 1 1 A 128 128 ASP CB C 127 39.735 41.147 -1.412 1
1 1509 . 20 1 1 A 128 128 ASP N N 127 121.926 119.842 2.084 1
1 1510 . 20 1 1 A 129 129 TYR H H 128 7.710 8.149 -0.439 1
1 1511 . 20 1 1 A 129 129 TYR HA H 128 3.908 3.991 -0.083 1
1 1518 . 20 1 1 A 129 129 TYR C C 128 177.633 177.507 0.126 1
1 1519 . 20 1 1 A 129 129 TYR CA C 128 61.796 61.143 0.653 1
1 1520 . 20 1 1 A 129 129 TYR CB C 128 39.372 38.379 0.993 1
1 1525 . 20 1 1 A 129 129 TYR N N 128 122.548 120.144 2.404 1
1 1526 . 20 1 1 A 130 130 ARG H H 129 8.622 8.231 0.391 1
1 1527 . 20 1 1 A 130 130 ARG HA H 129 3.722 3.787 -0.065 1
1 1535 . 20 1 1 A 130 130 ARG CA C 129 60.084 59.751 0.333 1
1 1536 . 20 1 1 A 130 130 ARG CB C 129 29.902 29.885 0.017 1
1 1539 . 20 1 1 A 130 130 ARG N N 129 118.302 119.271 -0.969 1
1 1541 . 20 1 1 A 131 131 ALA H H 130 7.936 8.094 -0.158 1
1 1542 . 20 1 1 A 131 131 ALA HA H 130 3.997 4.053 -0.056 1
1 1546 . 20 1 1 A 131 131 ALA C C 130 180.456 180.024 0.432 1
1 1547 . 20 1 1 A 131 131 ALA CA C 130 55.133 54.847 0.286 1
1 1548 . 20 1 1 A 131 131 ALA CB C 130 17.750 18.481 -0.731 1
1 1549 . 20 1 1 A 131 131 ALA N N 130 119.788 121.290 -1.502 1
1 1550 . 20 1 1 A 132 132 GLU H H 131 7.622 7.807 -0.185 1
1 1551 . 20 1 1 A 132 132 GLU HA H 131 3.862 3.932 -0.070 1
1 1556 . 20 1 1 A 132 132 GLU C C 131 179.528 179.243 0.285 1
1 1557 . 20 1 1 A 132 132 GLU CA C 131 58.849 59.375 -0.526 1
1 1558 . 20 1 1 A 132 132 GLU CB C 131 28.930 28.900 0.030 1
1 1560 . 20 1 1 A 132 132 GLU N N 131 118.428 117.826 0.602 1
1 1561 . 20 1 1 A 133 133 LYS H H 132 7.853 7.517 0.336 1
1 1562 . 20 1 1 A 133 133 LYS HA H 132 3.722 3.926 -0.204 1
1 1571 . 20 1 1 A 133 133 LYS C C 132 175.725 178.827 -3.102 1
1 1572 . 20 1 1 A 133 133 LYS CA C 132 57.544 59.064 -1.520 1
1 1573 . 20 1 1 A 133 133 LYS CB C 132 31.770 31.798 -0.028 1
1 1577 . 20 1 1 A 133 133 LYS N N 132 119.473 119.443 0.030 1
1 1578 . 20 1 1 A 134 134 GLU H H 133 8.151 7.694 0.457 1
1 1579 . 20 1 1 A 134 134 GLU HA H 133 4.161 4.286 -0.125 1
1 1584 . 20 1 1 A 134 134 GLU C C 133 177.453 176.942 0.511 1
1 1585 . 20 1 1 A 134 134 GLU CA C 133 57.222 56.304 0.918 1
1 1586 . 20 1 1 A 134 134 GLU CB C 133 30.091 30.292 -0.201 1
1 1588 . 20 1 1 A 134 134 GLU N N 133 116.525 117.067 -0.542 1
1 1589 . 20 1 1 A 135 135 GLY H H 134 7.702 7.767 -0.065 1
1 1590 . 20 1 1 A 135 135 GLY HA2 H 134 3.896 3.938 -0.042 1
1 1591 . 20 1 1 A 135 135 GLY HA3 H 134 3.897 3.948 -0.051 1
1 1592 . 20 1 1 A 135 135 GLY C C 134 174.538 173.690 0.848 1
1 1593 . 20 1 1 A 135 135 GLY CA C 134 45.975 45.134 0.841 1
1 1594 . 20 1 1 A 135 135 GLY N N 134 107.924 108.984 -1.060 1
1 1595 . 20 1 1 A 136 136 ARG H H 135 8.045 7.797 0.248 1
1 1596 . 20 1 1 A 136 136 ARG HA H 135 4.323 4.745 -0.422 1
1 1604 . 20 1 1 A 136 136 ARG C C 135 175.864 175.361 0.503 1
1 1605 . 20 1 1 A 136 136 ARG CA C 135 56.016 55.170 0.846 1
1 1606 . 20 1 1 A 136 136 ARG CB C 135 30.987 31.813 -0.826 1
1 1609 . 20 1 1 A 136 136 ARG N N 135 119.708 122.046 -2.338 1
1 1 . 21 1 1 A 14 14 PHE CA C 13 58.199 56.235 1.964 1
1 2 . 21 1 1 A 14 14 PHE CB C 13 39.717 43.508 -3.791 1
1 3 . 21 1 1 A 15 15 SER H H 14 8.299 9.170 -0.871 1
1 4 . 21 1 1 A 15 15 SER HA H 14 4.359 5.348 -0.989 1
1 7 . 21 1 1 A 15 15 SER CA C 14 58.249 56.217 2.032 1
1 8 . 21 1 1 A 15 15 SER CB C 14 63.936 66.063 -2.127 1
1 9 . 21 1 1 A 15 15 SER N N 14 117.379 114.554 2.825 1
1 10 . 21 1 1 A 16 16 SER H H 15 8.255 8.624 -0.369 1
1 11 . 21 1 1 A 16 16 SER HA H 15 3.729 5.093 -1.364 1
1 14 . 21 1 1 A 16 16 SER CA C 15 58.224 56.388 1.836 1
1 15 . 21 1 1 A 16 16 SER CB C 15 63.886 65.170 -1.284 1
1 16 . 21 1 1 A 16 16 SER N N 15 117.694 115.326 2.368 1
1 17 . 21 1 1 A 17 17 ALA H H 16 8.333 8.820 -0.487 1
1 18 . 21 1 1 A 17 17 ALA HA H 16 4.252 4.539 -0.287 1
1 22 . 21 1 1 A 17 17 ALA CA C 16 53.377 54.877 -1.500 1
1 23 . 21 1 1 A 17 17 ALA CB C 16 18.896 18.634 0.262 1
1 24 . 21 1 1 A 17 17 ALA N N 16 125.462 125.581 -0.119 1
1 25 . 21 1 1 A 18 18 SER H H 17 8.219 7.982 0.237 1
1 26 . 21 1 1 A 18 18 SER HA H 17 4.332 4.651 -0.319 1
1 29 . 21 1 1 A 18 18 SER CA C 17 59.105 57.651 1.454 1
1 30 . 21 1 1 A 18 18 SER CB C 17 63.592 63.654 -0.062 1
1 31 . 21 1 1 A 18 18 SER N N 17 114.821 112.871 1.950 1
1 32 . 21 1 1 A 19 19 ASP H H 18 8.309 7.747 0.562 1
1 33 . 21 1 1 A 19 19 ASP HA H 18 4.554 5.143 -0.589 1
1 36 . 21 1 1 A 19 19 ASP C C 18 176.528 176.244 0.284 1
1 37 . 21 1 1 A 19 19 ASP CA C 18 55.272 52.277 2.995 1
1 38 . 21 1 1 A 19 19 ASP CB C 18 40.883 44.001 -3.118 1
1 39 . 21 1 1 A 19 19 ASP N N 18 123.367 120.886 2.481 1
1 40 . 21 1 1 A 20 20 ALA H H 19 8.133 8.757 -0.624 1
1 41 . 21 1 1 A 20 20 ALA HA H 19 4.170 4.109 0.061 1
1 45 . 21 1 1 A 20 20 ALA C C 19 179.857 179.528 0.329 1
1 46 . 21 1 1 A 20 20 ALA CA C 19 54.341 55.164 -0.823 1
1 47 . 21 1 1 A 20 20 ALA CB C 19 18.660 18.355 0.305 1
1 48 . 21 1 1 A 20 20 ALA N N 19 123.350 121.772 1.578 1
1 49 . 21 1 1 A 21 21 GLU H H 20 8.140 8.211 -0.071 1
1 50 . 21 1 1 A 21 21 GLU HA H 20 4.128 4.073 0.055 1
1 55 . 21 1 1 A 21 21 GLU C C 20 177.675 178.455 -0.780 1
1 56 . 21 1 1 A 21 21 GLU CA C 20 58.520 59.592 -1.072 1
1 57 . 21 1 1 A 21 21 GLU CB C 20 29.765 29.521 0.244 1
1 59 . 21 1 1 A 21 21 GLU N N 20 119.063 119.385 -0.322 1
1 60 . 21 1 1 A 22 22 PHE H H 21 8.009 7.984 0.025 1
1 61 . 21 1 1 A 22 22 PHE HA H 21 4.123 4.277 -0.154 1
1 68 . 21 1 1 A 22 22 PHE C C 21 176.410 177.458 -1.048 1
1 69 . 21 1 1 A 22 22 PHE CA C 21 62.202 61.312 0.890 1
1 70 . 21 1 1 A 22 22 PHE CB C 21 39.223 39.249 -0.026 1
1 75 . 21 1 1 A 22 22 PHE N N 21 121.211 121.043 0.168 1
1 76 . 21 1 1 A 23 23 ASP H H 22 8.261 8.626 -0.365 1
1 77 . 21 1 1 A 23 23 ASP HA H 22 4.041 4.561 -0.520 1
1 80 . 21 1 1 A 23 23 ASP C C 22 179.078 178.301 0.777 1
1 81 . 21 1 1 A 23 23 ASP CA C 22 57.048 57.881 -0.833 1
1 82 . 21 1 1 A 23 23 ASP CB C 22 40.154 41.673 -1.519 1
1 83 . 21 1 1 A 23 23 ASP N N 22 116.876 118.801 -1.925 1
1 84 . 21 1 1 A 24 24 ALA H H 23 7.651 7.700 -0.049 1
1 85 . 21 1 1 A 24 24 ALA HA H 23 3.785 3.838 -0.053 1
1 89 . 21 1 1 A 24 24 ALA C C 23 179.577 179.551 0.026 1
1 90 . 21 1 1 A 24 24 ALA CA C 23 54.341 54.990 -0.649 1
1 91 . 21 1 1 A 24 24 ALA CB C 23 17.762 18.265 -0.503 1
1 92 . 21 1 1 A 24 24 ALA N N 23 121.873 121.445 0.428 1
1 93 . 21 1 1 A 25 25 VAL H H 24 7.718 7.720 -0.002 1
1 94 . 21 1 1 A 25 25 VAL HA H 24 3.216 3.444 -0.228 1
1 102 . 21 1 1 A 25 25 VAL C C 24 177.805 178.354 -0.549 1
1 103 . 21 1 1 A 25 25 VAL CA C 24 66.789 66.676 0.113 1
1 104 . 21 1 1 A 25 25 VAL CB C 24 31.277 31.166 0.111 1
1 107 . 21 1 1 A 25 25 VAL N N 24 117.890 118.382 -0.492 1
1 108 . 21 1 1 A 26 26 VAL H H 25 7.867 7.717 0.150 1
1 109 . 21 1 1 A 26 26 VAL HA H 25 3.274 3.549 -0.275 1
1 117 . 21 1 1 A 26 26 VAL C C 25 177.788 177.911 -0.123 1
1 118 . 21 1 1 A 26 26 VAL CA C 25 67.282 66.432 0.850 1
1 119 . 21 1 1 A 26 26 VAL CB C 25 31.266 31.451 -0.185 1
1 122 . 21 1 1 A 26 26 VAL N N 25 118.170 120.353 -2.183 1
1 123 . 21 1 1 A 27 27 GLY H H 26 7.544 7.649 -0.105 1
1 124 . 21 1 1 A 27 27 GLY HA2 H 26 3.592 3.536 0.056 1
1 125 . 21 1 1 A 27 27 GLY HA3 H 26 3.721 3.652 0.069 1
1 126 . 21 1 1 A 27 27 GLY C C 26 176.717 176.546 0.171 1
1 127 . 21 1 1 A 27 27 GLY CA C 26 47.085 47.271 -0.186 1
1 128 . 21 1 1 A 27 27 GLY N N 26 105.795 107.454 -1.659 1
1 129 . 21 1 1 A 28 28 TYR H H 27 7.625 7.350 0.275 1
1 130 . 21 1 1 A 28 28 TYR HA H 27 4.546 4.589 -0.043 1
1 137 . 21 1 1 A 28 28 TYR C C 27 178.991 178.217 0.774 1
1 138 . 21 1 1 A 28 28 TYR CA C 27 58.845 59.637 -0.792 1
1 139 . 21 1 1 A 28 28 TYR CB C 27 37.602 37.583 0.019 1
1 144 . 21 1 1 A 28 28 TYR N N 27 119.933 122.141 -2.208 1
1 145 . 21 1 1 A 29 29 LEU H H 28 8.517 8.128 0.389 1
1 146 . 21 1 1 A 29 29 LEU HA H 28 3.728 3.824 -0.096 1
1 156 . 21 1 1 A 29 29 LEU CA C 28 58.281 57.944 0.337 1
1 157 . 21 1 1 A 29 29 LEU CB C 28 41.948 41.396 0.552 1
1 161 . 21 1 1 A 29 29 LEU N N 28 119.669 120.331 -0.662 1
1 162 . 21 1 1 A 30 30 GLU H H 29 8.072 8.071 0.001 1
1 163 . 21 1 1 A 30 30 GLU HA H 29 3.722 3.874 -0.152 1
1 168 . 21 1 1 A 30 30 GLU C C 29 177.731 178.690 -0.959 1
1 169 . 21 1 1 A 30 30 GLU CA C 29 59.763 59.929 -0.166 1
1 170 . 21 1 1 A 30 30 GLU CB C 29 28.844 29.366 -0.522 1
1 172 . 21 1 1 A 30 30 GLU N N 29 117.666 117.870 -0.204 1
1 173 . 21 1 1 A 31 31 ASP H H 30 7.243 8.016 -0.773 1
1 174 . 21 1 1 A 31 31 ASP HA H 30 4.297 4.370 -0.073 1
1 177 . 21 1 1 A 31 31 ASP CA C 30 56.953 57.439 -0.486 1
1 178 . 21 1 1 A 31 31 ASP CB C 30 40.730 42.445 -1.715 1
1 179 . 21 1 1 A 31 31 ASP N N 30 116.720 119.401 -2.681 1
1 180 . 21 1 1 A 32 32 ILE H H 31 7.940 7.539 0.401 1
1 181 . 21 1 1 A 32 32 ILE HA H 31 3.640 3.704 -0.064 1
1 191 . 21 1 1 A 32 32 ILE C C 31 177.980 178.243 -0.263 1
1 192 . 21 1 1 A 32 32 ILE CA C 31 64.692 64.068 0.624 1
1 193 . 21 1 1 A 32 32 ILE CB C 31 38.938 36.384 2.554 1
1 197 . 21 1 1 A 32 32 ILE N N 31 119.728 118.967 0.761 1
1 198 . 21 1 1 A 33 33 ILE H H 32 7.984 7.694 0.290 1
1 199 . 21 1 1 A 33 33 ILE HA H 32 3.598 3.099 0.499 1
1 209 . 21 1 1 A 33 33 ILE C C 32 176.723 176.955 -0.232 1
1 210 . 21 1 1 A 33 33 ILE CA C 32 63.241 64.706 -1.465 1
1 211 . 21 1 1 A 33 33 ILE CB C 32 37.580 37.911 -0.331 1
1 215 . 21 1 1 A 33 33 ILE N N 32 113.919 121.597 -7.678 1
1 216 . 21 1 1 A 34 34 MET H H 33 7.288 7.573 -0.285 1
1 217 . 21 1 1 A 34 34 MET HA H 33 4.496 4.720 -0.224 1
1 225 . 21 1 1 A 34 34 MET C C 33 176.423 175.796 0.627 1
1 226 . 21 1 1 A 34 34 MET CA C 33 54.634 54.128 0.506 1
1 227 . 21 1 1 A 34 34 MET CB C 33 31.934 31.447 0.487 1
1 230 . 21 1 1 A 34 34 MET N N 33 115.130 116.673 -1.543 1
1 231 . 21 1 1 A 35 35 ASP H H 34 7.405 7.589 -0.184 1
1 232 . 21 1 1 A 35 35 ASP HA H 34 4.484 4.565 -0.081 1
1 235 . 21 1 1 A 35 35 ASP C C 34 177.139 176.797 0.342 1
1 236 . 21 1 1 A 35 35 ASP CA C 34 54.625 54.456 0.169 1
1 237 . 21 1 1 A 35 35 ASP CB C 34 43.554 42.866 0.688 1
1 238 . 21 1 1 A 35 35 ASP N N 34 121.814 122.557 -0.743 1
1 239 . 21 1 1 A 36 36 ASP H H 35 8.765 9.050 -0.285 1
1 240 . 21 1 1 A 36 36 ASP HA H 35 4.235 4.371 -0.136 1
1 243 . 21 1 1 A 36 36 ASP C C 35 178.320 178.422 -0.102 1
1 244 . 21 1 1 A 36 36 ASP CA C 35 57.832 57.259 0.573 1
1 245 . 21 1 1 A 36 36 ASP CB C 35 40.914 39.752 1.162 1
1 246 . 21 1 1 A 36 36 ASP N N 35 125.883 126.072 -0.189 1
1 247 . 21 1 1 A 37 37 GLU H H 36 8.905 8.369 0.536 1
1 248 . 21 1 1 A 37 37 GLU HA H 36 3.933 4.146 -0.213 1
1 253 . 21 1 1 A 37 37 GLU C C 36 179.304 179.078 0.226 1
1 254 . 21 1 1 A 37 37 GLU CA C 36 59.828 58.920 0.908 1
1 255 . 21 1 1 A 37 37 GLU CB C 36 29.380 29.686 -0.306 1
1 257 . 21 1 1 A 37 37 GLU N N 36 119.077 120.352 -1.275 1
1 258 . 21 1 1 A 38 38 PHE H H 37 7.460 8.104 -0.644 1
1 259 . 21 1 1 A 38 38 PHE HA H 37 3.642 3.954 -0.312 1
1 267 . 21 1 1 A 38 38 PHE C C 37 176.483 177.790 -1.307 1
1 268 . 21 1 1 A 38 38 PHE CA C 37 61.411 61.224 0.187 1
1 269 . 21 1 1 A 38 38 PHE CB C 37 39.355 39.026 0.329 1
1 275 . 21 1 1 A 38 38 PHE N N 37 119.968 122.896 -2.928 1
1 276 . 21 1 1 A 39 39 GLN H H 38 7.968 8.104 -0.136 1
1 277 . 21 1 1 A 39 39 GLN HA H 38 3.712 3.792 -0.080 1
1 284 . 21 1 1 A 39 39 GLN CA C 38 59.153 58.869 0.284 1
1 285 . 21 1 1 A 39 39 GLN CB C 38 28.213 28.347 -0.134 1
1 287 . 21 1 1 A 39 39 GLN N N 38 116.433 118.437 -2.004 1
1 289 . 21 1 1 A 40 40 LEU H H 39 7.930 7.714 0.216 1
1 290 . 21 1 1 A 40 40 LEU HA H 39 3.916 4.016 -0.100 1
1 300 . 21 1 1 A 40 40 LEU C C 39 177.731 178.207 -0.476 1
1 301 . 21 1 1 A 40 40 LEU CA C 39 57.915 57.985 -0.070 1
1 302 . 21 1 1 A 40 40 LEU CB C 39 41.989 41.557 0.432 1
1 306 . 21 1 1 A 40 40 LEU N N 39 119.505 121.560 -2.055 1
1 307 . 21 1 1 A 41 41 LEU H H 40 7.174 7.973 -0.799 1
1 308 . 21 1 1 A 41 41 LEU HA H 40 3.835 4.072 -0.237 1
1 318 . 21 1 1 A 41 41 LEU C C 40 179.738 178.206 1.532 1
1 319 . 21 1 1 A 41 41 LEU CA C 40 58.266 58.053 0.213 1
1 320 . 21 1 1 A 41 41 LEU CB C 40 42.050 41.630 0.420 1
1 324 . 21 1 1 A 41 41 LEU N N 40 120.971 119.833 1.138 1
1 325 . 21 1 1 A 42 42 GLN H H 41 8.058 8.011 0.047 1
1 326 . 21 1 1 A 42 42 GLN HA H 41 3.556 3.703 -0.147 1
1 333 . 21 1 1 A 42 42 GLN C C 41 177.642 178.548 -0.906 1
1 334 . 21 1 1 A 42 42 GLN CA C 41 59.826 59.135 0.691 1
1 335 . 21 1 1 A 42 42 GLN CB C 41 28.762 27.798 0.964 1
1 337 . 21 1 1 A 42 42 GLN N N 41 117.899 118.260 -0.361 1
1 339 . 21 1 1 A 43 43 ARG H H 42 8.179 7.815 0.364 1
1 340 . 21 1 1 A 43 43 ARG HA H 42 3.655 3.982 -0.327 1
1 347 . 21 1 1 A 43 43 ARG C C 42 178.051 178.359 -0.308 1
1 348 . 21 1 1 A 43 43 ARG CA C 42 59.766 58.774 0.992 1
1 349 . 21 1 1 A 43 43 ARG CB C 42 29.941 29.968 -0.027 1
1 352 . 21 1 1 A 43 43 ARG N N 42 119.392 119.721 -0.329 1
1 353 . 21 1 1 A 44 44 ASN H H 43 8.525 7.947 0.578 1
1 354 . 21 1 1 A 44 44 ASN HA H 43 4.332 4.415 -0.083 1
1 359 . 21 1 1 A 44 44 ASN C C 43 178.150 177.984 0.166 1
1 360 . 21 1 1 A 44 44 ASN CA C 43 55.841 56.219 -0.378 1
1 361 . 21 1 1 A 44 44 ASN CB C 43 37.632 39.270 -1.638 1
1 362 . 21 1 1 A 44 44 ASN N N 43 116.214 117.736 -1.522 1
1 364 . 21 1 1 A 45 45 PHE H H 44 7.586 7.904 -0.318 1
1 365 . 21 1 1 A 45 45 PHE HA H 44 4.132 4.324 -0.192 1
1 372 . 21 1 1 A 45 45 PHE C C 44 176.691 178.607 -1.916 1
1 373 . 21 1 1 A 45 45 PHE CA C 44 62.333 60.862 1.471 1
1 374 . 21 1 1 A 45 45 PHE CB C 44 39.449 39.003 0.446 1
1 379 . 21 1 1 A 45 45 PHE N N 44 121.501 117.520 3.981 1
1 380 . 21 1 1 A 46 46 MET H H 45 8.190 8.243 -0.053 1
1 381 . 21 1 1 A 46 46 MET HA H 45 4.060 4.251 -0.191 1
1 389 . 21 1 1 A 46 46 MET C C 45 179.754 178.153 1.601 1
1 390 . 21 1 1 A 46 46 MET CA C 45 57.742 57.890 -0.148 1
1 391 . 21 1 1 A 46 46 MET CB C 45 29.912 31.239 -1.327 1
1 394 . 21 1 1 A 46 46 MET N N 45 116.727 117.893 -1.166 1
1 395 . 21 1 1 A 47 47 ASP H H 46 8.579 8.298 0.281 1
1 396 . 21 1 1 A 47 47 ASP HA H 46 4.804 4.665 0.139 1
1 399 . 21 1 1 A 47 47 ASP C C 46 177.854 177.739 0.115 1
1 400 . 21 1 1 A 47 47 ASP CA C 46 57.277 57.272 0.005 1
1 401 . 21 1 1 A 47 47 ASP CB C 46 40.776 41.523 -0.747 1
1 402 . 21 1 1 A 47 47 ASP N N 46 117.798 120.688 -2.890 1
1 403 . 21 1 1 A 48 48 LYS H H 47 7.339 7.876 -0.537 1
1 404 . 21 1 1 A 48 48 LYS HA H 47 3.828 4.336 -0.508 1
1 413 . 21 1 1 A 48 48 LYS C C 47 178.812 178.826 -0.014 1
1 414 . 21 1 1 A 48 48 LYS CA C 47 58.953 57.715 1.238 1
1 415 . 21 1 1 A 48 48 LYS CB C 47 32.796 33.322 -0.526 1
1 419 . 21 1 1 A 48 48 LYS N N 47 117.852 118.083 -0.231 1
1 420 . 21 1 1 A 49 49 TYR H H 48 6.841 8.469 -1.628 1
1 421 . 21 1 1 A 49 49 TYR HA H 48 4.995 4.327 0.668 1
1 428 . 21 1 1 A 49 49 TYR C C 48 178.138 178.655 -0.517 1
1 429 . 21 1 1 A 49 49 TYR CA C 48 58.620 59.721 -1.101 1
1 430 . 21 1 1 A 49 49 TYR CB C 48 42.939 37.901 5.038 1
1 435 . 21 1 1 A 49 49 TYR N N 48 112.109 119.150 -7.041 1
1 436 . 21 1 1 A 50 50 TYR H H 49 8.491 8.117 0.374 1
1 437 . 21 1 1 A 50 50 TYR HA H 49 4.598 4.371 0.227 1
1 444 . 21 1 1 A 50 50 TYR C C 49 176.015 177.622 -1.607 1
1 445 . 21 1 1 A 50 50 TYR CA C 49 62.442 59.579 2.863 1
1 446 . 21 1 1 A 50 50 TYR CB C 49 36.588 36.961 -0.373 1
1 451 . 21 1 1 A 50 50 TYR N N 49 118.294 118.918 -0.624 1
1 452 . 21 1 1 A 51 51 LEU H H 50 7.512 7.539 -0.027 1
1 453 . 21 1 1 A 51 51 LEU HA H 50 3.878 3.606 0.272 1
1 463 . 21 1 1 A 51 51 LEU C C 50 178.625 178.732 -0.107 1
1 464 . 21 1 1 A 51 51 LEU CA C 50 55.994 57.208 -1.214 1
1 465 . 21 1 1 A 51 51 LEU CB C 50 40.743 41.674 -0.931 1
1 469 . 21 1 1 A 51 51 LEU N N 50 118.478 121.698 -3.220 1
1 470 . 21 1 1 A 52 52 GLU H H 51 8.042 7.956 0.086 1
1 471 . 21 1 1 A 52 52 GLU HA H 51 4.197 4.125 0.072 1
1 476 . 21 1 1 A 52 52 GLU C C 51 177.629 177.746 -0.117 1
1 477 . 21 1 1 A 52 52 GLU CA C 51 56.141 59.000 -2.859 1
1 478 . 21 1 1 A 52 52 GLU CB C 51 29.162 29.730 -0.568 1
1 480 . 21 1 1 A 52 52 GLU N N 51 115.067 117.859 -2.792 1
1 481 . 21 1 1 A 53 53 PHE H H 52 7.465 8.049 -0.584 1
1 482 . 21 1 1 A 53 53 PHE HA H 52 4.431 4.750 -0.319 1
1 490 . 21 1 1 A 53 53 PHE C C 52 174.325 175.112 -0.787 1
1 491 . 21 1 1 A 53 53 PHE CA C 52 58.986 57.218 1.768 1
1 492 . 21 1 1 A 53 53 PHE CB C 52 40.183 37.680 2.503 1
1 498 . 21 1 1 A 53 53 PHE N N 52 116.768 119.082 -2.314 1
1 499 . 21 1 1 A 54 54 GLU H H 53 7.484 8.803 -1.319 1
1 500 . 21 1 1 A 54 54 GLU HA H 53 4.583 4.897 -0.314 1
1 505 . 21 1 1 A 54 54 GLU C C 53 175.722 175.440 0.282 1
1 506 . 21 1 1 A 54 54 GLU CA C 53 54.248 55.073 -0.825 1
1 507 . 21 1 1 A 54 54 GLU CB C 53 34.409 32.093 2.316 1
1 509 . 21 1 1 A 54 54 GLU N N 53 118.844 124.188 -5.344 1
1 510 . 21 1 1 A 55 55 ASP H H 54 9.008 8.665 0.343 1
1 511 . 21 1 1 A 55 55 ASP HA H 54 4.735 4.817 -0.082 1
1 514 . 21 1 1 A 55 55 ASP C C 54 175.421 175.817 -0.396 1
1 515 . 21 1 1 A 55 55 ASP CA C 54 52.888 53.782 -0.894 1
1 516 . 21 1 1 A 55 55 ASP CB C 54 38.894 40.650 -1.756 1
1 517 . 21 1 1 A 55 55 ASP N N 54 123.654 123.130 0.524 1
1 518 . 21 1 1 A 56 56 THR H H 55 7.819 8.021 -0.202 1
1 519 . 21 1 1 A 56 56 THR HA H 55 4.574 5.054 -0.480 1
1 524 . 21 1 1 A 56 56 THR C C 55 174.096 174.389 -0.293 1
1 525 . 21 1 1 A 56 56 THR CA C 55 59.172 59.398 -0.226 1
1 526 . 21 1 1 A 56 56 THR CB C 55 71.889 72.328 -0.439 1
1 528 . 21 1 1 A 56 56 THR N N 55 112.015 117.049 -5.034 1
1 529 . 21 1 1 A 57 57 GLU H H 56 8.527 8.785 -0.258 1
1 530 . 21 1 1 A 57 57 GLU HA H 56 4.217 4.463 -0.246 1
1 535 . 21 1 1 A 57 57 GLU C C 56 177.042 176.277 0.765 1
1 536 . 21 1 1 A 57 57 GLU CA C 56 56.869 56.017 0.852 1
1 537 . 21 1 1 A 57 57 GLU CB C 56 29.731 29.729 0.002 1
1 539 . 21 1 1 A 57 57 GLU N N 56 117.531 119.040 -1.509 1
1 540 . 21 1 1 A 58 58 GLU H H 57 7.587 7.822 -0.235 1
1 541 . 21 1 1 A 58 58 GLU HA H 57 3.941 4.653 -0.712 1
1 546 . 21 1 1 A 58 58 GLU C C 57 176.849 175.501 1.348 1
1 547 . 21 1 1 A 58 58 GLU CA C 57 56.924 55.087 1.837 1
1 548 . 21 1 1 A 58 58 GLU CB C 57 30.251 30.813 -0.562 1
1 550 . 21 1 1 A 58 58 GLU N N 57 119.183 120.627 -1.444 1
1 551 . 21 1 1 A 59 59 ASN H H 58 9.120 8.777 0.343 1
1 552 . 21 1 1 A 59 59 ASN HA H 58 4.922 5.186 -0.264 1
1 557 . 21 1 1 A 59 59 ASN C C 58 174.254 173.757 0.497 1
1 558 . 21 1 1 A 59 59 ASN CA C 58 51.956 52.035 -0.079 1
1 559 . 21 1 1 A 59 59 ASN CB C 58 37.404 39.625 -2.221 1
1 560 . 21 1 1 A 59 59 ASN N N 58 126.767 121.377 5.390 1
1 562 . 21 1 1 A 60 60 LYS H H 59 5.892 9.032 -3.140 1
1 563 . 21 1 1 A 60 60 LYS HA H 59 3.798 4.490 -0.692 1
1 572 . 21 1 1 A 60 60 LYS C C 59 177.908 177.010 0.898 1
1 573 . 21 1 1 A 60 60 LYS CA C 59 56.623 55.480 1.143 1
1 574 . 21 1 1 A 60 60 LYS CB C 59 32.279 33.162 -0.883 1
1 578 . 21 1 1 A 60 60 LYS N N 59 121.527 126.849 -5.322 1
1 579 . 21 1 1 A 61 61 LEU H H 60 8.473 8.784 -0.311 1
1 580 . 21 1 1 A 61 61 LEU HA H 60 3.891 4.177 -0.286 1
1 590 . 21 1 1 A 61 61 LEU C C 60 179.843 178.579 1.264 1
1 591 . 21 1 1 A 61 61 LEU CA C 60 58.301 56.482 1.819 1
1 592 . 21 1 1 A 61 61 LEU CB C 60 41.305 41.467 -0.162 1
1 596 . 21 1 1 A 61 61 LEU N N 60 125.639 123.514 2.125 1
1 597 . 21 1 1 A 62 62 ILE H H 61 7.698 7.619 0.079 1
1 598 . 21 1 1 A 62 62 ILE HA H 61 3.952 3.800 0.152 1
1 608 . 21 1 1 A 62 62 ILE C C 61 175.392 177.268 -1.876 1
1 609 . 21 1 1 A 62 62 ILE CA C 61 61.743 63.163 -1.420 1
1 610 . 21 1 1 A 62 62 ILE CB C 61 39.108 37.640 1.468 1
1 614 . 21 1 1 A 62 62 ILE N N 61 114.111 119.582 -5.471 1
1 615 . 21 1 1 A 63 63 TYR H H 62 7.273 7.250 0.023 1
1 616 . 21 1 1 A 63 63 TYR HA H 62 4.343 4.237 0.106 1
1 623 . 21 1 1 A 63 63 TYR C C 62 178.264 178.574 -0.310 1
1 624 . 21 1 1 A 63 63 TYR CA C 62 57.231 61.112 -3.881 1
1 625 . 21 1 1 A 63 63 TYR CB C 62 36.332 37.339 -1.007 1
1 630 . 21 1 1 A 63 63 TYR N N 62 117.689 121.274 -3.585 1
1 631 . 21 1 1 A 64 64 THR H H 63 7.747 7.800 -0.053 1
1 632 . 21 1 1 A 64 64 THR HA H 63 4.266 4.203 0.063 1
1 637 . 21 1 1 A 64 64 THR CA C 63 69.362 67.553 1.809 1
1 638 . 21 1 1 A 64 64 THR CB C 63 66.962 67.463 -0.501 1
1 640 . 21 1 1 A 64 64 THR N N 63 113.755 116.270 -2.515 1
1 641 . 21 1 1 A 65 65 PRO HA H 64 4.372 4.372 0.000 1
1 648 . 21 1 1 A 65 65 PRO C C 64 179.913 179.342 0.571 1
1 649 . 21 1 1 A 65 65 PRO CA C 64 66.011 66.004 0.007 1
1 650 . 21 1 1 A 65 65 PRO CB C 64 30.642 30.683 -0.041 1
1 653 . 21 1 1 A 66 66 ILE H H 65 7.377 7.335 0.042 1
1 654 . 21 1 1 A 66 66 ILE HA H 65 3.530 3.906 -0.376 1
1 664 . 21 1 1 A 66 66 ILE C C 65 177.543 178.299 -0.756 1
1 665 . 21 1 1 A 66 66 ILE CA C 65 66.647 64.179 2.468 1
1 666 . 21 1 1 A 66 66 ILE CB C 65 38.029 37.719 0.310 1
1 670 . 21 1 1 A 66 66 ILE N N 65 118.353 116.656 1.697 1
1 671 . 21 1 1 A 67 67 PHE H H 66 8.480 8.404 0.076 1
1 672 . 21 1 1 A 67 67 PHE HA H 66 4.115 4.178 -0.063 1
1 680 . 21 1 1 A 67 67 PHE C C 66 177.293 178.215 -0.922 1
1 681 . 21 1 1 A 67 67 PHE CA C 66 59.570 62.078 -2.508 1
1 682 . 21 1 1 A 67 67 PHE CB C 66 38.865 39.616 -0.751 1
1 688 . 21 1 1 A 67 67 PHE N N 66 122.420 121.278 1.142 1
1 689 . 21 1 1 A 68 68 ASN H H 67 8.595 8.203 0.392 1
1 690 . 21 1 1 A 68 68 ASN HA H 67 4.211 4.423 -0.212 1
1 695 . 21 1 1 A 68 68 ASN C C 67 178.697 178.269 0.428 1
1 696 . 21 1 1 A 68 68 ASN CA C 67 56.056 56.182 -0.126 1
1 697 . 21 1 1 A 68 68 ASN CB C 67 37.704 38.057 -0.353 1
1 698 . 21 1 1 A 68 68 ASN N N 67 115.573 117.665 -2.092 1
1 700 . 21 1 1 A 69 69 GLU H H 68 8.414 7.993 0.421 1
1 701 . 21 1 1 A 69 69 GLU HA H 68 4.102 4.186 -0.084 1
1 706 . 21 1 1 A 69 69 GLU C C 68 177.880 178.842 -0.962 1
1 707 . 21 1 1 A 69 69 GLU CA C 68 59.399 59.325 0.074 1
1 708 . 21 1 1 A 69 69 GLU CB C 68 29.855 29.246 0.609 1
1 710 . 21 1 1 A 69 69 GLU N N 68 123.510 119.967 3.543 1
1 711 . 21 1 1 A 70 70 TYR H H 69 8.659 8.050 0.609 1
1 712 . 21 1 1 A 70 70 TYR HA H 69 3.362 4.183 -0.821 1
1 719 . 21 1 1 A 70 70 TYR C C 69 178.143 177.028 1.115 1
1 720 . 21 1 1 A 70 70 TYR CA C 69 60.686 61.106 -0.420 1
1 721 . 21 1 1 A 70 70 TYR CB C 69 38.560 38.936 -0.376 1
1 726 . 21 1 1 A 70 70 TYR N N 69 122.130 120.825 1.305 1
1 727 . 21 1 1 A 71 71 ILE H H 70 8.031 7.732 0.299 1
1 728 . 21 1 1 A 71 71 ILE HA H 70 3.265 3.740 -0.475 1
1 738 . 21 1 1 A 71 71 ILE C C 70 178.056 177.634 0.422 1
1 739 . 21 1 1 A 71 71 ILE CA C 70 63.756 63.960 -0.204 1
1 740 . 21 1 1 A 71 71 ILE CB C 70 37.321 36.660 0.661 1
1 744 . 21 1 1 A 71 71 ILE N N 70 118.906 120.148 -1.242 1
1 745 . 21 1 1 A 72 72 SER H H 71 7.803 7.699 0.104 1
1 746 . 21 1 1 A 72 72 SER HA H 71 4.029 4.413 -0.384 1
1 749 . 21 1 1 A 72 72 SER CA C 71 61.380 61.018 0.362 1
1 750 . 21 1 1 A 72 72 SER CB C 71 63.288 63.395 -0.107 1
1 751 . 21 1 1 A 72 72 SER N N 71 113.735 118.672 -4.937 1
1 752 . 21 1 1 A 73 73 LEU H H 72 7.952 8.099 -0.147 1
1 753 . 21 1 1 A 73 73 LEU HA H 72 4.418 4.160 0.258 1
1 763 . 21 1 1 A 73 73 LEU C C 72 177.767 178.187 -0.420 1
1 764 . 21 1 1 A 73 73 LEU CA C 72 56.543 57.430 -0.887 1
1 765 . 21 1 1 A 73 73 LEU CB C 72 44.517 41.740 2.777 1
1 769 . 21 1 1 A 73 73 LEU N N 72 119.411 122.585 -3.174 1
1 770 . 21 1 1 A 74 74 VAL H H 73 8.021 7.571 0.450 1
1 771 . 21 1 1 A 74 74 VAL HA H 73 3.532 3.317 0.215 1
1 779 . 21 1 1 A 74 74 VAL C C 73 177.126 177.994 -0.868 1
1 780 . 21 1 1 A 74 74 VAL CA C 73 66.250 66.401 -0.151 1
1 781 . 21 1 1 A 74 74 VAL CB C 73 31.212 31.099 0.113 1
1 784 . 21 1 1 A 74 74 VAL N N 73 118.747 119.239 -0.492 1
1 785 . 21 1 1 A 75 75 GLU H H 74 7.232 8.050 -0.818 1
1 786 . 21 1 1 A 75 75 GLU HA H 74 3.013 4.159 -1.146 1
1 791 . 21 1 1 A 75 75 GLU C C 74 178.804 179.370 -0.566 1
1 792 . 21 1 1 A 75 75 GLU CA C 74 60.536 59.990 0.546 1
1 793 . 21 1 1 A 75 75 GLU CB C 74 27.009 29.132 -2.123 1
1 795 . 21 1 1 A 75 75 GLU N N 74 118.660 119.723 -1.063 1
1 796 . 21 1 1 A 76 76 LYS H H 75 7.051 7.892 -0.841 1
1 797 . 21 1 1 A 76 76 LYS HA H 75 3.765 4.090 -0.325 1
1 806 . 21 1 1 A 76 76 LYS C C 75 177.765 178.110 -0.345 1
1 807 . 21 1 1 A 76 76 LYS CA C 75 58.357 58.508 -0.151 1
1 808 . 21 1 1 A 76 76 LYS CB C 75 31.939 32.264 -0.325 1
1 812 . 21 1 1 A 76 76 LYS N N 75 116.112 119.163 -3.051 1
1 813 . 21 1 1 A 77 77 TYR H H 76 7.067 7.771 -0.704 1
1 814 . 21 1 1 A 77 77 TYR HA H 76 4.036 4.180 -0.144 1
1 821 . 21 1 1 A 77 77 TYR C C 76 177.752 177.071 0.681 1
1 822 . 21 1 1 A 77 77 TYR CA C 76 61.820 61.236 0.584 1
1 823 . 21 1 1 A 77 77 TYR CB C 76 38.480 38.719 -0.239 1
1 828 . 21 1 1 A 77 77 TYR N N 76 118.434 121.433 -2.999 1
1 829 . 21 1 1 A 78 78 ILE H H 77 7.554 8.403 -0.849 1
1 830 . 21 1 1 A 78 78 ILE HA H 77 3.159 3.629 -0.470 1
1 840 . 21 1 1 A 78 78 ILE C C 77 177.341 177.890 -0.549 1
1 841 . 21 1 1 A 78 78 ILE CA C 77 65.177 65.227 -0.050 1
1 842 . 21 1 1 A 78 78 ILE CB C 77 37.339 37.723 -0.384 1
1 846 . 21 1 1 A 78 78 ILE N N 77 117.672 121.676 -4.004 1
1 847 . 21 1 1 A 79 79 GLU H H 78 8.296 8.127 0.169 1
1 848 . 21 1 1 A 79 79 GLU HA H 78 3.557 3.842 -0.285 1
1 853 . 21 1 1 A 79 79 GLU C C 78 177.742 178.983 -1.241 1
1 854 . 21 1 1 A 79 79 GLU CA C 78 60.847 60.134 0.713 1
1 855 . 21 1 1 A 79 79 GLU CB C 78 29.594 29.266 0.328 1
1 857 . 21 1 1 A 79 79 GLU N N 78 118.701 120.879 -2.178 1
1 858 . 21 1 1 A 80 80 GLU H H 79 8.330 8.443 -0.113 1
1 859 . 21 1 1 A 80 80 GLU HA H 79 3.774 4.021 -0.247 1
1 864 . 21 1 1 A 80 80 GLU C C 79 179.926 179.344 0.582 1
1 865 . 21 1 1 A 80 80 GLU CA C 79 59.581 59.112 0.469 1
1 866 . 21 1 1 A 80 80 GLU CB C 79 29.062 29.374 -0.312 1
1 868 . 21 1 1 A 80 80 GLU N N 79 116.767 117.741 -0.974 1
1 869 . 21 1 1 A 81 81 GLN H H 80 7.634 7.706 -0.072 1
1 870 . 21 1 1 A 81 81 GLN HA H 80 3.605 3.841 -0.236 1
1 877 . 21 1 1 A 81 81 GLN C C 80 179.681 178.703 0.978 1
1 878 . 21 1 1 A 81 81 GLN CA C 80 57.765 58.541 -0.776 1
1 879 . 21 1 1 A 81 81 GLN CB C 80 28.079 27.740 0.339 1
1 881 . 21 1 1 A 81 81 GLN N N 80 116.325 118.850 -2.525 1
1 883 . 21 1 1 A 82 82 LEU H H 81 8.156 7.531 0.625 1
1 884 . 21 1 1 A 82 82 LEU HA H 81 3.536 3.803 -0.267 1
1 894 . 21 1 1 A 82 82 LEU C C 81 178.945 179.541 -0.596 1
1 895 . 21 1 1 A 82 82 LEU CA C 81 57.761 56.869 0.892 1
1 896 . 21 1 1 A 82 82 LEU CB C 81 40.961 40.852 0.109 1
1 900 . 21 1 1 A 82 82 LEU N N 81 121.546 119.960 1.586 1
1 901 . 21 1 1 A 83 83 LEU H H 82 8.326 8.091 0.235 1
1 902 . 21 1 1 A 83 83 LEU HA H 82 4.198 4.306 -0.108 1
1 912 . 21 1 1 A 83 83 LEU C C 82 178.631 179.211 -0.580 1
1 913 . 21 1 1 A 83 83 LEU CA C 82 57.016 57.124 -0.108 1
1 914 . 21 1 1 A 83 83 LEU CB C 82 42.182 40.700 1.482 1
1 918 . 21 1 1 A 83 83 LEU N N 82 120.426 119.706 0.720 1
1 919 . 21 1 1 A 84 84 GLN H H 83 6.992 7.626 -0.634 1
1 920 . 21 1 1 A 84 84 GLN HA H 83 3.877 4.034 -0.157 1
1 927 . 21 1 1 A 84 84 GLN C C 83 177.008 177.455 -0.447 1
1 928 . 21 1 1 A 84 84 GLN CA C 83 57.543 58.835 -1.292 1
1 929 . 21 1 1 A 84 84 GLN CB C 83 28.688 28.515 0.173 1
1 931 . 21 1 1 A 84 84 GLN N N 83 114.001 117.179 -3.178 1
1 933 . 21 1 1 A 85 85 ARG H H 84 7.072 7.529 -0.457 1
1 934 . 21 1 1 A 85 85 ARG HA H 84 4.047 4.497 -0.450 1
1 942 . 21 1 1 A 85 85 ARG C C 84 175.999 175.722 0.277 1
1 943 . 21 1 1 A 85 85 ARG CA C 84 56.764 56.315 0.449 1
1 944 . 21 1 1 A 85 85 ARG CB C 84 32.044 31.786 0.258 1
1 947 . 21 1 1 A 85 85 ARG N N 84 115.827 114.550 1.277 1
1 949 . 21 1 1 A 86 86 ILE H H 85 8.238 7.623 0.615 1
1 950 . 21 1 1 A 86 86 ILE HA H 85 4.389 4.600 -0.211 1
1 960 . 21 1 1 A 86 86 ILE CA C 85 58.007 57.919 0.088 1
1 961 . 21 1 1 A 86 86 ILE CB C 85 39.604 38.897 0.707 1
1 965 . 21 1 1 A 86 86 ILE N N 85 119.285 120.157 -0.872 1
1 966 . 21 1 1 A 87 87 PRO HA H 86 4.392 4.539 -0.147 1
1 973 . 21 1 1 A 87 87 PRO C C 86 177.622 176.464 1.158 1
1 974 . 21 1 1 A 87 87 PRO CA C 86 64.665 64.260 0.405 1
1 975 . 21 1 1 A 87 87 PRO CB C 86 32.020 31.606 0.414 1
1 978 . 21 1 1 A 88 88 GLU H H 87 8.312 8.188 0.124 1
1 979 . 21 1 1 A 88 88 GLU HA H 87 4.208 4.540 -0.332 1
1 984 . 21 1 1 A 88 88 GLU C C 87 175.554 175.841 -0.287 1
1 985 . 21 1 1 A 88 88 GLU CA C 87 56.045 56.279 -0.234 1
1 986 . 21 1 1 A 88 88 GLU CB C 87 28.654 30.613 -1.959 1
1 988 . 21 1 1 A 88 88 GLU N N 87 114.256 116.767 -2.511 1
1 989 . 21 1 1 A 89 89 PHE H H 88 7.946 7.657 0.289 1
1 990 . 21 1 1 A 89 89 PHE HA H 88 3.993 4.655 -0.662 1
1 998 . 21 1 1 A 89 89 PHE C C 88 173.460 174.800 -1.340 1
1 999 . 21 1 1 A 89 89 PHE CA C 88 60.119 58.642 1.477 1
1 1000 . 21 1 1 A 89 89 PHE CB C 88 39.994 40.259 -0.265 1
1 1006 . 21 1 1 A 89 89 PHE N N 88 121.550 123.092 -1.542 1
1 1007 . 21 1 1 A 90 90 ASN H H 89 7.266 7.754 -0.488 1
1 1008 . 21 1 1 A 90 90 ASN HA H 89 4.454 4.982 -0.528 1
1 1013 . 21 1 1 A 90 90 ASN C C 89 173.921 175.145 -1.224 1
1 1014 . 21 1 1 A 90 90 ASN CA C 89 51.839 51.461 0.378 1
1 1015 . 21 1 1 A 90 90 ASN CB C 89 40.674 39.820 0.854 1
1 1016 . 21 1 1 A 90 90 ASN N N 89 125.344 124.914 0.430 1
1 1018 . 21 1 1 A 91 91 MET H H 90 8.968 8.813 0.155 1
1 1019 . 21 1 1 A 91 91 MET HA H 90 4.049 4.202 -0.153 1
1 1027 . 21 1 1 A 91 91 MET C C 90 177.475 177.900 -0.425 1
1 1028 . 21 1 1 A 91 91 MET CA C 90 57.758 58.039 -0.281 1
1 1029 . 21 1 1 A 91 91 MET CB C 90 32.250 32.272 -0.022 1
1 1032 . 21 1 1 A 91 91 MET N N 90 127.052 125.460 1.592 1
1 1033 . 21 1 1 A 92 92 ALA H H 91 8.292 8.089 0.203 1
1 1034 . 21 1 1 A 92 92 ALA HA H 91 4.059 4.103 -0.044 1
1 1038 . 21 1 1 A 92 92 ALA C C 91 180.412 179.715 0.697 1
1 1039 . 21 1 1 A 92 92 ALA CA C 91 55.368 55.004 0.364 1
1 1040 . 21 1 1 A 92 92 ALA CB C 91 17.527 18.407 -0.880 1
1 1041 . 21 1 1 A 92 92 ALA N N 91 123.752 121.355 2.397 1
1 1042 . 21 1 1 A 93 93 ALA H H 92 7.931 8.032 -0.101 1
1 1043 . 21 1 1 A 93 93 ALA HA H 92 4.054 4.290 -0.236 1
1 1047 . 21 1 1 A 93 93 ALA C C 92 180.482 179.918 0.564 1
1 1048 . 21 1 1 A 93 93 ALA CA C 92 54.614 54.949 -0.335 1
1 1049 . 21 1 1 A 93 93 ALA CB C 92 18.098 18.102 -0.004 1
1 1050 . 21 1 1 A 93 93 ALA N N 92 121.158 120.096 1.062 1
1 1051 . 21 1 1 A 94 94 PHE H H 93 8.110 7.678 0.432 1
1 1052 . 21 1 1 A 94 94 PHE HA H 93 4.304 4.186 0.118 1
1 1060 . 21 1 1 A 94 94 PHE C C 93 177.350 177.456 -0.106 1
1 1061 . 21 1 1 A 94 94 PHE CA C 93 61.641 61.505 0.136 1
1 1062 . 21 1 1 A 94 94 PHE CB C 93 40.014 39.333 0.681 1
1 1068 . 21 1 1 A 94 94 PHE N N 93 119.807 119.626 0.181 1
1 1069 . 21 1 1 A 95 95 THR H H 94 8.726 8.311 0.415 1
1 1070 . 21 1 1 A 95 95 THR HA H 94 3.569 4.080 -0.511 1
1 1075 . 21 1 1 A 95 95 THR C C 94 176.932 176.623 0.309 1
1 1076 . 21 1 1 A 95 95 THR CA C 94 66.833 65.556 1.277 1
1 1077 . 21 1 1 A 95 95 THR CB C 94 68.445 68.179 0.266 1
1 1079 . 21 1 1 A 95 95 THR N N 94 113.074 112.312 0.762 1
1 1080 . 21 1 1 A 96 96 THR H H 95 7.657 7.789 -0.132 1
1 1081 . 21 1 1 A 96 96 THR HA H 95 3.945 4.138 -0.193 1
1 1086 . 21 1 1 A 96 96 THR C C 95 176.386 177.659 -1.273 1
1 1087 . 21 1 1 A 96 96 THR CA C 95 66.550 65.906 0.644 1
1 1088 . 21 1 1 A 96 96 THR CB C 95 68.583 67.979 0.604 1
1 1090 . 21 1 1 A 96 96 THR N N 95 117.927 113.746 4.181 1
1 1091 . 21 1 1 A 97 97 THR H H 96 7.699 7.714 -0.015 1
1 1092 . 21 1 1 A 97 97 THR HA H 96 3.905 4.146 -0.241 1
1 1097 . 21 1 1 A 97 97 THR C C 96 176.572 176.623 -0.051 1
1 1098 . 21 1 1 A 97 97 THR CA C 96 65.979 66.360 -0.381 1
1 1099 . 21 1 1 A 97 97 THR CB C 96 68.553 68.459 0.094 1
1 1101 . 21 1 1 A 97 97 THR N N 96 118.518 117.318 1.200 1
1 1102 . 21 1 1 A 98 98 LEU H H 97 8.304 8.144 0.160 1
1 1103 . 21 1 1 A 98 98 LEU HA H 97 3.725 3.992 -0.267 1
1 1113 . 21 1 1 A 98 98 LEU C C 97 178.490 178.137 0.353 1
1 1114 . 21 1 1 A 98 98 LEU CA C 97 58.517 58.014 0.503 1
1 1115 . 21 1 1 A 98 98 LEU CB C 97 41.697 41.266 0.431 1
1 1119 . 21 1 1 A 98 98 LEU N N 97 122.882 121.996 0.886 1
1 1120 . 21 1 1 A 99 99 GLN H H 98 7.639 8.080 -0.441 1
1 1121 . 21 1 1 A 99 99 GLN HA H 98 3.927 4.087 -0.160 1
1 1128 . 21 1 1 A 99 99 GLN C C 98 178.068 177.358 0.710 1
1 1129 . 21 1 1 A 99 99 GLN CA C 98 58.735 57.977 0.758 1
1 1130 . 21 1 1 A 99 99 GLN CB C 98 27.986 28.118 -0.132 1
1 1132 . 21 1 1 A 99 99 GLN N N 98 114.302 116.221 -1.919 1
1 1134 . 21 1 1 A 100 100 HIS H H 99 7.575 7.470 0.105 1
1 1135 . 21 1 1 A 100 100 HIS HA H 99 4.524 4.452 0.072 1
1 1139 . 21 1 1 A 100 100 HIS C C 99 174.789 177.674 -2.885 1
1 1140 . 21 1 1 A 100 100 HIS CA C 99 56.154 59.348 -3.194 1
1 1141 . 21 1 1 A 100 100 HIS CB C 99 28.946 30.779 -1.833 1
1 1143 . 21 1 1 A 100 100 HIS N N 99 114.778 118.023 -3.245 1
1 1144 . 21 1 1 A 101 101 HIS H H 100 7.773 7.943 -0.170 1
1 1145 . 21 1 1 A 101 101 HIS HA H 100 4.704 4.085 0.619 1
1 1149 . 21 1 1 A 101 101 HIS C C 100 174.818 176.821 -2.003 1
1 1150 . 21 1 1 A 101 101 HIS CA C 100 54.830 58.191 -3.361 1
1 1151 . 21 1 1 A 101 101 HIS CB C 100 29.749 30.017 -0.268 1
1 1153 . 21 1 1 A 101 101 HIS N N 100 117.397 119.016 -1.619 1
1 1154 . 21 1 1 A 102 102 LYS H H 101 7.324 8.118 -0.794 1
1 1155 . 21 1 1 A 102 102 LYS HA H 101 3.611 4.012 -0.401 1
1 1164 . 21 1 1 A 102 102 LYS C C 101 176.823 178.954 -2.131 1
1 1165 . 21 1 1 A 102 102 LYS CA C 101 59.915 58.803 1.112 1
1 1166 . 21 1 1 A 102 102 LYS CB C 101 32.825 32.127 0.698 1
1 1170 . 21 1 1 A 102 102 LYS N N 101 120.533 118.992 1.541 1
1 1171 . 21 1 1 A 103 103 ASP H H 102 8.361 8.585 -0.224 1
1 1172 . 21 1 1 A 103 103 ASP HA H 102 4.421 4.276 0.145 1
1 1175 . 21 1 1 A 103 103 ASP C C 102 176.793 177.507 -0.714 1
1 1176 . 21 1 1 A 103 103 ASP CA C 102 55.500 56.399 -0.899 1
1 1177 . 21 1 1 A 103 103 ASP CB C 102 40.178 39.752 0.426 1
1 1178 . 21 1 1 A 103 103 ASP N N 102 114.814 116.725 -1.911 1
1 1179 . 21 1 1 A 104 104 GLU H H 103 7.858 7.783 0.075 1
1 1180 . 21 1 1 A 104 104 GLU HA H 103 4.339 4.566 -0.227 1
1 1183 . 21 1 1 A 104 104 GLU C C 103 175.777 176.875 -1.098 1
1 1184 . 21 1 1 A 104 104 GLU CA C 103 56.356 57.453 -1.097 1
1 1185 . 21 1 1 A 104 104 GLU CB C 103 31.293 31.916 -0.623 1
1 1186 . 21 1 1 A 104 104 GLU N N 103 116.826 117.794 -0.968 1
1 1187 . 21 1 1 A 105 105 VAL H H 104 7.201 7.232 -0.031 1
1 1188 . 21 1 1 A 105 105 VAL HA H 104 4.296 4.112 0.184 1
1 1196 . 21 1 1 A 105 105 VAL C C 104 174.482 175.987 -1.505 1
1 1197 . 21 1 1 A 105 105 VAL CA C 104 60.370 63.090 -2.720 1
1 1198 . 21 1 1 A 105 105 VAL CB C 104 34.341 32.181 2.160 1
1 1201 . 21 1 1 A 105 105 VAL N N 104 116.422 120.306 -3.884 1
1 1202 . 21 1 1 A 106 106 ALA H H 105 8.487 8.607 -0.120 1
1 1203 . 21 1 1 A 106 106 ALA HA H 105 4.172 4.478 -0.306 1
1 1207 . 21 1 1 A 106 106 ALA C C 105 179.030 178.324 0.706 1
1 1208 . 21 1 1 A 106 106 ALA CA C 105 52.966 52.284 0.682 1
1 1209 . 21 1 1 A 106 106 ALA CB C 105 19.371 19.072 0.299 1
1 1210 . 21 1 1 A 106 106 ALA N N 105 128.313 128.297 0.016 1
1 1211 . 21 1 1 A 107 107 GLY H H 106 8.738 8.785 -0.047 1
1 1212 . 21 1 1 A 107 107 GLY HA2 H 106 3.773 3.888 -0.115 1
1 1213 . 21 1 1 A 107 107 GLY HA3 H 106 3.998 3.961 0.037 1
1 1214 . 21 1 1 A 107 107 GLY C C 106 174.958 175.467 -0.509 1
1 1215 . 21 1 1 A 107 107 GLY CA C 106 47.449 47.187 0.262 1
1 1216 . 21 1 1 A 107 107 GLY N N 106 110.612 110.745 -0.133 1
1 1217 . 21 1 1 A 108 108 ASP H H 107 8.535 8.349 0.186 1
1 1218 . 21 1 1 A 108 108 ASP HA H 107 4.333 4.352 -0.019 1
1 1221 . 21 1 1 A 108 108 ASP C C 107 179.133 179.005 0.128 1
1 1222 . 21 1 1 A 108 108 ASP CA C 107 56.721 57.313 -0.592 1
1 1223 . 21 1 1 A 108 108 ASP CB C 107 39.336 41.645 -2.309 1
1 1224 . 21 1 1 A 108 108 ASP N N 107 117.474 121.627 -4.153 1
1 1225 . 21 1 1 A 109 109 ILE H H 108 7.459 7.982 -0.523 1
1 1226 . 21 1 1 A 109 109 ILE HA H 108 3.688 3.708 -0.020 1
1 1236 . 21 1 1 A 109 109 ILE C C 108 176.735 178.295 -1.560 1
1 1237 . 21 1 1 A 109 109 ILE CA C 108 63.474 65.532 -2.058 1
1 1238 . 21 1 1 A 109 109 ILE CB C 108 37.340 37.865 -0.525 1
1 1242 . 21 1 1 A 109 109 ILE N N 108 119.609 119.726 -0.117 1
1 1243 . 21 1 1 A 110 110 PHE H H 109 7.920 8.337 -0.417 1
1 1244 . 21 1 1 A 110 110 PHE HA H 109 3.759 4.094 -0.335 1
1 1252 . 21 1 1 A 110 110 PHE C C 109 177.132 177.309 -0.177 1
1 1253 . 21 1 1 A 110 110 PHE CA C 109 62.766 61.242 1.524 1
1 1254 . 21 1 1 A 110 110 PHE CB C 109 39.752 39.250 0.502 1
1 1260 . 21 1 1 A 110 110 PHE N N 109 120.906 120.247 0.659 1
1 1261 . 21 1 1 A 111 111 ASP H H 110 8.639 8.310 0.329 1
1 1262 . 21 1 1 A 111 111 ASP HA H 110 4.216 4.225 -0.009 1
1 1265 . 21 1 1 A 111 111 ASP C C 110 178.900 177.988 0.912 1
1 1266 . 21 1 1 A 111 111 ASP CA C 110 57.105 57.654 -0.549 1
1 1267 . 21 1 1 A 111 111 ASP CB C 110 39.697 41.870 -2.173 1
1 1268 . 21 1 1 A 111 111 ASP N N 110 117.124 118.816 -1.692 1
1 1269 . 21 1 1 A 112 112 MET H H 111 7.331 8.101 -0.770 1
1 1270 . 21 1 1 A 112 112 MET HA H 111 4.081 4.064 0.017 1
1 1278 . 21 1 1 A 112 112 MET C C 111 179.052 178.796 0.256 1
1 1279 . 21 1 1 A 112 112 MET CA C 111 58.202 58.358 -0.156 1
1 1280 . 21 1 1 A 112 112 MET CB C 111 31.827 32.379 -0.552 1
1 1283 . 21 1 1 A 112 112 MET N N 111 118.061 117.618 0.443 1
1 1284 . 21 1 1 A 113 113 LEU H H 112 8.001 7.833 0.168 1
1 1285 . 21 1 1 A 113 113 LEU HA H 112 3.723 3.580 0.143 1
1 1295 . 21 1 1 A 113 113 LEU C C 112 179.747 178.699 1.048 1
1 1296 . 21 1 1 A 113 113 LEU CA C 112 57.371 57.377 -0.006 1
1 1297 . 21 1 1 A 113 113 LEU CB C 112 40.671 40.906 -0.235 1
1 1301 . 21 1 1 A 113 113 LEU N N 112 120.426 121.055 -0.629 1
1 1302 . 21 1 1 A 114 114 LEU H H 113 7.744 7.356 0.388 1
1 1303 . 21 1 1 A 114 114 LEU HA H 113 4.007 3.613 0.394 1
1 1313 . 21 1 1 A 114 114 LEU C C 113 179.358 178.888 0.470 1
1 1314 . 21 1 1 A 114 114 LEU CA C 113 57.202 57.438 -0.236 1
1 1315 . 21 1 1 A 114 114 LEU CB C 113 41.727 41.186 0.541 1
1 1319 . 21 1 1 A 114 114 LEU N N 113 119.584 118.395 1.189 1
1 1320 . 21 1 1 A 115 115 THR H H 114 7.353 7.712 -0.359 1
1 1321 . 21 1 1 A 115 115 THR HA H 114 4.071 4.120 -0.049 1
1 1327 . 21 1 1 A 115 115 THR C C 114 173.591 176.785 -3.194 1
1 1328 . 21 1 1 A 115 115 THR CA C 114 65.332 64.826 0.506 1
1 1329 . 21 1 1 A 115 115 THR CB C 114 70.319 68.650 1.669 1
1 1331 . 21 1 1 A 115 115 THR N N 114 107.535 110.768 -3.233 1
1 1332 . 21 1 1 A 116 116 PHE H H 115 6.979 7.708 -0.729 1
1 1333 . 21 1 1 A 116 116 PHE HA H 115 5.022 4.359 0.663 1
1 1341 . 21 1 1 A 116 116 PHE C C 115 176.488 176.648 -0.160 1
1 1342 . 21 1 1 A 116 116 PHE CA C 115 55.911 60.956 -5.045 1
1 1343 . 21 1 1 A 116 116 PHE CB C 115 38.521 39.280 -0.759 1
1 1349 . 21 1 1 A 116 116 PHE N N 115 112.366 120.209 -7.843 1
1 1350 . 21 1 1 A 117 117 THR H H 116 7.564 7.645 -0.081 1
1 1351 . 21 1 1 A 117 117 THR HA H 116 4.626 4.824 -0.198 1
1 1356 . 21 1 1 A 117 117 THR C C 116 174.085 173.519 0.566 1
1 1357 . 21 1 1 A 117 117 THR CA C 116 61.636 61.511 0.125 1
1 1358 . 21 1 1 A 117 117 THR CB C 116 70.915 70.886 0.029 1
1 1360 . 21 1 1 A 117 117 THR N N 116 105.498 105.568 -0.070 1
1 1361 . 21 1 1 A 118 118 ASP H H 117 8.270 7.985 0.285 1
1 1362 . 21 1 1 A 118 118 ASP HA H 117 4.955 5.008 -0.053 1
1 1365 . 21 1 1 A 118 118 ASP C C 117 176.328 176.070 0.258 1
1 1366 . 21 1 1 A 118 118 ASP CA C 117 53.417 53.181 0.236 1
1 1367 . 21 1 1 A 118 118 ASP CB C 117 43.388 38.958 4.430 1
1 1368 . 21 1 1 A 118 118 ASP N N 117 124.409 123.767 0.642 1
1 1369 . 21 1 1 A 119 119 PHE H H 118 8.973 8.489 0.484 1
1 1370 . 21 1 1 A 119 119 PHE HA H 118 3.506 4.187 -0.681 1
1 1378 . 21 1 1 A 119 119 PHE CA C 118 61.490 61.544 -0.054 1
1 1379 . 21 1 1 A 119 119 PHE CB C 118 39.246 39.444 -0.198 1
1 1385 . 21 1 1 A 119 119 PHE N N 118 126.688 125.441 1.247 1
1 1386 . 21 1 1 A 120 120 LEU H H 119 8.099 8.352 -0.253 1
1 1387 . 21 1 1 A 120 120 LEU HA H 119 3.842 4.056 -0.214 1
1 1397 . 21 1 1 A 120 120 LEU C C 119 179.601 178.500 1.101 1
1 1398 . 21 1 1 A 120 120 LEU CA C 119 58.174 58.049 0.125 1
1 1399 . 21 1 1 A 120 120 LEU CB C 119 40.315 41.400 -1.085 1
1 1403 . 21 1 1 A 120 120 LEU N N 119 117.930 120.578 -2.648 1
1 1404 . 21 1 1 A 121 121 ALA H H 120 7.729 7.662 0.067 1
1 1405 . 21 1 1 A 121 121 ALA HA H 120 3.996 4.129 -0.133 1
1 1409 . 21 1 1 A 121 121 ALA C C 120 180.995 179.601 1.394 1
1 1410 . 21 1 1 A 121 121 ALA CA C 120 54.832 54.635 0.197 1
1 1411 . 21 1 1 A 121 121 ALA CB C 120 17.706 18.280 -0.574 1
1 1412 . 21 1 1 A 121 121 ALA N N 120 123.195 120.928 2.267 1
1 1413 . 21 1 1 A 122 122 PHE H H 121 7.943 7.801 0.142 1
1 1414 . 21 1 1 A 122 122 PHE HA H 121 3.887 3.941 -0.054 1
1 1419 . 21 1 1 A 122 122 PHE C C 121 175.410 176.980 -1.570 1
1 1420 . 21 1 1 A 122 122 PHE CA C 121 61.075 60.764 0.311 1
1 1421 . 21 1 1 A 122 122 PHE CB C 121 38.115 38.788 -0.673 1
1 1424 . 21 1 1 A 122 122 PHE N N 121 121.798 120.163 1.635 1
1 1425 . 21 1 1 A 123 123 LYS H H 122 8.468 7.906 0.562 1
1 1426 . 21 1 1 A 123 123 LYS HA H 122 3.077 3.801 -0.724 1
1 1435 . 21 1 1 A 123 123 LYS C C 122 178.453 178.815 -0.362 1
1 1436 . 21 1 1 A 123 123 LYS CA C 122 59.855 59.897 -0.042 1
1 1437 . 21 1 1 A 123 123 LYS CB C 122 32.374 32.052 0.322 1
1 1441 . 21 1 1 A 123 123 LYS N N 122 120.614 118.502 2.112 1
1 1442 . 21 1 1 A 124 124 GLU H H 123 8.100 7.794 0.306 1
1 1443 . 21 1 1 A 124 124 GLU HA H 123 3.652 4.039 -0.387 1
1 1448 . 21 1 1 A 124 124 GLU C C 123 177.743 178.662 -0.919 1
1 1449 . 21 1 1 A 124 124 GLU CA C 123 59.406 59.491 -0.085 1
1 1450 . 21 1 1 A 124 124 GLU CB C 123 28.811 29.236 -0.425 1
1 1452 . 21 1 1 A 124 124 GLU N N 123 117.404 118.984 -1.580 1
1 1453 . 21 1 1 A 125 125 MET H H 124 7.537 7.581 -0.044 1
1 1454 . 21 1 1 A 125 125 MET HA H 124 3.860 3.957 -0.097 1
1 1462 . 21 1 1 A 125 125 MET C C 124 179.522 178.318 1.204 1
1 1463 . 21 1 1 A 125 125 MET CA C 124 58.832 58.260 0.572 1
1 1464 . 21 1 1 A 125 125 MET CB C 124 31.765 31.533 0.232 1
1 1467 . 21 1 1 A 125 125 MET N N 124 119.413 119.159 0.254 1
1 1468 . 21 1 1 A 126 126 PHE H H 125 7.148 7.611 -0.463 1
1 1469 . 21 1 1 A 126 126 PHE HA H 125 3.633 4.177 -0.544 1
1 1476 . 21 1 1 A 126 126 PHE C C 125 178.994 178.104 0.890 1
1 1477 . 21 1 1 A 126 126 PHE CA C 125 63.148 61.083 2.065 1
1 1478 . 21 1 1 A 126 126 PHE CB C 125 39.830 38.507 1.323 1
1 1483 . 21 1 1 A 126 126 PHE N N 125 120.013 118.425 1.588 1
1 1484 . 21 1 1 A 127 127 LEU H H 126 8.369 8.540 -0.171 1
1 1485 . 21 1 1 A 127 127 LEU HA H 126 3.972 3.996 -0.024 1
1 1495 . 21 1 1 A 127 127 LEU C C 126 180.621 178.988 1.633 1
1 1496 . 21 1 1 A 127 127 LEU CA C 126 57.944 57.958 -0.014 1
1 1497 . 21 1 1 A 127 127 LEU CB C 126 40.543 41.325 -0.782 1
1 1501 . 21 1 1 A 127 127 LEU N N 126 119.692 119.800 -0.108 1
1 1502 . 21 1 1 A 128 128 ASP H H 127 8.578 8.017 0.561 1
1 1503 . 21 1 1 A 128 128 ASP HA H 127 4.308 4.329 -0.021 1
1 1506 . 21 1 1 A 128 128 ASP C C 127 178.254 178.153 0.101 1
1 1507 . 21 1 1 A 128 128 ASP CA C 127 56.964 57.246 -0.282 1
1 1508 . 21 1 1 A 128 128 ASP CB C 127 39.735 40.937 -1.202 1
1 1509 . 21 1 1 A 128 128 ASP N N 127 121.926 119.484 2.442 1
1 1510 . 21 1 1 A 129 129 TYR H H 128 7.710 8.091 -0.381 1
1 1511 . 21 1 1 A 129 129 TYR HA H 128 3.908 4.140 -0.232 1
1 1518 . 21 1 1 A 129 129 TYR C C 128 177.633 177.755 -0.122 1
1 1519 . 21 1 1 A 129 129 TYR CA C 128 61.796 61.399 0.397 1
1 1520 . 21 1 1 A 129 129 TYR CB C 128 39.372 38.544 0.828 1
1 1525 . 21 1 1 A 129 129 TYR N N 128 122.548 120.458 2.090 1
1 1526 . 21 1 1 A 130 130 ARG H H 129 8.622 8.380 0.242 1
1 1527 . 21 1 1 A 130 130 ARG HA H 129 3.722 4.114 -0.392 1
1 1535 . 21 1 1 A 130 130 ARG CA C 129 60.084 59.633 0.451 1
1 1536 . 21 1 1 A 130 130 ARG CB C 129 29.902 29.893 0.009 1
1 1539 . 21 1 1 A 130 130 ARG N N 129 118.302 119.304 -1.002 1
1 1541 . 21 1 1 A 131 131 ALA H H 130 7.936 7.925 0.011 1
1 1542 . 21 1 1 A 131 131 ALA HA H 130 3.997 4.004 -0.007 1
1 1546 . 21 1 1 A 131 131 ALA C C 130 180.456 180.133 0.323 1
1 1547 . 21 1 1 A 131 131 ALA CA C 130 55.133 54.965 0.168 1
1 1548 . 21 1 1 A 131 131 ALA CB C 130 17.750 18.099 -0.349 1
1 1549 . 21 1 1 A 131 131 ALA N N 130 119.788 122.016 -2.228 1
1 1550 . 21 1 1 A 132 132 GLU H H 131 7.622 7.734 -0.112 1
1 1551 . 21 1 1 A 132 132 GLU HA H 131 3.862 3.968 -0.106 1
1 1556 . 21 1 1 A 132 132 GLU C C 131 179.528 178.331 1.197 1
1 1557 . 21 1 1 A 132 132 GLU CA C 131 58.849 58.995 -0.146 1
1 1558 . 21 1 1 A 132 132 GLU CB C 131 28.930 29.096 -0.166 1
1 1560 . 21 1 1 A 132 132 GLU N N 131 118.428 118.293 0.135 1
1 1561 . 21 1 1 A 133 133 LYS H H 132 7.853 7.647 0.206 1
1 1562 . 21 1 1 A 133 133 LYS HA H 132 3.722 4.056 -0.334 1
1 1571 . 21 1 1 A 133 133 LYS C C 132 175.725 177.419 -1.694 1
1 1572 . 21 1 1 A 133 133 LYS CA C 132 57.544 58.469 -0.925 1
1 1573 . 21 1 1 A 133 133 LYS CB C 132 31.770 32.028 -0.258 1
1 1577 . 21 1 1 A 133 133 LYS N N 132 119.473 118.462 1.011 1
1 1578 . 21 1 1 A 134 134 GLU H H 133 8.151 7.895 0.256 1
1 1579 . 21 1 1 A 134 134 GLU HA H 133 4.161 4.502 -0.341 1
1 1584 . 21 1 1 A 134 134 GLU C C 133 177.453 177.522 -0.069 1
1 1585 . 21 1 1 A 134 134 GLU CA C 133 57.222 56.459 0.763 1
1 1586 . 21 1 1 A 134 134 GLU CB C 133 30.091 30.547 -0.456 1
1 1588 . 21 1 1 A 134 134 GLU N N 133 116.525 117.561 -1.036 1
1 1589 . 21 1 1 A 135 135 GLY H H 134 7.702 7.715 -0.013 1
1 1590 . 21 1 1 A 135 135 GLY HA2 H 134 3.896 3.948 -0.052 1
1 1591 . 21 1 1 A 135 135 GLY HA3 H 134 3.897 3.957 -0.060 1
1 1592 . 21 1 1 A 135 135 GLY C C 134 174.538 174.347 0.191 1
1 1593 . 21 1 1 A 135 135 GLY CA C 134 45.975 46.044 -0.069 1
1 1594 . 21 1 1 A 135 135 GLY N N 134 107.924 108.563 -0.639 1
1 1595 . 21 1 1 A 136 136 ARG H H 135 8.045 7.569 0.476 1
1 1596 . 21 1 1 A 136 136 ARG HA H 135 4.323 4.709 -0.386 1
1 1604 . 21 1 1 A 136 136 ARG C C 135 175.864 175.628 0.236 1
1 1605 . 21 1 1 A 136 136 ARG CA C 135 56.016 55.639 0.377 1
1 1606 . 21 1 1 A 136 136 ARG CB C 135 30.987 32.960 -1.973 1
1 1609 . 21 1 1 A 136 136 ARG N N 135 119.708 119.262 0.446 1
1 1 . 22 1 1 A 14 14 PHE CA C 13 58.199 58.924 -0.725 1
1 2 . 22 1 1 A 14 14 PHE CB C 13 39.717 38.427 1.290 1
1 3 . 22 1 1 A 15 15 SER H H 14 8.299 7.778 0.521 1
1 4 . 22 1 1 A 15 15 SER HA H 14 4.359 4.737 -0.378 1
1 7 . 22 1 1 A 15 15 SER CA C 14 58.249 56.250 1.999 1
1 8 . 22 1 1 A 15 15 SER CB C 14 63.936 64.837 -0.901 1
1 9 . 22 1 1 A 15 15 SER N N 14 117.379 115.601 1.778 1
1 10 . 22 1 1 A 16 16 SER H H 15 8.255 8.761 -0.506 1
1 11 . 22 1 1 A 16 16 SER HA H 15 3.729 4.356 -0.627 1
1 14 . 22 1 1 A 16 16 SER CA C 15 58.224 60.443 -2.219 1
1 15 . 22 1 1 A 16 16 SER CB C 15 63.886 63.601 0.285 1
1 16 . 22 1 1 A 16 16 SER N N 15 117.694 121.846 -4.152 1
1 17 . 22 1 1 A 17 17 ALA H H 16 8.333 7.985 0.348 1
1 18 . 22 1 1 A 17 17 ALA HA H 16 4.252 4.277 -0.025 1
1 22 . 22 1 1 A 17 17 ALA CA C 16 53.377 53.371 0.006 1
1 23 . 22 1 1 A 17 17 ALA CB C 16 18.896 18.364 0.532 1
1 24 . 22 1 1 A 17 17 ALA N N 16 125.462 124.633 0.829 1
1 25 . 22 1 1 A 18 18 SER H H 17 8.219 8.089 0.130 1
1 26 . 22 1 1 A 18 18 SER HA H 17 4.332 4.146 0.186 1
1 29 . 22 1 1 A 18 18 SER CA C 17 59.105 61.988 -2.883 1
1 30 . 22 1 1 A 18 18 SER CB C 17 63.592 63.528 0.064 1
1 31 . 22 1 1 A 18 18 SER N N 17 114.821 114.659 0.162 1
1 32 . 22 1 1 A 19 19 ASP H H 18 8.309 7.950 0.359 1
1 33 . 22 1 1 A 19 19 ASP HA H 18 4.554 4.956 -0.402 1
1 36 . 22 1 1 A 19 19 ASP C C 18 176.528 176.965 -0.437 1
1 37 . 22 1 1 A 19 19 ASP CA C 18 55.272 55.640 -0.368 1
1 38 . 22 1 1 A 19 19 ASP CB C 18 40.883 43.094 -2.211 1
1 39 . 22 1 1 A 19 19 ASP N N 18 123.367 119.420 3.947 1
1 40 . 22 1 1 A 20 20 ALA H H 19 8.133 8.408 -0.275 1
1 41 . 22 1 1 A 20 20 ALA HA H 19 4.170 4.079 0.091 1
1 45 . 22 1 1 A 20 20 ALA C C 19 179.857 178.897 0.960 1
1 46 . 22 1 1 A 20 20 ALA CA C 19 54.341 55.498 -1.157 1
1 47 . 22 1 1 A 20 20 ALA CB C 19 18.660 18.331 0.329 1
1 48 . 22 1 1 A 20 20 ALA N N 19 123.350 122.607 0.743 1
1 49 . 22 1 1 A 21 21 GLU H H 20 8.140 8.072 0.068 1
1 50 . 22 1 1 A 21 21 GLU HA H 20 4.128 4.084 0.044 1
1 55 . 22 1 1 A 21 21 GLU C C 20 177.675 178.611 -0.936 1
1 56 . 22 1 1 A 21 21 GLU CA C 20 58.520 59.497 -0.977 1
1 57 . 22 1 1 A 21 21 GLU CB C 20 29.765 29.519 0.246 1
1 59 . 22 1 1 A 21 21 GLU N N 20 119.063 118.771 0.292 1
1 60 . 22 1 1 A 22 22 PHE H H 21 8.009 7.932 0.077 1
1 61 . 22 1 1 A 22 22 PHE HA H 21 4.123 4.380 -0.257 1
1 68 . 22 1 1 A 22 22 PHE C C 21 176.410 177.365 -0.955 1
1 69 . 22 1 1 A 22 22 PHE CA C 21 62.202 61.419 0.783 1
1 70 . 22 1 1 A 22 22 PHE CB C 21 39.223 39.367 -0.144 1
1 75 . 22 1 1 A 22 22 PHE N N 21 121.211 120.988 0.223 1
1 76 . 22 1 1 A 23 23 ASP H H 22 8.261 8.506 -0.245 1
1 77 . 22 1 1 A 23 23 ASP HA H 22 4.041 4.354 -0.313 1
1 80 . 22 1 1 A 23 23 ASP C C 22 179.078 178.126 0.952 1
1 81 . 22 1 1 A 23 23 ASP CA C 22 57.048 57.877 -0.829 1
1 82 . 22 1 1 A 23 23 ASP CB C 22 40.154 42.147 -1.993 1
1 83 . 22 1 1 A 23 23 ASP N N 22 116.876 119.426 -2.550 1
1 84 . 22 1 1 A 24 24 ALA H H 23 7.651 7.573 0.078 1
1 85 . 22 1 1 A 24 24 ALA HA H 23 3.785 3.858 -0.073 1
1 89 . 22 1 1 A 24 24 ALA C C 23 179.577 179.490 0.087 1
1 90 . 22 1 1 A 24 24 ALA CA C 23 54.341 54.968 -0.627 1
1 91 . 22 1 1 A 24 24 ALA CB C 23 17.762 18.337 -0.575 1
1 92 . 22 1 1 A 24 24 ALA N N 23 121.873 121.293 0.580 1
1 93 . 22 1 1 A 25 25 VAL H H 24 7.718 7.816 -0.098 1
1 94 . 22 1 1 A 25 25 VAL HA H 24 3.216 3.527 -0.311 1
1 102 . 22 1 1 A 25 25 VAL C C 24 177.805 178.270 -0.465 1
1 103 . 22 1 1 A 25 25 VAL CA C 24 66.789 66.788 0.001 1
1 104 . 22 1 1 A 25 25 VAL CB C 24 31.277 31.246 0.031 1
1 107 . 22 1 1 A 25 25 VAL N N 24 117.890 118.093 -0.203 1
1 108 . 22 1 1 A 26 26 VAL H H 25 7.867 7.709 0.158 1
1 109 . 22 1 1 A 26 26 VAL HA H 25 3.274 3.474 -0.200 1
1 117 . 22 1 1 A 26 26 VAL C C 25 177.788 177.747 0.041 1
1 118 . 22 1 1 A 26 26 VAL CA C 25 67.282 66.286 0.996 1
1 119 . 22 1 1 A 26 26 VAL CB C 25 31.266 31.332 -0.066 1
1 122 . 22 1 1 A 26 26 VAL N N 25 118.170 119.903 -1.733 1
1 123 . 22 1 1 A 27 27 GLY H H 26 7.544 7.585 -0.041 1
1 124 . 22 1 1 A 27 27 GLY HA2 H 26 3.592 3.465 0.127 1
1 125 . 22 1 1 A 27 27 GLY HA3 H 26 3.721 3.599 0.122 1
1 126 . 22 1 1 A 27 27 GLY C C 26 176.717 176.421 0.296 1
1 127 . 22 1 1 A 27 27 GLY CA C 26 47.085 47.138 -0.053 1
1 128 . 22 1 1 A 27 27 GLY N N 26 105.795 107.634 -1.839 1
1 129 . 22 1 1 A 28 28 TYR H H 27 7.625 7.254 0.371 1
1 130 . 22 1 1 A 28 28 TYR HA H 27 4.546 4.564 -0.018 1
1 137 . 22 1 1 A 28 28 TYR C C 27 178.991 178.093 0.898 1
1 138 . 22 1 1 A 28 28 TYR CA C 27 58.845 59.681 -0.836 1
1 139 . 22 1 1 A 28 28 TYR CB C 27 37.602 37.505 0.097 1
1 144 . 22 1 1 A 28 28 TYR N N 27 119.933 121.752 -1.819 1
1 145 . 22 1 1 A 29 29 LEU H H 28 8.517 8.363 0.154 1
1 146 . 22 1 1 A 29 29 LEU HA H 28 3.728 3.835 -0.107 1
1 156 . 22 1 1 A 29 29 LEU CA C 28 58.281 58.120 0.161 1
1 157 . 22 1 1 A 29 29 LEU CB C 28 41.948 41.520 0.428 1
1 161 . 22 1 1 A 29 29 LEU N N 28 119.669 120.256 -0.587 1
1 162 . 22 1 1 A 30 30 GLU H H 29 8.072 7.924 0.148 1
1 163 . 22 1 1 A 30 30 GLU HA H 29 3.722 3.832 -0.110 1
1 168 . 22 1 1 A 30 30 GLU C C 29 177.731 178.883 -1.152 1
1 169 . 22 1 1 A 30 30 GLU CA C 29 59.763 59.941 -0.178 1
1 170 . 22 1 1 A 30 30 GLU CB C 29 28.844 29.191 -0.347 1
1 172 . 22 1 1 A 30 30 GLU N N 29 117.666 117.491 0.175 1
1 173 . 22 1 1 A 31 31 ASP H H 30 7.243 7.923 -0.680 1
1 174 . 22 1 1 A 31 31 ASP HA H 30 4.297 4.387 -0.090 1
1 177 . 22 1 1 A 31 31 ASP CA C 30 56.953 57.379 -0.426 1
1 178 . 22 1 1 A 31 31 ASP CB C 30 40.730 41.661 -0.931 1
1 179 . 22 1 1 A 31 31 ASP N N 30 116.720 119.008 -2.288 1
1 180 . 22 1 1 A 32 32 ILE H H 31 7.940 7.530 0.410 1
1 181 . 22 1 1 A 32 32 ILE HA H 31 3.640 3.720 -0.080 1
1 191 . 22 1 1 A 32 32 ILE C C 31 177.980 178.123 -0.143 1
1 192 . 22 1 1 A 32 32 ILE CA C 31 64.692 64.351 0.341 1
1 193 . 22 1 1 A 32 32 ILE CB C 31 38.938 37.200 1.738 1
1 197 . 22 1 1 A 32 32 ILE N N 31 119.728 119.020 0.708 1
1 198 . 22 1 1 A 33 33 ILE H H 32 7.984 7.809 0.175 1
1 199 . 22 1 1 A 33 33 ILE HA H 32 3.598 2.679 0.919 1
1 209 . 22 1 1 A 33 33 ILE C C 32 176.723 176.847 -0.124 1
1 210 . 22 1 1 A 33 33 ILE CA C 32 63.241 64.384 -1.143 1
1 211 . 22 1 1 A 33 33 ILE CB C 32 37.580 37.408 0.172 1
1 215 . 22 1 1 A 33 33 ILE N N 32 113.919 120.619 -6.700 1
1 216 . 22 1 1 A 34 34 MET H H 33 7.288 7.731 -0.443 1
1 217 . 22 1 1 A 34 34 MET HA H 33 4.496 4.645 -0.149 1
1 225 . 22 1 1 A 34 34 MET C C 33 176.423 175.717 0.706 1
1 226 . 22 1 1 A 34 34 MET CA C 33 54.634 54.320 0.314 1
1 227 . 22 1 1 A 34 34 MET CB C 33 31.934 31.591 0.343 1
1 230 . 22 1 1 A 34 34 MET N N 33 115.130 116.833 -1.703 1
1 231 . 22 1 1 A 35 35 ASP H H 34 7.405 7.436 -0.031 1
1 232 . 22 1 1 A 35 35 ASP HA H 34 4.484 4.504 -0.020 1
1 235 . 22 1 1 A 35 35 ASP C C 34 177.139 177.046 0.093 1
1 236 . 22 1 1 A 35 35 ASP CA C 34 54.625 54.747 -0.122 1
1 237 . 22 1 1 A 35 35 ASP CB C 34 43.554 43.171 0.383 1
1 238 . 22 1 1 A 35 35 ASP N N 34 121.814 121.852 -0.038 1
1 239 . 22 1 1 A 36 36 ASP H H 35 8.765 9.066 -0.301 1
1 240 . 22 1 1 A 36 36 ASP HA H 35 4.235 4.336 -0.101 1
1 243 . 22 1 1 A 36 36 ASP C C 35 178.320 178.596 -0.276 1
1 244 . 22 1 1 A 36 36 ASP CA C 35 57.832 57.023 0.809 1
1 245 . 22 1 1 A 36 36 ASP CB C 35 40.914 39.882 1.032 1
1 246 . 22 1 1 A 36 36 ASP N N 35 125.883 125.586 0.297 1
1 247 . 22 1 1 A 37 37 GLU H H 36 8.905 8.228 0.677 1
1 248 . 22 1 1 A 37 37 GLU HA H 36 3.933 4.118 -0.185 1
1 253 . 22 1 1 A 37 37 GLU C C 36 179.304 179.052 0.252 1
1 254 . 22 1 1 A 37 37 GLU CA C 36 59.828 58.923 0.905 1
1 255 . 22 1 1 A 37 37 GLU CB C 36 29.380 29.682 -0.302 1
1 257 . 22 1 1 A 37 37 GLU N N 36 119.077 120.457 -1.380 1
1 258 . 22 1 1 A 38 38 PHE H H 37 7.460 8.257 -0.797 1
1 259 . 22 1 1 A 38 38 PHE HA H 37 3.642 3.947 -0.305 1
1 267 . 22 1 1 A 38 38 PHE C C 37 176.483 177.974 -1.491 1
1 268 . 22 1 1 A 38 38 PHE CA C 37 61.411 61.101 0.310 1
1 269 . 22 1 1 A 38 38 PHE CB C 37 39.355 39.136 0.219 1
1 275 . 22 1 1 A 38 38 PHE N N 37 119.968 122.823 -2.855 1
1 276 . 22 1 1 A 39 39 GLN H H 38 7.968 8.130 -0.162 1
1 277 . 22 1 1 A 39 39 GLN HA H 38 3.712 3.849 -0.137 1
1 284 . 22 1 1 A 39 39 GLN CA C 38 59.153 58.828 0.325 1
1 285 . 22 1 1 A 39 39 GLN CB C 38 28.213 28.134 0.079 1
1 287 . 22 1 1 A 39 39 GLN N N 38 116.433 118.287 -1.854 1
1 289 . 22 1 1 A 40 40 LEU H H 39 7.930 7.669 0.261 1
1 290 . 22 1 1 A 40 40 LEU HA H 39 3.916 4.022 -0.106 1
1 300 . 22 1 1 A 40 40 LEU C C 39 177.731 178.399 -0.668 1
1 301 . 22 1 1 A 40 40 LEU CA C 39 57.915 58.000 -0.085 1
1 302 . 22 1 1 A 40 40 LEU CB C 39 41.989 41.785 0.204 1
1 306 . 22 1 1 A 40 40 LEU N N 39 119.505 121.471 -1.966 1
1 307 . 22 1 1 A 41 41 LEU H H 40 7.174 7.994 -0.820 1
1 308 . 22 1 1 A 41 41 LEU HA H 40 3.835 3.983 -0.148 1
1 318 . 22 1 1 A 41 41 LEU C C 40 179.738 178.392 1.346 1
1 319 . 22 1 1 A 41 41 LEU CA C 40 58.266 57.781 0.485 1
1 320 . 22 1 1 A 41 41 LEU CB C 40 42.050 40.757 1.293 1
1 324 . 22 1 1 A 41 41 LEU N N 40 120.971 119.591 1.380 1
1 325 . 22 1 1 A 42 42 GLN H H 41 8.058 8.024 0.034 1
1 326 . 22 1 1 A 42 42 GLN HA H 41 3.556 3.742 -0.186 1
1 333 . 22 1 1 A 42 42 GLN C C 41 177.642 178.889 -1.247 1
1 334 . 22 1 1 A 42 42 GLN CA C 41 59.826 59.055 0.771 1
1 335 . 22 1 1 A 42 42 GLN CB C 41 28.762 28.127 0.635 1
1 337 . 22 1 1 A 42 42 GLN N N 41 117.899 118.110 -0.211 1
1 339 . 22 1 1 A 43 43 ARG H H 42 8.179 7.718 0.461 1
1 340 . 22 1 1 A 43 43 ARG HA H 42 3.655 4.041 -0.386 1
1 347 . 22 1 1 A 43 43 ARG C C 42 178.051 178.751 -0.700 1
1 348 . 22 1 1 A 43 43 ARG CA C 42 59.766 59.083 0.683 1
1 349 . 22 1 1 A 43 43 ARG CB C 42 29.941 29.729 0.212 1
1 352 . 22 1 1 A 43 43 ARG N N 42 119.392 119.241 0.151 1
1 353 . 22 1 1 A 44 44 ASN H H 43 8.525 8.029 0.496 1
1 354 . 22 1 1 A 44 44 ASN HA H 43 4.332 4.498 -0.166 1
1 359 . 22 1 1 A 44 44 ASN C C 43 178.150 177.695 0.455 1
1 360 . 22 1 1 A 44 44 ASN CA C 43 55.841 56.281 -0.440 1
1 361 . 22 1 1 A 44 44 ASN CB C 43 37.632 38.335 -0.703 1
1 362 . 22 1 1 A 44 44 ASN N N 43 116.214 118.069 -1.855 1
1 364 . 22 1 1 A 45 45 PHE H H 44 7.586 8.138 -0.552 1
1 365 . 22 1 1 A 45 45 PHE HA H 44 4.132 4.167 -0.035 1
1 372 . 22 1 1 A 45 45 PHE C C 44 176.691 177.300 -0.609 1
1 373 . 22 1 1 A 45 45 PHE CA C 44 62.333 61.151 1.182 1
1 374 . 22 1 1 A 45 45 PHE CB C 44 39.449 38.806 0.643 1
1 379 . 22 1 1 A 45 45 PHE N N 44 121.501 121.708 -0.207 1
1 380 . 22 1 1 A 46 46 MET H H 45 8.190 8.316 -0.126 1
1 381 . 22 1 1 A 46 46 MET HA H 45 4.060 3.680 0.380 1
1 389 . 22 1 1 A 46 46 MET C C 45 179.754 177.956 1.798 1
1 390 . 22 1 1 A 46 46 MET CA C 45 57.742 57.492 0.250 1
1 391 . 22 1 1 A 46 46 MET CB C 45 29.912 30.683 -0.771 1
1 394 . 22 1 1 A 46 46 MET N N 45 116.727 117.074 -0.347 1
1 395 . 22 1 1 A 47 47 ASP H H 46 8.579 8.108 0.471 1
1 396 . 22 1 1 A 47 47 ASP HA H 46 4.804 4.595 0.209 1
1 399 . 22 1 1 A 47 47 ASP C C 46 177.854 177.784 0.070 1
1 400 . 22 1 1 A 47 47 ASP CA C 46 57.277 57.221 0.056 1
1 401 . 22 1 1 A 47 47 ASP CB C 46 40.776 41.764 -0.988 1
1 402 . 22 1 1 A 47 47 ASP N N 46 117.798 120.755 -2.957 1
1 403 . 22 1 1 A 48 48 LYS H H 47 7.339 7.528 -0.189 1
1 404 . 22 1 1 A 48 48 LYS HA H 47 3.828 4.291 -0.463 1
1 413 . 22 1 1 A 48 48 LYS C C 47 178.812 178.655 0.157 1
1 414 . 22 1 1 A 48 48 LYS CA C 47 58.953 58.141 0.812 1
1 415 . 22 1 1 A 48 48 LYS CB C 47 32.796 33.539 -0.743 1
1 419 . 22 1 1 A 48 48 LYS N N 47 117.852 118.588 -0.736 1
1 420 . 22 1 1 A 49 49 TYR H H 48 6.841 8.243 -1.402 1
1 421 . 22 1 1 A 49 49 TYR HA H 48 4.995 4.163 0.832 1
1 428 . 22 1 1 A 49 49 TYR C C 48 178.138 178.765 -0.627 1
1 429 . 22 1 1 A 49 49 TYR CA C 48 58.620 59.694 -1.074 1
1 430 . 22 1 1 A 49 49 TYR CB C 48 42.939 37.676 5.263 1
1 435 . 22 1 1 A 49 49 TYR N N 48 112.109 119.508 -7.399 1
1 436 . 22 1 1 A 50 50 TYR H H 49 8.491 7.944 0.547 1
1 437 . 22 1 1 A 50 50 TYR HA H 49 4.598 4.344 0.254 1
1 444 . 22 1 1 A 50 50 TYR C C 49 176.015 177.739 -1.724 1
1 445 . 22 1 1 A 50 50 TYR CA C 49 62.442 59.717 2.725 1
1 446 . 22 1 1 A 50 50 TYR CB C 49 36.588 37.039 -0.451 1
1 451 . 22 1 1 A 50 50 TYR N N 49 118.294 119.924 -1.630 1
1 452 . 22 1 1 A 51 51 LEU H H 50 7.512 7.506 0.006 1
1 453 . 22 1 1 A 51 51 LEU HA H 50 3.878 3.490 0.388 1
1 463 . 22 1 1 A 51 51 LEU C C 50 178.625 178.695 -0.070 1
1 464 . 22 1 1 A 51 51 LEU CA C 50 55.994 57.335 -1.341 1
1 465 . 22 1 1 A 51 51 LEU CB C 50 40.743 41.490 -0.747 1
1 469 . 22 1 1 A 51 51 LEU N N 50 118.478 121.371 -2.893 1
1 470 . 22 1 1 A 52 52 GLU H H 51 8.042 7.832 0.210 1
1 471 . 22 1 1 A 52 52 GLU HA H 51 4.197 3.904 0.293 1
1 476 . 22 1 1 A 52 52 GLU C C 51 177.629 177.565 0.064 1
1 477 . 22 1 1 A 52 52 GLU CA C 51 56.141 59.457 -3.316 1
1 478 . 22 1 1 A 52 52 GLU CB C 51 29.162 29.030 0.132 1
1 480 . 22 1 1 A 52 52 GLU N N 51 115.067 117.310 -2.243 1
1 481 . 22 1 1 A 53 53 PHE H H 52 7.465 7.982 -0.517 1
1 482 . 22 1 1 A 53 53 PHE HA H 52 4.431 4.581 -0.150 1
1 490 . 22 1 1 A 53 53 PHE C C 52 174.325 174.590 -0.265 1
1 491 . 22 1 1 A 53 53 PHE CA C 52 58.986 56.919 2.067 1
1 492 . 22 1 1 A 53 53 PHE CB C 52 40.183 37.259 2.924 1
1 498 . 22 1 1 A 53 53 PHE N N 52 116.768 118.638 -1.870 1
1 499 . 22 1 1 A 54 54 GLU H H 53 7.484 7.846 -0.362 1
1 500 . 22 1 1 A 54 54 GLU HA H 53 4.583 4.827 -0.244 1
1 505 . 22 1 1 A 54 54 GLU C C 53 175.722 175.389 0.333 1
1 506 . 22 1 1 A 54 54 GLU CA C 53 54.248 55.240 -0.992 1
1 507 . 22 1 1 A 54 54 GLU CB C 53 34.409 31.218 3.191 1
1 509 . 22 1 1 A 54 54 GLU N N 53 118.844 122.140 -3.296 1
1 510 . 22 1 1 A 55 55 ASP H H 54 9.008 8.651 0.357 1
1 511 . 22 1 1 A 55 55 ASP HA H 54 4.735 4.851 -0.116 1
1 514 . 22 1 1 A 55 55 ASP C C 54 175.421 175.908 -0.487 1
1 515 . 22 1 1 A 55 55 ASP CA C 54 52.888 53.965 -1.077 1
1 516 . 22 1 1 A 55 55 ASP CB C 54 38.894 40.691 -1.797 1
1 517 . 22 1 1 A 55 55 ASP N N 54 123.654 123.460 0.194 1
1 518 . 22 1 1 A 56 56 THR H H 55 7.819 8.564 -0.745 1
1 519 . 22 1 1 A 56 56 THR HA H 55 4.574 4.998 -0.424 1
1 524 . 22 1 1 A 56 56 THR C C 55 174.096 173.732 0.364 1
1 525 . 22 1 1 A 56 56 THR CA C 55 59.172 59.466 -0.294 1
1 526 . 22 1 1 A 56 56 THR CB C 55 71.889 72.403 -0.514 1
1 528 . 22 1 1 A 56 56 THR N N 55 112.015 117.333 -5.318 1
1 529 . 22 1 1 A 57 57 GLU H H 56 8.527 8.759 -0.232 1
1 530 . 22 1 1 A 57 57 GLU HA H 56 4.217 4.697 -0.480 1
1 535 . 22 1 1 A 57 57 GLU C C 56 177.042 175.891 1.151 1
1 536 . 22 1 1 A 57 57 GLU CA C 56 56.869 56.098 0.771 1
1 537 . 22 1 1 A 57 57 GLU CB C 56 29.731 31.174 -1.443 1
1 539 . 22 1 1 A 57 57 GLU N N 56 117.531 118.619 -1.088 1
1 540 . 22 1 1 A 58 58 GLU H H 57 7.587 7.688 -0.101 1
1 541 . 22 1 1 A 58 58 GLU HA H 57 3.941 4.888 -0.947 1
1 546 . 22 1 1 A 58 58 GLU C C 57 176.849 175.817 1.032 1
1 547 . 22 1 1 A 58 58 GLU CA C 57 56.924 55.598 1.326 1
1 548 . 22 1 1 A 58 58 GLU CB C 57 30.251 32.154 -1.903 1
1 550 . 22 1 1 A 58 58 GLU N N 57 119.183 121.723 -2.540 1
1 551 . 22 1 1 A 59 59 ASN H H 58 9.120 8.796 0.324 1
1 552 . 22 1 1 A 59 59 ASN HA H 58 4.922 5.283 -0.361 1
1 557 . 22 1 1 A 59 59 ASN C C 58 174.254 174.910 -0.656 1
1 558 . 22 1 1 A 59 59 ASN CA C 58 51.956 52.484 -0.528 1
1 559 . 22 1 1 A 59 59 ASN CB C 58 37.404 39.700 -2.296 1
1 560 . 22 1 1 A 59 59 ASN N N 58 126.767 121.902 4.865 1
1 562 . 22 1 1 A 60 60 LYS H H 59 5.892 8.923 -3.031 1
1 563 . 22 1 1 A 60 60 LYS HA H 59 3.798 4.788 -0.990 1
1 572 . 22 1 1 A 60 60 LYS C C 59 177.908 176.913 0.995 1
1 573 . 22 1 1 A 60 60 LYS CA C 59 56.623 54.813 1.810 1
1 574 . 22 1 1 A 60 60 LYS CB C 59 32.279 35.203 -2.924 1
1 578 . 22 1 1 A 60 60 LYS N N 59 121.527 121.058 0.469 1
1 579 . 22 1 1 A 61 61 LEU H H 60 8.473 8.839 -0.366 1
1 580 . 22 1 1 A 61 61 LEU HA H 60 3.891 4.168 -0.277 1
1 590 . 22 1 1 A 61 61 LEU C C 60 179.843 178.943 0.900 1
1 591 . 22 1 1 A 61 61 LEU CA C 60 58.301 57.043 1.258 1
1 592 . 22 1 1 A 61 61 LEU CB C 60 41.305 41.698 -0.393 1
1 596 . 22 1 1 A 61 61 LEU N N 60 125.639 123.220 2.419 1
1 597 . 22 1 1 A 62 62 ILE H H 61 7.698 7.865 -0.167 1
1 598 . 22 1 1 A 62 62 ILE HA H 61 3.952 3.838 0.114 1
1 608 . 22 1 1 A 62 62 ILE C C 61 175.392 177.059 -1.667 1
1 609 . 22 1 1 A 62 62 ILE CA C 61 61.743 63.308 -1.565 1
1 610 . 22 1 1 A 62 62 ILE CB C 61 39.108 37.663 1.445 1
1 614 . 22 1 1 A 62 62 ILE N N 61 114.111 119.025 -4.914 1
1 615 . 22 1 1 A 63 63 TYR H H 62 7.273 7.645 -0.372 1
1 616 . 22 1 1 A 63 63 TYR HA H 62 4.343 4.238 0.105 1
1 623 . 22 1 1 A 63 63 TYR C C 62 178.264 178.512 -0.248 1
1 624 . 22 1 1 A 63 63 TYR CA C 62 57.231 61.153 -3.922 1
1 625 . 22 1 1 A 63 63 TYR CB C 62 36.332 37.521 -1.189 1
1 630 . 22 1 1 A 63 63 TYR N N 62 117.689 121.309 -3.620 1
1 631 . 22 1 1 A 64 64 THR H H 63 7.747 8.064 -0.317 1
1 632 . 22 1 1 A 64 64 THR HA H 63 4.266 4.224 0.042 1
1 637 . 22 1 1 A 64 64 THR CA C 63 69.362 67.579 1.783 1
1 638 . 22 1 1 A 64 64 THR CB C 63 66.962 67.414 -0.452 1
1 640 . 22 1 1 A 64 64 THR N N 63 113.755 116.236 -2.481 1
1 641 . 22 1 1 A 65 65 PRO HA H 64 4.372 4.397 -0.025 1
1 648 . 22 1 1 A 65 65 PRO C C 64 179.913 179.316 0.597 1
1 649 . 22 1 1 A 65 65 PRO CA C 64 66.011 65.932 0.079 1
1 650 . 22 1 1 A 65 65 PRO CB C 64 30.642 30.646 -0.004 1
1 653 . 22 1 1 A 66 66 ILE H H 65 7.377 7.193 0.184 1
1 654 . 22 1 1 A 66 66 ILE HA H 65 3.530 3.853 -0.323 1
1 664 . 22 1 1 A 66 66 ILE C C 65 177.543 178.414 -0.871 1
1 665 . 22 1 1 A 66 66 ILE CA C 65 66.647 64.147 2.500 1
1 666 . 22 1 1 A 66 66 ILE CB C 65 38.029 37.540 0.489 1
1 670 . 22 1 1 A 66 66 ILE N N 65 118.353 116.770 1.583 1
1 671 . 22 1 1 A 67 67 PHE H H 66 8.480 8.491 -0.011 1
1 672 . 22 1 1 A 67 67 PHE HA H 66 4.115 4.408 -0.293 1
1 680 . 22 1 1 A 67 67 PHE C C 66 177.293 178.162 -0.869 1
1 681 . 22 1 1 A 67 67 PHE CA C 66 59.570 62.021 -2.451 1
1 682 . 22 1 1 A 67 67 PHE CB C 66 38.865 39.496 -0.631 1
1 688 . 22 1 1 A 67 67 PHE N N 66 122.420 120.974 1.446 1
1 689 . 22 1 1 A 68 68 ASN H H 67 8.595 8.267 0.328 1
1 690 . 22 1 1 A 68 68 ASN HA H 67 4.211 4.413 -0.202 1
1 695 . 22 1 1 A 68 68 ASN C C 67 178.697 178.253 0.444 1
1 696 . 22 1 1 A 68 68 ASN CA C 67 56.056 56.192 -0.136 1
1 697 . 22 1 1 A 68 68 ASN CB C 67 37.704 38.079 -0.375 1
1 698 . 22 1 1 A 68 68 ASN N N 67 115.573 117.590 -2.017 1
1 700 . 22 1 1 A 69 69 GLU H H 68 8.414 7.993 0.421 1
1 701 . 22 1 1 A 69 69 GLU HA H 68 4.102 4.421 -0.319 1
1 706 . 22 1 1 A 69 69 GLU C C 68 177.880 178.976 -1.096 1
1 707 . 22 1 1 A 69 69 GLU CA C 68 59.399 59.396 0.003 1
1 708 . 22 1 1 A 69 69 GLU CB C 68 29.855 29.378 0.477 1
1 710 . 22 1 1 A 69 69 GLU N N 68 123.510 119.977 3.533 1
1 711 . 22 1 1 A 70 70 TYR H H 69 8.659 8.082 0.577 1
1 712 . 22 1 1 A 70 70 TYR HA H 69 3.362 4.233 -0.871 1
1 719 . 22 1 1 A 70 70 TYR C C 69 178.143 176.877 1.266 1
1 720 . 22 1 1 A 70 70 TYR CA C 69 60.686 61.626 -0.940 1
1 721 . 22 1 1 A 70 70 TYR CB C 69 38.560 39.042 -0.482 1
1 726 . 22 1 1 A 70 70 TYR N N 69 122.130 121.271 0.859 1
1 727 . 22 1 1 A 71 71 ILE H H 70 8.031 7.726 0.305 1
1 728 . 22 1 1 A 71 71 ILE HA H 70 3.265 3.567 -0.302 1
1 738 . 22 1 1 A 71 71 ILE C C 70 178.056 177.972 0.084 1
1 739 . 22 1 1 A 71 71 ILE CA C 70 63.756 63.905 -0.149 1
1 740 . 22 1 1 A 71 71 ILE CB C 70 37.321 36.504 0.817 1
1 744 . 22 1 1 A 71 71 ILE N N 70 118.906 120.381 -1.475 1
1 745 . 22 1 1 A 72 72 SER H H 71 7.803 7.800 0.003 1
1 746 . 22 1 1 A 72 72 SER HA H 71 4.029 4.252 -0.223 1
1 749 . 22 1 1 A 72 72 SER CA C 71 61.380 61.225 0.155 1
1 750 . 22 1 1 A 72 72 SER CB C 71 63.288 62.999 0.289 1
1 751 . 22 1 1 A 72 72 SER N N 71 113.735 114.958 -1.223 1
1 752 . 22 1 1 A 73 73 LEU H H 72 7.952 8.123 -0.171 1
1 753 . 22 1 1 A 73 73 LEU HA H 72 4.418 4.227 0.191 1
1 763 . 22 1 1 A 73 73 LEU C C 72 177.767 178.406 -0.639 1
1 764 . 22 1 1 A 73 73 LEU CA C 72 56.543 57.566 -1.023 1
1 765 . 22 1 1 A 73 73 LEU CB C 72 44.517 42.007 2.510 1
1 769 . 22 1 1 A 73 73 LEU N N 72 119.411 123.552 -4.141 1
1 770 . 22 1 1 A 74 74 VAL H H 73 8.021 7.697 0.324 1
1 771 . 22 1 1 A 74 74 VAL HA H 73 3.532 3.331 0.201 1
1 779 . 22 1 1 A 74 74 VAL C C 73 177.126 177.877 -0.751 1
1 780 . 22 1 1 A 74 74 VAL CA C 73 66.250 66.426 -0.176 1
1 781 . 22 1 1 A 74 74 VAL CB C 73 31.212 31.186 0.026 1
1 784 . 22 1 1 A 74 74 VAL N N 73 118.747 119.297 -0.550 1
1 785 . 22 1 1 A 75 75 GLU H H 74 7.232 7.829 -0.597 1
1 786 . 22 1 1 A 75 75 GLU HA H 74 3.013 4.052 -1.039 1
1 791 . 22 1 1 A 75 75 GLU C C 74 178.804 179.413 -0.609 1
1 792 . 22 1 1 A 75 75 GLU CA C 74 60.536 59.873 0.663 1
1 793 . 22 1 1 A 75 75 GLU CB C 74 27.009 28.995 -1.986 1
1 795 . 22 1 1 A 75 75 GLU N N 74 118.660 119.650 -0.990 1
1 796 . 22 1 1 A 76 76 LYS H H 75 7.051 7.432 -0.381 1
1 797 . 22 1 1 A 76 76 LYS HA H 75 3.765 4.074 -0.309 1
1 806 . 22 1 1 A 76 76 LYS C C 75 177.765 178.102 -0.337 1
1 807 . 22 1 1 A 76 76 LYS CA C 75 58.357 58.458 -0.101 1
1 808 . 22 1 1 A 76 76 LYS CB C 75 31.939 32.358 -0.419 1
1 812 . 22 1 1 A 76 76 LYS N N 75 116.112 119.129 -3.017 1
1 813 . 22 1 1 A 77 77 TYR H H 76 7.067 7.757 -0.690 1
1 814 . 22 1 1 A 77 77 TYR HA H 76 4.036 4.212 -0.176 1
1 821 . 22 1 1 A 77 77 TYR C C 76 177.752 177.223 0.529 1
1 822 . 22 1 1 A 77 77 TYR CA C 76 61.820 61.260 0.560 1
1 823 . 22 1 1 A 77 77 TYR CB C 76 38.480 38.616 -0.136 1
1 828 . 22 1 1 A 77 77 TYR N N 76 118.434 121.632 -3.198 1
1 829 . 22 1 1 A 78 78 ILE H H 77 7.554 8.333 -0.779 1
1 830 . 22 1 1 A 78 78 ILE HA H 77 3.159 3.693 -0.534 1
1 840 . 22 1 1 A 78 78 ILE C C 77 177.341 178.050 -0.709 1
1 841 . 22 1 1 A 78 78 ILE CA C 77 65.177 65.266 -0.089 1
1 842 . 22 1 1 A 78 78 ILE CB C 77 37.339 37.906 -0.567 1
1 846 . 22 1 1 A 78 78 ILE N N 77 117.672 121.387 -3.715 1
1 847 . 22 1 1 A 79 79 GLU H H 78 8.296 8.013 0.283 1
1 848 . 22 1 1 A 79 79 GLU HA H 78 3.557 3.842 -0.285 1
1 853 . 22 1 1 A 79 79 GLU C C 78 177.742 178.817 -1.075 1
1 854 . 22 1 1 A 79 79 GLU CA C 78 60.847 60.126 0.721 1
1 855 . 22 1 1 A 79 79 GLU CB C 78 29.594 29.228 0.366 1
1 857 . 22 1 1 A 79 79 GLU N N 78 118.701 120.611 -1.910 1
1 858 . 22 1 1 A 80 80 GLU H H 79 8.330 8.360 -0.030 1
1 859 . 22 1 1 A 80 80 GLU HA H 79 3.774 4.028 -0.254 1
1 864 . 22 1 1 A 80 80 GLU C C 79 179.926 179.188 0.738 1
1 865 . 22 1 1 A 80 80 GLU CA C 79 59.581 58.962 0.619 1
1 866 . 22 1 1 A 80 80 GLU CB C 79 29.062 28.969 0.093 1
1 868 . 22 1 1 A 80 80 GLU N N 79 116.767 118.059 -1.292 1
1 869 . 22 1 1 A 81 81 GLN H H 80 7.634 7.758 -0.124 1
1 870 . 22 1 1 A 81 81 GLN HA H 80 3.605 3.865 -0.260 1
1 877 . 22 1 1 A 81 81 GLN C C 80 179.681 178.943 0.738 1
1 878 . 22 1 1 A 81 81 GLN CA C 80 57.765 58.571 -0.806 1
1 879 . 22 1 1 A 81 81 GLN CB C 80 28.079 27.929 0.150 1
1 881 . 22 1 1 A 81 81 GLN N N 80 116.325 118.783 -2.458 1
1 883 . 22 1 1 A 82 82 LEU H H 81 8.156 7.660 0.496 1
1 884 . 22 1 1 A 82 82 LEU HA H 81 3.536 3.782 -0.246 1
1 894 . 22 1 1 A 82 82 LEU C C 81 178.945 179.355 -0.410 1
1 895 . 22 1 1 A 82 82 LEU CA C 81 57.761 57.372 0.389 1
1 896 . 22 1 1 A 82 82 LEU CB C 81 40.961 40.846 0.115 1
1 900 . 22 1 1 A 82 82 LEU N N 81 121.546 120.176 1.370 1
1 901 . 22 1 1 A 83 83 LEU H H 82 8.326 8.089 0.237 1
1 902 . 22 1 1 A 83 83 LEU HA H 82 4.198 4.232 -0.034 1
1 912 . 22 1 1 A 83 83 LEU C C 82 178.631 179.380 -0.749 1
1 913 . 22 1 1 A 83 83 LEU CA C 82 57.016 57.122 -0.106 1
1 914 . 22 1 1 A 83 83 LEU CB C 82 42.182 40.841 1.341 1
1 918 . 22 1 1 A 83 83 LEU N N 82 120.426 119.200 1.226 1
1 919 . 22 1 1 A 84 84 GLN H H 83 6.992 7.705 -0.713 1
1 920 . 22 1 1 A 84 84 GLN HA H 83 3.877 4.008 -0.131 1
1 927 . 22 1 1 A 84 84 GLN C C 83 177.008 176.527 0.481 1
1 928 . 22 1 1 A 84 84 GLN CA C 83 57.543 58.386 -0.843 1
1 929 . 22 1 1 A 84 84 GLN CB C 83 28.688 28.502 0.186 1
1 931 . 22 1 1 A 84 84 GLN N N 83 114.001 117.391 -3.390 1
1 933 . 22 1 1 A 85 85 ARG H H 84 7.072 7.688 -0.616 1
1 934 . 22 1 1 A 85 85 ARG HA H 84 4.047 4.444 -0.397 1
1 942 . 22 1 1 A 85 85 ARG C C 84 175.999 175.607 0.392 1
1 943 . 22 1 1 A 85 85 ARG CA C 84 56.764 56.704 0.060 1
1 944 . 22 1 1 A 85 85 ARG CB C 84 32.044 32.269 -0.225 1
1 947 . 22 1 1 A 85 85 ARG N N 84 115.827 118.862 -3.035 1
1 949 . 22 1 1 A 86 86 ILE H H 85 8.238 7.746 0.492 1
1 950 . 22 1 1 A 86 86 ILE HA H 85 4.389 4.534 -0.145 1
1 960 . 22 1 1 A 86 86 ILE CA C 85 58.007 57.843 0.164 1
1 961 . 22 1 1 A 86 86 ILE CB C 85 39.604 38.805 0.799 1
1 965 . 22 1 1 A 86 86 ILE N N 85 119.285 118.240 1.045 1
1 966 . 22 1 1 A 87 87 PRO HA H 86 4.392 4.525 -0.133 1
1 973 . 22 1 1 A 87 87 PRO C C 86 177.622 176.310 1.312 1
1 974 . 22 1 1 A 87 87 PRO CA C 86 64.665 64.273 0.392 1
1 975 . 22 1 1 A 87 87 PRO CB C 86 32.020 31.583 0.437 1
1 978 . 22 1 1 A 88 88 GLU H H 87 8.312 8.183 0.129 1
1 979 . 22 1 1 A 88 88 GLU HA H 87 4.208 4.566 -0.358 1
1 984 . 22 1 1 A 88 88 GLU C C 87 175.554 175.824 -0.270 1
1 985 . 22 1 1 A 88 88 GLU CA C 87 56.045 56.270 -0.225 1
1 986 . 22 1 1 A 88 88 GLU CB C 87 28.654 30.799 -2.145 1
1 988 . 22 1 1 A 88 88 GLU N N 87 114.256 116.760 -2.504 1
1 989 . 22 1 1 A 89 89 PHE H H 88 7.946 7.689 0.257 1
1 990 . 22 1 1 A 89 89 PHE HA H 88 3.993 4.555 -0.562 1
1 998 . 22 1 1 A 89 89 PHE C C 88 173.460 174.328 -0.868 1
1 999 . 22 1 1 A 89 89 PHE CA C 88 60.119 58.952 1.167 1
1 1000 . 22 1 1 A 89 89 PHE CB C 88 39.994 39.906 0.088 1
1 1006 . 22 1 1 A 89 89 PHE N N 88 121.550 123.057 -1.507 1
1 1007 . 22 1 1 A 90 90 ASN H H 89 7.266 7.801 -0.535 1
1 1008 . 22 1 1 A 90 90 ASN HA H 89 4.454 4.992 -0.538 1
1 1013 . 22 1 1 A 90 90 ASN C C 89 173.921 175.235 -1.314 1
1 1014 . 22 1 1 A 90 90 ASN CA C 89 51.839 51.372 0.467 1
1 1015 . 22 1 1 A 90 90 ASN CB C 89 40.674 39.364 1.310 1
1 1016 . 22 1 1 A 90 90 ASN N N 89 125.344 124.772 0.572 1
1 1018 . 22 1 1 A 91 91 MET H H 90 8.968 8.716 0.252 1
1 1019 . 22 1 1 A 91 91 MET HA H 90 4.049 4.230 -0.181 1
1 1027 . 22 1 1 A 91 91 MET C C 90 177.475 177.906 -0.431 1
1 1028 . 22 1 1 A 91 91 MET CA C 90 57.758 57.819 -0.061 1
1 1029 . 22 1 1 A 91 91 MET CB C 90 32.250 32.454 -0.204 1
1 1032 . 22 1 1 A 91 91 MET N N 90 127.052 125.222 1.830 1
1 1033 . 22 1 1 A 92 92 ALA H H 91 8.292 8.005 0.287 1
1 1034 . 22 1 1 A 92 92 ALA HA H 91 4.059 4.102 -0.043 1
1 1038 . 22 1 1 A 92 92 ALA C C 91 180.412 179.714 0.698 1
1 1039 . 22 1 1 A 92 92 ALA CA C 91 55.368 54.850 0.518 1
1 1040 . 22 1 1 A 92 92 ALA CB C 91 17.527 18.832 -1.305 1
1 1041 . 22 1 1 A 92 92 ALA N N 91 123.752 121.398 2.354 1
1 1042 . 22 1 1 A 93 93 ALA H H 92 7.931 8.020 -0.089 1
1 1043 . 22 1 1 A 93 93 ALA HA H 92 4.054 4.079 -0.025 1
1 1047 . 22 1 1 A 93 93 ALA C C 92 180.482 179.935 0.547 1
1 1048 . 22 1 1 A 93 93 ALA CA C 92 54.614 54.883 -0.269 1
1 1049 . 22 1 1 A 93 93 ALA CB C 92 18.098 18.129 -0.031 1
1 1050 . 22 1 1 A 93 93 ALA N N 92 121.158 120.131 1.027 1
1 1051 . 22 1 1 A 94 94 PHE H H 93 8.110 7.770 0.340 1
1 1052 . 22 1 1 A 94 94 PHE HA H 93 4.304 4.121 0.183 1
1 1060 . 22 1 1 A 94 94 PHE C C 93 177.350 177.128 0.222 1
1 1061 . 22 1 1 A 94 94 PHE CA C 93 61.641 61.446 0.195 1
1 1062 . 22 1 1 A 94 94 PHE CB C 93 40.014 39.514 0.500 1
1 1068 . 22 1 1 A 94 94 PHE N N 93 119.807 119.800 0.007 1
1 1069 . 22 1 1 A 95 95 THR H H 94 8.726 8.127 0.599 1
1 1070 . 22 1 1 A 95 95 THR HA H 94 3.569 3.929 -0.360 1
1 1075 . 22 1 1 A 95 95 THR C C 94 176.932 176.824 0.108 1
1 1076 . 22 1 1 A 95 95 THR CA C 94 66.833 65.397 1.436 1
1 1077 . 22 1 1 A 95 95 THR CB C 94 68.445 68.260 0.185 1
1 1079 . 22 1 1 A 95 95 THR N N 94 113.074 112.154 0.920 1
1 1080 . 22 1 1 A 96 96 THR H H 95 7.657 7.772 -0.115 1
1 1081 . 22 1 1 A 96 96 THR HA H 95 3.945 3.984 -0.039 1
1 1086 . 22 1 1 A 96 96 THR C C 95 176.386 176.343 0.043 1
1 1087 . 22 1 1 A 96 96 THR CA C 95 66.550 66.010 0.540 1
1 1088 . 22 1 1 A 96 96 THR CB C 95 68.583 68.523 0.060 1
1 1090 . 22 1 1 A 96 96 THR N N 95 117.927 116.897 1.030 1
1 1091 . 22 1 1 A 97 97 THR H H 96 7.699 7.552 0.147 1
1 1092 . 22 1 1 A 97 97 THR HA H 96 3.905 4.074 -0.169 1
1 1097 . 22 1 1 A 97 97 THR C C 96 176.572 176.278 0.294 1
1 1098 . 22 1 1 A 97 97 THR CA C 96 65.979 66.208 -0.229 1
1 1099 . 22 1 1 A 97 97 THR CB C 96 68.553 68.221 0.332 1
1 1101 . 22 1 1 A 97 97 THR N N 96 118.518 117.128 1.390 1
1 1102 . 22 1 1 A 98 98 LEU H H 97 8.304 8.038 0.266 1
1 1103 . 22 1 1 A 98 98 LEU HA H 97 3.725 3.775 -0.050 1
1 1113 . 22 1 1 A 98 98 LEU C C 97 178.490 178.142 0.348 1
1 1114 . 22 1 1 A 98 98 LEU CA C 97 58.517 57.933 0.584 1
1 1115 . 22 1 1 A 98 98 LEU CB C 97 41.697 41.192 0.505 1
1 1119 . 22 1 1 A 98 98 LEU N N 97 122.882 121.907 0.975 1
1 1120 . 22 1 1 A 99 99 GLN H H 98 7.639 8.062 -0.423 1
1 1121 . 22 1 1 A 99 99 GLN HA H 98 3.927 4.146 -0.219 1
1 1128 . 22 1 1 A 99 99 GLN C C 98 178.068 177.480 0.588 1
1 1129 . 22 1 1 A 99 99 GLN CA C 98 58.735 58.023 0.712 1
1 1130 . 22 1 1 A 99 99 GLN CB C 98 27.986 28.127 -0.141 1
1 1132 . 22 1 1 A 99 99 GLN N N 98 114.302 116.086 -1.784 1
1 1134 . 22 1 1 A 100 100 HIS H H 99 7.575 7.095 0.480 1
1 1135 . 22 1 1 A 100 100 HIS HA H 99 4.524 4.466 0.058 1
1 1139 . 22 1 1 A 100 100 HIS C C 99 174.789 177.621 -2.832 1
1 1140 . 22 1 1 A 100 100 HIS CA C 99 56.154 59.522 -3.368 1
1 1141 . 22 1 1 A 100 100 HIS CB C 99 28.946 30.794 -1.848 1
1 1143 . 22 1 1 A 100 100 HIS N N 99 114.778 118.245 -3.467 1
1 1144 . 22 1 1 A 101 101 HIS H H 100 7.773 8.081 -0.308 1
1 1145 . 22 1 1 A 101 101 HIS HA H 100 4.704 4.341 0.363 1
1 1149 . 22 1 1 A 101 101 HIS C C 100 174.818 177.266 -2.448 1
1 1150 . 22 1 1 A 101 101 HIS CA C 100 54.830 58.583 -3.753 1
1 1151 . 22 1 1 A 101 101 HIS CB C 100 29.749 28.410 1.339 1
1 1153 . 22 1 1 A 101 101 HIS N N 100 117.397 117.169 0.228 1
1 1154 . 22 1 1 A 102 102 LYS H H 101 7.324 8.057 -0.733 1
1 1155 . 22 1 1 A 102 102 LYS HA H 101 3.611 4.066 -0.455 1
1 1164 . 22 1 1 A 102 102 LYS C C 101 176.823 178.505 -1.682 1
1 1165 . 22 1 1 A 102 102 LYS CA C 101 59.915 58.913 1.002 1
1 1166 . 22 1 1 A 102 102 LYS CB C 101 32.825 32.092 0.733 1
1 1170 . 22 1 1 A 102 102 LYS N N 101 120.533 122.040 -1.507 1
1 1171 . 22 1 1 A 103 103 ASP H H 102 8.361 7.742 0.619 1
1 1172 . 22 1 1 A 103 103 ASP HA H 102 4.421 4.430 -0.009 1
1 1175 . 22 1 1 A 103 103 ASP C C 102 176.793 177.679 -0.886 1
1 1176 . 22 1 1 A 103 103 ASP CA C 102 55.500 56.342 -0.842 1
1 1177 . 22 1 1 A 103 103 ASP CB C 102 40.178 40.857 -0.679 1
1 1178 . 22 1 1 A 103 103 ASP N N 102 114.814 119.438 -4.624 1
1 1179 . 22 1 1 A 104 104 GLU H H 103 7.858 7.937 -0.079 1
1 1180 . 22 1 1 A 104 104 GLU HA H 103 4.339 4.346 -0.007 1
1 1183 . 22 1 1 A 104 104 GLU C C 103 175.777 176.850 -1.073 1
1 1184 . 22 1 1 A 104 104 GLU CA C 103 56.356 57.987 -1.631 1
1 1185 . 22 1 1 A 104 104 GLU CB C 103 31.293 30.812 0.481 1
1 1186 . 22 1 1 A 104 104 GLU N N 103 116.826 118.943 -2.117 1
1 1187 . 22 1 1 A 105 105 VAL H H 104 7.201 7.676 -0.475 1
1 1188 . 22 1 1 A 105 105 VAL HA H 104 4.296 4.137 0.159 1
1 1196 . 22 1 1 A 105 105 VAL C C 104 174.482 175.575 -1.093 1
1 1197 . 22 1 1 A 105 105 VAL CA C 104 60.370 62.642 -2.272 1
1 1198 . 22 1 1 A 105 105 VAL CB C 104 34.341 33.093 1.248 1
1 1201 . 22 1 1 A 105 105 VAL N N 104 116.422 119.772 -3.350 1
1 1202 . 22 1 1 A 106 106 ALA H H 105 8.487 8.456 0.031 1
1 1203 . 22 1 1 A 106 106 ALA HA H 105 4.172 4.412 -0.240 1
1 1207 . 22 1 1 A 106 106 ALA C C 105 179.030 178.880 0.150 1
1 1208 . 22 1 1 A 106 106 ALA CA C 105 52.966 52.671 0.295 1
1 1209 . 22 1 1 A 106 106 ALA CB C 105 19.371 19.651 -0.280 1
1 1210 . 22 1 1 A 106 106 ALA N N 105 128.313 128.715 -0.402 1
1 1211 . 22 1 1 A 107 107 GLY H H 106 8.738 8.805 -0.067 1
1 1212 . 22 1 1 A 107 107 GLY HA2 H 106 3.773 3.871 -0.098 1
1 1213 . 22 1 1 A 107 107 GLY HA3 H 106 3.998 3.936 0.062 1
1 1214 . 22 1 1 A 107 107 GLY C C 106 174.958 175.474 -0.516 1
1 1215 . 22 1 1 A 107 107 GLY CA C 106 47.449 47.212 0.237 1
1 1216 . 22 1 1 A 107 107 GLY N N 106 110.612 110.907 -0.295 1
1 1217 . 22 1 1 A 108 108 ASP H H 107 8.535 7.828 0.707 1
1 1218 . 22 1 1 A 108 108 ASP HA H 107 4.333 4.354 -0.021 1
1 1221 . 22 1 1 A 108 108 ASP C C 107 179.133 179.024 0.109 1
1 1222 . 22 1 1 A 108 108 ASP CA C 107 56.721 56.393 0.328 1
1 1223 . 22 1 1 A 108 108 ASP CB C 107 39.336 40.578 -1.242 1
1 1224 . 22 1 1 A 108 108 ASP N N 107 117.474 122.245 -4.771 1
1 1225 . 22 1 1 A 109 109 ILE H H 108 7.459 7.977 -0.518 1
1 1226 . 22 1 1 A 109 109 ILE HA H 108 3.688 3.738 -0.050 1
1 1236 . 22 1 1 A 109 109 ILE C C 108 176.735 178.341 -1.606 1
1 1237 . 22 1 1 A 109 109 ILE CA C 108 63.474 65.654 -2.180 1
1 1238 . 22 1 1 A 109 109 ILE CB C 108 37.340 37.748 -0.408 1
1 1242 . 22 1 1 A 109 109 ILE N N 108 119.609 119.581 0.028 1
1 1243 . 22 1 1 A 110 110 PHE H H 109 7.920 8.382 -0.462 1
1 1244 . 22 1 1 A 110 110 PHE HA H 109 3.759 4.082 -0.323 1
1 1252 . 22 1 1 A 110 110 PHE C C 109 177.132 177.389 -0.257 1
1 1253 . 22 1 1 A 110 110 PHE CA C 109 62.766 61.237 1.529 1
1 1254 . 22 1 1 A 110 110 PHE CB C 109 39.752 39.295 0.457 1
1 1260 . 22 1 1 A 110 110 PHE N N 109 120.906 120.456 0.450 1
1 1261 . 22 1 1 A 111 111 ASP H H 110 8.639 8.207 0.432 1
1 1262 . 22 1 1 A 111 111 ASP HA H 110 4.216 4.223 -0.007 1
1 1265 . 22 1 1 A 111 111 ASP C C 110 178.900 178.421 0.479 1
1 1266 . 22 1 1 A 111 111 ASP CA C 110 57.105 57.274 -0.169 1
1 1267 . 22 1 1 A 111 111 ASP CB C 110 39.697 41.724 -2.027 1
1 1268 . 22 1 1 A 111 111 ASP N N 110 117.124 119.030 -1.906 1
1 1269 . 22 1 1 A 112 112 MET H H 111 7.331 7.546 -0.215 1
1 1270 . 22 1 1 A 112 112 MET HA H 111 4.081 4.150 -0.069 1
1 1278 . 22 1 1 A 112 112 MET C C 111 179.052 178.165 0.887 1
1 1279 . 22 1 1 A 112 112 MET CA C 111 58.202 58.110 0.092 1
1 1280 . 22 1 1 A 112 112 MET CB C 111 31.827 32.447 -0.620 1
1 1283 . 22 1 1 A 112 112 MET N N 111 118.061 119.438 -1.377 1
1 1284 . 22 1 1 A 113 113 LEU H H 112 8.001 8.052 -0.051 1
1 1285 . 22 1 1 A 113 113 LEU HA H 112 3.723 3.613 0.110 1
1 1295 . 22 1 1 A 113 113 LEU C C 112 179.747 178.660 1.087 1
1 1296 . 22 1 1 A 113 113 LEU CA C 112 57.371 57.430 -0.059 1
1 1297 . 22 1 1 A 113 113 LEU CB C 112 40.671 41.231 -0.560 1
1 1301 . 22 1 1 A 113 113 LEU N N 112 120.426 119.656 0.770 1
1 1302 . 22 1 1 A 114 114 LEU H H 113 7.744 7.704 0.040 1
1 1303 . 22 1 1 A 114 114 LEU HA H 113 4.007 3.551 0.456 1
1 1313 . 22 1 1 A 114 114 LEU C C 113 179.358 178.542 0.816 1
1 1314 . 22 1 1 A 114 114 LEU CA C 113 57.202 57.525 -0.323 1
1 1315 . 22 1 1 A 114 114 LEU CB C 113 41.727 41.601 0.126 1
1 1319 . 22 1 1 A 114 114 LEU N N 113 119.584 119.657 -0.073 1
1 1320 . 22 1 1 A 115 115 THR H H 114 7.353 7.609 -0.256 1
1 1321 . 22 1 1 A 115 115 THR HA H 114 4.071 4.089 -0.018 1
1 1327 . 22 1 1 A 115 115 THR C C 114 173.591 176.323 -2.732 1
1 1328 . 22 1 1 A 115 115 THR CA C 114 65.332 64.478 0.854 1
1 1329 . 22 1 1 A 115 115 THR CB C 114 70.319 68.660 1.659 1
1 1331 . 22 1 1 A 115 115 THR N N 114 107.535 112.310 -4.775 1
1 1332 . 22 1 1 A 116 116 PHE H H 115 6.979 7.832 -0.853 1
1 1333 . 22 1 1 A 116 116 PHE HA H 115 5.022 4.496 0.526 1
1 1341 . 22 1 1 A 116 116 PHE C C 115 176.488 175.979 0.509 1
1 1342 . 22 1 1 A 116 116 PHE CA C 115 55.911 61.277 -5.366 1
1 1343 . 22 1 1 A 116 116 PHE CB C 115 38.521 38.832 -0.311 1
1 1349 . 22 1 1 A 116 116 PHE N N 115 112.366 119.988 -7.622 1
1 1350 . 22 1 1 A 117 117 THR H H 116 7.564 8.042 -0.478 1
1 1351 . 22 1 1 A 117 117 THR HA H 116 4.626 4.872 -0.246 1
1 1356 . 22 1 1 A 117 117 THR C C 116 174.085 173.978 0.107 1
1 1357 . 22 1 1 A 117 117 THR CA C 116 61.636 62.601 -0.965 1
1 1358 . 22 1 1 A 117 117 THR CB C 116 70.915 72.433 -1.518 1
1 1360 . 22 1 1 A 117 117 THR N N 116 105.498 112.805 -7.307 1
1 1361 . 22 1 1 A 118 118 ASP H H 117 8.270 7.494 0.776 1
1 1362 . 22 1 1 A 118 118 ASP HA H 117 4.955 5.012 -0.057 1
1 1365 . 22 1 1 A 118 118 ASP C C 117 176.328 176.264 0.064 1
1 1366 . 22 1 1 A 118 118 ASP CA C 117 53.417 53.452 -0.035 1
1 1367 . 22 1 1 A 118 118 ASP CB C 117 43.388 38.730 4.658 1
1 1368 . 22 1 1 A 118 118 ASP N N 117 124.409 121.274 3.135 1
1 1369 . 22 1 1 A 119 119 PHE H H 118 8.973 8.685 0.288 1
1 1370 . 22 1 1 A 119 119 PHE HA H 118 3.506 4.197 -0.691 1
1 1378 . 22 1 1 A 119 119 PHE CA C 118 61.490 61.176 0.314 1
1 1379 . 22 1 1 A 119 119 PHE CB C 118 39.246 39.573 -0.327 1
1 1385 . 22 1 1 A 119 119 PHE N N 118 126.688 125.853 0.835 1
1 1386 . 22 1 1 A 120 120 LEU H H 119 8.099 8.284 -0.185 1
1 1387 . 22 1 1 A 120 120 LEU HA H 119 3.842 3.961 -0.119 1
1 1397 . 22 1 1 A 120 120 LEU C C 119 179.601 179.634 -0.033 1
1 1398 . 22 1 1 A 120 120 LEU CA C 119 58.174 57.743 0.431 1
1 1399 . 22 1 1 A 120 120 LEU CB C 119 40.315 40.829 -0.514 1
1 1403 . 22 1 1 A 120 120 LEU N N 119 117.930 119.827 -1.897 1
1 1404 . 22 1 1 A 121 121 ALA H H 120 7.729 7.556 0.173 1
1 1405 . 22 1 1 A 121 121 ALA HA H 120 3.996 4.126 -0.130 1
1 1409 . 22 1 1 A 121 121 ALA C C 120 180.995 179.695 1.300 1
1 1410 . 22 1 1 A 121 121 ALA CA C 120 54.832 54.615 0.217 1
1 1411 . 22 1 1 A 121 121 ALA CB C 120 17.706 18.275 -0.569 1
1 1412 . 22 1 1 A 121 121 ALA N N 120 123.195 121.434 1.761 1
1 1413 . 22 1 1 A 122 122 PHE H H 121 7.943 7.777 0.166 1
1 1414 . 22 1 1 A 122 122 PHE HA H 121 3.887 3.873 0.014 1
1 1419 . 22 1 1 A 122 122 PHE C C 121 175.410 176.893 -1.483 1
1 1420 . 22 1 1 A 122 122 PHE CA C 121 61.075 60.825 0.250 1
1 1421 . 22 1 1 A 122 122 PHE CB C 121 38.115 38.880 -0.765 1
1 1424 . 22 1 1 A 122 122 PHE N N 121 121.798 119.977 1.821 1
1 1425 . 22 1 1 A 123 123 LYS H H 122 8.468 7.932 0.536 1
1 1426 . 22 1 1 A 123 123 LYS HA H 122 3.077 3.553 -0.476 1
1 1435 . 22 1 1 A 123 123 LYS C C 122 178.453 178.703 -0.250 1
1 1436 . 22 1 1 A 123 123 LYS CA C 122 59.855 59.864 -0.009 1
1 1437 . 22 1 1 A 123 123 LYS CB C 122 32.374 32.363 0.011 1
1 1441 . 22 1 1 A 123 123 LYS N N 122 120.614 118.444 2.170 1
1 1442 . 22 1 1 A 124 124 GLU H H 123 8.100 7.967 0.133 1
1 1443 . 22 1 1 A 124 124 GLU HA H 123 3.652 3.997 -0.345 1
1 1448 . 22 1 1 A 124 124 GLU C C 123 177.743 178.452 -0.709 1
1 1449 . 22 1 1 A 124 124 GLU CA C 123 59.406 59.571 -0.165 1
1 1450 . 22 1 1 A 124 124 GLU CB C 123 28.811 29.056 -0.245 1
1 1452 . 22 1 1 A 124 124 GLU N N 123 117.404 118.820 -1.416 1
1 1453 . 22 1 1 A 125 125 MET H H 124 7.537 7.527 0.010 1
1 1454 . 22 1 1 A 125 125 MET HA H 124 3.860 3.888 -0.028 1
1 1462 . 22 1 1 A 125 125 MET C C 124 179.522 178.468 1.054 1
1 1463 . 22 1 1 A 125 125 MET CA C 124 58.832 58.466 0.366 1
1 1464 . 22 1 1 A 125 125 MET CB C 124 31.765 31.315 0.450 1
1 1467 . 22 1 1 A 125 125 MET N N 124 119.413 118.878 0.535 1
1 1468 . 22 1 1 A 126 126 PHE H H 125 7.148 7.481 -0.333 1
1 1469 . 22 1 1 A 126 126 PHE HA H 125 3.633 4.159 -0.526 1
1 1476 . 22 1 1 A 126 126 PHE C C 125 178.994 178.180 0.814 1
1 1477 . 22 1 1 A 126 126 PHE CA C 125 63.148 60.895 2.253 1
1 1478 . 22 1 1 A 126 126 PHE CB C 125 39.830 38.544 1.286 1
1 1483 . 22 1 1 A 126 126 PHE N N 125 120.013 118.275 1.738 1
1 1484 . 22 1 1 A 127 127 LEU H H 126 8.369 8.443 -0.074 1
1 1485 . 22 1 1 A 127 127 LEU HA H 126 3.972 3.966 0.006 1
1 1495 . 22 1 1 A 127 127 LEU C C 126 180.621 179.054 1.567 1
1 1496 . 22 1 1 A 127 127 LEU CA C 126 57.944 57.841 0.103 1
1 1497 . 22 1 1 A 127 127 LEU CB C 126 40.543 40.976 -0.433 1
1 1501 . 22 1 1 A 127 127 LEU N N 126 119.692 119.715 -0.023 1
1 1502 . 22 1 1 A 128 128 ASP H H 127 8.578 8.141 0.437 1
1 1503 . 22 1 1 A 128 128 ASP HA H 127 4.308 4.339 -0.031 1
1 1506 . 22 1 1 A 128 128 ASP C C 127 178.254 178.089 0.165 1
1 1507 . 22 1 1 A 128 128 ASP CA C 127 56.964 57.145 -0.181 1
1 1508 . 22 1 1 A 128 128 ASP CB C 127 39.735 40.594 -0.859 1
1 1509 . 22 1 1 A 128 128 ASP N N 127 121.926 119.438 2.488 1
1 1510 . 22 1 1 A 129 129 TYR H H 128 7.710 7.996 -0.286 1
1 1511 . 22 1 1 A 129 129 TYR HA H 128 3.908 3.989 -0.081 1
1 1518 . 22 1 1 A 129 129 TYR C C 128 177.633 177.492 0.141 1
1 1519 . 22 1 1 A 129 129 TYR CA C 128 61.796 61.589 0.207 1
1 1520 . 22 1 1 A 129 129 TYR CB C 128 39.372 38.911 0.461 1
1 1525 . 22 1 1 A 129 129 TYR N N 128 122.548 120.234 2.314 1
1 1526 . 22 1 1 A 130 130 ARG H H 129 8.622 8.320 0.302 1
1 1527 . 22 1 1 A 130 130 ARG HA H 129 3.722 3.926 -0.204 1
1 1535 . 22 1 1 A 130 130 ARG CA C 129 60.084 59.739 0.345 1
1 1536 . 22 1 1 A 130 130 ARG CB C 129 29.902 29.959 -0.057 1
1 1539 . 22 1 1 A 130 130 ARG N N 129 118.302 119.492 -1.190 1
1 1541 . 22 1 1 A 131 131 ALA H H 130 7.936 8.057 -0.121 1
1 1542 . 22 1 1 A 131 131 ALA HA H 130 3.997 4.017 -0.020 1
1 1546 . 22 1 1 A 131 131 ALA C C 130 180.456 180.320 0.136 1
1 1547 . 22 1 1 A 131 131 ALA CA C 130 55.133 54.758 0.375 1
1 1548 . 22 1 1 A 131 131 ALA CB C 130 17.750 18.167 -0.417 1
1 1549 . 22 1 1 A 131 131 ALA N N 130 119.788 121.138 -1.350 1
1 1550 . 22 1 1 A 132 132 GLU H H 131 7.622 7.433 0.189 1
1 1551 . 22 1 1 A 132 132 GLU HA H 131 3.862 3.991 -0.129 1
1 1556 . 22 1 1 A 132 132 GLU C C 131 179.528 178.818 0.710 1
1 1557 . 22 1 1 A 132 132 GLU CA C 131 58.849 58.616 0.233 1
1 1558 . 22 1 1 A 132 132 GLU CB C 131 28.930 29.045 -0.115 1
1 1560 . 22 1 1 A 132 132 GLU N N 131 118.428 118.281 0.147 1
1 1561 . 22 1 1 A 133 133 LYS H H 132 7.853 7.680 0.173 1
1 1562 . 22 1 1 A 133 133 LYS HA H 132 3.722 3.966 -0.244 1
1 1571 . 22 1 1 A 133 133 LYS C C 132 175.725 179.359 -3.634 1
1 1572 . 22 1 1 A 133 133 LYS CA C 132 57.544 58.773 -1.229 1
1 1573 . 22 1 1 A 133 133 LYS CB C 132 31.770 32.222 -0.452 1
1 1577 . 22 1 1 A 133 133 LYS N N 132 119.473 118.762 0.711 1
1 1578 . 22 1 1 A 134 134 GLU H H 133 8.151 7.539 0.612 1
1 1579 . 22 1 1 A 134 134 GLU HA H 133 4.161 4.163 -0.002 1
1 1584 . 22 1 1 A 134 134 GLU C C 133 177.453 176.850 0.603 1
1 1585 . 22 1 1 A 134 134 GLU CA C 133 57.222 56.673 0.549 1
1 1586 . 22 1 1 A 134 134 GLU CB C 133 30.091 29.748 0.343 1
1 1588 . 22 1 1 A 134 134 GLU N N 133 116.525 117.601 -1.076 1
1 1589 . 22 1 1 A 135 135 GLY H H 134 7.702 7.634 0.068 1
1 1590 . 22 1 1 A 135 135 GLY HA2 H 134 3.896 3.962 -0.066 1
1 1591 . 22 1 1 A 135 135 GLY HA3 H 134 3.897 3.973 -0.076 1
1 1592 . 22 1 1 A 135 135 GLY C C 134 174.538 175.175 -0.637 1
1 1593 . 22 1 1 A 135 135 GLY CA C 134 45.975 45.472 0.503 1
1 1594 . 22 1 1 A 135 135 GLY N N 134 107.924 108.007 -0.083 1
1 1595 . 22 1 1 A 136 136 ARG H H 135 8.045 8.131 -0.086 1
1 1596 . 22 1 1 A 136 136 ARG HA H 135 4.323 4.321 0.002 1
1 1604 . 22 1 1 A 136 136 ARG C C 135 175.864 176.162 -0.298 1
1 1605 . 22 1 1 A 136 136 ARG CA C 135 56.016 56.259 -0.243 1
1 1606 . 22 1 1 A 136 136 ARG CB C 135 30.987 30.743 0.244 1
1 1609 . 22 1 1 A 136 136 ARG N N 135 119.708 118.906 0.802 1
1 1 . 23 1 1 A 14 14 PHE CA C 13 58.199 58.091 0.108 1
1 2 . 23 1 1 A 14 14 PHE CB C 13 39.717 41.026 -1.309 1
1 3 . 23 1 1 A 15 15 SER H H 14 8.299 7.752 0.547 1
1 4 . 23 1 1 A 15 15 SER HA H 14 4.359 4.800 -0.441 1
1 7 . 23 1 1 A 15 15 SER CA C 14 58.249 57.556 0.693 1
1 8 . 23 1 1 A 15 15 SER CB C 14 63.936 65.082 -1.146 1
1 9 . 23 1 1 A 15 15 SER N N 14 117.379 113.164 4.215 1
1 10 . 23 1 1 A 16 16 SER H H 15 8.255 8.756 -0.501 1
1 11 . 23 1 1 A 16 16 SER HA H 15 3.729 4.881 -1.152 1
1 14 . 23 1 1 A 16 16 SER CA C 15 58.224 59.375 -1.151 1
1 15 . 23 1 1 A 16 16 SER CB C 15 63.886 63.735 0.151 1
1 16 . 23 1 1 A 16 16 SER N N 15 117.694 120.647 -2.953 1
1 17 . 23 1 1 A 17 17 ALA H H 16 8.333 8.447 -0.114 1
1 18 . 23 1 1 A 17 17 ALA HA H 16 4.252 4.392 -0.140 1
1 22 . 23 1 1 A 17 17 ALA CA C 16 53.377 54.941 -1.564 1
1 23 . 23 1 1 A 17 17 ALA CB C 16 18.896 18.590 0.306 1
1 24 . 23 1 1 A 17 17 ALA N N 16 125.462 125.367 0.095 1
1 25 . 23 1 1 A 18 18 SER H H 17 8.219 7.819 0.400 1
1 26 . 23 1 1 A 18 18 SER HA H 17 4.332 4.497 -0.165 1
1 29 . 23 1 1 A 18 18 SER CA C 17 59.105 58.715 0.390 1
1 30 . 23 1 1 A 18 18 SER CB C 17 63.592 63.157 0.435 1
1 31 . 23 1 1 A 18 18 SER N N 17 114.821 109.981 4.840 1
1 32 . 23 1 1 A 19 19 ASP H H 18 8.309 7.774 0.535 1
1 33 . 23 1 1 A 19 19 ASP HA H 18 4.554 5.042 -0.488 1
1 36 . 23 1 1 A 19 19 ASP C C 18 176.528 175.949 0.579 1
1 37 . 23 1 1 A 19 19 ASP CA C 18 55.272 52.679 2.593 1
1 38 . 23 1 1 A 19 19 ASP CB C 18 40.883 43.921 -3.038 1
1 39 . 23 1 1 A 19 19 ASP N N 18 123.367 120.999 2.368 1
1 40 . 23 1 1 A 20 20 ALA H H 19 8.133 8.796 -0.663 1
1 41 . 23 1 1 A 20 20 ALA HA H 19 4.170 4.093 0.077 1
1 45 . 23 1 1 A 20 20 ALA C C 19 179.857 179.390 0.467 1
1 46 . 23 1 1 A 20 20 ALA CA C 19 54.341 55.103 -0.762 1
1 47 . 23 1 1 A 20 20 ALA CB C 19 18.660 18.461 0.199 1
1 48 . 23 1 1 A 20 20 ALA N N 19 123.350 126.332 -2.982 1
1 49 . 23 1 1 A 21 21 GLU H H 20 8.140 7.932 0.208 1
1 50 . 23 1 1 A 21 21 GLU HA H 20 4.128 4.091 0.037 1
1 55 . 23 1 1 A 21 21 GLU C C 20 177.675 178.414 -0.739 1
1 56 . 23 1 1 A 21 21 GLU CA C 20 58.520 59.585 -1.065 1
1 57 . 23 1 1 A 21 21 GLU CB C 20 29.765 29.490 0.275 1
1 59 . 23 1 1 A 21 21 GLU N N 20 119.063 119.374 -0.311 1
1 60 . 23 1 1 A 22 22 PHE H H 21 8.009 7.957 0.052 1
1 61 . 23 1 1 A 22 22 PHE HA H 21 4.123 4.256 -0.133 1
1 68 . 23 1 1 A 22 22 PHE C C 21 176.410 177.516 -1.106 1
1 69 . 23 1 1 A 22 22 PHE CA C 21 62.202 61.012 1.190 1
1 70 . 23 1 1 A 22 22 PHE CB C 21 39.223 39.059 0.164 1
1 75 . 23 1 1 A 22 22 PHE N N 21 121.211 120.938 0.273 1
1 76 . 23 1 1 A 23 23 ASP H H 22 8.261 8.548 -0.287 1
1 77 . 23 1 1 A 23 23 ASP HA H 22 4.041 4.665 -0.624 1
1 80 . 23 1 1 A 23 23 ASP C C 22 179.078 178.231 0.847 1
1 81 . 23 1 1 A 23 23 ASP CA C 22 57.048 58.081 -1.033 1
1 82 . 23 1 1 A 23 23 ASP CB C 22 40.154 41.929 -1.775 1
1 83 . 23 1 1 A 23 23 ASP N N 22 116.876 118.916 -2.040 1
1 84 . 23 1 1 A 24 24 ALA H H 23 7.651 7.796 -0.145 1
1 85 . 23 1 1 A 24 24 ALA HA H 23 3.785 3.897 -0.112 1
1 89 . 23 1 1 A 24 24 ALA C C 23 179.577 179.638 -0.061 1
1 90 . 23 1 1 A 24 24 ALA CA C 23 54.341 55.072 -0.731 1
1 91 . 23 1 1 A 24 24 ALA CB C 23 17.762 18.274 -0.512 1
1 92 . 23 1 1 A 24 24 ALA N N 23 121.873 121.390 0.483 1
1 93 . 23 1 1 A 25 25 VAL H H 24 7.718 7.774 -0.056 1
1 94 . 23 1 1 A 25 25 VAL HA H 24 3.216 3.633 -0.417 1
1 102 . 23 1 1 A 25 25 VAL C C 24 177.805 178.422 -0.617 1
1 103 . 23 1 1 A 25 25 VAL CA C 24 66.789 66.815 -0.026 1
1 104 . 23 1 1 A 25 25 VAL CB C 24 31.277 31.195 0.082 1
1 107 . 23 1 1 A 25 25 VAL N N 24 117.890 118.545 -0.655 1
1 108 . 23 1 1 A 26 26 VAL H H 25 7.867 7.762 0.105 1
1 109 . 23 1 1 A 26 26 VAL HA H 25 3.274 3.651 -0.377 1
1 117 . 23 1 1 A 26 26 VAL C C 25 177.788 178.030 -0.242 1
1 118 . 23 1 1 A 26 26 VAL CA C 25 67.282 66.392 0.890 1
1 119 . 23 1 1 A 26 26 VAL CB C 25 31.266 31.474 -0.208 1
1 122 . 23 1 1 A 26 26 VAL N N 25 118.170 120.156 -1.986 1
1 123 . 23 1 1 A 27 27 GLY H H 26 7.544 7.732 -0.188 1
1 124 . 23 1 1 A 27 27 GLY HA2 H 26 3.592 3.528 0.064 1
1 125 . 23 1 1 A 27 27 GLY HA3 H 26 3.721 3.653 0.068 1
1 126 . 23 1 1 A 27 27 GLY C C 26 176.717 176.580 0.137 1
1 127 . 23 1 1 A 27 27 GLY CA C 26 47.085 47.273 -0.188 1
1 128 . 23 1 1 A 27 27 GLY N N 26 105.795 107.713 -1.918 1
1 129 . 23 1 1 A 28 28 TYR H H 27 7.625 7.542 0.083 1
1 130 . 23 1 1 A 28 28 TYR HA H 27 4.546 4.600 -0.054 1
1 137 . 23 1 1 A 28 28 TYR C C 27 178.991 178.116 0.875 1
1 138 . 23 1 1 A 28 28 TYR CA C 27 58.845 59.609 -0.764 1
1 139 . 23 1 1 A 28 28 TYR CB C 27 37.602 37.602 0.000 1
1 144 . 23 1 1 A 28 28 TYR N N 27 119.933 122.367 -2.434 1
1 145 . 23 1 1 A 29 29 LEU H H 28 8.517 8.179 0.338 1
1 146 . 23 1 1 A 29 29 LEU HA H 28 3.728 3.837 -0.109 1
1 156 . 23 1 1 A 29 29 LEU CA C 28 58.281 58.158 0.123 1
1 157 . 23 1 1 A 29 29 LEU CB C 28 41.948 41.442 0.506 1
1 161 . 23 1 1 A 29 29 LEU N N 28 119.669 120.347 -0.678 1
1 162 . 23 1 1 A 30 30 GLU H H 29 8.072 7.986 0.086 1
1 163 . 23 1 1 A 30 30 GLU HA H 29 3.722 3.924 -0.202 1
1 168 . 23 1 1 A 30 30 GLU C C 29 177.731 179.185 -1.454 1
1 169 . 23 1 1 A 30 30 GLU CA C 29 59.763 59.854 -0.091 1
1 170 . 23 1 1 A 30 30 GLU CB C 29 28.844 29.149 -0.305 1
1 172 . 23 1 1 A 30 30 GLU N N 29 117.666 117.659 0.007 1
1 173 . 23 1 1 A 31 31 ASP H H 30 7.243 7.915 -0.672 1
1 174 . 23 1 1 A 31 31 ASP HA H 30 4.297 4.423 -0.126 1
1 177 . 23 1 1 A 31 31 ASP CA C 30 56.953 57.073 -0.120 1
1 178 . 23 1 1 A 31 31 ASP CB C 30 40.730 41.642 -0.912 1
1 179 . 23 1 1 A 31 31 ASP N N 30 116.720 119.314 -2.594 1
1 180 . 23 1 1 A 32 32 ILE H H 31 7.940 7.435 0.505 1
1 181 . 23 1 1 A 32 32 ILE HA H 31 3.640 3.715 -0.075 1
1 191 . 23 1 1 A 32 32 ILE C C 31 177.980 178.046 -0.066 1
1 192 . 23 1 1 A 32 32 ILE CA C 31 64.692 64.090 0.602 1
1 193 . 23 1 1 A 32 32 ILE CB C 31 38.938 37.253 1.685 1
1 197 . 23 1 1 A 32 32 ILE N N 31 119.728 118.022 1.706 1
1 198 . 23 1 1 A 33 33 ILE H H 32 7.984 7.786 0.198 1
1 199 . 23 1 1 A 33 33 ILE HA H 32 3.598 3.120 0.478 1
1 209 . 23 1 1 A 33 33 ILE C C 32 176.723 177.037 -0.314 1
1 210 . 23 1 1 A 33 33 ILE CA C 32 63.241 64.489 -1.248 1
1 211 . 23 1 1 A 33 33 ILE CB C 32 37.580 37.874 -0.294 1
1 215 . 23 1 1 A 33 33 ILE N N 32 113.919 120.757 -6.838 1
1 216 . 23 1 1 A 34 34 MET H H 33 7.288 7.584 -0.296 1
1 217 . 23 1 1 A 34 34 MET HA H 33 4.496 4.670 -0.174 1
1 225 . 23 1 1 A 34 34 MET C C 33 176.423 175.743 0.680 1
1 226 . 23 1 1 A 34 34 MET CA C 33 54.634 54.261 0.373 1
1 227 . 23 1 1 A 34 34 MET CB C 33 31.934 31.821 0.113 1
1 230 . 23 1 1 A 34 34 MET N N 33 115.130 116.786 -1.656 1
1 231 . 23 1 1 A 35 35 ASP H H 34 7.405 7.710 -0.305 1
1 232 . 23 1 1 A 35 35 ASP HA H 34 4.484 4.536 -0.052 1
1 235 . 23 1 1 A 35 35 ASP C C 34 177.139 176.764 0.375 1
1 236 . 23 1 1 A 35 35 ASP CA C 34 54.625 54.634 -0.009 1
1 237 . 23 1 1 A 35 35 ASP CB C 34 43.554 42.482 1.072 1
1 238 . 23 1 1 A 35 35 ASP N N 34 121.814 122.167 -0.353 1
1 239 . 23 1 1 A 36 36 ASP H H 35 8.765 8.782 -0.017 1
1 240 . 23 1 1 A 36 36 ASP HA H 35 4.235 4.309 -0.074 1
1 243 . 23 1 1 A 36 36 ASP C C 35 178.320 178.463 -0.143 1
1 244 . 23 1 1 A 36 36 ASP CA C 35 57.832 58.090 -0.258 1
1 245 . 23 1 1 A 36 36 ASP CB C 35 40.914 40.415 0.499 1
1 246 . 23 1 1 A 36 36 ASP N N 35 125.883 125.297 0.586 1
1 247 . 23 1 1 A 37 37 GLU H H 36 8.905 8.020 0.885 1
1 248 . 23 1 1 A 37 37 GLU HA H 36 3.933 3.979 -0.046 1
1 253 . 23 1 1 A 37 37 GLU C C 36 179.304 179.047 0.257 1
1 254 . 23 1 1 A 37 37 GLU CA C 36 59.828 59.285 0.543 1
1 255 . 23 1 1 A 37 37 GLU CB C 36 29.380 29.460 -0.080 1
1 257 . 23 1 1 A 37 37 GLU N N 36 119.077 120.576 -1.499 1
1 258 . 23 1 1 A 38 38 PHE H H 37 7.460 8.208 -0.748 1
1 259 . 23 1 1 A 38 38 PHE HA H 37 3.642 4.052 -0.410 1
1 267 . 23 1 1 A 38 38 PHE C C 37 176.483 177.928 -1.445 1
1 268 . 23 1 1 A 38 38 PHE CA C 37 61.411 61.310 0.101 1
1 269 . 23 1 1 A 38 38 PHE CB C 37 39.355 39.207 0.148 1
1 275 . 23 1 1 A 38 38 PHE N N 37 119.968 120.550 -0.582 1
1 276 . 23 1 1 A 39 39 GLN H H 38 7.968 8.180 -0.212 1
1 277 . 23 1 1 A 39 39 GLN HA H 38 3.712 3.815 -0.103 1
1 284 . 23 1 1 A 39 39 GLN CA C 38 59.153 58.951 0.202 1
1 285 . 23 1 1 A 39 39 GLN CB C 38 28.213 28.295 -0.082 1
1 287 . 23 1 1 A 39 39 GLN N N 38 116.433 118.049 -1.616 1
1 289 . 23 1 1 A 40 40 LEU H H 39 7.930 7.638 0.292 1
1 290 . 23 1 1 A 40 40 LEU HA H 39 3.916 4.040 -0.124 1
1 300 . 23 1 1 A 40 40 LEU C C 39 177.731 178.063 -0.332 1
1 301 . 23 1 1 A 40 40 LEU CA C 39 57.915 57.870 0.045 1
1 302 . 23 1 1 A 40 40 LEU CB C 39 41.989 41.508 0.481 1
1 306 . 23 1 1 A 40 40 LEU N N 39 119.505 121.837 -2.332 1
1 307 . 23 1 1 A 41 41 LEU H H 40 7.174 7.723 -0.549 1
1 308 . 23 1 1 A 41 41 LEU HA H 40 3.835 3.974 -0.139 1
1 318 . 23 1 1 A 41 41 LEU C C 40 179.738 178.198 1.540 1
1 319 . 23 1 1 A 41 41 LEU CA C 40 58.266 58.269 -0.003 1
1 320 . 23 1 1 A 41 41 LEU CB C 40 42.050 41.437 0.613 1
1 324 . 23 1 1 A 41 41 LEU N N 40 120.971 119.902 1.069 1
1 325 . 23 1 1 A 42 42 GLN H H 41 8.058 7.932 0.126 1
1 326 . 23 1 1 A 42 42 GLN HA H 41 3.556 3.752 -0.196 1
1 333 . 23 1 1 A 42 42 GLN C C 41 177.642 178.429 -0.787 1
1 334 . 23 1 1 A 42 42 GLN CA C 41 59.826 59.146 0.680 1
1 335 . 23 1 1 A 42 42 GLN CB C 41 28.762 28.044 0.718 1
1 337 . 23 1 1 A 42 42 GLN N N 41 117.899 117.665 0.234 1
1 339 . 23 1 1 A 43 43 ARG H H 42 8.179 7.789 0.390 1
1 340 . 23 1 1 A 43 43 ARG HA H 42 3.655 3.961 -0.306 1
1 347 . 23 1 1 A 43 43 ARG C C 42 178.051 178.911 -0.860 1
1 348 . 23 1 1 A 43 43 ARG CA C 42 59.766 59.167 0.599 1
1 349 . 23 1 1 A 43 43 ARG CB C 42 29.941 29.999 -0.058 1
1 352 . 23 1 1 A 43 43 ARG N N 42 119.392 118.878 0.514 1
1 353 . 23 1 1 A 44 44 ASN H H 43 8.525 8.152 0.373 1
1 354 . 23 1 1 A 44 44 ASN HA H 43 4.332 4.357 -0.025 1
1 359 . 23 1 1 A 44 44 ASN C C 43 178.150 177.717 0.433 1
1 360 . 23 1 1 A 44 44 ASN CA C 43 55.841 56.179 -0.338 1
1 361 . 23 1 1 A 44 44 ASN CB C 43 37.632 39.431 -1.799 1
1 362 . 23 1 1 A 44 44 ASN N N 43 116.214 118.100 -1.886 1
1 364 . 23 1 1 A 45 45 PHE H H 44 7.586 7.897 -0.311 1
1 365 . 23 1 1 A 45 45 PHE HA H 44 4.132 4.304 -0.172 1
1 372 . 23 1 1 A 45 45 PHE C C 44 176.691 178.450 -1.759 1
1 373 . 23 1 1 A 45 45 PHE CA C 44 62.333 60.596 1.737 1
1 374 . 23 1 1 A 45 45 PHE CB C 44 39.449 38.294 1.155 1
1 379 . 23 1 1 A 45 45 PHE N N 44 121.501 117.634 3.867 1
1 380 . 23 1 1 A 46 46 MET H H 45 8.190 8.351 -0.161 1
1 381 . 23 1 1 A 46 46 MET HA H 45 4.060 4.426 -0.366 1
1 389 . 23 1 1 A 46 46 MET C C 45 179.754 178.185 1.569 1
1 390 . 23 1 1 A 46 46 MET CA C 45 57.742 57.816 -0.074 1
1 391 . 23 1 1 A 46 46 MET CB C 45 29.912 31.079 -1.167 1
1 394 . 23 1 1 A 46 46 MET N N 45 116.727 117.454 -0.727 1
1 395 . 23 1 1 A 47 47 ASP H H 46 8.579 8.193 0.386 1
1 396 . 23 1 1 A 47 47 ASP HA H 46 4.804 4.477 0.327 1
1 399 . 23 1 1 A 47 47 ASP C C 46 177.854 178.393 -0.539 1
1 400 . 23 1 1 A 47 47 ASP CA C 46 57.277 57.108 0.169 1
1 401 . 23 1 1 A 47 47 ASP CB C 46 40.776 41.615 -0.839 1
1 402 . 23 1 1 A 47 47 ASP N N 46 117.798 120.857 -3.059 1
1 403 . 23 1 1 A 48 48 LYS H H 47 7.339 7.712 -0.373 1
1 404 . 23 1 1 A 48 48 LYS HA H 47 3.828 4.309 -0.481 1
1 413 . 23 1 1 A 48 48 LYS C C 47 178.812 178.687 0.125 1
1 414 . 23 1 1 A 48 48 LYS CA C 47 58.953 58.573 0.380 1
1 415 . 23 1 1 A 48 48 LYS CB C 47 32.796 32.986 -0.190 1
1 419 . 23 1 1 A 48 48 LYS N N 47 117.852 119.629 -1.777 1
1 420 . 23 1 1 A 49 49 TYR H H 48 6.841 8.563 -1.722 1
1 421 . 23 1 1 A 49 49 TYR HA H 48 4.995 4.508 0.487 1
1 428 . 23 1 1 A 49 49 TYR C C 48 178.138 178.041 0.097 1
1 429 . 23 1 1 A 49 49 TYR CA C 48 58.620 59.925 -1.305 1
1 430 . 23 1 1 A 49 49 TYR CB C 48 42.939 38.437 4.502 1
1 435 . 23 1 1 A 49 49 TYR N N 48 112.109 119.750 -7.641 1
1 436 . 23 1 1 A 50 50 TYR H H 49 8.491 8.286 0.205 1
1 437 . 23 1 1 A 50 50 TYR HA H 49 4.598 4.193 0.405 1
1 444 . 23 1 1 A 50 50 TYR C C 49 176.015 176.915 -0.900 1
1 445 . 23 1 1 A 50 50 TYR CA C 49 62.442 60.081 2.361 1
1 446 . 23 1 1 A 50 50 TYR CB C 49 36.588 37.578 -0.990 1
1 451 . 23 1 1 A 50 50 TYR N N 49 118.294 119.612 -1.318 1
1 452 . 23 1 1 A 51 51 LEU H H 50 7.512 7.490 0.022 1
1 453 . 23 1 1 A 51 51 LEU HA H 50 3.878 3.536 0.342 1
1 463 . 23 1 1 A 51 51 LEU C C 50 178.625 178.229 0.396 1
1 464 . 23 1 1 A 51 51 LEU CA C 50 55.994 57.508 -1.514 1
1 465 . 23 1 1 A 51 51 LEU CB C 50 40.743 41.131 -0.388 1
1 469 . 23 1 1 A 51 51 LEU N N 50 118.478 119.520 -1.042 1
1 470 . 23 1 1 A 52 52 GLU H H 51 8.042 8.011 0.031 1
1 471 . 23 1 1 A 52 52 GLU HA H 51 4.197 3.850 0.347 1
1 476 . 23 1 1 A 52 52 GLU C C 51 177.629 177.663 -0.034 1
1 477 . 23 1 1 A 52 52 GLU CA C 51 56.141 59.430 -3.289 1
1 478 . 23 1 1 A 52 52 GLU CB C 51 29.162 29.276 -0.114 1
1 480 . 23 1 1 A 52 52 GLU N N 51 115.067 118.459 -3.392 1
1 481 . 23 1 1 A 53 53 PHE H H 52 7.465 8.081 -0.616 1
1 482 . 23 1 1 A 53 53 PHE HA H 52 4.431 4.621 -0.190 1
1 490 . 23 1 1 A 53 53 PHE C C 52 174.325 174.699 -0.374 1
1 491 . 23 1 1 A 53 53 PHE CA C 52 58.986 57.010 1.976 1
1 492 . 23 1 1 A 53 53 PHE CB C 52 40.183 37.310 2.873 1
1 498 . 23 1 1 A 53 53 PHE N N 52 116.768 118.754 -1.986 1
1 499 . 23 1 1 A 54 54 GLU H H 53 7.484 8.475 -0.991 1
1 500 . 23 1 1 A 54 54 GLU HA H 53 4.583 4.744 -0.161 1
1 505 . 23 1 1 A 54 54 GLU C C 53 175.722 175.816 -0.094 1
1 506 . 23 1 1 A 54 54 GLU CA C 53 54.248 55.868 -1.620 1
1 507 . 23 1 1 A 54 54 GLU CB C 53 34.409 31.238 3.171 1
1 509 . 23 1 1 A 54 54 GLU N N 53 118.844 124.412 -5.568 1
1 510 . 23 1 1 A 55 55 ASP H H 54 9.008 8.717 0.291 1
1 511 . 23 1 1 A 55 55 ASP HA H 54 4.735 4.837 -0.102 1
1 514 . 23 1 1 A 55 55 ASP C C 54 175.421 175.964 -0.543 1
1 515 . 23 1 1 A 55 55 ASP CA C 54 52.888 53.929 -1.041 1
1 516 . 23 1 1 A 55 55 ASP CB C 54 38.894 40.656 -1.762 1
1 517 . 23 1 1 A 55 55 ASP N N 54 123.654 124.336 -0.682 1
1 518 . 23 1 1 A 56 56 THR H H 55 7.819 8.012 -0.193 1
1 519 . 23 1 1 A 56 56 THR HA H 55 4.574 4.948 -0.374 1
1 524 . 23 1 1 A 56 56 THR C C 55 174.096 174.350 -0.254 1
1 525 . 23 1 1 A 56 56 THR CA C 55 59.172 59.563 -0.391 1
1 526 . 23 1 1 A 56 56 THR CB C 55 71.889 72.231 -0.342 1
1 528 . 23 1 1 A 56 56 THR N N 55 112.015 117.542 -5.527 1
1 529 . 23 1 1 A 57 57 GLU H H 56 8.527 8.875 -0.348 1
1 530 . 23 1 1 A 57 57 GLU HA H 56 4.217 4.504 -0.287 1
1 535 . 23 1 1 A 57 57 GLU C C 56 177.042 176.357 0.685 1
1 536 . 23 1 1 A 57 57 GLU CA C 56 56.869 57.013 -0.144 1
1 537 . 23 1 1 A 57 57 GLU CB C 56 29.731 31.390 -1.659 1
1 539 . 23 1 1 A 57 57 GLU N N 56 117.531 118.825 -1.294 1
1 540 . 23 1 1 A 58 58 GLU H H 57 7.587 7.882 -0.295 1
1 541 . 23 1 1 A 58 58 GLU HA H 57 3.941 4.736 -0.795 1
1 546 . 23 1 1 A 58 58 GLU C C 57 176.849 175.739 1.110 1
1 547 . 23 1 1 A 58 58 GLU CA C 57 56.924 54.838 2.086 1
1 548 . 23 1 1 A 58 58 GLU CB C 57 30.251 31.238 -0.987 1
1 550 . 23 1 1 A 58 58 GLU N N 57 119.183 117.985 1.198 1
1 551 . 23 1 1 A 59 59 ASN H H 58 9.120 8.735 0.385 1
1 552 . 23 1 1 A 59 59 ASN HA H 58 4.922 5.446 -0.524 1
1 557 . 23 1 1 A 59 59 ASN C C 58 174.254 174.348 -0.094 1
1 558 . 23 1 1 A 59 59 ASN CA C 58 51.956 52.303 -0.347 1
1 559 . 23 1 1 A 59 59 ASN CB C 58 37.404 40.766 -3.362 1
1 560 . 23 1 1 A 59 59 ASN N N 58 126.767 120.438 6.329 1
1 562 . 23 1 1 A 60 60 LYS H H 59 5.892 8.750 -2.858 1
1 563 . 23 1 1 A 60 60 LYS HA H 59 3.798 4.832 -1.034 1
1 572 . 23 1 1 A 60 60 LYS C C 59 177.908 177.234 0.674 1
1 573 . 23 1 1 A 60 60 LYS CA C 59 56.623 54.841 1.782 1
1 574 . 23 1 1 A 60 60 LYS CB C 59 32.279 35.092 -2.813 1
1 578 . 23 1 1 A 60 60 LYS N N 59 121.527 120.474 1.053 1
1 579 . 23 1 1 A 61 61 LEU H H 60 8.473 8.836 -0.363 1
1 580 . 23 1 1 A 61 61 LEU HA H 60 3.891 4.204 -0.313 1
1 590 . 23 1 1 A 61 61 LEU C C 60 179.843 178.055 1.788 1
1 591 . 23 1 1 A 61 61 LEU CA C 60 58.301 57.262 1.039 1
1 592 . 23 1 1 A 61 61 LEU CB C 60 41.305 41.793 -0.488 1
1 596 . 23 1 1 A 61 61 LEU N N 60 125.639 125.014 0.625 1
1 597 . 23 1 1 A 62 62 ILE H H 61 7.698 8.027 -0.329 1
1 598 . 23 1 1 A 62 62 ILE HA H 61 3.952 3.885 0.067 1
1 608 . 23 1 1 A 62 62 ILE C C 61 175.392 177.220 -1.828 1
1 609 . 23 1 1 A 62 62 ILE CA C 61 61.743 63.384 -1.641 1
1 610 . 23 1 1 A 62 62 ILE CB C 61 39.108 37.755 1.353 1
1 614 . 23 1 1 A 62 62 ILE N N 61 114.111 118.807 -4.696 1
1 615 . 23 1 1 A 63 63 TYR H H 62 7.273 7.787 -0.514 1
1 616 . 23 1 1 A 63 63 TYR HA H 62 4.343 4.241 0.102 1
1 623 . 23 1 1 A 63 63 TYR C C 62 178.264 178.596 -0.332 1
1 624 . 23 1 1 A 63 63 TYR CA C 62 57.231 60.980 -3.749 1
1 625 . 23 1 1 A 63 63 TYR CB C 62 36.332 37.402 -1.070 1
1 630 . 23 1 1 A 63 63 TYR N N 62 117.689 121.350 -3.661 1
1 631 . 23 1 1 A 64 64 THR H H 63 7.747 8.073 -0.326 1
1 632 . 23 1 1 A 64 64 THR HA H 63 4.266 4.236 0.030 1
1 637 . 23 1 1 A 64 64 THR CA C 63 69.362 67.562 1.800 1
1 638 . 23 1 1 A 64 64 THR CB C 63 66.962 67.832 -0.870 1
1 640 . 23 1 1 A 64 64 THR N N 63 113.755 116.273 -2.518 1
1 641 . 23 1 1 A 65 65 PRO HA H 64 4.372 4.391 -0.019 1
1 648 . 23 1 1 A 65 65 PRO C C 64 179.913 179.467 0.446 1
1 649 . 23 1 1 A 65 65 PRO CA C 64 66.011 66.296 -0.285 1
1 650 . 23 1 1 A 65 65 PRO CB C 64 30.642 30.776 -0.134 1
1 653 . 23 1 1 A 66 66 ILE H H 65 7.377 7.316 0.061 1
1 654 . 23 1 1 A 66 66 ILE HA H 65 3.530 3.893 -0.363 1
1 664 . 23 1 1 A 66 66 ILE C C 65 177.543 178.351 -0.808 1
1 665 . 23 1 1 A 66 66 ILE CA C 65 66.647 64.180 2.467 1
1 666 . 23 1 1 A 66 66 ILE CB C 65 38.029 37.537 0.492 1
1 670 . 23 1 1 A 66 66 ILE N N 65 118.353 116.554 1.799 1
1 671 . 23 1 1 A 67 67 PHE H H 66 8.480 8.390 0.090 1
1 672 . 23 1 1 A 67 67 PHE HA H 66 4.115 4.404 -0.289 1
1 680 . 23 1 1 A 67 67 PHE C C 66 177.293 178.492 -1.199 1
1 681 . 23 1 1 A 67 67 PHE CA C 66 59.570 61.656 -2.086 1
1 682 . 23 1 1 A 67 67 PHE CB C 66 38.865 39.465 -0.600 1
1 688 . 23 1 1 A 67 67 PHE N N 66 122.420 120.666 1.754 1
1 689 . 23 1 1 A 68 68 ASN H H 67 8.595 8.064 0.531 1
1 690 . 23 1 1 A 68 68 ASN HA H 67 4.211 4.401 -0.190 1
1 695 . 23 1 1 A 68 68 ASN C C 67 178.697 178.215 0.482 1
1 696 . 23 1 1 A 68 68 ASN CA C 67 56.056 56.186 -0.130 1
1 697 . 23 1 1 A 68 68 ASN CB C 67 37.704 37.952 -0.248 1
1 698 . 23 1 1 A 68 68 ASN N N 67 115.573 117.617 -2.044 1
1 700 . 23 1 1 A 69 69 GLU H H 68 8.414 8.005 0.409 1
1 701 . 23 1 1 A 69 69 GLU HA H 68 4.102 4.195 -0.093 1
1 706 . 23 1 1 A 69 69 GLU C C 68 177.880 178.866 -0.986 1
1 707 . 23 1 1 A 69 69 GLU CA C 68 59.399 59.376 0.023 1
1 708 . 23 1 1 A 69 69 GLU CB C 68 29.855 29.387 0.468 1
1 710 . 23 1 1 A 69 69 GLU N N 68 123.510 120.058 3.452 1
1 711 . 23 1 1 A 70 70 TYR H H 69 8.659 8.044 0.615 1
1 712 . 23 1 1 A 70 70 TYR HA H 69 3.362 4.134 -0.772 1
1 719 . 23 1 1 A 70 70 TYR C C 69 178.143 176.943 1.200 1
1 720 . 23 1 1 A 70 70 TYR CA C 69 60.686 61.306 -0.620 1
1 721 . 23 1 1 A 70 70 TYR CB C 69 38.560 38.822 -0.262 1
1 726 . 23 1 1 A 70 70 TYR N N 69 122.130 120.910 1.220 1
1 727 . 23 1 1 A 71 71 ILE H H 70 8.031 7.765 0.266 1
1 728 . 23 1 1 A 71 71 ILE HA H 70 3.265 3.614 -0.349 1
1 738 . 23 1 1 A 71 71 ILE C C 70 178.056 178.007 0.049 1
1 739 . 23 1 1 A 71 71 ILE CA C 70 63.756 63.975 -0.219 1
1 740 . 23 1 1 A 71 71 ILE CB C 70 37.321 36.370 0.951 1
1 744 . 23 1 1 A 71 71 ILE N N 70 118.906 120.385 -1.479 1
1 745 . 23 1 1 A 72 72 SER H H 71 7.803 8.091 -0.288 1
1 746 . 23 1 1 A 72 72 SER HA H 71 4.029 4.322 -0.293 1
1 749 . 23 1 1 A 72 72 SER CA C 71 61.380 61.434 -0.054 1
1 750 . 23 1 1 A 72 72 SER CB C 71 63.288 63.304 -0.016 1
1 751 . 23 1 1 A 72 72 SER N N 71 113.735 117.983 -4.248 1
1 752 . 23 1 1 A 73 73 LEU H H 72 7.952 7.852 0.100 1
1 753 . 23 1 1 A 73 73 LEU HA H 72 4.418 4.130 0.288 1
1 763 . 23 1 1 A 73 73 LEU C C 72 177.767 178.233 -0.466 1
1 764 . 23 1 1 A 73 73 LEU CA C 72 56.543 57.433 -0.890 1
1 765 . 23 1 1 A 73 73 LEU CB C 72 44.517 41.854 2.663 1
1 769 . 23 1 1 A 73 73 LEU N N 72 119.411 122.313 -2.902 1
1 770 . 23 1 1 A 74 74 VAL H H 73 8.021 7.648 0.373 1
1 771 . 23 1 1 A 74 74 VAL HA H 73 3.532 3.322 0.210 1
1 779 . 23 1 1 A 74 74 VAL C C 73 177.126 177.931 -0.805 1
1 780 . 23 1 1 A 74 74 VAL CA C 73 66.250 66.307 -0.057 1
1 781 . 23 1 1 A 74 74 VAL CB C 73 31.212 31.184 0.028 1
1 784 . 23 1 1 A 74 74 VAL N N 73 118.747 119.076 -0.329 1
1 785 . 23 1 1 A 75 75 GLU H H 74 7.232 7.851 -0.619 1
1 786 . 23 1 1 A 75 75 GLU HA H 74 3.013 3.966 -0.953 1
1 791 . 23 1 1 A 75 75 GLU C C 74 178.804 178.974 -0.170 1
1 792 . 23 1 1 A 75 75 GLU CA C 74 60.536 59.920 0.616 1
1 793 . 23 1 1 A 75 75 GLU CB C 74 27.009 28.993 -1.984 1
1 795 . 23 1 1 A 75 75 GLU N N 74 118.660 119.811 -1.151 1
1 796 . 23 1 1 A 76 76 LYS H H 75 7.051 7.541 -0.490 1
1 797 . 23 1 1 A 76 76 LYS HA H 75 3.765 3.997 -0.232 1
1 806 . 23 1 1 A 76 76 LYS C C 75 177.765 178.379 -0.614 1
1 807 . 23 1 1 A 76 76 LYS CA C 75 58.357 58.672 -0.315 1
1 808 . 23 1 1 A 76 76 LYS CB C 75 31.939 31.941 -0.002 1
1 812 . 23 1 1 A 76 76 LYS N N 75 116.112 119.797 -3.685 1
1 813 . 23 1 1 A 77 77 TYR H H 76 7.067 7.677 -0.610 1
1 814 . 23 1 1 A 77 77 TYR HA H 76 4.036 4.137 -0.101 1
1 821 . 23 1 1 A 77 77 TYR C C 76 177.752 177.113 0.639 1
1 822 . 23 1 1 A 77 77 TYR CA C 76 61.820 61.348 0.472 1
1 823 . 23 1 1 A 77 77 TYR CB C 76 38.480 38.576 -0.096 1
1 828 . 23 1 1 A 77 77 TYR N N 76 118.434 120.578 -2.144 1
1 829 . 23 1 1 A 78 78 ILE H H 77 7.554 8.249 -0.695 1
1 830 . 23 1 1 A 78 78 ILE HA H 77 3.159 3.576 -0.417 1
1 840 . 23 1 1 A 78 78 ILE C C 77 177.341 177.893 -0.552 1
1 841 . 23 1 1 A 78 78 ILE CA C 77 65.177 65.194 -0.017 1
1 842 . 23 1 1 A 78 78 ILE CB C 77 37.339 37.854 -0.515 1
1 846 . 23 1 1 A 78 78 ILE N N 77 117.672 121.363 -3.691 1
1 847 . 23 1 1 A 79 79 GLU H H 78 8.296 8.046 0.250 1
1 848 . 23 1 1 A 79 79 GLU HA H 78 3.557 3.734 -0.177 1
1 853 . 23 1 1 A 79 79 GLU C C 78 177.742 178.796 -1.054 1
1 854 . 23 1 1 A 79 79 GLU CA C 78 60.847 59.949 0.898 1
1 855 . 23 1 1 A 79 79 GLU CB C 78 29.594 29.189 0.405 1
1 857 . 23 1 1 A 79 79 GLU N N 78 118.701 120.725 -2.024 1
1 858 . 23 1 1 A 80 80 GLU H H 79 8.330 8.098 0.232 1
1 859 . 23 1 1 A 80 80 GLU HA H 79 3.774 4.000 -0.226 1
1 864 . 23 1 1 A 80 80 GLU C C 79 179.926 179.088 0.838 1
1 865 . 23 1 1 A 80 80 GLU CA C 79 59.581 58.883 0.698 1
1 866 . 23 1 1 A 80 80 GLU CB C 79 29.062 29.461 -0.399 1
1 868 . 23 1 1 A 80 80 GLU N N 79 116.767 118.613 -1.846 1
1 869 . 23 1 1 A 81 81 GLN H H 80 7.634 7.652 -0.018 1
1 870 . 23 1 1 A 81 81 GLN HA H 80 3.605 3.840 -0.235 1
1 877 . 23 1 1 A 81 81 GLN C C 80 179.681 178.671 1.010 1
1 878 . 23 1 1 A 81 81 GLN CA C 80 57.765 58.424 -0.659 1
1 879 . 23 1 1 A 81 81 GLN CB C 80 28.079 28.008 0.071 1
1 881 . 23 1 1 A 81 81 GLN N N 80 116.325 118.529 -2.204 1
1 883 . 23 1 1 A 82 82 LEU H H 81 8.156 7.560 0.596 1
1 884 . 23 1 1 A 82 82 LEU HA H 81 3.536 3.759 -0.223 1
1 894 . 23 1 1 A 82 82 LEU C C 81 178.945 179.165 -0.220 1
1 895 . 23 1 1 A 82 82 LEU CA C 81 57.761 56.855 0.906 1
1 896 . 23 1 1 A 82 82 LEU CB C 81 40.961 40.841 0.120 1
1 900 . 23 1 1 A 82 82 LEU N N 81 121.546 120.292 1.254 1
1 901 . 23 1 1 A 83 83 LEU H H 82 8.326 8.012 0.314 1
1 902 . 23 1 1 A 83 83 LEU HA H 82 4.198 4.204 -0.006 1
1 912 . 23 1 1 A 83 83 LEU C C 82 178.631 179.236 -0.605 1
1 913 . 23 1 1 A 83 83 LEU CA C 82 57.016 57.315 -0.299 1
1 914 . 23 1 1 A 83 83 LEU CB C 82 42.182 40.709 1.473 1
1 918 . 23 1 1 A 83 83 LEU N N 82 120.426 118.956 1.470 1
1 919 . 23 1 1 A 84 84 GLN H H 83 6.992 7.527 -0.535 1
1 920 . 23 1 1 A 84 84 GLN HA H 83 3.877 3.992 -0.115 1
1 927 . 23 1 1 A 84 84 GLN C C 83 177.008 176.964 0.044 1
1 928 . 23 1 1 A 84 84 GLN CA C 83 57.543 58.752 -1.209 1
1 929 . 23 1 1 A 84 84 GLN CB C 83 28.688 28.607 0.081 1
1 931 . 23 1 1 A 84 84 GLN N N 83 114.001 117.391 -3.390 1
1 933 . 23 1 1 A 85 85 ARG H H 84 7.072 7.431 -0.359 1
1 934 . 23 1 1 A 85 85 ARG HA H 84 4.047 4.384 -0.337 1
1 942 . 23 1 1 A 85 85 ARG C C 84 175.999 175.356 0.643 1
1 943 . 23 1 1 A 85 85 ARG CA C 84 56.764 55.745 1.019 1
1 944 . 23 1 1 A 85 85 ARG CB C 84 32.044 32.189 -0.145 1
1 947 . 23 1 1 A 85 85 ARG N N 84 115.827 116.406 -0.579 1
1 949 . 23 1 1 A 86 86 ILE H H 85 8.238 7.810 0.428 1
1 950 . 23 1 1 A 86 86 ILE HA H 85 4.389 4.583 -0.194 1
1 960 . 23 1 1 A 86 86 ILE CA C 85 58.007 57.905 0.102 1
1 961 . 23 1 1 A 86 86 ILE CB C 85 39.604 38.932 0.672 1
1 965 . 23 1 1 A 86 86 ILE N N 85 119.285 119.134 0.151 1
1 966 . 23 1 1 A 87 87 PRO HA H 86 4.392 4.534 -0.142 1
1 973 . 23 1 1 A 87 87 PRO C C 86 177.622 176.486 1.136 1
1 974 . 23 1 1 A 87 87 PRO CA C 86 64.665 64.251 0.414 1
1 975 . 23 1 1 A 87 87 PRO CB C 86 32.020 31.656 0.364 1
1 978 . 23 1 1 A 88 88 GLU H H 87 8.312 8.199 0.113 1
1 979 . 23 1 1 A 88 88 GLU HA H 87 4.208 4.548 -0.340 1
1 984 . 23 1 1 A 88 88 GLU C C 87 175.554 175.805 -0.251 1
1 985 . 23 1 1 A 88 88 GLU CA C 87 56.045 56.249 -0.204 1
1 986 . 23 1 1 A 88 88 GLU CB C 87 28.654 30.657 -2.003 1
1 988 . 23 1 1 A 88 88 GLU N N 87 114.256 116.682 -2.426 1
1 989 . 23 1 1 A 89 89 PHE H H 88 7.946 7.527 0.419 1
1 990 . 23 1 1 A 89 89 PHE HA H 88 3.993 4.428 -0.435 1
1 998 . 23 1 1 A 89 89 PHE C C 88 173.460 174.933 -1.473 1
1 999 . 23 1 1 A 89 89 PHE CA C 88 60.119 59.153 0.966 1
1 1000 . 23 1 1 A 89 89 PHE CB C 88 39.994 39.801 0.193 1
1 1006 . 23 1 1 A 89 89 PHE N N 88 121.550 123.231 -1.681 1
1 1007 . 23 1 1 A 90 90 ASN H H 89 7.266 7.802 -0.536 1
1 1008 . 23 1 1 A 90 90 ASN HA H 89 4.454 5.022 -0.568 1
1 1013 . 23 1 1 A 90 90 ASN C C 89 173.921 175.106 -1.185 1
1 1014 . 23 1 1 A 90 90 ASN CA C 89 51.839 51.931 -0.092 1
1 1015 . 23 1 1 A 90 90 ASN CB C 89 40.674 39.789 0.885 1
1 1016 . 23 1 1 A 90 90 ASN N N 89 125.344 124.819 0.525 1
1 1018 . 23 1 1 A 91 91 MET H H 90 8.968 8.968 0.000 1
1 1019 . 23 1 1 A 91 91 MET HA H 90 4.049 4.439 -0.390 1
1 1027 . 23 1 1 A 91 91 MET C C 90 177.475 178.051 -0.576 1
1 1028 . 23 1 1 A 91 91 MET CA C 90 57.758 58.335 -0.577 1
1 1029 . 23 1 1 A 91 91 MET CB C 90 32.250 31.367 0.883 1
1 1032 . 23 1 1 A 91 91 MET N N 90 127.052 124.572 2.480 1
1 1033 . 23 1 1 A 92 92 ALA H H 91 8.292 8.022 0.270 1
1 1034 . 23 1 1 A 92 92 ALA HA H 91 4.059 4.157 -0.098 1
1 1038 . 23 1 1 A 92 92 ALA C C 91 180.412 179.699 0.713 1
1 1039 . 23 1 1 A 92 92 ALA CA C 91 55.368 54.877 0.491 1
1 1040 . 23 1 1 A 92 92 ALA CB C 91 17.527 18.746 -1.219 1
1 1041 . 23 1 1 A 92 92 ALA N N 91 123.752 121.651 2.101 1
1 1042 . 23 1 1 A 93 93 ALA H H 92 7.931 7.890 0.041 1
1 1043 . 23 1 1 A 93 93 ALA HA H 92 4.054 4.097 -0.043 1
1 1047 . 23 1 1 A 93 93 ALA C C 92 180.482 179.921 0.561 1
1 1048 . 23 1 1 A 93 93 ALA CA C 92 54.614 54.899 -0.285 1
1 1049 . 23 1 1 A 93 93 ALA CB C 92 18.098 18.191 -0.093 1
1 1050 . 23 1 1 A 93 93 ALA N N 92 121.158 119.966 1.192 1
1 1051 . 23 1 1 A 94 94 PHE H H 93 8.110 7.839 0.271 1
1 1052 . 23 1 1 A 94 94 PHE HA H 93 4.304 4.155 0.149 1
1 1060 . 23 1 1 A 94 94 PHE C C 93 177.350 177.121 0.229 1
1 1061 . 23 1 1 A 94 94 PHE CA C 93 61.641 61.468 0.173 1
1 1062 . 23 1 1 A 94 94 PHE CB C 93 40.014 39.321 0.693 1
1 1068 . 23 1 1 A 94 94 PHE N N 93 119.807 119.899 -0.092 1
1 1069 . 23 1 1 A 95 95 THR H H 94 8.726 8.100 0.626 1
1 1070 . 23 1 1 A 95 95 THR HA H 94 3.569 3.855 -0.286 1
1 1075 . 23 1 1 A 95 95 THR C C 94 176.932 176.486 0.446 1
1 1076 . 23 1 1 A 95 95 THR CA C 94 66.833 65.289 1.544 1
1 1077 . 23 1 1 A 95 95 THR CB C 94 68.445 68.140 0.305 1
1 1079 . 23 1 1 A 95 95 THR N N 94 113.074 112.173 0.901 1
1 1080 . 23 1 1 A 96 96 THR H H 95 7.657 8.081 -0.424 1
1 1081 . 23 1 1 A 96 96 THR HA H 95 3.945 3.952 -0.007 1
1 1086 . 23 1 1 A 96 96 THR C C 95 176.386 176.484 -0.098 1
1 1087 . 23 1 1 A 96 96 THR CA C 95 66.550 65.685 0.865 1
1 1088 . 23 1 1 A 96 96 THR CB C 95 68.583 69.037 -0.454 1
1 1090 . 23 1 1 A 96 96 THR N N 95 117.927 117.984 -0.057 1
1 1091 . 23 1 1 A 97 97 THR H H 96 7.699 7.657 0.042 1
1 1092 . 23 1 1 A 97 97 THR HA H 96 3.905 4.081 -0.176 1
1 1097 . 23 1 1 A 97 97 THR C C 96 176.572 176.476 0.096 1
1 1098 . 23 1 1 A 97 97 THR CA C 96 65.979 66.350 -0.371 1
1 1099 . 23 1 1 A 97 97 THR CB C 96 68.553 68.476 0.077 1
1 1101 . 23 1 1 A 97 97 THR N N 96 118.518 117.227 1.291 1
1 1102 . 23 1 1 A 98 98 LEU H H 97 8.304 8.224 0.080 1
1 1103 . 23 1 1 A 98 98 LEU HA H 97 3.725 3.958 -0.233 1
1 1113 . 23 1 1 A 98 98 LEU C C 97 178.490 178.746 -0.256 1
1 1114 . 23 1 1 A 98 98 LEU CA C 97 58.517 58.060 0.457 1
1 1115 . 23 1 1 A 98 98 LEU CB C 97 41.697 41.118 0.579 1
1 1119 . 23 1 1 A 98 98 LEU N N 97 122.882 122.012 0.870 1
1 1120 . 23 1 1 A 99 99 GLN H H 98 7.639 7.946 -0.307 1
1 1121 . 23 1 1 A 99 99 GLN HA H 98 3.927 4.041 -0.114 1
1 1128 . 23 1 1 A 99 99 GLN C C 98 178.068 177.857 0.211 1
1 1129 . 23 1 1 A 99 99 GLN CA C 98 58.735 59.109 -0.374 1
1 1130 . 23 1 1 A 99 99 GLN CB C 98 27.986 28.282 -0.296 1
1 1132 . 23 1 1 A 99 99 GLN N N 98 114.302 118.255 -3.953 1
1 1134 . 23 1 1 A 100 100 HIS H H 99 7.575 7.661 -0.086 1
1 1135 . 23 1 1 A 100 100 HIS HA H 99 4.524 4.439 0.085 1
1 1139 . 23 1 1 A 100 100 HIS C C 99 174.789 177.541 -2.752 1
1 1140 . 23 1 1 A 100 100 HIS CA C 99 56.154 58.257 -2.103 1
1 1141 . 23 1 1 A 100 100 HIS CB C 99 28.946 30.968 -2.022 1
1 1143 . 23 1 1 A 100 100 HIS N N 99 114.778 118.125 -3.347 1
1 1144 . 23 1 1 A 101 101 HIS H H 100 7.773 8.115 -0.342 1
1 1145 . 23 1 1 A 101 101 HIS HA H 100 4.704 3.986 0.718 1
1 1149 . 23 1 1 A 101 101 HIS C C 100 174.818 176.928 -2.110 1
1 1150 . 23 1 1 A 101 101 HIS CA C 100 54.830 58.252 -3.422 1
1 1151 . 23 1 1 A 101 101 HIS CB C 100 29.749 30.055 -0.306 1
1 1153 . 23 1 1 A 101 101 HIS N N 100 117.397 119.153 -1.756 1
1 1154 . 23 1 1 A 102 102 LYS H H 101 7.324 8.140 -0.816 1
1 1155 . 23 1 1 A 102 102 LYS HA H 101 3.611 4.078 -0.467 1
1 1164 . 23 1 1 A 102 102 LYS C C 101 176.823 178.710 -1.887 1
1 1165 . 23 1 1 A 102 102 LYS CA C 101 59.915 58.905 1.010 1
1 1166 . 23 1 1 A 102 102 LYS CB C 101 32.825 32.258 0.567 1
1 1170 . 23 1 1 A 102 102 LYS N N 101 120.533 117.549 2.984 1
1 1171 . 23 1 1 A 103 103 ASP H H 102 8.361 8.764 -0.403 1
1 1172 . 23 1 1 A 103 103 ASP HA H 102 4.421 4.372 0.049 1
1 1175 . 23 1 1 A 103 103 ASP C C 102 176.793 176.960 -0.167 1
1 1176 . 23 1 1 A 103 103 ASP CA C 102 55.500 54.934 0.566 1
1 1177 . 23 1 1 A 103 103 ASP CB C 102 40.178 39.425 0.753 1
1 1178 . 23 1 1 A 103 103 ASP N N 102 114.814 118.227 -3.413 1
1 1179 . 23 1 1 A 104 104 GLU H H 103 7.858 8.198 -0.340 1
1 1180 . 23 1 1 A 104 104 GLU HA H 103 4.339 4.606 -0.267 1
1 1183 . 23 1 1 A 104 104 GLU C C 103 175.777 175.960 -0.183 1
1 1184 . 23 1 1 A 104 104 GLU CA C 103 56.356 57.924 -1.568 1
1 1185 . 23 1 1 A 104 104 GLU CB C 103 31.293 32.063 -0.770 1
1 1186 . 23 1 1 A 104 104 GLU N N 103 116.826 118.531 -1.705 1
1 1187 . 23 1 1 A 105 105 VAL H H 104 7.201 7.226 -0.025 1
1 1188 . 23 1 1 A 105 105 VAL HA H 104 4.296 4.253 0.043 1
1 1196 . 23 1 1 A 105 105 VAL C C 104 174.482 175.734 -1.252 1
1 1197 . 23 1 1 A 105 105 VAL CA C 104 60.370 61.804 -1.434 1
1 1198 . 23 1 1 A 105 105 VAL CB C 104 34.341 33.126 1.215 1
1 1201 . 23 1 1 A 105 105 VAL N N 104 116.422 116.364 0.058 1
1 1202 . 23 1 1 A 106 106 ALA H H 105 8.487 8.639 -0.152 1
1 1203 . 23 1 1 A 106 106 ALA HA H 105 4.172 4.394 -0.222 1
1 1207 . 23 1 1 A 106 106 ALA C C 105 179.030 178.209 0.821 1
1 1208 . 23 1 1 A 106 106 ALA CA C 105 52.966 51.711 1.255 1
1 1209 . 23 1 1 A 106 106 ALA CB C 105 19.371 18.794 0.577 1
1 1210 . 23 1 1 A 106 106 ALA N N 105 128.313 126.274 2.039 1
1 1211 . 23 1 1 A 107 107 GLY H H 106 8.738 8.748 -0.010 1
1 1212 . 23 1 1 A 107 107 GLY HA2 H 106 3.773 3.865 -0.092 1
1 1213 . 23 1 1 A 107 107 GLY HA3 H 106 3.998 3.928 0.070 1
1 1214 . 23 1 1 A 107 107 GLY C C 106 174.958 175.425 -0.467 1
1 1215 . 23 1 1 A 107 107 GLY CA C 106 47.449 47.219 0.230 1
1 1216 . 23 1 1 A 107 107 GLY N N 106 110.612 110.584 0.028 1
1 1217 . 23 1 1 A 108 108 ASP H H 107 8.535 7.837 0.698 1
1 1218 . 23 1 1 A 108 108 ASP HA H 107 4.333 4.370 -0.037 1
1 1221 . 23 1 1 A 108 108 ASP C C 107 179.133 178.914 0.219 1
1 1222 . 23 1 1 A 108 108 ASP CA C 107 56.721 56.433 0.288 1
1 1223 . 23 1 1 A 108 108 ASP CB C 107 39.336 40.472 -1.136 1
1 1224 . 23 1 1 A 108 108 ASP N N 107 117.474 122.121 -4.647 1
1 1225 . 23 1 1 A 109 109 ILE H H 108 7.459 7.888 -0.429 1
1 1226 . 23 1 1 A 109 109 ILE HA H 108 3.688 3.827 -0.139 1
1 1236 . 23 1 1 A 109 109 ILE C C 108 176.735 178.426 -1.691 1
1 1237 . 23 1 1 A 109 109 ILE CA C 108 63.474 65.346 -1.872 1
1 1238 . 23 1 1 A 109 109 ILE CB C 108 37.340 37.629 -0.289 1
1 1242 . 23 1 1 A 109 109 ILE N N 108 119.609 119.885 -0.276 1
1 1243 . 23 1 1 A 110 110 PHE H H 109 7.920 8.357 -0.437 1
1 1244 . 23 1 1 A 110 110 PHE HA H 109 3.759 4.086 -0.327 1
1 1252 . 23 1 1 A 110 110 PHE C C 109 177.132 177.381 -0.249 1
1 1253 . 23 1 1 A 110 110 PHE CA C 109 62.766 61.240 1.526 1
1 1254 . 23 1 1 A 110 110 PHE CB C 109 39.752 39.309 0.443 1
1 1260 . 23 1 1 A 110 110 PHE N N 109 120.906 120.438 0.468 1
1 1261 . 23 1 1 A 111 111 ASP H H 110 8.639 8.229 0.410 1
1 1262 . 23 1 1 A 111 111 ASP HA H 110 4.216 4.216 0.000 1
1 1265 . 23 1 1 A 111 111 ASP C C 110 178.900 178.372 0.528 1
1 1266 . 23 1 1 A 111 111 ASP CA C 110 57.105 57.278 -0.173 1
1 1267 . 23 1 1 A 111 111 ASP CB C 110 39.697 41.800 -2.103 1
1 1268 . 23 1 1 A 111 111 ASP N N 110 117.124 119.048 -1.924 1
1 1269 . 23 1 1 A 112 112 MET H H 111 7.331 7.528 -0.197 1
1 1270 . 23 1 1 A 112 112 MET HA H 111 4.081 4.123 -0.042 1
1 1278 . 23 1 1 A 112 112 MET C C 111 179.052 178.127 0.925 1
1 1279 . 23 1 1 A 112 112 MET CA C 111 58.202 58.101 0.101 1
1 1280 . 23 1 1 A 112 112 MET CB C 111 31.827 32.436 -0.609 1
1 1283 . 23 1 1 A 112 112 MET N N 111 118.061 119.422 -1.361 1
1 1284 . 23 1 1 A 113 113 LEU H H 112 8.001 8.016 -0.015 1
1 1285 . 23 1 1 A 113 113 LEU HA H 112 3.723 3.490 0.233 1
1 1295 . 23 1 1 A 113 113 LEU C C 112 179.747 178.572 1.175 1
1 1296 . 23 1 1 A 113 113 LEU CA C 112 57.371 57.330 0.041 1
1 1297 . 23 1 1 A 113 113 LEU CB C 112 40.671 41.131 -0.460 1
1 1301 . 23 1 1 A 113 113 LEU N N 112 120.426 119.622 0.804 1
1 1302 . 23 1 1 A 114 114 LEU H H 113 7.744 7.677 0.067 1
1 1303 . 23 1 1 A 114 114 LEU HA H 113 4.007 3.436 0.571 1
1 1313 . 23 1 1 A 114 114 LEU C C 113 179.358 178.492 0.866 1
1 1314 . 23 1 1 A 114 114 LEU CA C 113 57.202 57.460 -0.258 1
1 1315 . 23 1 1 A 114 114 LEU CB C 113 41.727 41.582 0.145 1
1 1319 . 23 1 1 A 114 114 LEU N N 113 119.584 119.491 0.093 1
1 1320 . 23 1 1 A 115 115 THR H H 114 7.353 7.539 -0.186 1
1 1321 . 23 1 1 A 115 115 THR HA H 114 4.071 4.075 -0.004 1
1 1327 . 23 1 1 A 115 115 THR C C 114 173.591 176.505 -2.914 1
1 1328 . 23 1 1 A 115 115 THR CA C 114 65.332 64.614 0.718 1
1 1329 . 23 1 1 A 115 115 THR CB C 114 70.319 68.561 1.758 1
1 1331 . 23 1 1 A 115 115 THR N N 114 107.535 112.326 -4.791 1
1 1332 . 23 1 1 A 116 116 PHE H H 115 6.979 7.825 -0.846 1
1 1333 . 23 1 1 A 116 116 PHE HA H 115 5.022 4.259 0.763 1
1 1341 . 23 1 1 A 116 116 PHE C C 115 176.488 176.534 -0.046 1
1 1342 . 23 1 1 A 116 116 PHE CA C 115 55.911 60.909 -4.998 1
1 1343 . 23 1 1 A 116 116 PHE CB C 115 38.521 39.051 -0.530 1
1 1349 . 23 1 1 A 116 116 PHE N N 115 112.366 119.927 -7.561 1
1 1350 . 23 1 1 A 117 117 THR H H 116 7.564 7.479 0.085 1
1 1351 . 23 1 1 A 117 117 THR HA H 116 4.626 4.751 -0.125 1
1 1356 . 23 1 1 A 117 117 THR C C 116 174.085 174.493 -0.408 1
1 1357 . 23 1 1 A 117 117 THR CA C 116 61.636 62.375 -0.739 1
1 1358 . 23 1 1 A 117 117 THR CB C 116 70.915 70.423 0.492 1
1 1360 . 23 1 1 A 117 117 THR N N 116 105.498 106.479 -0.981 1
1 1361 . 23 1 1 A 118 118 ASP H H 117 8.270 7.432 0.838 1
1 1362 . 23 1 1 A 118 118 ASP HA H 117 4.955 4.954 0.001 1
1 1365 . 23 1 1 A 118 118 ASP C C 117 176.328 176.385 -0.057 1
1 1366 . 23 1 1 A 118 118 ASP CA C 117 53.417 53.839 -0.422 1
1 1367 . 23 1 1 A 118 118 ASP CB C 117 43.388 39.288 4.100 1
1 1368 . 23 1 1 A 118 118 ASP N N 117 124.409 122.154 2.255 1
1 1369 . 23 1 1 A 119 119 PHE H H 118 8.973 8.764 0.209 1
1 1370 . 23 1 1 A 119 119 PHE HA H 118 3.506 4.202 -0.696 1
1 1378 . 23 1 1 A 119 119 PHE CA C 118 61.490 61.214 0.276 1
1 1379 . 23 1 1 A 119 119 PHE CB C 118 39.246 39.576 -0.330 1
1 1385 . 23 1 1 A 119 119 PHE N N 118 126.688 125.889 0.799 1
1 1386 . 23 1 1 A 120 120 LEU H H 119 8.099 8.298 -0.199 1
1 1387 . 23 1 1 A 120 120 LEU HA H 119 3.842 3.966 -0.124 1
1 1397 . 23 1 1 A 120 120 LEU C C 119 179.601 179.471 0.130 1
1 1398 . 23 1 1 A 120 120 LEU CA C 119 58.174 57.953 0.221 1
1 1399 . 23 1 1 A 120 120 LEU CB C 119 40.315 41.068 -0.753 1
1 1403 . 23 1 1 A 120 120 LEU N N 119 117.930 119.840 -1.910 1
1 1404 . 23 1 1 A 121 121 ALA H H 120 7.729 7.635 0.094 1
1 1405 . 23 1 1 A 121 121 ALA HA H 120 3.996 4.086 -0.090 1
1 1409 . 23 1 1 A 121 121 ALA C C 120 180.995 179.810 1.185 1
1 1410 . 23 1 1 A 121 121 ALA CA C 120 54.832 54.586 0.246 1
1 1411 . 23 1 1 A 121 121 ALA CB C 120 17.706 18.203 -0.497 1
1 1412 . 23 1 1 A 121 121 ALA N N 120 123.195 121.393 1.802 1
1 1413 . 23 1 1 A 122 122 PHE H H 121 7.943 7.773 0.170 1
1 1414 . 23 1 1 A 122 122 PHE HA H 121 3.887 3.823 0.064 1
1 1419 . 23 1 1 A 122 122 PHE C C 121 175.410 176.865 -1.455 1
1 1420 . 23 1 1 A 122 122 PHE CA C 121 61.075 60.703 0.372 1
1 1421 . 23 1 1 A 122 122 PHE CB C 121 38.115 38.913 -0.798 1
1 1424 . 23 1 1 A 122 122 PHE N N 121 121.798 120.292 1.506 1
1 1425 . 23 1 1 A 123 123 LYS H H 122 8.468 7.975 0.493 1
1 1426 . 23 1 1 A 123 123 LYS HA H 122 3.077 3.680 -0.603 1
1 1435 . 23 1 1 A 123 123 LYS C C 122 178.453 178.738 -0.285 1
1 1436 . 23 1 1 A 123 123 LYS CA C 122 59.855 59.947 -0.092 1
1 1437 . 23 1 1 A 123 123 LYS CB C 122 32.374 32.518 -0.144 1
1 1441 . 23 1 1 A 123 123 LYS N N 122 120.614 118.282 2.332 1
1 1442 . 23 1 1 A 124 124 GLU H H 123 8.100 7.947 0.153 1
1 1443 . 23 1 1 A 124 124 GLU HA H 123 3.652 4.006 -0.354 1
1 1448 . 23 1 1 A 124 124 GLU C C 123 177.743 178.430 -0.687 1
1 1449 . 23 1 1 A 124 124 GLU CA C 123 59.406 59.556 -0.150 1
1 1450 . 23 1 1 A 124 124 GLU CB C 123 28.811 29.090 -0.279 1
1 1452 . 23 1 1 A 124 124 GLU N N 123 117.404 118.772 -1.368 1
1 1453 . 23 1 1 A 125 125 MET H H 124 7.537 7.577 -0.040 1
1 1454 . 23 1 1 A 125 125 MET HA H 124 3.860 3.931 -0.071 1
1 1462 . 23 1 1 A 125 125 MET C C 124 179.522 178.368 1.154 1
1 1463 . 23 1 1 A 125 125 MET CA C 124 58.832 58.479 0.353 1
1 1464 . 23 1 1 A 125 125 MET CB C 124 31.765 31.340 0.425 1
1 1467 . 23 1 1 A 125 125 MET N N 124 119.413 118.891 0.522 1
1 1468 . 23 1 1 A 126 126 PHE H H 125 7.148 7.468 -0.320 1
1 1469 . 23 1 1 A 126 126 PHE HA H 125 3.633 4.264 -0.631 1
1 1476 . 23 1 1 A 126 126 PHE C C 125 178.994 178.258 0.736 1
1 1477 . 23 1 1 A 126 126 PHE CA C 125 63.148 60.902 2.246 1
1 1478 . 23 1 1 A 126 126 PHE CB C 125 39.830 38.461 1.369 1
1 1483 . 23 1 1 A 126 126 PHE N N 125 120.013 118.818 1.195 1
1 1484 . 23 1 1 A 127 127 LEU H H 126 8.369 8.236 0.133 1
1 1485 . 23 1 1 A 127 127 LEU HA H 126 3.972 4.025 -0.053 1
1 1495 . 23 1 1 A 127 127 LEU C C 126 180.621 179.339 1.282 1
1 1496 . 23 1 1 A 127 127 LEU CA C 126 57.944 57.632 0.312 1
1 1497 . 23 1 1 A 127 127 LEU CB C 126 40.543 41.075 -0.532 1
1 1501 . 23 1 1 A 127 127 LEU N N 126 119.692 119.528 0.164 1
1 1502 . 23 1 1 A 128 128 ASP H H 127 8.578 8.134 0.444 1
1 1503 . 23 1 1 A 128 128 ASP HA H 127 4.308 4.354 -0.046 1
1 1506 . 23 1 1 A 128 128 ASP C C 127 178.254 178.145 0.109 1
1 1507 . 23 1 1 A 128 128 ASP CA C 127 56.964 57.236 -0.272 1
1 1508 . 23 1 1 A 128 128 ASP CB C 127 39.735 40.928 -1.193 1
1 1509 . 23 1 1 A 128 128 ASP N N 127 121.926 119.912 2.014 1
1 1510 . 23 1 1 A 129 129 TYR H H 128 7.710 8.026 -0.316 1
1 1511 . 23 1 1 A 129 129 TYR HA H 128 3.908 4.061 -0.153 1
1 1518 . 23 1 1 A 129 129 TYR C C 128 177.633 177.614 0.019 1
1 1519 . 23 1 1 A 129 129 TYR CA C 128 61.796 61.567 0.229 1
1 1520 . 23 1 1 A 129 129 TYR CB C 128 39.372 38.546 0.826 1
1 1525 . 23 1 1 A 129 129 TYR N N 128 122.548 120.086 2.462 1
1 1526 . 23 1 1 A 130 130 ARG H H 129 8.622 8.593 0.029 1
1 1527 . 23 1 1 A 130 130 ARG HA H 129 3.722 4.059 -0.337 1
1 1535 . 23 1 1 A 130 130 ARG CA C 129 60.084 59.792 0.292 1
1 1536 . 23 1 1 A 130 130 ARG CB C 129 29.902 30.022 -0.120 1
1 1539 . 23 1 1 A 130 130 ARG N N 129 118.302 119.343 -1.041 1
1 1541 . 23 1 1 A 131 131 ALA H H 130 7.936 8.263 -0.327 1
1 1542 . 23 1 1 A 131 131 ALA HA H 130 3.997 4.025 -0.028 1
1 1546 . 23 1 1 A 131 131 ALA C C 130 180.456 179.714 0.742 1
1 1547 . 23 1 1 A 131 131 ALA CA C 130 55.133 55.058 0.075 1
1 1548 . 23 1 1 A 131 131 ALA CB C 130 17.750 18.227 -0.477 1
1 1549 . 23 1 1 A 131 131 ALA N N 130 119.788 121.391 -1.603 1
1 1550 . 23 1 1 A 132 132 GLU H H 131 7.622 7.723 -0.101 1
1 1551 . 23 1 1 A 132 132 GLU HA H 131 3.862 3.996 -0.134 1
1 1556 . 23 1 1 A 132 132 GLU C C 131 179.528 179.011 0.517 1
1 1557 . 23 1 1 A 132 132 GLU CA C 131 58.849 58.941 -0.092 1
1 1558 . 23 1 1 A 132 132 GLU CB C 131 28.930 29.447 -0.517 1
1 1560 . 23 1 1 A 132 132 GLU N N 131 118.428 118.857 -0.429 1
1 1561 . 23 1 1 A 133 133 LYS H H 132 7.853 7.791 0.062 1
1 1562 . 23 1 1 A 133 133 LYS HA H 132 3.722 3.999 -0.277 1
1 1571 . 23 1 1 A 133 133 LYS C C 132 175.725 178.477 -2.752 1
1 1572 . 23 1 1 A 133 133 LYS CA C 132 57.544 58.870 -1.326 1
1 1573 . 23 1 1 A 133 133 LYS CB C 132 31.770 31.889 -0.119 1
1 1577 . 23 1 1 A 133 133 LYS N N 132 119.473 118.714 0.759 1
1 1578 . 23 1 1 A 134 134 GLU H H 133 8.151 7.867 0.284 1
1 1579 . 23 1 1 A 134 134 GLU HA H 133 4.161 4.298 -0.137 1
1 1584 . 23 1 1 A 134 134 GLU C C 133 177.453 178.901 -1.448 1
1 1585 . 23 1 1 A 134 134 GLU CA C 133 57.222 57.351 -0.129 1
1 1586 . 23 1 1 A 134 134 GLU CB C 133 30.091 29.941 0.150 1
1 1588 . 23 1 1 A 134 134 GLU N N 133 116.525 118.497 -1.972 1
1 1589 . 23 1 1 A 135 135 GLY H H 134 7.702 7.991 -0.289 1
1 1590 . 23 1 1 A 135 135 GLY HA2 H 134 3.896 3.793 0.103 1
1 1591 . 23 1 1 A 135 135 GLY HA3 H 134 3.897 3.802 0.095 1
1 1592 . 23 1 1 A 135 135 GLY C C 134 174.538 174.431 0.107 1
1 1593 . 23 1 1 A 135 135 GLY CA C 134 45.975 46.844 -0.869 1
1 1594 . 23 1 1 A 135 135 GLY N N 134 107.924 108.445 -0.521 1
1 1595 . 23 1 1 A 136 136 ARG H H 135 8.045 7.674 0.371 1
1 1596 . 23 1 1 A 136 136 ARG HA H 135 4.323 4.694 -0.371 1
1 1604 . 23 1 1 A 136 136 ARG C C 135 175.864 176.109 -0.245 1
1 1605 . 23 1 1 A 136 136 ARG CA C 135 56.016 56.087 -0.071 1
1 1606 . 23 1 1 A 136 136 ARG CB C 135 30.987 31.763 -0.776 1
1 1609 . 23 1 1 A 136 136 ARG N N 135 119.708 119.142 0.566 1
1 1 . 24 1 1 A 14 14 PHE CA C 13 58.199 58.663 -0.464 1
1 2 . 24 1 1 A 14 14 PHE CB C 13 39.717 39.051 0.666 1
1 3 . 24 1 1 A 15 15 SER H H 14 8.299 8.608 -0.309 1
1 4 . 24 1 1 A 15 15 SER HA H 14 4.359 4.689 -0.330 1
1 7 . 24 1 1 A 15 15 SER CA C 14 58.249 57.407 0.842 1
1 8 . 24 1 1 A 15 15 SER CB C 14 63.936 67.308 -3.372 1
1 9 . 24 1 1 A 15 15 SER N N 14 117.379 123.906 -6.527 1
1 10 . 24 1 1 A 16 16 SER H H 15 8.255 8.700 -0.445 1
1 11 . 24 1 1 A 16 16 SER HA H 15 3.729 4.551 -0.822 1
1 14 . 24 1 1 A 16 16 SER CA C 15 58.224 60.391 -2.167 1
1 15 . 24 1 1 A 16 16 SER CB C 15 63.886 64.576 -0.690 1
1 16 . 24 1 1 A 16 16 SER N N 15 117.694 118.522 -0.828 1
1 17 . 24 1 1 A 17 17 ALA H H 16 8.333 8.046 0.287 1
1 18 . 24 1 1 A 17 17 ALA HA H 16 4.252 4.453 -0.201 1
1 22 . 24 1 1 A 17 17 ALA CA C 16 53.377 54.202 -0.825 1
1 23 . 24 1 1 A 17 17 ALA CB C 16 18.896 18.483 0.413 1
1 24 . 24 1 1 A 17 17 ALA N N 16 125.462 123.786 1.676 1
1 25 . 24 1 1 A 18 18 SER H H 17 8.219 7.863 0.356 1
1 26 . 24 1 1 A 18 18 SER HA H 17 4.332 4.790 -0.458 1
1 29 . 24 1 1 A 18 18 SER CA C 17 59.105 56.173 2.932 1
1 30 . 24 1 1 A 18 18 SER CB C 17 63.592 65.425 -1.833 1
1 31 . 24 1 1 A 18 18 SER N N 17 114.821 109.821 5.000 1
1 32 . 24 1 1 A 19 19 ASP H H 18 8.309 8.979 -0.670 1
1 33 . 24 1 1 A 19 19 ASP HA H 18 4.554 4.399 0.155 1
1 36 . 24 1 1 A 19 19 ASP C C 18 176.528 176.662 -0.134 1
1 37 . 24 1 1 A 19 19 ASP CA C 18 55.272 56.258 -0.986 1
1 38 . 24 1 1 A 19 19 ASP CB C 18 40.883 39.391 1.492 1
1 39 . 24 1 1 A 19 19 ASP N N 18 123.367 120.429 2.938 1
1 40 . 24 1 1 A 20 20 ALA H H 19 8.133 8.756 -0.623 1
1 41 . 24 1 1 A 20 20 ALA HA H 19 4.170 4.059 0.111 1
1 45 . 24 1 1 A 20 20 ALA C C 19 179.857 179.674 0.183 1
1 46 . 24 1 1 A 20 20 ALA CA C 19 54.341 54.942 -0.601 1
1 47 . 24 1 1 A 20 20 ALA CB C 19 18.660 18.211 0.449 1
1 48 . 24 1 1 A 20 20 ALA N N 19 123.350 124.811 -1.461 1
1 49 . 24 1 1 A 21 21 GLU H H 20 8.140 8.184 -0.044 1
1 50 . 24 1 1 A 21 21 GLU HA H 20 4.128 4.056 0.072 1
1 55 . 24 1 1 A 21 21 GLU C C 20 177.675 178.496 -0.821 1
1 56 . 24 1 1 A 21 21 GLU CA C 20 58.520 59.578 -1.058 1
1 57 . 24 1 1 A 21 21 GLU CB C 20 29.765 29.511 0.254 1
1 59 . 24 1 1 A 21 21 GLU N N 20 119.063 119.482 -0.419 1
1 60 . 24 1 1 A 22 22 PHE H H 21 8.009 7.946 0.063 1
1 61 . 24 1 1 A 22 22 PHE HA H 21 4.123 4.229 -0.106 1
1 68 . 24 1 1 A 22 22 PHE C C 21 176.410 177.364 -0.954 1
1 69 . 24 1 1 A 22 22 PHE CA C 21 62.202 61.355 0.847 1
1 70 . 24 1 1 A 22 22 PHE CB C 21 39.223 39.479 -0.256 1
1 75 . 24 1 1 A 22 22 PHE N N 21 121.211 120.980 0.231 1
1 76 . 24 1 1 A 23 23 ASP H H 22 8.261 8.359 -0.098 1
1 77 . 24 1 1 A 23 23 ASP HA H 22 4.041 4.345 -0.304 1
1 80 . 24 1 1 A 23 23 ASP C C 22 179.078 178.643 0.435 1
1 81 . 24 1 1 A 23 23 ASP CA C 22 57.048 57.231 -0.183 1
1 82 . 24 1 1 A 23 23 ASP CB C 22 40.154 40.050 0.104 1
1 83 . 24 1 1 A 23 23 ASP N N 22 116.876 118.842 -1.966 1
1 84 . 24 1 1 A 24 24 ALA H H 23 7.651 7.664 -0.013 1
1 85 . 24 1 1 A 24 24 ALA HA H 23 3.785 3.881 -0.096 1
1 89 . 24 1 1 A 24 24 ALA C C 23 179.577 179.832 -0.255 1
1 90 . 24 1 1 A 24 24 ALA CA C 23 54.341 55.117 -0.776 1
1 91 . 24 1 1 A 24 24 ALA CB C 23 17.762 18.216 -0.454 1
1 92 . 24 1 1 A 24 24 ALA N N 23 121.873 122.576 -0.703 1
1 93 . 24 1 1 A 25 25 VAL H H 24 7.718 7.833 -0.115 1
1 94 . 24 1 1 A 25 25 VAL HA H 24 3.216 3.648 -0.432 1
1 102 . 24 1 1 A 25 25 VAL C C 24 177.805 178.393 -0.588 1
1 103 . 24 1 1 A 25 25 VAL CA C 24 66.789 66.854 -0.065 1
1 104 . 24 1 1 A 25 25 VAL CB C 24 31.277 31.229 0.048 1
1 107 . 24 1 1 A 25 25 VAL N N 24 117.890 118.658 -0.768 1
1 108 . 24 1 1 A 26 26 VAL H H 25 7.867 7.721 0.146 1
1 109 . 24 1 1 A 26 26 VAL HA H 25 3.274 3.577 -0.303 1
1 117 . 24 1 1 A 26 26 VAL C C 25 177.788 177.934 -0.146 1
1 118 . 24 1 1 A 26 26 VAL CA C 25 67.282 66.260 1.022 1
1 119 . 24 1 1 A 26 26 VAL CB C 25 31.266 31.359 -0.093 1
1 122 . 24 1 1 A 26 26 VAL N N 25 118.170 119.967 -1.797 1
1 123 . 24 1 1 A 27 27 GLY H H 26 7.544 7.703 -0.159 1
1 124 . 24 1 1 A 27 27 GLY HA2 H 26 3.592 3.490 0.102 1
1 125 . 24 1 1 A 27 27 GLY HA3 H 26 3.721 3.613 0.108 1
1 126 . 24 1 1 A 27 27 GLY C C 26 176.717 176.515 0.202 1
1 127 . 24 1 1 A 27 27 GLY CA C 26 47.085 47.187 -0.102 1
1 128 . 24 1 1 A 27 27 GLY N N 26 105.795 107.717 -1.922 1
1 129 . 24 1 1 A 28 28 TYR H H 27 7.625 7.389 0.236 1
1 130 . 24 1 1 A 28 28 TYR HA H 27 4.546 4.574 -0.028 1
1 137 . 24 1 1 A 28 28 TYR C C 27 178.991 178.120 0.871 1
1 138 . 24 1 1 A 28 28 TYR CA C 27 58.845 59.660 -0.815 1
1 139 . 24 1 1 A 28 28 TYR CB C 27 37.602 37.522 0.080 1
1 144 . 24 1 1 A 28 28 TYR N N 27 119.933 121.754 -1.821 1
1 145 . 24 1 1 A 29 29 LEU H H 28 8.517 8.281 0.236 1
1 146 . 24 1 1 A 29 29 LEU HA H 28 3.728 3.838 -0.110 1
1 156 . 24 1 1 A 29 29 LEU CA C 28 58.281 57.911 0.370 1
1 157 . 24 1 1 A 29 29 LEU CB C 28 41.948 41.380 0.568 1
1 161 . 24 1 1 A 29 29 LEU N N 28 119.669 120.124 -0.455 1
1 162 . 24 1 1 A 30 30 GLU H H 29 8.072 7.941 0.131 1
1 163 . 24 1 1 A 30 30 GLU HA H 29 3.722 3.875 -0.153 1
1 168 . 24 1 1 A 30 30 GLU C C 29 177.731 179.081 -1.350 1
1 169 . 24 1 1 A 30 30 GLU CA C 29 59.763 59.951 -0.188 1
1 170 . 24 1 1 A 30 30 GLU CB C 29 28.844 29.267 -0.423 1
1 172 . 24 1 1 A 30 30 GLU N N 29 117.666 117.965 -0.299 1
1 173 . 24 1 1 A 31 31 ASP H H 30 7.243 7.995 -0.752 1
1 174 . 24 1 1 A 31 31 ASP HA H 30 4.297 4.405 -0.108 1
1 177 . 24 1 1 A 31 31 ASP CA C 30 56.953 57.182 -0.229 1
1 178 . 24 1 1 A 31 31 ASP CB C 30 40.730 41.680 -0.950 1
1 179 . 24 1 1 A 31 31 ASP N N 30 116.720 119.074 -2.354 1
1 180 . 24 1 1 A 32 32 ILE H H 31 7.940 7.426 0.514 1
1 181 . 24 1 1 A 32 32 ILE HA H 31 3.640 3.744 -0.104 1
1 191 . 24 1 1 A 32 32 ILE C C 31 177.980 178.241 -0.261 1
1 192 . 24 1 1 A 32 32 ILE CA C 31 64.692 64.140 0.552 1
1 193 . 24 1 1 A 32 32 ILE CB C 31 38.938 37.718 1.220 1
1 197 . 24 1 1 A 32 32 ILE N N 31 119.728 118.425 1.303 1
1 198 . 24 1 1 A 33 33 ILE H H 32 7.984 7.861 0.123 1
1 199 . 24 1 1 A 33 33 ILE HA H 32 3.598 3.197 0.401 1
1 209 . 24 1 1 A 33 33 ILE C C 32 176.723 176.962 -0.239 1
1 210 . 24 1 1 A 33 33 ILE CA C 32 63.241 64.596 -1.355 1
1 211 . 24 1 1 A 33 33 ILE CB C 32 37.580 37.769 -0.189 1
1 215 . 24 1 1 A 33 33 ILE N N 32 113.919 120.452 -6.533 1
1 216 . 24 1 1 A 34 34 MET H H 33 7.288 7.615 -0.327 1
1 217 . 24 1 1 A 34 34 MET HA H 33 4.496 4.688 -0.192 1
1 225 . 24 1 1 A 34 34 MET C C 33 176.423 175.794 0.629 1
1 226 . 24 1 1 A 34 34 MET CA C 33 54.634 54.280 0.354 1
1 227 . 24 1 1 A 34 34 MET CB C 33 31.934 31.947 -0.013 1
1 230 . 24 1 1 A 34 34 MET N N 33 115.130 116.859 -1.729 1
1 231 . 24 1 1 A 35 35 ASP H H 34 7.405 7.764 -0.359 1
1 232 . 24 1 1 A 35 35 ASP HA H 34 4.484 4.537 -0.053 1
1 235 . 24 1 1 A 35 35 ASP C C 34 177.139 176.917 0.222 1
1 236 . 24 1 1 A 35 35 ASP CA C 34 54.625 54.718 -0.093 1
1 237 . 24 1 1 A 35 35 ASP CB C 34 43.554 42.674 0.880 1
1 238 . 24 1 1 A 35 35 ASP N N 34 121.814 121.875 -0.061 1
1 239 . 24 1 1 A 36 36 ASP H H 35 8.765 9.056 -0.291 1
1 240 . 24 1 1 A 36 36 ASP HA H 35 4.235 4.300 -0.065 1
1 243 . 24 1 1 A 36 36 ASP C C 35 178.320 178.533 -0.213 1
1 244 . 24 1 1 A 36 36 ASP CA C 35 57.832 57.051 0.781 1
1 245 . 24 1 1 A 36 36 ASP CB C 35 40.914 39.760 1.154 1
1 246 . 24 1 1 A 36 36 ASP N N 35 125.883 126.206 -0.323 1
1 247 . 24 1 1 A 37 37 GLU H H 36 8.905 8.239 0.666 1
1 248 . 24 1 1 A 37 37 GLU HA H 36 3.933 4.147 -0.214 1
1 253 . 24 1 1 A 37 37 GLU C C 36 179.304 179.052 0.252 1
1 254 . 24 1 1 A 37 37 GLU CA C 36 59.828 59.251 0.577 1
1 255 . 24 1 1 A 37 37 GLU CB C 36 29.380 29.356 0.024 1
1 257 . 24 1 1 A 37 37 GLU N N 36 119.077 120.910 -1.833 1
1 258 . 24 1 1 A 38 38 PHE H H 37 7.460 8.254 -0.794 1
1 259 . 24 1 1 A 38 38 PHE HA H 37 3.642 3.949 -0.307 1
1 267 . 24 1 1 A 38 38 PHE C C 37 176.483 177.969 -1.486 1
1 268 . 24 1 1 A 38 38 PHE CA C 37 61.411 61.271 0.140 1
1 269 . 24 1 1 A 38 38 PHE CB C 37 39.355 39.016 0.339 1
1 275 . 24 1 1 A 38 38 PHE N N 37 119.968 120.805 -0.837 1
1 276 . 24 1 1 A 39 39 GLN H H 38 7.968 7.976 -0.008 1
1 277 . 24 1 1 A 39 39 GLN HA H 38 3.712 3.726 -0.014 1
1 284 . 24 1 1 A 39 39 GLN CA C 38 59.153 58.782 0.371 1
1 285 . 24 1 1 A 39 39 GLN CB C 38 28.213 28.297 -0.084 1
1 287 . 24 1 1 A 39 39 GLN N N 38 116.433 118.266 -1.833 1
1 289 . 24 1 1 A 40 40 LEU H H 39 7.930 7.560 0.370 1
1 290 . 24 1 1 A 40 40 LEU HA H 39 3.916 3.991 -0.075 1
1 300 . 24 1 1 A 40 40 LEU C C 39 177.731 178.126 -0.395 1
1 301 . 24 1 1 A 40 40 LEU CA C 39 57.915 58.007 -0.092 1
1 302 . 24 1 1 A 40 40 LEU CB C 39 41.989 41.620 0.369 1
1 306 . 24 1 1 A 40 40 LEU N N 39 119.505 121.105 -1.600 1
1 307 . 24 1 1 A 41 41 LEU H H 40 7.174 7.683 -0.509 1
1 308 . 24 1 1 A 41 41 LEU HA H 40 3.835 3.970 -0.135 1
1 318 . 24 1 1 A 41 41 LEU C C 40 179.738 178.310 1.428 1
1 319 . 24 1 1 A 41 41 LEU CA C 40 58.266 58.317 -0.051 1
1 320 . 24 1 1 A 41 41 LEU CB C 40 42.050 41.090 0.960 1
1 324 . 24 1 1 A 41 41 LEU N N 40 120.971 119.615 1.356 1
1 325 . 24 1 1 A 42 42 GLN H H 41 8.058 7.912 0.146 1
1 326 . 24 1 1 A 42 42 GLN HA H 41 3.556 3.736 -0.180 1
1 333 . 24 1 1 A 42 42 GLN C C 41 177.642 178.462 -0.820 1
1 334 . 24 1 1 A 42 42 GLN CA C 41 59.826 59.135 0.691 1
1 335 . 24 1 1 A 42 42 GLN CB C 41 28.762 27.976 0.786 1
1 337 . 24 1 1 A 42 42 GLN N N 41 117.899 117.975 -0.076 1
1 339 . 24 1 1 A 43 43 ARG H H 42 8.179 7.797 0.382 1
1 340 . 24 1 1 A 43 43 ARG HA H 42 3.655 3.935 -0.280 1
1 347 . 24 1 1 A 43 43 ARG C C 42 178.051 178.665 -0.614 1
1 348 . 24 1 1 A 43 43 ARG CA C 42 59.766 58.655 1.111 1
1 349 . 24 1 1 A 43 43 ARG CB C 42 29.941 30.395 -0.454 1
1 352 . 24 1 1 A 43 43 ARG N N 42 119.392 119.511 -0.119 1
1 353 . 24 1 1 A 44 44 ASN H H 43 8.525 8.162 0.363 1
1 354 . 24 1 1 A 44 44 ASN HA H 43 4.332 4.378 -0.046 1
1 359 . 24 1 1 A 44 44 ASN C C 43 178.150 178.363 -0.213 1
1 360 . 24 1 1 A 44 44 ASN CA C 43 55.841 56.281 -0.440 1
1 361 . 24 1 1 A 44 44 ASN CB C 43 37.632 38.206 -0.574 1
1 362 . 24 1 1 A 44 44 ASN N N 43 116.214 117.984 -1.770 1
1 364 . 24 1 1 A 45 45 PHE H H 44 7.586 7.802 -0.216 1
1 365 . 24 1 1 A 45 45 PHE HA H 44 4.132 4.384 -0.252 1
1 372 . 24 1 1 A 45 45 PHE C C 44 176.691 178.688 -1.997 1
1 373 . 24 1 1 A 45 45 PHE CA C 44 62.333 60.946 1.387 1
1 374 . 24 1 1 A 45 45 PHE CB C 44 39.449 39.006 0.443 1
1 379 . 24 1 1 A 45 45 PHE N N 44 121.501 119.171 2.330 1
1 380 . 24 1 1 A 46 46 MET H H 45 8.190 8.449 -0.259 1
1 381 . 24 1 1 A 46 46 MET HA H 45 4.060 4.178 -0.118 1
1 389 . 24 1 1 A 46 46 MET C C 45 179.754 178.273 1.481 1
1 390 . 24 1 1 A 46 46 MET CA C 45 57.742 58.587 -0.845 1
1 391 . 24 1 1 A 46 46 MET CB C 45 29.912 32.105 -2.193 1
1 394 . 24 1 1 A 46 46 MET N N 45 116.727 117.966 -1.239 1
1 395 . 24 1 1 A 47 47 ASP H H 46 8.579 8.233 0.346 1
1 396 . 24 1 1 A 47 47 ASP HA H 46 4.804 4.713 0.091 1
1 399 . 24 1 1 A 47 47 ASP C C 46 177.854 177.685 0.169 1
1 400 . 24 1 1 A 47 47 ASP CA C 46 57.277 57.308 -0.031 1
1 401 . 24 1 1 A 47 47 ASP CB C 46 40.776 41.901 -1.125 1
1 402 . 24 1 1 A 47 47 ASP N N 46 117.798 120.620 -2.822 1
1 403 . 24 1 1 A 48 48 LYS H H 47 7.339 8.048 -0.709 1
1 404 . 24 1 1 A 48 48 LYS HA H 47 3.828 4.368 -0.540 1
1 413 . 24 1 1 A 48 48 LYS C C 47 178.812 178.609 0.203 1
1 414 . 24 1 1 A 48 48 LYS CA C 47 58.953 57.451 1.502 1
1 415 . 24 1 1 A 48 48 LYS CB C 47 32.796 33.479 -0.683 1
1 419 . 24 1 1 A 48 48 LYS N N 47 117.852 117.982 -0.130 1
1 420 . 24 1 1 A 49 49 TYR H H 48 6.841 8.726 -1.885 1
1 421 . 24 1 1 A 49 49 TYR HA H 48 4.995 4.384 0.611 1
1 428 . 24 1 1 A 49 49 TYR C C 48 178.138 178.611 -0.473 1
1 429 . 24 1 1 A 49 49 TYR CA C 48 58.620 60.006 -1.386 1
1 430 . 24 1 1 A 49 49 TYR CB C 48 42.939 38.534 4.405 1
1 435 . 24 1 1 A 49 49 TYR N N 48 112.109 119.168 -7.059 1
1 436 . 24 1 1 A 50 50 TYR H H 49 8.491 8.381 0.110 1
1 437 . 24 1 1 A 50 50 TYR HA H 49 4.598 4.168 0.430 1
1 444 . 24 1 1 A 50 50 TYR C C 49 176.015 178.272 -2.257 1
1 445 . 24 1 1 A 50 50 TYR CA C 49 62.442 59.679 2.763 1
1 446 . 24 1 1 A 50 50 TYR CB C 49 36.588 37.117 -0.529 1
1 451 . 24 1 1 A 50 50 TYR N N 49 118.294 119.262 -0.968 1
1 452 . 24 1 1 A 51 51 LEU H H 50 7.512 7.615 -0.103 1
1 453 . 24 1 1 A 51 51 LEU HA H 50 3.878 3.482 0.396 1
1 463 . 24 1 1 A 51 51 LEU C C 50 178.625 178.840 -0.215 1
1 464 . 24 1 1 A 51 51 LEU CA C 50 55.994 57.256 -1.262 1
1 465 . 24 1 1 A 51 51 LEU CB C 50 40.743 41.155 -0.412 1
1 469 . 24 1 1 A 51 51 LEU N N 50 118.478 121.667 -3.189 1
1 470 . 24 1 1 A 52 52 GLU H H 51 8.042 8.152 -0.110 1
1 471 . 24 1 1 A 52 52 GLU HA H 51 4.197 4.025 0.172 1
1 476 . 24 1 1 A 52 52 GLU C C 51 177.629 177.579 0.050 1
1 477 . 24 1 1 A 52 52 GLU CA C 51 56.141 58.970 -2.829 1
1 478 . 24 1 1 A 52 52 GLU CB C 51 29.162 29.669 -0.507 1
1 480 . 24 1 1 A 52 52 GLU N N 51 115.067 118.033 -2.966 1
1 481 . 24 1 1 A 53 53 PHE H H 52 7.465 7.825 -0.360 1
1 482 . 24 1 1 A 53 53 PHE HA H 52 4.431 4.695 -0.264 1
1 490 . 24 1 1 A 53 53 PHE C C 52 174.325 174.899 -0.574 1
1 491 . 24 1 1 A 53 53 PHE CA C 52 58.986 56.820 2.166 1
1 492 . 24 1 1 A 53 53 PHE CB C 52 40.183 36.843 3.340 1
1 498 . 24 1 1 A 53 53 PHE N N 52 116.768 117.409 -0.641 1
1 499 . 24 1 1 A 54 54 GLU H H 53 7.484 8.431 -0.947 1
1 500 . 24 1 1 A 54 54 GLU HA H 53 4.583 4.801 -0.218 1
1 505 . 24 1 1 A 54 54 GLU C C 53 175.722 175.702 0.020 1
1 506 . 24 1 1 A 54 54 GLU CA C 53 54.248 55.262 -1.014 1
1 507 . 24 1 1 A 54 54 GLU CB C 53 34.409 31.106 3.303 1
1 509 . 24 1 1 A 54 54 GLU N N 53 118.844 125.236 -6.392 1
1 510 . 24 1 1 A 55 55 ASP H H 54 9.008 8.599 0.409 1
1 511 . 24 1 1 A 55 55 ASP HA H 54 4.735 4.785 -0.050 1
1 514 . 24 1 1 A 55 55 ASP C C 54 175.421 176.265 -0.844 1
1 515 . 24 1 1 A 55 55 ASP CA C 54 52.888 54.211 -1.323 1
1 516 . 24 1 1 A 55 55 ASP CB C 54 38.894 40.766 -1.872 1
1 517 . 24 1 1 A 55 55 ASP N N 54 123.654 125.081 -1.427 1
1 518 . 24 1 1 A 56 56 THR H H 55 7.819 8.224 -0.405 1
1 519 . 24 1 1 A 56 56 THR HA H 55 4.574 4.910 -0.336 1
1 524 . 24 1 1 A 56 56 THR C C 55 174.096 174.810 -0.714 1
1 525 . 24 1 1 A 56 56 THR CA C 55 59.172 59.669 -0.497 1
1 526 . 24 1 1 A 56 56 THR CB C 55 71.889 72.400 -0.511 1
1 528 . 24 1 1 A 56 56 THR N N 55 112.015 114.001 -1.986 1
1 529 . 24 1 1 A 57 57 GLU H H 56 8.527 8.669 -0.142 1
1 530 . 24 1 1 A 57 57 GLU HA H 56 4.217 4.341 -0.124 1
1 535 . 24 1 1 A 57 57 GLU C C 56 177.042 176.512 0.530 1
1 536 . 24 1 1 A 57 57 GLU CA C 56 56.869 58.531 -1.662 1
1 537 . 24 1 1 A 57 57 GLU CB C 56 29.731 30.607 -0.876 1
1 539 . 24 1 1 A 57 57 GLU N N 56 117.531 120.137 -2.606 1
1 540 . 24 1 1 A 58 58 GLU H H 57 7.587 7.775 -0.188 1
1 541 . 24 1 1 A 58 58 GLU HA H 57 3.941 4.626 -0.685 1
1 546 . 24 1 1 A 58 58 GLU C C 57 176.849 176.226 0.623 1
1 547 . 24 1 1 A 58 58 GLU CA C 57 56.924 55.823 1.101 1
1 548 . 24 1 1 A 58 58 GLU CB C 57 30.251 31.261 -1.010 1
1 550 . 24 1 1 A 58 58 GLU N N 57 119.183 118.480 0.703 1
1 551 . 24 1 1 A 59 59 ASN H H 58 9.120 8.770 0.350 1
1 552 . 24 1 1 A 59 59 ASN HA H 58 4.922 4.897 0.025 1
1 557 . 24 1 1 A 59 59 ASN C C 58 174.254 175.607 -1.353 1
1 558 . 24 1 1 A 59 59 ASN CA C 58 51.956 52.681 -0.725 1
1 559 . 24 1 1 A 59 59 ASN CB C 58 37.404 39.488 -2.084 1
1 560 . 24 1 1 A 59 59 ASN N N 58 126.767 123.051 3.716 1
1 562 . 24 1 1 A 60 60 LYS H H 59 5.892 9.023 -3.131 1
1 563 . 24 1 1 A 60 60 LYS HA H 59 3.798 4.641 -0.843 1
1 572 . 24 1 1 A 60 60 LYS C C 59 177.908 177.447 0.461 1
1 573 . 24 1 1 A 60 60 LYS CA C 59 56.623 54.527 2.096 1
1 574 . 24 1 1 A 60 60 LYS CB C 59 32.279 34.713 -2.434 1
1 578 . 24 1 1 A 60 60 LYS N N 59 121.527 121.753 -0.226 1
1 579 . 24 1 1 A 61 61 LEU H H 60 8.473 8.744 -0.271 1
1 580 . 24 1 1 A 61 61 LEU HA H 60 3.891 4.197 -0.306 1
1 590 . 24 1 1 A 61 61 LEU C C 60 179.843 178.649 1.194 1
1 591 . 24 1 1 A 61 61 LEU CA C 60 58.301 56.416 1.885 1
1 592 . 24 1 1 A 61 61 LEU CB C 60 41.305 41.402 -0.097 1
1 596 . 24 1 1 A 61 61 LEU N N 60 125.639 122.902 2.737 1
1 597 . 24 1 1 A 62 62 ILE H H 61 7.698 7.763 -0.065 1
1 598 . 24 1 1 A 62 62 ILE HA H 61 3.952 3.820 0.132 1
1 608 . 24 1 1 A 62 62 ILE C C 61 175.392 177.230 -1.838 1
1 609 . 24 1 1 A 62 62 ILE CA C 61 61.743 63.150 -1.407 1
1 610 . 24 1 1 A 62 62 ILE CB C 61 39.108 37.659 1.449 1
1 614 . 24 1 1 A 62 62 ILE N N 61 114.111 119.667 -5.556 1
1 615 . 24 1 1 A 63 63 TYR H H 62 7.273 7.620 -0.347 1
1 616 . 24 1 1 A 63 63 TYR HA H 62 4.343 4.150 0.193 1
1 623 . 24 1 1 A 63 63 TYR C C 62 178.264 178.574 -0.310 1
1 624 . 24 1 1 A 63 63 TYR CA C 62 57.231 60.904 -3.673 1
1 625 . 24 1 1 A 63 63 TYR CB C 62 36.332 37.369 -1.037 1
1 630 . 24 1 1 A 63 63 TYR N N 62 117.689 121.283 -3.594 1
1 631 . 24 1 1 A 64 64 THR H H 63 7.747 7.882 -0.135 1
1 632 . 24 1 1 A 64 64 THR HA H 63 4.266 4.250 0.016 1
1 637 . 24 1 1 A 64 64 THR CA C 63 69.362 67.569 1.793 1
1 638 . 24 1 1 A 64 64 THR CB C 63 66.962 67.513 -0.551 1
1 640 . 24 1 1 A 64 64 THR N N 63 113.755 116.047 -2.292 1
1 641 . 24 1 1 A 65 65 PRO HA H 64 4.372 4.370 0.002 1
1 648 . 24 1 1 A 65 65 PRO C C 64 179.913 179.374 0.539 1
1 649 . 24 1 1 A 65 65 PRO CA C 64 66.011 66.205 -0.194 1
1 650 . 24 1 1 A 65 65 PRO CB C 64 30.642 30.631 0.011 1
1 653 . 24 1 1 A 66 66 ILE H H 65 7.377 7.362 0.015 1
1 654 . 24 1 1 A 66 66 ILE HA H 65 3.530 3.890 -0.360 1
1 664 . 24 1 1 A 66 66 ILE C C 65 177.543 178.158 -0.615 1
1 665 . 24 1 1 A 66 66 ILE CA C 65 66.647 64.235 2.412 1
1 666 . 24 1 1 A 66 66 ILE CB C 65 38.029 37.731 0.298 1
1 670 . 24 1 1 A 66 66 ILE N N 65 118.353 116.645 1.708 1
1 671 . 24 1 1 A 67 67 PHE H H 66 8.480 8.437 0.043 1
1 672 . 24 1 1 A 67 67 PHE HA H 66 4.115 4.413 -0.298 1
1 680 . 24 1 1 A 67 67 PHE C C 66 177.293 178.240 -0.947 1
1 681 . 24 1 1 A 67 67 PHE CA C 66 59.570 62.045 -2.475 1
1 682 . 24 1 1 A 67 67 PHE CB C 66 38.865 39.530 -0.665 1
1 688 . 24 1 1 A 67 67 PHE N N 66 122.420 120.388 2.032 1
1 689 . 24 1 1 A 68 68 ASN H H 67 8.595 8.056 0.539 1
1 690 . 24 1 1 A 68 68 ASN HA H 67 4.211 4.200 0.011 1
1 695 . 24 1 1 A 68 68 ASN C C 67 178.697 178.093 0.604 1
1 696 . 24 1 1 A 68 68 ASN CA C 67 56.056 56.489 -0.433 1
1 697 . 24 1 1 A 68 68 ASN CB C 67 37.704 37.768 -0.064 1
1 698 . 24 1 1 A 68 68 ASN N N 67 115.573 116.684 -1.111 1
1 700 . 24 1 1 A 69 69 GLU H H 68 8.414 8.104 0.310 1
1 701 . 24 1 1 A 69 69 GLU HA H 68 4.102 4.339 -0.237 1
1 706 . 24 1 1 A 69 69 GLU C C 68 177.880 178.770 -0.890 1
1 707 . 24 1 1 A 69 69 GLU CA C 68 59.399 59.442 -0.043 1
1 708 . 24 1 1 A 69 69 GLU CB C 68 29.855 29.459 0.396 1
1 710 . 24 1 1 A 69 69 GLU N N 68 123.510 120.002 3.508 1
1 711 . 24 1 1 A 70 70 TYR H H 69 8.659 8.051 0.608 1
1 712 . 24 1 1 A 70 70 TYR HA H 69 3.362 4.125 -0.763 1
1 719 . 24 1 1 A 70 70 TYR C C 69 178.143 176.924 1.219 1
1 720 . 24 1 1 A 70 70 TYR CA C 69 60.686 61.302 -0.616 1
1 721 . 24 1 1 A 70 70 TYR CB C 69 38.560 38.754 -0.194 1
1 726 . 24 1 1 A 70 70 TYR N N 69 122.130 120.835 1.295 1
1 727 . 24 1 1 A 71 71 ILE H H 70 8.031 7.765 0.266 1
1 728 . 24 1 1 A 71 71 ILE HA H 70 3.265 3.726 -0.461 1
1 738 . 24 1 1 A 71 71 ILE C C 70 178.056 177.700 0.356 1
1 739 . 24 1 1 A 71 71 ILE CA C 70 63.756 63.931 -0.175 1
1 740 . 24 1 1 A 71 71 ILE CB C 70 37.321 36.634 0.687 1
1 744 . 24 1 1 A 71 71 ILE N N 70 118.906 120.449 -1.543 1
1 745 . 24 1 1 A 72 72 SER H H 71 7.803 7.859 -0.056 1
1 746 . 24 1 1 A 72 72 SER HA H 71 4.029 4.260 -0.231 1
1 749 . 24 1 1 A 72 72 SER CA C 71 61.380 60.972 0.408 1
1 750 . 24 1 1 A 72 72 SER CB C 71 63.288 63.177 0.111 1
1 751 . 24 1 1 A 72 72 SER N N 71 113.735 114.739 -1.004 1
1 752 . 24 1 1 A 73 73 LEU H H 72 7.952 7.980 -0.028 1
1 753 . 24 1 1 A 73 73 LEU HA H 72 4.418 4.122 0.296 1
1 763 . 24 1 1 A 73 73 LEU C C 72 177.767 178.235 -0.468 1
1 764 . 24 1 1 A 73 73 LEU CA C 72 56.543 57.401 -0.858 1
1 765 . 24 1 1 A 73 73 LEU CB C 72 44.517 41.679 2.838 1
1 769 . 24 1 1 A 73 73 LEU N N 72 119.411 123.517 -4.106 1
1 770 . 24 1 1 A 74 74 VAL H H 73 8.021 7.518 0.503 1
1 771 . 24 1 1 A 74 74 VAL HA H 73 3.532 3.314 0.218 1
1 779 . 24 1 1 A 74 74 VAL C C 73 177.126 178.101 -0.975 1
1 780 . 24 1 1 A 74 74 VAL CA C 73 66.250 66.485 -0.235 1
1 781 . 24 1 1 A 74 74 VAL CB C 73 31.212 31.118 0.094 1
1 784 . 24 1 1 A 74 74 VAL N N 73 118.747 119.167 -0.420 1
1 785 . 24 1 1 A 75 75 GLU H H 74 7.232 7.978 -0.746 1
1 786 . 24 1 1 A 75 75 GLU HA H 74 3.013 4.146 -1.133 1
1 791 . 24 1 1 A 75 75 GLU C C 74 178.804 179.278 -0.474 1
1 792 . 24 1 1 A 75 75 GLU CA C 74 60.536 59.895 0.641 1
1 793 . 24 1 1 A 75 75 GLU CB C 74 27.009 29.004 -1.995 1
1 795 . 24 1 1 A 75 75 GLU N N 74 118.660 119.783 -1.123 1
1 796 . 24 1 1 A 76 76 LYS H H 75 7.051 7.854 -0.803 1
1 797 . 24 1 1 A 76 76 LYS HA H 75 3.765 4.067 -0.302 1
1 806 . 24 1 1 A 76 76 LYS C C 75 177.765 178.019 -0.254 1
1 807 . 24 1 1 A 76 76 LYS CA C 75 58.357 58.614 -0.257 1
1 808 . 24 1 1 A 76 76 LYS CB C 75 31.939 32.481 -0.542 1
1 812 . 24 1 1 A 76 76 LYS N N 75 116.112 119.213 -3.101 1
1 813 . 24 1 1 A 77 77 TYR H H 76 7.067 7.738 -0.671 1
1 814 . 24 1 1 A 77 77 TYR HA H 76 4.036 4.173 -0.137 1
1 821 . 24 1 1 A 77 77 TYR C C 76 177.752 176.968 0.784 1
1 822 . 24 1 1 A 77 77 TYR CA C 76 61.820 61.088 0.732 1
1 823 . 24 1 1 A 77 77 TYR CB C 76 38.480 38.663 -0.183 1
1 828 . 24 1 1 A 77 77 TYR N N 76 118.434 121.049 -2.615 1
1 829 . 24 1 1 A 78 78 ILE H H 77 7.554 8.299 -0.745 1
1 830 . 24 1 1 A 78 78 ILE HA H 77 3.159 3.622 -0.463 1
1 840 . 24 1 1 A 78 78 ILE C C 77 177.341 177.934 -0.593 1
1 841 . 24 1 1 A 78 78 ILE CA C 77 65.177 65.361 -0.184 1
1 842 . 24 1 1 A 78 78 ILE CB C 77 37.339 38.060 -0.721 1
1 846 . 24 1 1 A 78 78 ILE N N 77 117.672 121.087 -3.415 1
1 847 . 24 1 1 A 79 79 GLU H H 78 8.296 8.057 0.239 1
1 848 . 24 1 1 A 79 79 GLU HA H 78 3.557 3.835 -0.278 1
1 853 . 24 1 1 A 79 79 GLU C C 78 177.742 178.916 -1.174 1
1 854 . 24 1 1 A 79 79 GLU CA C 78 60.847 60.056 0.791 1
1 855 . 24 1 1 A 79 79 GLU CB C 78 29.594 29.165 0.429 1
1 857 . 24 1 1 A 79 79 GLU N N 78 118.701 120.977 -2.276 1
1 858 . 24 1 1 A 80 80 GLU H H 79 8.330 8.213 0.117 1
1 859 . 24 1 1 A 80 80 GLU HA H 79 3.774 4.002 -0.228 1
1 864 . 24 1 1 A 80 80 GLU C C 79 179.926 179.181 0.745 1
1 865 . 24 1 1 A 80 80 GLU CA C 79 59.581 58.953 0.628 1
1 866 . 24 1 1 A 80 80 GLU CB C 79 29.062 29.207 -0.145 1
1 868 . 24 1 1 A 80 80 GLU N N 79 116.767 118.057 -1.290 1
1 869 . 24 1 1 A 81 81 GLN H H 80 7.634 7.722 -0.088 1
1 870 . 24 1 1 A 81 81 GLN HA H 80 3.605 3.837 -0.232 1
1 877 . 24 1 1 A 81 81 GLN C C 80 179.681 178.607 1.074 1
1 878 . 24 1 1 A 81 81 GLN CA C 80 57.765 58.552 -0.787 1
1 879 . 24 1 1 A 81 81 GLN CB C 80 28.079 27.975 0.104 1
1 881 . 24 1 1 A 81 81 GLN N N 80 116.325 118.695 -2.370 1
1 883 . 24 1 1 A 82 82 LEU H H 81 8.156 7.554 0.602 1
1 884 . 24 1 1 A 82 82 LEU HA H 81 3.536 3.730 -0.194 1
1 894 . 24 1 1 A 82 82 LEU C C 81 178.945 179.304 -0.359 1
1 895 . 24 1 1 A 82 82 LEU CA C 81 57.761 56.719 1.042 1
1 896 . 24 1 1 A 82 82 LEU CB C 81 40.961 40.931 0.030 1
1 900 . 24 1 1 A 82 82 LEU N N 81 121.546 120.136 1.410 1
1 901 . 24 1 1 A 83 83 LEU H H 82 8.326 7.945 0.381 1
1 902 . 24 1 1 A 83 83 LEU HA H 82 4.198 4.131 0.067 1
1 912 . 24 1 1 A 83 83 LEU C C 82 178.631 179.253 -0.622 1
1 913 . 24 1 1 A 83 83 LEU CA C 82 57.016 56.916 0.100 1
1 914 . 24 1 1 A 83 83 LEU CB C 82 42.182 40.911 1.271 1
1 918 . 24 1 1 A 83 83 LEU N N 82 120.426 119.077 1.349 1
1 919 . 24 1 1 A 84 84 GLN H H 83 6.992 7.586 -0.594 1
1 920 . 24 1 1 A 84 84 GLN HA H 83 3.877 4.002 -0.125 1
1 927 . 24 1 1 A 84 84 GLN C C 83 177.008 176.970 0.038 1
1 928 . 24 1 1 A 84 84 GLN CA C 83 57.543 58.267 -0.724 1
1 929 . 24 1 1 A 84 84 GLN CB C 83 28.688 28.572 0.116 1
1 931 . 24 1 1 A 84 84 GLN N N 83 114.001 117.178 -3.177 1
1 933 . 24 1 1 A 85 85 ARG H H 84 7.072 7.310 -0.238 1
1 934 . 24 1 1 A 85 85 ARG HA H 84 4.047 4.336 -0.289 1
1 942 . 24 1 1 A 85 85 ARG C C 84 175.999 175.010 0.989 1
1 943 . 24 1 1 A 85 85 ARG CA C 84 56.764 55.612 1.152 1
1 944 . 24 1 1 A 85 85 ARG CB C 84 32.044 31.894 0.150 1
1 947 . 24 1 1 A 85 85 ARG N N 84 115.827 116.839 -1.012 1
1 949 . 24 1 1 A 86 86 ILE H H 85 8.238 7.282 0.956 1
1 950 . 24 1 1 A 86 86 ILE HA H 85 4.389 4.502 -0.113 1
1 960 . 24 1 1 A 86 86 ILE CA C 85 58.007 57.854 0.153 1
1 961 . 24 1 1 A 86 86 ILE CB C 85 39.604 39.379 0.225 1
1 965 . 24 1 1 A 86 86 ILE N N 85 119.285 119.119 0.166 1
1 966 . 24 1 1 A 87 87 PRO HA H 86 4.392 4.593 -0.201 1
1 973 . 24 1 1 A 87 87 PRO C C 86 177.622 177.495 0.127 1
1 974 . 24 1 1 A 87 87 PRO CA C 86 64.665 64.249 0.416 1
1 975 . 24 1 1 A 87 87 PRO CB C 86 32.020 31.768 0.252 1
1 978 . 24 1 1 A 88 88 GLU H H 87 8.312 8.613 -0.301 1
1 979 . 24 1 1 A 88 88 GLU HA H 87 4.208 4.406 -0.198 1
1 984 . 24 1 1 A 88 88 GLU C C 87 175.554 176.590 -1.036 1
1 985 . 24 1 1 A 88 88 GLU CA C 87 56.045 55.855 0.190 1
1 986 . 24 1 1 A 88 88 GLU CB C 87 28.654 29.242 -0.588 1
1 988 . 24 1 1 A 88 88 GLU N N 87 114.256 115.639 -1.383 1
1 989 . 24 1 1 A 89 89 PHE H H 88 7.946 7.401 0.545 1
1 990 . 24 1 1 A 89 89 PHE HA H 88 3.993 4.312 -0.319 1
1 998 . 24 1 1 A 89 89 PHE C C 88 173.460 175.170 -1.710 1
1 999 . 24 1 1 A 89 89 PHE CA C 88 60.119 59.573 0.546 1
1 1000 . 24 1 1 A 89 89 PHE CB C 88 39.994 39.623 0.371 1
1 1006 . 24 1 1 A 89 89 PHE N N 88 121.550 122.461 -0.911 1
1 1007 . 24 1 1 A 90 90 ASN H H 89 7.266 7.797 -0.531 1
1 1008 . 24 1 1 A 90 90 ASN HA H 89 4.454 4.943 -0.489 1
1 1013 . 24 1 1 A 90 90 ASN C C 89 173.921 175.021 -1.100 1
1 1014 . 24 1 1 A 90 90 ASN CA C 89 51.839 51.251 0.588 1
1 1015 . 24 1 1 A 90 90 ASN CB C 89 40.674 38.576 2.098 1
1 1016 . 24 1 1 A 90 90 ASN N N 89 125.344 124.574 0.770 1
1 1018 . 24 1 1 A 91 91 MET H H 90 8.968 8.365 0.603 1
1 1019 . 24 1 1 A 91 91 MET HA H 90 4.049 4.046 0.003 1
1 1027 . 24 1 1 A 91 91 MET C C 90 177.475 178.022 -0.547 1
1 1028 . 24 1 1 A 91 91 MET CA C 90 57.758 58.321 -0.563 1
1 1029 . 24 1 1 A 91 91 MET CB C 90 32.250 32.389 -0.139 1
1 1032 . 24 1 1 A 91 91 MET N N 90 127.052 124.800 2.252 1
1 1033 . 24 1 1 A 92 92 ALA H H 91 8.292 8.075 0.217 1
1 1034 . 24 1 1 A 92 92 ALA HA H 91 4.059 4.132 -0.073 1
1 1038 . 24 1 1 A 92 92 ALA C C 91 180.412 179.984 0.428 1
1 1039 . 24 1 1 A 92 92 ALA CA C 91 55.368 55.017 0.351 1
1 1040 . 24 1 1 A 92 92 ALA CB C 91 17.527 18.354 -0.827 1
1 1041 . 24 1 1 A 92 92 ALA N N 91 123.752 121.285 2.467 1
1 1042 . 24 1 1 A 93 93 ALA H H 92 7.931 7.996 -0.065 1
1 1043 . 24 1 1 A 93 93 ALA HA H 92 4.054 4.228 -0.174 1
1 1047 . 24 1 1 A 93 93 ALA C C 92 180.482 179.769 0.713 1
1 1048 . 24 1 1 A 93 93 ALA CA C 92 54.614 54.839 -0.225 1
1 1049 . 24 1 1 A 93 93 ALA CB C 92 18.098 18.185 -0.087 1
1 1050 . 24 1 1 A 93 93 ALA N N 92 121.158 120.014 1.144 1
1 1051 . 24 1 1 A 94 94 PHE H H 93 8.110 7.895 0.215 1
1 1052 . 24 1 1 A 94 94 PHE HA H 93 4.304 4.179 0.125 1
1 1060 . 24 1 1 A 94 94 PHE C C 93 177.350 177.277 0.073 1
1 1061 . 24 1 1 A 94 94 PHE CA C 93 61.641 61.478 0.163 1
1 1062 . 24 1 1 A 94 94 PHE CB C 93 40.014 39.301 0.713 1
1 1068 . 24 1 1 A 94 94 PHE N N 93 119.807 119.664 0.143 1
1 1069 . 24 1 1 A 95 95 THR H H 94 8.726 8.397 0.329 1
1 1070 . 24 1 1 A 95 95 THR HA H 94 3.569 3.948 -0.379 1
1 1075 . 24 1 1 A 95 95 THR C C 94 176.932 176.485 0.447 1
1 1076 . 24 1 1 A 95 95 THR CA C 94 66.833 65.395 1.438 1
1 1077 . 24 1 1 A 95 95 THR CB C 94 68.445 68.160 0.285 1
1 1079 . 24 1 1 A 95 95 THR N N 94 113.074 112.268 0.806 1
1 1080 . 24 1 1 A 96 96 THR H H 95 7.657 7.831 -0.174 1
1 1081 . 24 1 1 A 96 96 THR HA H 95 3.945 4.265 -0.320 1
1 1086 . 24 1 1 A 96 96 THR C C 95 176.386 177.448 -1.062 1
1 1087 . 24 1 1 A 96 96 THR CA C 95 66.550 65.684 0.866 1
1 1088 . 24 1 1 A 96 96 THR CB C 95 68.583 67.956 0.627 1
1 1090 . 24 1 1 A 96 96 THR N N 95 117.927 114.107 3.820 1
1 1091 . 24 1 1 A 97 97 THR H H 96 7.699 7.813 -0.114 1
1 1092 . 24 1 1 A 97 97 THR HA H 96 3.905 4.027 -0.122 1
1 1097 . 24 1 1 A 97 97 THR C C 96 176.572 176.471 0.101 1
1 1098 . 24 1 1 A 97 97 THR CA C 96 65.979 66.774 -0.795 1
1 1099 . 24 1 1 A 97 97 THR CB C 96 68.553 68.070 0.483 1
1 1101 . 24 1 1 A 97 97 THR N N 96 118.518 117.537 0.981 1
1 1102 . 24 1 1 A 98 98 LEU H H 97 8.304 8.108 0.196 1
1 1103 . 24 1 1 A 98 98 LEU HA H 97 3.725 3.784 -0.059 1
1 1113 . 24 1 1 A 98 98 LEU C C 97 178.490 178.664 -0.174 1
1 1114 . 24 1 1 A 98 98 LEU CA C 97 58.517 58.002 0.515 1
1 1115 . 24 1 1 A 98 98 LEU CB C 97 41.697 40.889 0.808 1
1 1119 . 24 1 1 A 98 98 LEU N N 97 122.882 121.795 1.087 1
1 1120 . 24 1 1 A 99 99 GLN H H 98 7.639 7.789 -0.150 1
1 1121 . 24 1 1 A 99 99 GLN HA H 98 3.927 3.990 -0.063 1
1 1128 . 24 1 1 A 99 99 GLN C C 98 178.068 178.688 -0.620 1
1 1129 . 24 1 1 A 99 99 GLN CA C 98 58.735 59.199 -0.464 1
1 1130 . 24 1 1 A 99 99 GLN CB C 98 27.986 28.205 -0.219 1
1 1132 . 24 1 1 A 99 99 GLN N N 98 114.302 118.399 -4.097 1
1 1134 . 24 1 1 A 100 100 HIS H H 99 7.575 7.358 0.217 1
1 1135 . 24 1 1 A 100 100 HIS HA H 99 4.524 4.407 0.117 1
1 1139 . 24 1 1 A 100 100 HIS C C 99 174.789 177.921 -3.132 1
1 1140 . 24 1 1 A 100 100 HIS CA C 99 56.154 60.018 -3.864 1
1 1141 . 24 1 1 A 100 100 HIS CB C 99 28.946 30.703 -1.757 1
1 1143 . 24 1 1 A 100 100 HIS N N 99 114.778 119.385 -4.607 1
1 1144 . 24 1 1 A 101 101 HIS H H 100 7.773 8.204 -0.431 1
1 1145 . 24 1 1 A 101 101 HIS HA H 100 4.704 4.364 0.340 1
1 1149 . 24 1 1 A 101 101 HIS C C 100 174.818 177.306 -2.488 1
1 1150 . 24 1 1 A 101 101 HIS CA C 100 54.830 58.612 -3.782 1
1 1151 . 24 1 1 A 101 101 HIS CB C 100 29.749 28.594 1.155 1
1 1153 . 24 1 1 A 101 101 HIS N N 100 117.397 117.263 0.134 1
1 1154 . 24 1 1 A 102 102 LYS H H 101 7.324 8.085 -0.761 1
1 1155 . 24 1 1 A 102 102 LYS HA H 101 3.611 4.058 -0.447 1
1 1164 . 24 1 1 A 102 102 LYS C C 101 176.823 178.103 -1.280 1
1 1165 . 24 1 1 A 102 102 LYS CA C 101 59.915 58.794 1.121 1
1 1166 . 24 1 1 A 102 102 LYS CB C 101 32.825 32.049 0.776 1
1 1170 . 24 1 1 A 102 102 LYS N N 101 120.533 122.174 -1.641 1
1 1171 . 24 1 1 A 103 103 ASP H H 102 8.361 7.710 0.651 1
1 1172 . 24 1 1 A 103 103 ASP HA H 102 4.421 4.443 -0.022 1
1 1175 . 24 1 1 A 103 103 ASP C C 102 176.793 177.745 -0.952 1
1 1176 . 24 1 1 A 103 103 ASP CA C 102 55.500 56.212 -0.712 1
1 1177 . 24 1 1 A 103 103 ASP CB C 102 40.178 40.940 -0.762 1
1 1178 . 24 1 1 A 103 103 ASP N N 102 114.814 119.462 -4.648 1
1 1179 . 24 1 1 A 104 104 GLU H H 103 7.858 8.235 -0.377 1
1 1180 . 24 1 1 A 104 104 GLU HA H 103 4.339 4.414 -0.075 1
1 1183 . 24 1 1 A 104 104 GLU C C 103 175.777 176.685 -0.908 1
1 1184 . 24 1 1 A 104 104 GLU CA C 103 56.356 57.919 -1.563 1
1 1185 . 24 1 1 A 104 104 GLU CB C 103 31.293 31.042 0.251 1
1 1186 . 24 1 1 A 104 104 GLU N N 103 116.826 118.960 -2.134 1
1 1187 . 24 1 1 A 105 105 VAL H H 104 7.201 7.877 -0.676 1
1 1188 . 24 1 1 A 105 105 VAL HA H 104 4.296 4.138 0.158 1
1 1196 . 24 1 1 A 105 105 VAL C C 104 174.482 175.660 -1.178 1
1 1197 . 24 1 1 A 105 105 VAL CA C 104 60.370 62.615 -2.245 1
1 1198 . 24 1 1 A 105 105 VAL CB C 104 34.341 32.941 1.400 1
1 1201 . 24 1 1 A 105 105 VAL N N 104 116.422 119.755 -3.333 1
1 1202 . 24 1 1 A 106 106 ALA H H 105 8.487 8.437 0.050 1
1 1203 . 24 1 1 A 106 106 ALA HA H 105 4.172 4.380 -0.208 1
1 1207 . 24 1 1 A 106 106 ALA C C 105 179.030 178.871 0.159 1
1 1208 . 24 1 1 A 106 106 ALA CA C 105 52.966 52.668 0.298 1
1 1209 . 24 1 1 A 106 106 ALA CB C 105 19.371 19.642 -0.271 1
1 1210 . 24 1 1 A 106 106 ALA N N 105 128.313 128.640 -0.327 1
1 1211 . 24 1 1 A 107 107 GLY H H 106 8.738 8.799 -0.061 1
1 1212 . 24 1 1 A 107 107 GLY HA2 H 106 3.773 3.873 -0.100 1
1 1213 . 24 1 1 A 107 107 GLY HA3 H 106 3.998 3.942 0.056 1
1 1214 . 24 1 1 A 107 107 GLY C C 106 174.958 175.542 -0.584 1
1 1215 . 24 1 1 A 107 107 GLY CA C 106 47.449 47.102 0.347 1
1 1216 . 24 1 1 A 107 107 GLY N N 106 110.612 110.888 -0.276 1
1 1217 . 24 1 1 A 108 108 ASP H H 107 8.535 8.286 0.249 1
1 1218 . 24 1 1 A 108 108 ASP HA H 107 4.333 4.377 -0.044 1
1 1221 . 24 1 1 A 108 108 ASP C C 107 179.133 179.014 0.119 1
1 1222 . 24 1 1 A 108 108 ASP CA C 107 56.721 57.064 -0.343 1
1 1223 . 24 1 1 A 108 108 ASP CB C 107 39.336 41.343 -2.007 1
1 1224 . 24 1 1 A 108 108 ASP N N 107 117.474 121.598 -4.124 1
1 1225 . 24 1 1 A 109 109 ILE H H 108 7.459 7.916 -0.457 1
1 1226 . 24 1 1 A 109 109 ILE HA H 108 3.688 3.784 -0.096 1
1 1236 . 24 1 1 A 109 109 ILE C C 108 176.735 178.354 -1.619 1
1 1237 . 24 1 1 A 109 109 ILE CA C 108 63.474 65.559 -2.085 1
1 1238 . 24 1 1 A 109 109 ILE CB C 108 37.340 37.808 -0.468 1
1 1242 . 24 1 1 A 109 109 ILE N N 108 119.609 119.791 -0.182 1
1 1243 . 24 1 1 A 110 110 PHE H H 109 7.920 8.367 -0.447 1
1 1244 . 24 1 1 A 110 110 PHE HA H 109 3.759 4.080 -0.321 1
1 1252 . 24 1 1 A 110 110 PHE C C 109 177.132 177.384 -0.252 1
1 1253 . 24 1 1 A 110 110 PHE CA C 109 62.766 61.221 1.545 1
1 1254 . 24 1 1 A 110 110 PHE CB C 109 39.752 39.295 0.457 1
1 1260 . 24 1 1 A 110 110 PHE N N 109 120.906 120.315 0.591 1
1 1261 . 24 1 1 A 111 111 ASP H H 110 8.639 8.278 0.361 1
1 1262 . 24 1 1 A 111 111 ASP HA H 110 4.216 4.217 -0.001 1
1 1265 . 24 1 1 A 111 111 ASP C C 110 178.900 178.407 0.493 1
1 1266 . 24 1 1 A 111 111 ASP CA C 110 57.105 57.268 -0.163 1
1 1267 . 24 1 1 A 111 111 ASP CB C 110 39.697 41.722 -2.025 1
1 1268 . 24 1 1 A 111 111 ASP N N 110 117.124 119.022 -1.898 1
1 1269 . 24 1 1 A 112 112 MET H H 111 7.331 7.549 -0.218 1
1 1270 . 24 1 1 A 112 112 MET HA H 111 4.081 4.136 -0.055 1
1 1278 . 24 1 1 A 112 112 MET C C 111 179.052 178.137 0.915 1
1 1279 . 24 1 1 A 112 112 MET CA C 111 58.202 58.074 0.128 1
1 1280 . 24 1 1 A 112 112 MET CB C 111 31.827 32.395 -0.568 1
1 1283 . 24 1 1 A 112 112 MET N N 111 118.061 119.422 -1.361 1
1 1284 . 24 1 1 A 113 113 LEU H H 112 8.001 8.022 -0.021 1
1 1285 . 24 1 1 A 113 113 LEU HA H 112 3.723 3.544 0.179 1
1 1295 . 24 1 1 A 113 113 LEU C C 112 179.747 178.604 1.143 1
1 1296 . 24 1 1 A 113 113 LEU CA C 112 57.371 57.380 -0.009 1
1 1297 . 24 1 1 A 113 113 LEU CB C 112 40.671 41.047 -0.376 1
1 1301 . 24 1 1 A 113 113 LEU N N 112 120.426 119.651 0.775 1
1 1302 . 24 1 1 A 114 114 LEU H H 113 7.744 7.627 0.117 1
1 1303 . 24 1 1 A 114 114 LEU HA H 113 4.007 3.511 0.496 1
1 1313 . 24 1 1 A 114 114 LEU C C 113 179.358 178.543 0.815 1
1 1314 . 24 1 1 A 114 114 LEU CA C 113 57.202 57.516 -0.314 1
1 1315 . 24 1 1 A 114 114 LEU CB C 113 41.727 41.579 0.148 1
1 1319 . 24 1 1 A 114 114 LEU N N 113 119.584 119.621 -0.037 1
1 1320 . 24 1 1 A 115 115 THR H H 114 7.353 7.619 -0.266 1
1 1321 . 24 1 1 A 115 115 THR HA H 114 4.071 4.138 -0.067 1
1 1327 . 24 1 1 A 115 115 THR C C 114 173.591 176.404 -2.813 1
1 1328 . 24 1 1 A 115 115 THR CA C 114 65.332 64.338 0.994 1
1 1329 . 24 1 1 A 115 115 THR CB C 114 70.319 68.754 1.565 1
1 1331 . 24 1 1 A 115 115 THR N N 114 107.535 112.363 -4.828 1
1 1332 . 24 1 1 A 116 116 PHE H H 115 6.979 7.790 -0.811 1
1 1333 . 24 1 1 A 116 116 PHE HA H 115 5.022 4.267 0.755 1
1 1341 . 24 1 1 A 116 116 PHE C C 115 176.488 176.552 -0.064 1
1 1342 . 24 1 1 A 116 116 PHE CA C 115 55.911 60.914 -5.003 1
1 1343 . 24 1 1 A 116 116 PHE CB C 115 38.521 39.178 -0.657 1
1 1349 . 24 1 1 A 116 116 PHE N N 115 112.366 120.024 -7.658 1
1 1350 . 24 1 1 A 117 117 THR H H 116 7.564 7.324 0.240 1
1 1351 . 24 1 1 A 117 117 THR HA H 116 4.626 4.810 -0.184 1
1 1356 . 24 1 1 A 117 117 THR C C 116 174.085 174.403 -0.318 1
1 1357 . 24 1 1 A 117 117 THR CA C 116 61.636 61.866 -0.230 1
1 1358 . 24 1 1 A 117 117 THR CB C 116 70.915 70.820 0.095 1
1 1360 . 24 1 1 A 117 117 THR N N 116 105.498 105.608 -0.110 1
1 1361 . 24 1 1 A 118 118 ASP H H 117 8.270 7.466 0.804 1
1 1362 . 24 1 1 A 118 118 ASP HA H 117 4.955 4.999 -0.044 1
1 1365 . 24 1 1 A 118 118 ASP C C 117 176.328 176.205 0.123 1
1 1366 . 24 1 1 A 118 118 ASP CA C 117 53.417 53.507 -0.090 1
1 1367 . 24 1 1 A 118 118 ASP CB C 117 43.388 38.876 4.512 1
1 1368 . 24 1 1 A 118 118 ASP N N 117 124.409 123.842 0.567 1
1 1369 . 24 1 1 A 119 119 PHE H H 118 8.973 8.749 0.224 1
1 1370 . 24 1 1 A 119 119 PHE HA H 118 3.506 4.144 -0.638 1
1 1378 . 24 1 1 A 119 119 PHE CA C 118 61.490 61.486 0.004 1
1 1379 . 24 1 1 A 119 119 PHE CB C 118 39.246 39.464 -0.218 1
1 1385 . 24 1 1 A 119 119 PHE N N 118 126.688 125.482 1.206 1
1 1386 . 24 1 1 A 120 120 LEU H H 119 8.099 8.387 -0.288 1
1 1387 . 24 1 1 A 120 120 LEU HA H 119 3.842 3.874 -0.032 1
1 1397 . 24 1 1 A 120 120 LEU C C 119 179.601 179.487 0.114 1
1 1398 . 24 1 1 A 120 120 LEU CA C 119 58.174 57.886 0.288 1
1 1399 . 24 1 1 A 120 120 LEU CB C 119 40.315 41.247 -0.932 1
1 1403 . 24 1 1 A 120 120 LEU N N 119 117.930 120.181 -2.251 1
1 1404 . 24 1 1 A 121 121 ALA H H 120 7.729 7.588 0.141 1
1 1405 . 24 1 1 A 121 121 ALA HA H 120 3.996 4.124 -0.128 1
1 1409 . 24 1 1 A 121 121 ALA C C 120 180.995 179.734 1.261 1
1 1410 . 24 1 1 A 121 121 ALA CA C 120 54.832 54.623 0.209 1
1 1411 . 24 1 1 A 121 121 ALA CB C 120 17.706 18.274 -0.568 1
1 1412 . 24 1 1 A 121 121 ALA N N 120 123.195 121.257 1.938 1
1 1413 . 24 1 1 A 122 122 PHE H H 121 7.943 7.803 0.140 1
1 1414 . 24 1 1 A 122 122 PHE HA H 121 3.887 3.859 0.028 1
1 1419 . 24 1 1 A 122 122 PHE C C 121 175.410 177.003 -1.593 1
1 1420 . 24 1 1 A 122 122 PHE CA C 121 61.075 60.725 0.350 1
1 1421 . 24 1 1 A 122 122 PHE CB C 121 38.115 39.056 -0.941 1
1 1424 . 24 1 1 A 122 122 PHE N N 121 121.798 120.131 1.667 1
1 1425 . 24 1 1 A 123 123 LYS H H 122 8.468 7.866 0.602 1
1 1426 . 24 1 1 A 123 123 LYS HA H 122 3.077 3.901 -0.824 1
1 1435 . 24 1 1 A 123 123 LYS C C 122 178.453 178.892 -0.439 1
1 1436 . 24 1 1 A 123 123 LYS CA C 122 59.855 59.961 -0.106 1
1 1437 . 24 1 1 A 123 123 LYS CB C 122 32.374 32.009 0.365 1
1 1441 . 24 1 1 A 123 123 LYS N N 122 120.614 118.469 2.145 1
1 1442 . 24 1 1 A 124 124 GLU H H 123 8.100 7.904 0.196 1
1 1443 . 24 1 1 A 124 124 GLU HA H 123 3.652 4.001 -0.349 1
1 1448 . 24 1 1 A 124 124 GLU C C 123 177.743 178.533 -0.790 1
1 1449 . 24 1 1 A 124 124 GLU CA C 123 59.406 59.627 -0.221 1
1 1450 . 24 1 1 A 124 124 GLU CB C 123 28.811 29.084 -0.273 1
1 1452 . 24 1 1 A 124 124 GLU N N 123 117.404 119.022 -1.618 1
1 1453 . 24 1 1 A 125 125 MET H H 124 7.537 7.702 -0.165 1
1 1454 . 24 1 1 A 125 125 MET HA H 124 3.860 3.986 -0.126 1
1 1462 . 24 1 1 A 125 125 MET C C 124 179.522 178.349 1.173 1
1 1463 . 24 1 1 A 125 125 MET CA C 124 58.832 58.517 0.315 1
1 1464 . 24 1 1 A 125 125 MET CB C 124 31.765 31.431 0.334 1
1 1467 . 24 1 1 A 125 125 MET N N 124 119.413 118.901 0.512 1
1 1468 . 24 1 1 A 126 126 PHE H H 125 7.148 7.552 -0.404 1
1 1469 . 24 1 1 A 126 126 PHE HA H 125 3.633 4.192 -0.559 1
1 1476 . 24 1 1 A 126 126 PHE C C 125 178.994 178.289 0.705 1
1 1477 . 24 1 1 A 126 126 PHE CA C 125 63.148 60.849 2.299 1
1 1478 . 24 1 1 A 126 126 PHE CB C 125 39.830 39.024 0.806 1
1 1483 . 24 1 1 A 126 126 PHE N N 125 120.013 118.998 1.015 1
1 1484 . 24 1 1 A 127 127 LEU H H 126 8.369 8.607 -0.238 1
1 1485 . 24 1 1 A 127 127 LEU HA H 126 3.972 4.029 -0.057 1
1 1495 . 24 1 1 A 127 127 LEU C C 126 180.621 179.061 1.560 1
1 1496 . 24 1 1 A 127 127 LEU CA C 126 57.944 57.944 0.000 1
1 1497 . 24 1 1 A 127 127 LEU CB C 126 40.543 41.252 -0.709 1
1 1501 . 24 1 1 A 127 127 LEU N N 126 119.692 119.784 -0.092 1
1 1502 . 24 1 1 A 128 128 ASP H H 127 8.578 8.069 0.509 1
1 1503 . 24 1 1 A 128 128 ASP HA H 127 4.308 4.330 -0.022 1
1 1506 . 24 1 1 A 128 128 ASP C C 127 178.254 177.981 0.273 1
1 1507 . 24 1 1 A 128 128 ASP CA C 127 56.964 57.292 -0.328 1
1 1508 . 24 1 1 A 128 128 ASP CB C 127 39.735 41.102 -1.367 1
1 1509 . 24 1 1 A 128 128 ASP N N 127 121.926 119.532 2.394 1
1 1510 . 24 1 1 A 129 129 TYR H H 128 7.710 8.272 -0.562 1
1 1511 . 24 1 1 A 129 129 TYR HA H 128 3.908 4.198 -0.290 1
1 1518 . 24 1 1 A 129 129 TYR C C 128 177.633 177.752 -0.119 1
1 1519 . 24 1 1 A 129 129 TYR CA C 128 61.796 61.291 0.505 1
1 1520 . 24 1 1 A 129 129 TYR CB C 128 39.372 38.479 0.893 1
1 1525 . 24 1 1 A 129 129 TYR N N 128 122.548 120.225 2.323 1
1 1526 . 24 1 1 A 130 130 ARG H H 129 8.622 8.629 -0.007 1
1 1527 . 24 1 1 A 130 130 ARG HA H 129 3.722 3.998 -0.276 1
1 1535 . 24 1 1 A 130 130 ARG CA C 129 60.084 59.709 0.375 1
1 1536 . 24 1 1 A 130 130 ARG CB C 129 29.902 29.869 0.033 1
1 1539 . 24 1 1 A 130 130 ARG N N 129 118.302 119.209 -0.907 1
1 1541 . 24 1 1 A 131 131 ALA H H 130 7.936 7.826 0.110 1
1 1542 . 24 1 1 A 131 131 ALA HA H 130 3.997 4.060 -0.063 1
1 1546 . 24 1 1 A 131 131 ALA C C 130 180.456 179.342 1.114 1
1 1547 . 24 1 1 A 131 131 ALA CA C 130 55.133 54.873 0.260 1
1 1548 . 24 1 1 A 131 131 ALA CB C 130 17.750 18.194 -0.444 1
1 1549 . 24 1 1 A 131 131 ALA N N 130 119.788 121.428 -1.640 1
1 1550 . 24 1 1 A 132 132 GLU H H 131 7.622 7.442 0.180 1
1 1551 . 24 1 1 A 132 132 GLU HA H 131 3.862 4.073 -0.211 1
1 1556 . 24 1 1 A 132 132 GLU C C 131 179.528 179.196 0.332 1
1 1557 . 24 1 1 A 132 132 GLU CA C 131 58.849 58.212 0.637 1
1 1558 . 24 1 1 A 132 132 GLU CB C 131 28.930 29.276 -0.346 1
1 1560 . 24 1 1 A 132 132 GLU N N 131 118.428 118.100 0.328 1
1 1561 . 24 1 1 A 133 133 LYS H H 132 7.853 7.475 0.378 1
1 1562 . 24 1 1 A 133 133 LYS HA H 132 3.722 3.947 -0.225 1
1 1571 . 24 1 1 A 133 133 LYS C C 132 175.725 178.193 -2.468 1
1 1572 . 24 1 1 A 133 133 LYS CA C 132 57.544 59.185 -1.641 1
1 1573 . 24 1 1 A 133 133 LYS CB C 132 31.770 32.051 -0.281 1
1 1577 . 24 1 1 A 133 133 LYS N N 132 119.473 120.024 -0.551 1
1 1578 . 24 1 1 A 134 134 GLU H H 133 8.151 8.119 0.032 1
1 1579 . 24 1 1 A 134 134 GLU HA H 133 4.161 4.294 -0.133 1
1 1584 . 24 1 1 A 134 134 GLU C C 133 177.453 179.276 -1.823 1
1 1585 . 24 1 1 A 134 134 GLU CA C 133 57.222 57.284 -0.062 1
1 1586 . 24 1 1 A 134 134 GLU CB C 133 30.091 30.206 -0.115 1
1 1588 . 24 1 1 A 134 134 GLU N N 133 116.525 118.114 -1.589 1
1 1589 . 24 1 1 A 135 135 GLY H H 134 7.702 8.191 -0.489 1
1 1590 . 24 1 1 A 135 135 GLY HA2 H 134 3.896 3.714 0.182 1
1 1591 . 24 1 1 A 135 135 GLY HA3 H 134 3.897 3.729 0.168 1
1 1592 . 24 1 1 A 135 135 GLY C C 134 174.538 174.533 0.005 1
1 1593 . 24 1 1 A 135 135 GLY CA C 134 45.975 47.189 -1.214 1
1 1594 . 24 1 1 A 135 135 GLY N N 134 107.924 108.844 -0.920 1
1 1595 . 24 1 1 A 136 136 ARG H H 135 8.045 7.542 0.503 1
1 1596 . 24 1 1 A 136 136 ARG HA H 135 4.323 4.118 0.205 1
1 1604 . 24 1 1 A 136 136 ARG C C 135 175.864 175.904 -0.040 1
1 1605 . 24 1 1 A 136 136 ARG CA C 135 56.016 58.334 -2.318 1
1 1606 . 24 1 1 A 136 136 ARG CB C 135 30.987 29.110 1.877 1
1 1609 . 24 1 1 A 136 136 ARG N N 135 119.708 116.142 3.566 1
1 1 . 25 1 1 A 14 14 PHE CA C 13 58.199 58.443 -0.244 1
1 2 . 25 1 1 A 14 14 PHE CB C 13 39.717 37.300 2.417 1
1 3 . 25 1 1 A 15 15 SER H H 14 8.299 7.936 0.363 1
1 4 . 25 1 1 A 15 15 SER HA H 14 4.359 5.293 -0.934 1
1 7 . 25 1 1 A 15 15 SER CA C 14 58.249 57.210 1.039 1
1 8 . 25 1 1 A 15 15 SER CB C 14 63.936 65.770 -1.834 1
1 9 . 25 1 1 A 15 15 SER N N 14 117.379 114.354 3.025 1
1 10 . 25 1 1 A 16 16 SER H H 15 8.255 8.921 -0.666 1
1 11 . 25 1 1 A 16 16 SER HA H 15 3.729 4.805 -1.076 1
1 14 . 25 1 1 A 16 16 SER CA C 15 58.224 56.749 1.475 1
1 15 . 25 1 1 A 16 16 SER CB C 15 63.886 63.736 0.150 1
1 16 . 25 1 1 A 16 16 SER N N 15 117.694 120.771 -3.077 1
1 17 . 25 1 1 A 17 17 ALA H H 16 8.333 8.822 -0.489 1
1 18 . 25 1 1 A 17 17 ALA HA H 16 4.252 4.307 -0.055 1
1 22 . 25 1 1 A 17 17 ALA CA C 16 53.377 53.931 -0.554 1
1 23 . 25 1 1 A 17 17 ALA CB C 16 18.896 18.555 0.341 1
1 24 . 25 1 1 A 17 17 ALA N N 16 125.462 129.628 -4.166 1
1 25 . 25 1 1 A 18 18 SER H H 17 8.219 7.950 0.269 1
1 26 . 25 1 1 A 18 18 SER HA H 17 4.332 4.272 0.060 1
1 29 . 25 1 1 A 18 18 SER CA C 17 59.105 61.339 -2.234 1
1 30 . 25 1 1 A 18 18 SER CB C 17 63.592 62.501 1.091 1
1 31 . 25 1 1 A 18 18 SER N N 17 114.821 113.523 1.298 1
1 32 . 25 1 1 A 19 19 ASP H H 18 8.309 8.127 0.182 1
1 33 . 25 1 1 A 19 19 ASP HA H 18 4.554 5.043 -0.489 1
1 36 . 25 1 1 A 19 19 ASP C C 18 176.528 176.864 -0.336 1
1 37 . 25 1 1 A 19 19 ASP CA C 18 55.272 54.758 0.514 1
1 38 . 25 1 1 A 19 19 ASP CB C 18 40.883 44.072 -3.189 1
1 39 . 25 1 1 A 19 19 ASP N N 18 123.367 119.380 3.987 1
1 40 . 25 1 1 A 20 20 ALA H H 19 8.133 7.732 0.401 1
1 41 . 25 1 1 A 20 20 ALA HA H 19 4.170 4.047 0.123 1
1 45 . 25 1 1 A 20 20 ALA C C 19 179.857 178.799 1.058 1
1 46 . 25 1 1 A 20 20 ALA CA C 19 54.341 55.625 -1.284 1
1 47 . 25 1 1 A 20 20 ALA CB C 19 18.660 18.617 0.043 1
1 48 . 25 1 1 A 20 20 ALA N N 19 123.350 122.225 1.125 1
1 49 . 25 1 1 A 21 21 GLU H H 20 8.140 7.831 0.309 1
1 50 . 25 1 1 A 21 21 GLU HA H 20 4.128 4.173 -0.045 1
1 55 . 25 1 1 A 21 21 GLU C C 20 177.675 178.958 -1.283 1
1 56 . 25 1 1 A 21 21 GLU CA C 20 58.520 59.455 -0.935 1
1 57 . 25 1 1 A 21 21 GLU CB C 20 29.765 29.504 0.261 1
1 59 . 25 1 1 A 21 21 GLU N N 20 119.063 118.768 0.295 1
1 60 . 25 1 1 A 22 22 PHE H H 21 8.009 7.998 0.011 1
1 61 . 25 1 1 A 22 22 PHE HA H 21 4.123 4.483 -0.360 1
1 68 . 25 1 1 A 22 22 PHE C C 21 176.410 177.311 -0.901 1
1 69 . 25 1 1 A 22 22 PHE CA C 21 62.202 61.328 0.874 1
1 70 . 25 1 1 A 22 22 PHE CB C 21 39.223 39.121 0.102 1
1 75 . 25 1 1 A 22 22 PHE N N 21 121.211 121.254 -0.043 1
1 76 . 25 1 1 A 23 23 ASP H H 22 8.261 8.481 -0.220 1
1 77 . 25 1 1 A 23 23 ASP HA H 22 4.041 4.384 -0.343 1
1 80 . 25 1 1 A 23 23 ASP C C 22 179.078 178.066 1.012 1
1 81 . 25 1 1 A 23 23 ASP CA C 22 57.048 57.769 -0.721 1
1 82 . 25 1 1 A 23 23 ASP CB C 22 40.154 41.390 -1.236 1
1 83 . 25 1 1 A 23 23 ASP N N 22 116.876 119.065 -2.189 1
1 84 . 25 1 1 A 24 24 ALA H H 23 7.651 7.674 -0.023 1
1 85 . 25 1 1 A 24 24 ALA HA H 23 3.785 3.894 -0.109 1
1 89 . 25 1 1 A 24 24 ALA C C 23 179.577 179.497 0.080 1
1 90 . 25 1 1 A 24 24 ALA CA C 23 54.341 55.059 -0.718 1
1 91 . 25 1 1 A 24 24 ALA CB C 23 17.762 18.540 -0.778 1
1 92 . 25 1 1 A 24 24 ALA N N 23 121.873 121.476 0.397 1
1 93 . 25 1 1 A 25 25 VAL H H 24 7.718 8.049 -0.331 1
1 94 . 25 1 1 A 25 25 VAL HA H 24 3.216 3.656 -0.440 1
1 102 . 25 1 1 A 25 25 VAL C C 24 177.805 178.244 -0.439 1
1 103 . 25 1 1 A 25 25 VAL CA C 24 66.789 66.926 -0.137 1
1 104 . 25 1 1 A 25 25 VAL CB C 24 31.277 31.325 -0.048 1
1 107 . 25 1 1 A 25 25 VAL N N 24 117.890 117.953 -0.063 1
1 108 . 25 1 1 A 26 26 VAL H H 25 7.867 7.749 0.118 1
1 109 . 25 1 1 A 26 26 VAL HA H 25 3.274 3.511 -0.237 1
1 117 . 25 1 1 A 26 26 VAL C C 25 177.788 177.926 -0.138 1
1 118 . 25 1 1 A 26 26 VAL CA C 25 67.282 66.324 0.958 1
1 119 . 25 1 1 A 26 26 VAL CB C 25 31.266 31.394 -0.128 1
1 122 . 25 1 1 A 26 26 VAL N N 25 118.170 119.814 -1.644 1
1 123 . 25 1 1 A 27 27 GLY H H 26 7.544 7.813 -0.269 1
1 124 . 25 1 1 A 27 27 GLY HA2 H 26 3.592 3.502 0.090 1
1 125 . 25 1 1 A 27 27 GLY HA3 H 26 3.721 3.627 0.094 1
1 126 . 25 1 1 A 27 27 GLY C C 26 176.717 176.462 0.255 1
1 127 . 25 1 1 A 27 27 GLY CA C 26 47.085 47.230 -0.145 1
1 128 . 25 1 1 A 27 27 GLY N N 26 105.795 107.536 -1.741 1
1 129 . 25 1 1 A 28 28 TYR H H 27 7.625 7.398 0.227 1
1 130 . 25 1 1 A 28 28 TYR HA H 27 4.546 4.581 -0.035 1
1 137 . 25 1 1 A 28 28 TYR C C 27 178.991 178.225 0.766 1
1 138 . 25 1 1 A 28 28 TYR CA C 27 58.845 59.822 -0.977 1
1 139 . 25 1 1 A 28 28 TYR CB C 27 37.602 37.448 0.154 1
1 144 . 25 1 1 A 28 28 TYR N N 27 119.933 122.020 -2.087 1
1 145 . 25 1 1 A 29 29 LEU H H 28 8.517 8.181 0.336 1
1 146 . 25 1 1 A 29 29 LEU HA H 28 3.728 3.836 -0.108 1
1 156 . 25 1 1 A 29 29 LEU CA C 28 58.281 58.162 0.119 1
1 157 . 25 1 1 A 29 29 LEU CB C 28 41.948 41.374 0.574 1
1 161 . 25 1 1 A 29 29 LEU N N 28 119.669 120.651 -0.982 1
1 162 . 25 1 1 A 30 30 GLU H H 29 8.072 7.927 0.145 1
1 163 . 25 1 1 A 30 30 GLU HA H 29 3.722 3.861 -0.139 1
1 168 . 25 1 1 A 30 30 GLU C C 29 177.731 178.922 -1.191 1
1 169 . 25 1 1 A 30 30 GLU CA C 29 59.763 59.936 -0.173 1
1 170 . 25 1 1 A 30 30 GLU CB C 29 28.844 29.465 -0.621 1
1 172 . 25 1 1 A 30 30 GLU N N 29 117.666 117.605 0.061 1
1 173 . 25 1 1 A 31 31 ASP H H 30 7.243 8.036 -0.793 1
1 174 . 25 1 1 A 31 31 ASP HA H 30 4.297 4.372 -0.075 1
1 177 . 25 1 1 A 31 31 ASP CA C 30 56.953 57.259 -0.306 1
1 178 . 25 1 1 A 31 31 ASP CB C 30 40.730 42.353 -1.623 1
1 179 . 25 1 1 A 31 31 ASP N N 30 116.720 119.373 -2.653 1
1 180 . 25 1 1 A 32 32 ILE H H 31 7.940 7.560 0.380 1
1 181 . 25 1 1 A 32 32 ILE HA H 31 3.640 3.684 -0.044 1
1 191 . 25 1 1 A 32 32 ILE C C 31 177.980 178.152 -0.172 1
1 192 . 25 1 1 A 32 32 ILE CA C 31 64.692 64.412 0.280 1
1 193 . 25 1 1 A 32 32 ILE CB C 31 38.938 37.501 1.437 1
1 197 . 25 1 1 A 32 32 ILE N N 31 119.728 118.909 0.819 1
1 198 . 25 1 1 A 33 33 ILE H H 32 7.984 7.619 0.365 1
1 199 . 25 1 1 A 33 33 ILE HA H 32 3.598 3.355 0.243 1
1 209 . 25 1 1 A 33 33 ILE C C 32 176.723 177.017 -0.294 1
1 210 . 25 1 1 A 33 33 ILE CA C 32 63.241 64.710 -1.469 1
1 211 . 25 1 1 A 33 33 ILE CB C 32 37.580 37.978 -0.398 1
1 215 . 25 1 1 A 33 33 ILE N N 32 113.919 120.810 -6.891 1
1 216 . 25 1 1 A 34 34 MET H H 33 7.288 7.547 -0.259 1
1 217 . 25 1 1 A 34 34 MET HA H 33 4.496 4.679 -0.183 1
1 225 . 25 1 1 A 34 34 MET C C 33 176.423 175.754 0.669 1
1 226 . 25 1 1 A 34 34 MET CA C 33 54.634 54.102 0.532 1
1 227 . 25 1 1 A 34 34 MET CB C 33 31.934 31.895 0.039 1
1 230 . 25 1 1 A 34 34 MET N N 33 115.130 116.482 -1.352 1
1 231 . 25 1 1 A 35 35 ASP H H 34 7.405 7.746 -0.341 1
1 232 . 25 1 1 A 35 35 ASP HA H 34 4.484 4.547 -0.063 1
1 235 . 25 1 1 A 35 35 ASP C C 34 177.139 176.732 0.407 1
1 236 . 25 1 1 A 35 35 ASP CA C 34 54.625 54.602 0.023 1
1 237 . 25 1 1 A 35 35 ASP CB C 34 43.554 42.628 0.926 1
1 238 . 25 1 1 A 35 35 ASP N N 34 121.814 122.408 -0.594 1
1 239 . 25 1 1 A 36 36 ASP H H 35 8.765 9.040 -0.275 1
1 240 . 25 1 1 A 36 36 ASP HA H 35 4.235 4.333 -0.098 1
1 243 . 25 1 1 A 36 36 ASP C C 35 178.320 178.320 0.000 1
1 244 . 25 1 1 A 36 36 ASP CA C 35 57.832 57.266 0.566 1
1 245 . 25 1 1 A 36 36 ASP CB C 35 40.914 39.776 1.138 1
1 246 . 25 1 1 A 36 36 ASP N N 35 125.883 126.482 -0.599 1
1 247 . 25 1 1 A 37 37 GLU H H 36 8.905 8.178 0.727 1
1 248 . 25 1 1 A 37 37 GLU HA H 36 3.933 4.096 -0.163 1
1 253 . 25 1 1 A 37 37 GLU C C 36 179.304 179.009 0.295 1
1 254 . 25 1 1 A 37 37 GLU CA C 36 59.828 58.916 0.912 1
1 255 . 25 1 1 A 37 37 GLU CB C 36 29.380 29.424 -0.044 1
1 257 . 25 1 1 A 37 37 GLU N N 36 119.077 120.338 -1.261 1
1 258 . 25 1 1 A 38 38 PHE H H 37 7.460 8.270 -0.810 1
1 259 . 25 1 1 A 38 38 PHE HA H 37 3.642 3.861 -0.219 1
1 267 . 25 1 1 A 38 38 PHE C C 37 176.483 177.888 -1.405 1
1 268 . 25 1 1 A 38 38 PHE CA C 37 61.411 61.177 0.234 1
1 269 . 25 1 1 A 38 38 PHE CB C 37 39.355 38.954 0.401 1
1 275 . 25 1 1 A 38 38 PHE N N 37 119.968 122.807 -2.839 1
1 276 . 25 1 1 A 39 39 GLN H H 38 7.968 8.145 -0.177 1
1 277 . 25 1 1 A 39 39 GLN HA H 38 3.712 3.718 -0.006 1
1 284 . 25 1 1 A 39 39 GLN CA C 38 59.153 58.778 0.375 1
1 285 . 25 1 1 A 39 39 GLN CB C 38 28.213 28.210 0.003 1
1 287 . 25 1 1 A 39 39 GLN N N 38 116.433 118.450 -2.017 1
1 289 . 25 1 1 A 40 40 LEU H H 39 7.930 7.623 0.307 1
1 290 . 25 1 1 A 40 40 LEU HA H 39 3.916 3.994 -0.078 1
1 300 . 25 1 1 A 40 40 LEU C C 39 177.731 177.986 -0.255 1
1 301 . 25 1 1 A 40 40 LEU CA C 39 57.915 57.889 0.026 1
1 302 . 25 1 1 A 40 40 LEU CB C 39 41.989 41.444 0.545 1
1 306 . 25 1 1 A 40 40 LEU N N 39 119.505 121.406 -1.901 1
1 307 . 25 1 1 A 41 41 LEU H H 40 7.174 7.594 -0.420 1
1 308 . 25 1 1 A 41 41 LEU HA H 40 3.835 3.971 -0.136 1
1 318 . 25 1 1 A 41 41 LEU C C 40 179.738 178.323 1.415 1
1 319 . 25 1 1 A 41 41 LEU CA C 40 58.266 58.356 -0.090 1
1 320 . 25 1 1 A 41 41 LEU CB C 40 42.050 41.446 0.604 1
1 324 . 25 1 1 A 41 41 LEU N N 40 120.971 119.719 1.252 1
1 325 . 25 1 1 A 42 42 GLN H H 41 8.058 7.887 0.171 1
1 326 . 25 1 1 A 42 42 GLN HA H 41 3.556 3.759 -0.203 1
1 333 . 25 1 1 A 42 42 GLN C C 41 177.642 178.408 -0.766 1
1 334 . 25 1 1 A 42 42 GLN CA C 41 59.826 59.189 0.637 1
1 335 . 25 1 1 A 42 42 GLN CB C 41 28.762 27.837 0.925 1
1 337 . 25 1 1 A 42 42 GLN N N 41 117.899 117.784 0.115 1
1 339 . 25 1 1 A 43 43 ARG H H 42 8.179 7.670 0.509 1
1 340 . 25 1 1 A 43 43 ARG HA H 42 3.655 3.882 -0.227 1
1 347 . 25 1 1 A 43 43 ARG C C 42 178.051 178.253 -0.202 1
1 348 . 25 1 1 A 43 43 ARG CA C 42 59.766 58.673 1.093 1
1 349 . 25 1 1 A 43 43 ARG CB C 42 29.941 29.994 -0.053 1
1 352 . 25 1 1 A 43 43 ARG N N 42 119.392 119.634 -0.242 1
1 353 . 25 1 1 A 44 44 ASN H H 43 8.525 8.142 0.383 1
1 354 . 25 1 1 A 44 44 ASN HA H 43 4.332 4.375 -0.043 1
1 359 . 25 1 1 A 44 44 ASN C C 43 178.150 177.687 0.463 1
1 360 . 25 1 1 A 44 44 ASN CA C 43 55.841 56.189 -0.348 1
1 361 . 25 1 1 A 44 44 ASN CB C 43 37.632 39.190 -1.558 1
1 362 . 25 1 1 A 44 44 ASN N N 43 116.214 117.585 -1.371 1
1 364 . 25 1 1 A 45 45 PHE H H 44 7.586 7.777 -0.191 1
1 365 . 25 1 1 A 45 45 PHE HA H 44 4.132 4.284 -0.152 1
1 372 . 25 1 1 A 45 45 PHE C C 44 176.691 178.331 -1.640 1
1 373 . 25 1 1 A 45 45 PHE CA C 44 62.333 60.555 1.778 1
1 374 . 25 1 1 A 45 45 PHE CB C 44 39.449 38.676 0.773 1
1 379 . 25 1 1 A 45 45 PHE N N 44 121.501 117.769 3.732 1
1 380 . 25 1 1 A 46 46 MET H H 45 8.190 8.419 -0.229 1
1 381 . 25 1 1 A 46 46 MET HA H 45 4.060 4.257 -0.197 1
1 389 . 25 1 1 A 46 46 MET C C 45 179.754 178.211 1.543 1
1 390 . 25 1 1 A 46 46 MET CA C 45 57.742 57.828 -0.086 1
1 391 . 25 1 1 A 46 46 MET CB C 45 29.912 31.299 -1.387 1
1 394 . 25 1 1 A 46 46 MET N N 45 116.727 117.607 -0.880 1
1 395 . 25 1 1 A 47 47 ASP H H 46 8.579 8.237 0.342 1
1 396 . 25 1 1 A 47 47 ASP HA H 46 4.804 4.693 0.111 1
1 399 . 25 1 1 A 47 47 ASP C C 46 177.854 177.687 0.167 1
1 400 . 25 1 1 A 47 47 ASP CA C 46 57.277 57.308 -0.031 1
1 401 . 25 1 1 A 47 47 ASP CB C 46 40.776 41.943 -1.167 1
1 402 . 25 1 1 A 47 47 ASP N N 46 117.798 120.924 -3.126 1
1 403 . 25 1 1 A 48 48 LYS H H 47 7.339 7.820 -0.481 1
1 404 . 25 1 1 A 48 48 LYS HA H 47 3.828 4.384 -0.556 1
1 413 . 25 1 1 A 48 48 LYS C C 47 178.812 178.508 0.304 1
1 414 . 25 1 1 A 48 48 LYS CA C 47 58.953 57.365 1.588 1
1 415 . 25 1 1 A 48 48 LYS CB C 47 32.796 33.410 -0.614 1
1 419 . 25 1 1 A 48 48 LYS N N 47 117.852 117.877 -0.025 1
1 420 . 25 1 1 A 49 49 TYR H H 48 6.841 8.458 -1.617 1
1 421 . 25 1 1 A 49 49 TYR HA H 48 4.995 4.293 0.702 1
1 428 . 25 1 1 A 49 49 TYR C C 48 178.138 178.701 -0.563 1
1 429 . 25 1 1 A 49 49 TYR CA C 48 58.620 59.700 -1.080 1
1 430 . 25 1 1 A 49 49 TYR CB C 48 42.939 38.121 4.818 1
1 435 . 25 1 1 A 49 49 TYR N N 48 112.109 119.111 -7.002 1
1 436 . 25 1 1 A 50 50 TYR H H 49 8.491 8.280 0.211 1
1 437 . 25 1 1 A 50 50 TYR HA H 49 4.598 4.303 0.295 1
1 444 . 25 1 1 A 50 50 TYR C C 49 176.015 177.505 -1.490 1
1 445 . 25 1 1 A 50 50 TYR CA C 49 62.442 59.538 2.904 1
1 446 . 25 1 1 A 50 50 TYR CB C 49 36.588 36.857 -0.269 1
1 451 . 25 1 1 A 50 50 TYR N N 49 118.294 119.417 -1.123 1
1 452 . 25 1 1 A 51 51 LEU H H 50 7.512 7.674 -0.162 1
1 453 . 25 1 1 A 51 51 LEU HA H 50 3.878 3.573 0.305 1
1 463 . 25 1 1 A 51 51 LEU C C 50 178.625 178.758 -0.133 1
1 464 . 25 1 1 A 51 51 LEU CA C 50 55.994 57.352 -1.358 1
1 465 . 25 1 1 A 51 51 LEU CB C 50 40.743 41.661 -0.918 1
1 469 . 25 1 1 A 51 51 LEU N N 50 118.478 121.742 -3.264 1
1 470 . 25 1 1 A 52 52 GLU H H 51 8.042 8.018 0.024 1
1 471 . 25 1 1 A 52 52 GLU HA H 51 4.197 3.983 0.214 1
1 476 . 25 1 1 A 52 52 GLU C C 51 177.629 177.719 -0.090 1
1 477 . 25 1 1 A 52 52 GLU CA C 51 56.141 59.540 -3.399 1
1 478 . 25 1 1 A 52 52 GLU CB C 51 29.162 29.469 -0.307 1
1 480 . 25 1 1 A 52 52 GLU N N 51 115.067 117.579 -2.512 1
1 481 . 25 1 1 A 53 53 PHE H H 52 7.465 7.949 -0.484 1
1 482 . 25 1 1 A 53 53 PHE HA H 52 4.431 4.609 -0.178 1
1 490 . 25 1 1 A 53 53 PHE C C 52 174.325 174.849 -0.524 1
1 491 . 25 1 1 A 53 53 PHE CA C 52 58.986 57.140 1.846 1
1 492 . 25 1 1 A 53 53 PHE CB C 52 40.183 37.588 2.595 1
1 498 . 25 1 1 A 53 53 PHE N N 52 116.768 118.748 -1.980 1
1 499 . 25 1 1 A 54 54 GLU H H 53 7.484 8.516 -1.032 1
1 500 . 25 1 1 A 54 54 GLU HA H 53 4.583 4.985 -0.402 1
1 505 . 25 1 1 A 54 54 GLU C C 53 175.722 175.388 0.334 1
1 506 . 25 1 1 A 54 54 GLU CA C 53 54.248 54.302 -0.054 1
1 507 . 25 1 1 A 54 54 GLU CB C 53 34.409 33.239 1.170 1
1 509 . 25 1 1 A 54 54 GLU N N 53 118.844 125.575 -6.731 1
1 510 . 25 1 1 A 55 55 ASP H H 54 9.008 8.684 0.324 1
1 511 . 25 1 1 A 55 55 ASP HA H 54 4.735 4.744 -0.009 1
1 514 . 25 1 1 A 55 55 ASP C C 54 175.421 176.161 -0.740 1
1 515 . 25 1 1 A 55 55 ASP CA C 54 52.888 54.288 -1.400 1
1 516 . 25 1 1 A 55 55 ASP CB C 54 38.894 40.777 -1.883 1
1 517 . 25 1 1 A 55 55 ASP N N 54 123.654 124.547 -0.893 1
1 518 . 25 1 1 A 56 56 THR H H 55 7.819 8.628 -0.809 1
1 519 . 25 1 1 A 56 56 THR HA H 55 4.574 5.055 -0.481 1
1 524 . 25 1 1 A 56 56 THR C C 55 174.096 174.199 -0.103 1
1 525 . 25 1 1 A 56 56 THR CA C 55 59.172 60.236 -1.064 1
1 526 . 25 1 1 A 56 56 THR CB C 55 71.889 72.164 -0.275 1
1 528 . 25 1 1 A 56 56 THR N N 55 112.015 115.136 -3.121 1
1 529 . 25 1 1 A 57 57 GLU H H 56 8.527 8.529 -0.002 1
1 530 . 25 1 1 A 57 57 GLU HA H 56 4.217 4.671 -0.454 1
1 535 . 25 1 1 A 57 57 GLU C C 56 177.042 175.768 1.274 1
1 536 . 25 1 1 A 57 57 GLU CA C 56 56.869 55.601 1.268 1
1 537 . 25 1 1 A 57 57 GLU CB C 56 29.731 30.438 -0.707 1
1 539 . 25 1 1 A 57 57 GLU N N 56 117.531 119.067 -1.536 1
1 540 . 25 1 1 A 58 58 GLU H H 57 7.587 7.717 -0.130 1
1 541 . 25 1 1 A 58 58 GLU HA H 57 3.941 4.822 -0.881 1
1 546 . 25 1 1 A 58 58 GLU C C 57 176.849 175.366 1.483 1
1 547 . 25 1 1 A 58 58 GLU CA C 57 56.924 55.349 1.575 1
1 548 . 25 1 1 A 58 58 GLU CB C 57 30.251 32.161 -1.910 1
1 550 . 25 1 1 A 58 58 GLU N N 57 119.183 122.540 -3.357 1
1 551 . 25 1 1 A 59 59 ASN H H 58 9.120 8.681 0.439 1
1 552 . 25 1 1 A 59 59 ASN HA H 58 4.922 5.157 -0.235 1
1 557 . 25 1 1 A 59 59 ASN C C 58 174.254 175.261 -1.007 1
1 558 . 25 1 1 A 59 59 ASN CA C 58 51.956 53.386 -1.430 1
1 559 . 25 1 1 A 59 59 ASN CB C 58 37.404 39.410 -2.006 1
1 560 . 25 1 1 A 59 59 ASN N N 58 126.767 125.422 1.345 1
1 562 . 25 1 1 A 60 60 LYS H H 59 5.892 9.076 -3.184 1
1 563 . 25 1 1 A 60 60 LYS HA H 59 3.798 4.825 -1.027 1
1 572 . 25 1 1 A 60 60 LYS C C 59 177.908 176.894 1.014 1
1 573 . 25 1 1 A 60 60 LYS CA C 59 56.623 54.747 1.876 1
1 574 . 25 1 1 A 60 60 LYS CB C 59 32.279 34.761 -2.482 1
1 578 . 25 1 1 A 60 60 LYS N N 59 121.527 123.305 -1.778 1
1 579 . 25 1 1 A 61 61 LEU H H 60 8.473 8.761 -0.288 1
1 580 . 25 1 1 A 61 61 LEU HA H 60 3.891 4.205 -0.314 1
1 590 . 25 1 1 A 61 61 LEU C C 60 179.843 178.309 1.534 1
1 591 . 25 1 1 A 61 61 LEU CA C 60 58.301 56.183 2.118 1
1 592 . 25 1 1 A 61 61 LEU CB C 60 41.305 41.475 -0.170 1
1 596 . 25 1 1 A 61 61 LEU N N 60 125.639 123.550 2.089 1
1 597 . 25 1 1 A 62 62 ILE H H 61 7.698 7.654 0.044 1
1 598 . 25 1 1 A 62 62 ILE HA H 61 3.952 3.850 0.102 1
1 608 . 25 1 1 A 62 62 ILE C C 61 175.392 177.095 -1.703 1
1 609 . 25 1 1 A 62 62 ILE CA C 61 61.743 63.310 -1.567 1
1 610 . 25 1 1 A 62 62 ILE CB C 61 39.108 37.720 1.388 1
1 614 . 25 1 1 A 62 62 ILE N N 61 114.111 119.886 -5.775 1
1 615 . 25 1 1 A 63 63 TYR H H 62 7.273 7.535 -0.262 1
1 616 . 25 1 1 A 63 63 TYR HA H 62 4.343 4.231 0.112 1
1 623 . 25 1 1 A 63 63 TYR C C 62 178.264 178.603 -0.339 1
1 624 . 25 1 1 A 63 63 TYR CA C 62 57.231 60.991 -3.760 1
1 625 . 25 1 1 A 63 63 TYR CB C 62 36.332 37.357 -1.025 1
1 630 . 25 1 1 A 63 63 TYR N N 62 117.689 121.361 -3.672 1
1 631 . 25 1 1 A 64 64 THR H H 63 7.747 8.018 -0.271 1
1 632 . 25 1 1 A 64 64 THR HA H 63 4.266 4.208 0.058 1
1 637 . 25 1 1 A 64 64 THR CA C 63 69.362 67.534 1.828 1
1 638 . 25 1 1 A 64 64 THR CB C 63 66.962 67.906 -0.944 1
1 640 . 25 1 1 A 64 64 THR N N 63 113.755 116.310 -2.555 1
1 641 . 25 1 1 A 65 65 PRO HA H 64 4.372 4.383 -0.011 1
1 648 . 25 1 1 A 65 65 PRO C C 64 179.913 179.396 0.517 1
1 649 . 25 1 1 A 65 65 PRO CA C 64 66.011 66.230 -0.219 1
1 650 . 25 1 1 A 65 65 PRO CB C 64 30.642 30.794 -0.152 1
1 653 . 25 1 1 A 66 66 ILE H H 65 7.377 7.338 0.039 1
1 654 . 25 1 1 A 66 66 ILE HA H 65 3.530 3.896 -0.366 1
1 664 . 25 1 1 A 66 66 ILE C C 65 177.543 178.393 -0.850 1
1 665 . 25 1 1 A 66 66 ILE CA C 65 66.647 64.319 2.328 1
1 666 . 25 1 1 A 66 66 ILE CB C 65 38.029 37.774 0.255 1
1 670 . 25 1 1 A 66 66 ILE N N 65 118.353 116.720 1.633 1
1 671 . 25 1 1 A 67 67 PHE H H 66 8.480 8.420 0.060 1
1 672 . 25 1 1 A 67 67 PHE HA H 66 4.115 4.365 -0.250 1
1 680 . 25 1 1 A 67 67 PHE C C 66 177.293 178.039 -0.746 1
1 681 . 25 1 1 A 67 67 PHE CA C 66 59.570 62.200 -2.630 1
1 682 . 25 1 1 A 67 67 PHE CB C 66 38.865 39.696 -0.831 1
1 688 . 25 1 1 A 67 67 PHE N N 66 122.420 120.500 1.920 1
1 689 . 25 1 1 A 68 68 ASN H H 67 8.595 8.134 0.461 1
1 690 . 25 1 1 A 68 68 ASN HA H 67 4.211 4.263 -0.052 1
1 695 . 25 1 1 A 68 68 ASN C C 67 178.697 178.222 0.475 1
1 696 . 25 1 1 A 68 68 ASN CA C 67 56.056 56.335 -0.279 1
1 697 . 25 1 1 A 68 68 ASN CB C 67 37.704 37.868 -0.164 1
1 698 . 25 1 1 A 68 68 ASN N N 67 115.573 116.706 -1.133 1
1 700 . 25 1 1 A 69 69 GLU H H 68 8.414 8.031 0.383 1
1 701 . 25 1 1 A 69 69 GLU HA H 68 4.102 4.171 -0.069 1
1 706 . 25 1 1 A 69 69 GLU C C 68 177.880 178.772 -0.892 1
1 707 . 25 1 1 A 69 69 GLU CA C 68 59.399 59.484 -0.085 1
1 708 . 25 1 1 A 69 69 GLU CB C 68 29.855 29.474 0.381 1
1 710 . 25 1 1 A 69 69 GLU N N 68 123.510 120.062 3.448 1
1 711 . 25 1 1 A 70 70 TYR H H 69 8.659 8.003 0.656 1
1 712 . 25 1 1 A 70 70 TYR HA H 69 3.362 4.105 -0.743 1
1 719 . 25 1 1 A 70 70 TYR C C 69 178.143 177.037 1.106 1
1 720 . 25 1 1 A 70 70 TYR CA C 69 60.686 61.156 -0.470 1
1 721 . 25 1 1 A 70 70 TYR CB C 69 38.560 38.818 -0.258 1
1 726 . 25 1 1 A 70 70 TYR N N 69 122.130 120.738 1.392 1
1 727 . 25 1 1 A 71 71 ILE H H 70 8.031 7.779 0.252 1
1 728 . 25 1 1 A 71 71 ILE HA H 70 3.265 3.685 -0.420 1
1 738 . 25 1 1 A 71 71 ILE C C 70 178.056 177.982 0.074 1
1 739 . 25 1 1 A 71 71 ILE CA C 70 63.756 63.944 -0.188 1
1 740 . 25 1 1 A 71 71 ILE CB C 70 37.321 36.418 0.903 1
1 744 . 25 1 1 A 71 71 ILE N N 70 118.906 120.424 -1.518 1
1 745 . 25 1 1 A 72 72 SER H H 71 7.803 7.820 -0.017 1
1 746 . 25 1 1 A 72 72 SER HA H 71 4.029 4.288 -0.259 1
1 749 . 25 1 1 A 72 72 SER CA C 71 61.380 61.102 0.278 1
1 750 . 25 1 1 A 72 72 SER CB C 71 63.288 63.095 0.193 1
1 751 . 25 1 1 A 72 72 SER N N 71 113.735 116.993 -3.258 1
1 752 . 25 1 1 A 73 73 LEU H H 72 7.952 7.819 0.133 1
1 753 . 25 1 1 A 73 73 LEU HA H 72 4.418 4.108 0.310 1
1 763 . 25 1 1 A 73 73 LEU C C 72 177.767 178.309 -0.542 1
1 764 . 25 1 1 A 73 73 LEU CA C 72 56.543 57.389 -0.846 1
1 765 . 25 1 1 A 73 73 LEU CB C 72 44.517 41.745 2.772 1
1 769 . 25 1 1 A 73 73 LEU N N 72 119.411 122.414 -3.003 1
1 770 . 25 1 1 A 74 74 VAL H H 73 8.021 7.634 0.387 1
1 771 . 25 1 1 A 74 74 VAL HA H 73 3.532 3.347 0.185 1
1 779 . 25 1 1 A 74 74 VAL C C 73 177.126 177.969 -0.843 1
1 780 . 25 1 1 A 74 74 VAL CA C 73 66.250 66.354 -0.104 1
1 781 . 25 1 1 A 74 74 VAL CB C 73 31.212 31.123 0.089 1
1 784 . 25 1 1 A 74 74 VAL N N 73 118.747 119.234 -0.487 1
1 785 . 25 1 1 A 75 75 GLU H H 74 7.232 7.872 -0.640 1
1 786 . 25 1 1 A 75 75 GLU HA H 74 3.013 4.166 -1.153 1
1 791 . 25 1 1 A 75 75 GLU C C 74 178.804 179.000 -0.196 1
1 792 . 25 1 1 A 75 75 GLU CA C 74 60.536 59.844 0.692 1
1 793 . 25 1 1 A 75 75 GLU CB C 74 27.009 29.162 -2.153 1
1 795 . 25 1 1 A 75 75 GLU N N 74 118.660 119.826 -1.166 1
1 796 . 25 1 1 A 76 76 LYS H H 75 7.051 7.777 -0.726 1
1 797 . 25 1 1 A 76 76 LYS HA H 75 3.765 4.029 -0.264 1
1 806 . 25 1 1 A 76 76 LYS C C 75 177.765 178.493 -0.728 1
1 807 . 25 1 1 A 76 76 LYS CA C 75 58.357 58.704 -0.347 1
1 808 . 25 1 1 A 76 76 LYS CB C 75 31.939 32.233 -0.294 1
1 812 . 25 1 1 A 76 76 LYS N N 75 116.112 119.412 -3.300 1
1 813 . 25 1 1 A 77 77 TYR H H 76 7.067 7.750 -0.683 1
1 814 . 25 1 1 A 77 77 TYR HA H 76 4.036 4.145 -0.109 1
1 821 . 25 1 1 A 77 77 TYR C C 76 177.752 177.246 0.506 1
1 822 . 25 1 1 A 77 77 TYR CA C 76 61.820 61.191 0.629 1
1 823 . 25 1 1 A 77 77 TYR CB C 76 38.480 38.653 -0.173 1
1 828 . 25 1 1 A 77 77 TYR N N 76 118.434 121.113 -2.679 1
1 829 . 25 1 1 A 78 78 ILE H H 77 7.554 8.306 -0.752 1
1 830 . 25 1 1 A 78 78 ILE HA H 77 3.159 3.681 -0.522 1
1 840 . 25 1 1 A 78 78 ILE C C 77 177.341 177.952 -0.611 1
1 841 . 25 1 1 A 78 78 ILE CA C 77 65.177 64.998 0.179 1
1 842 . 25 1 1 A 78 78 ILE CB C 77 37.339 37.864 -0.525 1
1 846 . 25 1 1 A 78 78 ILE N N 77 117.672 121.092 -3.420 1
1 847 . 25 1 1 A 79 79 GLU H H 78 8.296 7.927 0.369 1
1 848 . 25 1 1 A 79 79 GLU HA H 78 3.557 3.750 -0.193 1
1 853 . 25 1 1 A 79 79 GLU C C 78 177.742 178.531 -0.789 1
1 854 . 25 1 1 A 79 79 GLU CA C 78 60.847 60.016 0.831 1
1 855 . 25 1 1 A 79 79 GLU CB C 78 29.594 29.065 0.529 1
1 857 . 25 1 1 A 79 79 GLU N N 78 118.701 120.409 -1.708 1
1 858 . 25 1 1 A 80 80 GLU H H 79 8.330 8.433 -0.103 1
1 859 . 25 1 1 A 80 80 GLU HA H 79 3.774 3.918 -0.144 1
1 864 . 25 1 1 A 80 80 GLU C C 79 179.926 178.759 1.167 1
1 865 . 25 1 1 A 80 80 GLU CA C 79 59.581 59.114 0.467 1
1 866 . 25 1 1 A 80 80 GLU CB C 79 29.062 29.133 -0.071 1
1 868 . 25 1 1 A 80 80 GLU N N 79 116.767 117.983 -1.216 1
1 869 . 25 1 1 A 81 81 GLN H H 80 7.634 7.863 -0.229 1
1 870 . 25 1 1 A 81 81 GLN HA H 80 3.605 3.879 -0.274 1
1 877 . 25 1 1 A 81 81 GLN C C 80 179.681 177.501 2.180 1
1 878 . 25 1 1 A 81 81 GLN CA C 80 57.765 57.974 -0.209 1
1 879 . 25 1 1 A 81 81 GLN CB C 80 28.079 27.133 0.946 1
1 881 . 25 1 1 A 81 81 GLN N N 80 116.325 117.720 -1.395 1
1 883 . 25 1 1 A 82 82 LEU H H 81 8.156 7.452 0.704 1
1 884 . 25 1 1 A 82 82 LEU HA H 81 3.536 3.807 -0.271 1
1 894 . 25 1 1 A 82 82 LEU C C 81 178.945 179.348 -0.403 1
1 895 . 25 1 1 A 82 82 LEU CA C 81 57.761 56.894 0.867 1
1 896 . 25 1 1 A 82 82 LEU CB C 81 40.961 41.047 -0.086 1
1 900 . 25 1 1 A 82 82 LEU N N 81 121.546 121.400 0.146 1
1 901 . 25 1 1 A 83 83 LEU H H 82 8.326 8.268 0.058 1
1 902 . 25 1 1 A 83 83 LEU HA H 82 4.198 4.161 0.037 1
1 912 . 25 1 1 A 83 83 LEU C C 82 178.631 179.090 -0.459 1
1 913 . 25 1 1 A 83 83 LEU CA C 82 57.016 57.041 -0.025 1
1 914 . 25 1 1 A 83 83 LEU CB C 82 42.182 40.872 1.310 1
1 918 . 25 1 1 A 83 83 LEU N N 82 120.426 118.812 1.614 1
1 919 . 25 1 1 A 84 84 GLN H H 83 6.992 7.690 -0.698 1
1 920 . 25 1 1 A 84 84 GLN HA H 83 3.877 3.980 -0.103 1
1 927 . 25 1 1 A 84 84 GLN C C 83 177.008 176.919 0.089 1
1 928 . 25 1 1 A 84 84 GLN CA C 83 57.543 58.666 -1.123 1
1 929 . 25 1 1 A 84 84 GLN CB C 83 28.688 28.394 0.294 1
1 931 . 25 1 1 A 84 84 GLN N N 83 114.001 117.648 -3.647 1
1 933 . 25 1 1 A 85 85 ARG H H 84 7.072 7.283 -0.211 1
1 934 . 25 1 1 A 85 85 ARG HA H 84 4.047 4.386 -0.339 1
1 942 . 25 1 1 A 85 85 ARG C C 84 175.999 175.732 0.267 1
1 943 . 25 1 1 A 85 85 ARG CA C 84 56.764 56.027 0.737 1
1 944 . 25 1 1 A 85 85 ARG CB C 84 32.044 32.462 -0.418 1
1 947 . 25 1 1 A 85 85 ARG N N 84 115.827 116.649 -0.822 1
1 949 . 25 1 1 A 86 86 ILE H H 85 8.238 7.455 0.783 1
1 950 . 25 1 1 A 86 86 ILE HA H 85 4.389 4.564 -0.175 1
1 960 . 25 1 1 A 86 86 ILE CA C 85 58.007 57.904 0.103 1
1 961 . 25 1 1 A 86 86 ILE CB C 85 39.604 38.589 1.015 1
1 965 . 25 1 1 A 86 86 ILE N N 85 119.285 120.035 -0.750 1
1 966 . 25 1 1 A 87 87 PRO HA H 86 4.392 4.500 -0.108 1
1 973 . 25 1 1 A 87 87 PRO C C 86 177.622 177.067 0.555 1
1 974 . 25 1 1 A 87 87 PRO CA C 86 64.665 64.308 0.357 1
1 975 . 25 1 1 A 87 87 PRO CB C 86 32.020 31.734 0.286 1
1 978 . 25 1 1 A 88 88 GLU H H 87 8.312 8.195 0.117 1
1 979 . 25 1 1 A 88 88 GLU HA H 87 4.208 4.534 -0.326 1
1 984 . 25 1 1 A 88 88 GLU C C 87 175.554 175.919 -0.365 1
1 985 . 25 1 1 A 88 88 GLU CA C 87 56.045 56.267 -0.222 1
1 986 . 25 1 1 A 88 88 GLU CB C 87 28.654 30.352 -1.698 1
1 988 . 25 1 1 A 88 88 GLU N N 87 114.256 116.928 -2.672 1
1 989 . 25 1 1 A 89 89 PHE H H 88 7.946 7.555 0.391 1
1 990 . 25 1 1 A 89 89 PHE HA H 88 3.993 4.385 -0.392 1
1 998 . 25 1 1 A 89 89 PHE C C 88 173.460 175.106 -1.646 1
1 999 . 25 1 1 A 89 89 PHE CA C 88 60.119 59.481 0.638 1
1 1000 . 25 1 1 A 89 89 PHE CB C 88 39.994 39.663 0.331 1
1 1006 . 25 1 1 A 89 89 PHE N N 88 121.550 123.277 -1.727 1
1 1007 . 25 1 1 A 90 90 ASN H H 89 7.266 7.819 -0.553 1
1 1008 . 25 1 1 A 90 90 ASN HA H 89 4.454 4.978 -0.524 1
1 1013 . 25 1 1 A 90 90 ASN C C 89 173.921 174.945 -1.024 1
1 1014 . 25 1 1 A 90 90 ASN CA C 89 51.839 51.754 0.085 1
1 1015 . 25 1 1 A 90 90 ASN CB C 89 40.674 39.369 1.305 1
1 1016 . 25 1 1 A 90 90 ASN N N 89 125.344 124.453 0.891 1
1 1018 . 25 1 1 A 91 91 MET H H 90 8.968 8.668 0.300 1
1 1019 . 25 1 1 A 91 91 MET HA H 90 4.049 4.152 -0.103 1
1 1027 . 25 1 1 A 91 91 MET C C 90 177.475 178.399 -0.924 1
1 1028 . 25 1 1 A 91 91 MET CA C 90 57.758 58.606 -0.848 1
1 1029 . 25 1 1 A 91 91 MET CB C 90 32.250 32.015 0.235 1
1 1032 . 25 1 1 A 91 91 MET N N 90 127.052 122.983 4.069 1
1 1033 . 25 1 1 A 92 92 ALA H H 91 8.292 8.111 0.181 1
1 1034 . 25 1 1 A 92 92 ALA HA H 91 4.059 4.122 -0.063 1
1 1038 . 25 1 1 A 92 92 ALA C C 91 180.412 179.848 0.564 1
1 1039 . 25 1 1 A 92 92 ALA CA C 91 55.368 55.044 0.324 1
1 1040 . 25 1 1 A 92 92 ALA CB C 91 17.527 18.432 -0.905 1
1 1041 . 25 1 1 A 92 92 ALA N N 91 123.752 121.211 2.541 1
1 1042 . 25 1 1 A 93 93 ALA H H 92 7.931 7.686 0.245 1
1 1043 . 25 1 1 A 93 93 ALA HA H 92 4.054 4.078 -0.024 1
1 1047 . 25 1 1 A 93 93 ALA C C 92 180.482 179.825 0.657 1
1 1048 . 25 1 1 A 93 93 ALA CA C 92 54.614 54.867 -0.253 1
1 1049 . 25 1 1 A 93 93 ALA CB C 92 18.098 18.291 -0.193 1
1 1050 . 25 1 1 A 93 93 ALA N N 92 121.158 119.961 1.197 1
1 1051 . 25 1 1 A 94 94 PHE H H 93 8.110 8.007 0.103 1
1 1052 . 25 1 1 A 94 94 PHE HA H 93 4.304 4.098 0.206 1
1 1060 . 25 1 1 A 94 94 PHE C C 93 177.350 177.509 -0.159 1
1 1061 . 25 1 1 A 94 94 PHE CA C 93 61.641 61.448 0.193 1
1 1062 . 25 1 1 A 94 94 PHE CB C 93 40.014 39.213 0.801 1
1 1068 . 25 1 1 A 94 94 PHE N N 93 119.807 120.205 -0.398 1
1 1069 . 25 1 1 A 95 95 THR H H 94 8.726 8.256 0.470 1
1 1070 . 25 1 1 A 95 95 THR HA H 94 3.569 4.065 -0.496 1
1 1075 . 25 1 1 A 95 95 THR C C 94 176.932 176.890 0.042 1
1 1076 . 25 1 1 A 95 95 THR CA C 94 66.833 65.484 1.349 1
1 1077 . 25 1 1 A 95 95 THR CB C 94 68.445 68.135 0.310 1
1 1079 . 25 1 1 A 95 95 THR N N 94 113.074 112.708 0.366 1
1 1080 . 25 1 1 A 96 96 THR H H 95 7.657 7.792 -0.135 1
1 1081 . 25 1 1 A 96 96 THR HA H 95 3.945 3.997 -0.052 1
1 1086 . 25 1 1 A 96 96 THR C C 95 176.386 176.329 0.057 1
1 1087 . 25 1 1 A 96 96 THR CA C 95 66.550 66.057 0.493 1
1 1088 . 25 1 1 A 96 96 THR CB C 95 68.583 68.569 0.014 1
1 1090 . 25 1 1 A 96 96 THR N N 95 117.927 117.641 0.286 1
1 1091 . 25 1 1 A 97 97 THR H H 96 7.699 7.681 0.018 1
1 1092 . 25 1 1 A 97 97 THR HA H 96 3.905 3.947 -0.042 1
1 1097 . 25 1 1 A 97 97 THR C C 96 176.572 176.446 0.126 1
1 1098 . 25 1 1 A 97 97 THR CA C 96 65.979 66.212 -0.233 1
1 1099 . 25 1 1 A 97 97 THR CB C 96 68.553 68.203 0.350 1
1 1101 . 25 1 1 A 97 97 THR N N 96 118.518 117.159 1.359 1
1 1102 . 25 1 1 A 98 98 LEU H H 97 8.304 8.045 0.259 1
1 1103 . 25 1 1 A 98 98 LEU HA H 97 3.725 3.902 -0.177 1
1 1113 . 25 1 1 A 98 98 LEU C C 97 178.490 178.627 -0.137 1
1 1114 . 25 1 1 A 98 98 LEU CA C 97 58.517 57.982 0.535 1
1 1115 . 25 1 1 A 98 98 LEU CB C 97 41.697 41.343 0.354 1
1 1119 . 25 1 1 A 98 98 LEU N N 97 122.882 121.854 1.028 1
1 1120 . 25 1 1 A 99 99 GLN H H 98 7.639 8.089 -0.450 1
1 1121 . 25 1 1 A 99 99 GLN HA H 98 3.927 3.996 -0.069 1
1 1128 . 25 1 1 A 99 99 GLN C C 98 178.068 178.453 -0.385 1
1 1129 . 25 1 1 A 99 99 GLN CA C 98 58.735 59.087 -0.352 1
1 1130 . 25 1 1 A 99 99 GLN CB C 98 27.986 28.220 -0.234 1
1 1132 . 25 1 1 A 99 99 GLN N N 98 114.302 117.706 -3.404 1
1 1134 . 25 1 1 A 100 100 HIS H H 99 7.575 8.126 -0.551 1
1 1135 . 25 1 1 A 100 100 HIS HA H 99 4.524 4.312 0.212 1
1 1139 . 25 1 1 A 100 100 HIS C C 99 174.789 177.543 -2.754 1
1 1140 . 25 1 1 A 100 100 HIS CA C 99 56.154 59.000 -2.846 1
1 1141 . 25 1 1 A 100 100 HIS CB C 99 28.946 29.874 -0.928 1
1 1143 . 25 1 1 A 100 100 HIS N N 99 114.778 120.929 -6.151 1
1 1144 . 25 1 1 A 101 101 HIS H H 100 7.773 8.263 -0.490 1
1 1145 . 25 1 1 A 101 101 HIS HA H 100 4.704 4.080 0.624 1
1 1149 . 25 1 1 A 101 101 HIS C C 100 174.818 177.180 -2.362 1
1 1150 . 25 1 1 A 101 101 HIS CA C 100 54.830 58.875 -4.045 1
1 1151 . 25 1 1 A 101 101 HIS CB C 100 29.749 28.506 1.243 1
1 1153 . 25 1 1 A 101 101 HIS N N 100 117.397 115.977 1.420 1
1 1154 . 25 1 1 A 102 102 LYS H H 101 7.324 8.228 -0.904 1
1 1155 . 25 1 1 A 102 102 LYS HA H 101 3.611 4.055 -0.444 1
1 1164 . 25 1 1 A 102 102 LYS C C 101 176.823 178.686 -1.863 1
1 1165 . 25 1 1 A 102 102 LYS CA C 101 59.915 58.670 1.245 1
1 1166 . 25 1 1 A 102 102 LYS CB C 101 32.825 32.316 0.509 1
1 1170 . 25 1 1 A 102 102 LYS N N 101 120.533 122.226 -1.693 1
1 1171 . 25 1 1 A 103 103 ASP H H 102 8.361 7.531 0.830 1
1 1172 . 25 1 1 A 103 103 ASP HA H 102 4.421 4.421 0.000 1
1 1175 . 25 1 1 A 103 103 ASP C C 102 176.793 177.666 -0.873 1
1 1176 . 25 1 1 A 103 103 ASP CA C 102 55.500 56.081 -0.581 1
1 1177 . 25 1 1 A 103 103 ASP CB C 102 40.178 40.512 -0.334 1
1 1178 . 25 1 1 A 103 103 ASP N N 102 114.814 119.298 -4.484 1
1 1179 . 25 1 1 A 104 104 GLU H H 103 7.858 8.052 -0.194 1
1 1180 . 25 1 1 A 104 104 GLU HA H 103 4.339 4.608 -0.269 1
1 1183 . 25 1 1 A 104 104 GLU C C 103 175.777 176.769 -0.992 1
1 1184 . 25 1 1 A 104 104 GLU CA C 103 56.356 57.410 -1.054 1
1 1185 . 25 1 1 A 104 104 GLU CB C 103 31.293 32.578 -1.285 1
1 1186 . 25 1 1 A 104 104 GLU N N 103 116.826 118.270 -1.444 1
1 1187 . 25 1 1 A 105 105 VAL H H 104 7.201 7.533 -0.332 1
1 1188 . 25 1 1 A 105 105 VAL HA H 104 4.296 4.084 0.212 1
1 1196 . 25 1 1 A 105 105 VAL C C 104 174.482 176.008 -1.526 1
1 1197 . 25 1 1 A 105 105 VAL CA C 104 60.370 63.014 -2.644 1
1 1198 . 25 1 1 A 105 105 VAL CB C 104 34.341 32.378 1.963 1
1 1201 . 25 1 1 A 105 105 VAL N N 104 116.422 120.270 -3.848 1
1 1202 . 25 1 1 A 106 106 ALA H H 105 8.487 8.471 0.016 1
1 1203 . 25 1 1 A 106 106 ALA HA H 105 4.172 4.422 -0.250 1
1 1207 . 25 1 1 A 106 106 ALA C C 105 179.030 178.880 0.150 1
1 1208 . 25 1 1 A 106 106 ALA CA C 105 52.966 52.467 0.499 1
1 1209 . 25 1 1 A 106 106 ALA CB C 105 19.371 19.459 -0.088 1
1 1210 . 25 1 1 A 106 106 ALA N N 105 128.313 127.710 0.603 1
1 1211 . 25 1 1 A 107 107 GLY H H 106 8.738 8.784 -0.046 1
1 1212 . 25 1 1 A 107 107 GLY HA2 H 106 3.773 3.871 -0.098 1
1 1213 . 25 1 1 A 107 107 GLY HA3 H 106 3.998 3.935 0.063 1
1 1214 . 25 1 1 A 107 107 GLY C C 106 174.958 175.541 -0.583 1
1 1215 . 25 1 1 A 107 107 GLY CA C 106 47.449 47.147 0.302 1
1 1216 . 25 1 1 A 107 107 GLY N N 106 110.612 110.799 -0.187 1
1 1217 . 25 1 1 A 108 108 ASP H H 107 8.535 8.331 0.204 1
1 1218 . 25 1 1 A 108 108 ASP HA H 107 4.333 4.370 -0.037 1
1 1221 . 25 1 1 A 108 108 ASP C C 107 179.133 178.724 0.409 1
1 1222 . 25 1 1 A 108 108 ASP CA C 107 56.721 57.117 -0.396 1
1 1223 . 25 1 1 A 108 108 ASP CB C 107 39.336 41.631 -2.295 1
1 1224 . 25 1 1 A 108 108 ASP N N 107 117.474 121.606 -4.132 1
1 1225 . 25 1 1 A 109 109 ILE H H 108 7.459 7.923 -0.464 1
1 1226 . 25 1 1 A 109 109 ILE HA H 108 3.688 3.834 -0.146 1
1 1236 . 25 1 1 A 109 109 ILE C C 108 176.735 178.433 -1.698 1
1 1237 . 25 1 1 A 109 109 ILE CA C 108 63.474 65.354 -1.880 1
1 1238 . 25 1 1 A 109 109 ILE CB C 108 37.340 37.727 -0.387 1
1 1242 . 25 1 1 A 109 109 ILE N N 108 119.609 119.559 0.050 1
1 1243 . 25 1 1 A 110 110 PHE H H 109 7.920 8.327 -0.407 1
1 1244 . 25 1 1 A 110 110 PHE HA H 109 3.759 4.092 -0.333 1
1 1252 . 25 1 1 A 110 110 PHE C C 109 177.132 177.406 -0.274 1
1 1253 . 25 1 1 A 110 110 PHE CA C 109 62.766 61.244 1.522 1
1 1254 . 25 1 1 A 110 110 PHE CB C 109 39.752 39.349 0.403 1
1 1260 . 25 1 1 A 110 110 PHE N N 109 120.906 120.454 0.452 1
1 1261 . 25 1 1 A 111 111 ASP H H 110 8.639 8.296 0.343 1
1 1262 . 25 1 1 A 111 111 ASP HA H 110 4.216 4.237 -0.021 1
1 1265 . 25 1 1 A 111 111 ASP C C 110 178.900 178.431 0.469 1
1 1266 . 25 1 1 A 111 111 ASP CA C 110 57.105 57.251 -0.146 1
1 1267 . 25 1 1 A 111 111 ASP CB C 110 39.697 41.712 -2.015 1
1 1268 . 25 1 1 A 111 111 ASP N N 110 117.124 119.055 -1.931 1
1 1269 . 25 1 1 A 112 112 MET H H 111 7.331 7.539 -0.208 1
1 1270 . 25 1 1 A 112 112 MET HA H 111 4.081 4.142 -0.061 1
1 1278 . 25 1 1 A 112 112 MET C C 111 179.052 178.167 0.885 1
1 1279 . 25 1 1 A 112 112 MET CA C 111 58.202 58.109 0.093 1
1 1280 . 25 1 1 A 112 112 MET CB C 111 31.827 32.360 -0.533 1
1 1283 . 25 1 1 A 112 112 MET N N 111 118.061 119.455 -1.394 1
1 1284 . 25 1 1 A 113 113 LEU H H 112 8.001 8.036 -0.035 1
1 1285 . 25 1 1 A 113 113 LEU HA H 112 3.723 3.597 0.126 1
1 1295 . 25 1 1 A 113 113 LEU C C 112 179.747 178.675 1.072 1
1 1296 . 25 1 1 A 113 113 LEU CA C 112 57.371 57.437 -0.066 1
1 1297 . 25 1 1 A 113 113 LEU CB C 112 40.671 41.146 -0.475 1
1 1301 . 25 1 1 A 113 113 LEU N N 112 120.426 119.677 0.749 1
1 1302 . 25 1 1 A 114 114 LEU H H 113 7.744 7.638 0.106 1
1 1303 . 25 1 1 A 114 114 LEU HA H 113 4.007 3.535 0.472 1
1 1313 . 25 1 1 A 114 114 LEU C C 113 179.358 178.546 0.812 1
1 1314 . 25 1 1 A 114 114 LEU CA C 113 57.202 57.529 -0.327 1
1 1315 . 25 1 1 A 114 114 LEU CB C 113 41.727 41.626 0.101 1
1 1319 . 25 1 1 A 114 114 LEU N N 113 119.584 119.631 -0.047 1
1 1320 . 25 1 1 A 115 115 THR H H 114 7.353 7.600 -0.247 1
1 1321 . 25 1 1 A 115 115 THR HA H 114 4.071 4.082 -0.011 1
1 1327 . 25 1 1 A 115 115 THR C C 114 173.591 176.292 -2.701 1
1 1328 . 25 1 1 A 115 115 THR CA C 114 65.332 64.709 0.623 1
1 1329 . 25 1 1 A 115 115 THR CB C 114 70.319 68.547 1.772 1
1 1331 . 25 1 1 A 115 115 THR N N 114 107.535 112.359 -4.824 1
1 1332 . 25 1 1 A 116 116 PHE H H 115 6.979 7.944 -0.965 1
1 1333 . 25 1 1 A 116 116 PHE HA H 115 5.022 4.404 0.618 1
1 1341 . 25 1 1 A 116 116 PHE C C 115 176.488 176.221 0.267 1
1 1342 . 25 1 1 A 116 116 PHE CA C 115 55.911 61.106 -5.195 1
1 1343 . 25 1 1 A 116 116 PHE CB C 115 38.521 38.926 -0.405 1
1 1349 . 25 1 1 A 116 116 PHE N N 115 112.366 119.933 -7.567 1
1 1350 . 25 1 1 A 117 117 THR H H 116 7.564 8.218 -0.654 1
1 1351 . 25 1 1 A 117 117 THR HA H 116 4.626 4.850 -0.224 1
1 1356 . 25 1 1 A 117 117 THR C C 116 174.085 174.089 -0.004 1
1 1357 . 25 1 1 A 117 117 THR CA C 116 61.636 62.668 -1.032 1
1 1358 . 25 1 1 A 117 117 THR CB C 116 70.915 72.357 -1.442 1
1 1360 . 25 1 1 A 117 117 THR N N 116 105.498 112.927 -7.429 1
1 1361 . 25 1 1 A 118 118 ASP H H 117 8.270 7.883 0.387 1
1 1362 . 25 1 1 A 118 118 ASP HA H 117 4.955 4.681 0.274 1
1 1365 . 25 1 1 A 118 118 ASP C C 117 176.328 176.361 -0.033 1
1 1366 . 25 1 1 A 118 118 ASP CA C 117 53.417 52.858 0.559 1
1 1367 . 25 1 1 A 118 118 ASP CB C 117 43.388 39.496 3.892 1
1 1368 . 25 1 1 A 118 118 ASP N N 117 124.409 121.610 2.799 1
1 1369 . 25 1 1 A 119 119 PHE H H 118 8.973 8.630 0.343 1
1 1370 . 25 1 1 A 119 119 PHE HA H 118 3.506 4.179 -0.673 1
1 1378 . 25 1 1 A 119 119 PHE CA C 118 61.490 61.107 0.383 1
1 1379 . 25 1 1 A 119 119 PHE CB C 118 39.246 39.507 -0.261 1
1 1385 . 25 1 1 A 119 119 PHE N N 118 126.688 126.471 0.217 1
1 1386 . 25 1 1 A 120 120 LEU H H 119 8.099 8.284 -0.185 1
1 1387 . 25 1 1 A 120 120 LEU HA H 119 3.842 3.916 -0.074 1
1 1397 . 25 1 1 A 120 120 LEU C C 119 179.601 179.492 0.109 1
1 1398 . 25 1 1 A 120 120 LEU CA C 119 58.174 57.874 0.300 1
1 1399 . 25 1 1 A 120 120 LEU CB C 119 40.315 41.497 -1.182 1
1 1403 . 25 1 1 A 120 120 LEU N N 119 117.930 119.807 -1.877 1
1 1404 . 25 1 1 A 121 121 ALA H H 120 7.729 8.030 -0.301 1
1 1405 . 25 1 1 A 121 121 ALA HA H 120 3.996 4.119 -0.123 1
1 1409 . 25 1 1 A 121 121 ALA C C 120 180.995 179.658 1.337 1
1 1410 . 25 1 1 A 121 121 ALA CA C 120 54.832 54.642 0.190 1
1 1411 . 25 1 1 A 121 121 ALA CB C 120 17.706 18.261 -0.555 1
1 1412 . 25 1 1 A 121 121 ALA N N 120 123.195 120.721 2.474 1
1 1413 . 25 1 1 A 122 122 PHE H H 121 7.943 7.825 0.118 1
1 1414 . 25 1 1 A 122 122 PHE HA H 121 3.887 3.915 -0.028 1
1 1419 . 25 1 1 A 122 122 PHE C C 121 175.410 176.934 -1.524 1
1 1420 . 25 1 1 A 122 122 PHE CA C 121 61.075 60.739 0.336 1
1 1421 . 25 1 1 A 122 122 PHE CB C 121 38.115 38.769 -0.654 1
1 1424 . 25 1 1 A 122 122 PHE N N 121 121.798 120.166 1.632 1
1 1425 . 25 1 1 A 123 123 LYS H H 122 8.468 7.894 0.574 1
1 1426 . 25 1 1 A 123 123 LYS HA H 122 3.077 3.855 -0.778 1
1 1435 . 25 1 1 A 123 123 LYS C C 122 178.453 179.058 -0.605 1
1 1436 . 25 1 1 A 123 123 LYS CA C 122 59.855 59.990 -0.135 1
1 1437 . 25 1 1 A 123 123 LYS CB C 122 32.374 32.340 0.034 1
1 1441 . 25 1 1 A 123 123 LYS N N 122 120.614 118.360 2.254 1
1 1442 . 25 1 1 A 124 124 GLU H H 123 8.100 8.133 -0.033 1
1 1443 . 25 1 1 A 124 124 GLU HA H 123 3.652 3.980 -0.328 1
1 1448 . 25 1 1 A 124 124 GLU C C 123 177.743 179.088 -1.345 1
1 1449 . 25 1 1 A 124 124 GLU CA C 123 59.406 59.575 -0.169 1
1 1450 . 25 1 1 A 124 124 GLU CB C 123 28.811 29.127 -0.316 1
1 1452 . 25 1 1 A 124 124 GLU N N 123 117.404 118.550 -1.146 1
1 1453 . 25 1 1 A 125 125 MET H H 124 7.537 7.570 -0.033 1
1 1454 . 25 1 1 A 125 125 MET HA H 124 3.860 3.951 -0.091 1
1 1462 . 25 1 1 A 125 125 MET C C 124 179.522 178.359 1.163 1
1 1463 . 25 1 1 A 125 125 MET CA C 124 58.832 58.514 0.318 1
1 1464 . 25 1 1 A 125 125 MET CB C 124 31.765 31.337 0.428 1
1 1467 . 25 1 1 A 125 125 MET N N 124 119.413 119.585 -0.172 1
1 1468 . 25 1 1 A 126 126 PHE H H 125 7.148 7.547 -0.399 1
1 1469 . 25 1 1 A 126 126 PHE HA H 125 3.633 4.217 -0.584 1
1 1476 . 25 1 1 A 126 126 PHE C C 125 178.994 178.293 0.701 1
1 1477 . 25 1 1 A 126 126 PHE CA C 125 63.148 60.954 2.194 1
1 1478 . 25 1 1 A 126 126 PHE CB C 125 39.830 38.457 1.373 1
1 1483 . 25 1 1 A 126 126 PHE N N 125 120.013 119.067 0.946 1
1 1484 . 25 1 1 A 127 127 LEU H H 126 8.369 8.387 -0.018 1
1 1485 . 25 1 1 A 127 127 LEU HA H 126 3.972 4.051 -0.079 1
1 1495 . 25 1 1 A 127 127 LEU C C 126 180.621 179.336 1.285 1
1 1496 . 25 1 1 A 127 127 LEU CA C 126 57.944 57.649 0.295 1
1 1497 . 25 1 1 A 127 127 LEU CB C 126 40.543 40.991 -0.448 1
1 1501 . 25 1 1 A 127 127 LEU N N 126 119.692 119.592 0.100 1
1 1502 . 25 1 1 A 128 128 ASP H H 127 8.578 7.993 0.585 1
1 1503 . 25 1 1 A 128 128 ASP HA H 127 4.308 4.340 -0.032 1
1 1506 . 25 1 1 A 128 128 ASP C C 127 178.254 178.173 0.081 1
1 1507 . 25 1 1 A 128 128 ASP CA C 127 56.964 57.222 -0.258 1
1 1508 . 25 1 1 A 128 128 ASP CB C 127 39.735 40.928 -1.193 1
1 1509 . 25 1 1 A 128 128 ASP N N 127 121.926 119.958 1.968 1
1 1510 . 25 1 1 A 129 129 TYR H H 128 7.710 8.162 -0.452 1
1 1511 . 25 1 1 A 129 129 TYR HA H 128 3.908 4.016 -0.108 1
1 1518 . 25 1 1 A 129 129 TYR C C 128 177.633 177.643 -0.010 1
1 1519 . 25 1 1 A 129 129 TYR CA C 128 61.796 61.168 0.628 1
1 1520 . 25 1 1 A 129 129 TYR CB C 128 39.372 38.468 0.904 1
1 1525 . 25 1 1 A 129 129 TYR N N 128 122.548 120.347 2.201 1
1 1526 . 25 1 1 A 130 130 ARG H H 129 8.622 8.595 0.027 1
1 1527 . 25 1 1 A 130 130 ARG HA H 129 3.722 3.905 -0.183 1
1 1535 . 25 1 1 A 130 130 ARG CA C 129 60.084 59.712 0.372 1
1 1536 . 25 1 1 A 130 130 ARG CB C 129 29.902 30.021 -0.119 1
1 1539 . 25 1 1 A 130 130 ARG N N 129 118.302 119.401 -1.099 1
1 1541 . 25 1 1 A 131 131 ALA H H 130 7.936 8.076 -0.140 1
1 1542 . 25 1 1 A 131 131 ALA HA H 130 3.997 4.016 -0.019 1
1 1546 . 25 1 1 A 131 131 ALA C C 130 180.456 179.751 0.705 1
1 1547 . 25 1 1 A 131 131 ALA CA C 130 55.133 55.009 0.124 1
1 1548 . 25 1 1 A 131 131 ALA CB C 130 17.750 18.214 -0.464 1
1 1549 . 25 1 1 A 131 131 ALA N N 130 119.788 121.389 -1.601 1
1 1550 . 25 1 1 A 132 132 GLU H H 131 7.622 7.597 0.025 1
1 1551 . 25 1 1 A 132 132 GLU HA H 131 3.862 3.999 -0.137 1
1 1556 . 25 1 1 A 132 132 GLU C C 131 179.528 179.123 0.405 1
1 1557 . 25 1 1 A 132 132 GLU CA C 131 58.849 58.582 0.267 1
1 1558 . 25 1 1 A 132 132 GLU CB C 131 28.930 29.386 -0.456 1
1 1560 . 25 1 1 A 132 132 GLU N N 131 118.428 118.423 0.005 1
1 1561 . 25 1 1 A 133 133 LYS H H 132 7.853 7.444 0.409 1
1 1562 . 25 1 1 A 133 133 LYS HA H 132 3.722 3.954 -0.232 1
1 1571 . 25 1 1 A 133 133 LYS C C 132 175.725 178.385 -2.660 1
1 1572 . 25 1 1 A 133 133 LYS CA C 132 57.544 58.786 -1.242 1
1 1573 . 25 1 1 A 133 133 LYS CB C 132 31.770 31.787 -0.017 1
1 1577 . 25 1 1 A 133 133 LYS N N 132 119.473 118.941 0.532 1
1 1578 . 25 1 1 A 134 134 GLU H H 133 8.151 7.340 0.811 1
1 1579 . 25 1 1 A 134 134 GLU HA H 133 4.161 4.372 -0.211 1
1 1584 . 25 1 1 A 134 134 GLU C C 133 177.453 176.820 0.633 1
1 1585 . 25 1 1 A 134 134 GLU CA C 133 57.222 56.143 1.079 1
1 1586 . 25 1 1 A 134 134 GLU CB C 133 30.091 30.395 -0.304 1
1 1588 . 25 1 1 A 134 134 GLU N N 133 116.525 116.895 -0.370 1
1 1589 . 25 1 1 A 135 135 GLY H H 134 7.702 7.682 0.020 1
1 1590 . 25 1 1 A 135 135 GLY HA2 H 134 3.896 3.988 -0.092 1
1 1591 . 25 1 1 A 135 135 GLY HA3 H 134 3.897 3.999 -0.102 1
1 1592 . 25 1 1 A 135 135 GLY C C 134 174.538 173.617 0.921 1
1 1593 . 25 1 1 A 135 135 GLY CA C 134 45.975 44.917 1.058 1
1 1594 . 25 1 1 A 135 135 GLY N N 134 107.924 108.002 -0.078 1
1 1595 . 25 1 1 A 136 136 ARG H H 135 8.045 8.519 -0.474 1
1 1596 . 25 1 1 A 136 136 ARG HA H 135 4.323 3.961 0.362 1
1 1604 . 25 1 1 A 136 136 ARG C C 135 175.864 176.454 -0.590 1
1 1605 . 25 1 1 A 136 136 ARG CA C 135 56.016 57.759 -1.743 1
1 1606 . 25 1 1 A 136 136 ARG CB C 135 30.987 30.306 0.681 1
1 1609 . 25 1 1 A 136 136 ARG N N 135 119.708 124.396 -4.688 1
1 1 . 26 1 1 A 14 14 PHE CA C 13 58.199 55.707 2.492 1
1 2 . 26 1 1 A 14 14 PHE CB C 13 39.717 41.039 -1.322 1
1 3 . 26 1 1 A 15 15 SER H H 14 8.299 9.194 -0.895 1
1 4 . 26 1 1 A 15 15 SER HA H 14 4.359 4.672 -0.313 1
1 7 . 26 1 1 A 15 15 SER CA C 14 58.249 59.099 -0.850 1
1 8 . 26 1 1 A 15 15 SER CB C 14 63.936 65.916 -1.980 1
1 9 . 26 1 1 A 15 15 SER N N 14 117.379 113.851 3.528 1
1 10 . 26 1 1 A 16 16 SER H H 15 8.255 8.244 0.011 1
1 11 . 26 1 1 A 16 16 SER HA H 15 3.729 4.868 -1.139 1
1 14 . 26 1 1 A 16 16 SER CA C 15 58.224 58.418 -0.194 1
1 15 . 26 1 1 A 16 16 SER CB C 15 63.886 65.427 -1.541 1
1 16 . 26 1 1 A 16 16 SER N N 15 117.694 111.352 6.342 1
1 17 . 26 1 1 A 17 17 ALA H H 16 8.333 8.256 0.077 1
1 18 . 26 1 1 A 17 17 ALA HA H 16 4.252 4.007 0.245 1
1 22 . 26 1 1 A 17 17 ALA CA C 16 53.377 55.235 -1.858 1
1 23 . 26 1 1 A 17 17 ALA CB C 16 18.896 18.559 0.337 1
1 24 . 26 1 1 A 17 17 ALA N N 16 125.462 124.897 0.565 1
1 25 . 26 1 1 A 18 18 SER H H 17 8.219 7.988 0.231 1
1 26 . 26 1 1 A 18 18 SER HA H 17 4.332 4.481 -0.149 1
1 29 . 26 1 1 A 18 18 SER CA C 17 59.105 58.654 0.451 1
1 30 . 26 1 1 A 18 18 SER CB C 17 63.592 63.349 0.243 1
1 31 . 26 1 1 A 18 18 SER N N 17 114.821 112.443 2.378 1
1 32 . 26 1 1 A 19 19 ASP H H 18 8.309 7.753 0.556 1
1 33 . 26 1 1 A 19 19 ASP HA H 18 4.554 4.810 -0.256 1
1 36 . 26 1 1 A 19 19 ASP C C 18 176.528 176.947 -0.419 1
1 37 . 26 1 1 A 19 19 ASP CA C 18 55.272 53.062 2.210 1
1 38 . 26 1 1 A 19 19 ASP CB C 18 40.883 43.055 -2.172 1
1 39 . 26 1 1 A 19 19 ASP N N 18 123.367 121.857 1.510 1
1 40 . 26 1 1 A 20 20 ALA H H 19 8.133 8.864 -0.731 1
1 41 . 26 1 1 A 20 20 ALA HA H 19 4.170 4.048 0.122 1
1 45 . 26 1 1 A 20 20 ALA C C 19 179.857 179.530 0.327 1
1 46 . 26 1 1 A 20 20 ALA CA C 19 54.341 55.157 -0.816 1
1 47 . 26 1 1 A 20 20 ALA CB C 19 18.660 18.379 0.281 1
1 48 . 26 1 1 A 20 20 ALA N N 19 123.350 126.897 -3.547 1
1 49 . 26 1 1 A 21 21 GLU H H 20 8.140 8.166 -0.026 1
1 50 . 26 1 1 A 21 21 GLU HA H 20 4.128 4.102 0.026 1
1 55 . 26 1 1 A 21 21 GLU C C 20 177.675 178.552 -0.877 1
1 56 . 26 1 1 A 21 21 GLU CA C 20 58.520 59.526 -1.006 1
1 57 . 26 1 1 A 21 21 GLU CB C 20 29.765 29.545 0.220 1
1 59 . 26 1 1 A 21 21 GLU N N 20 119.063 119.435 -0.372 1
1 60 . 26 1 1 A 22 22 PHE H H 21 8.009 7.854 0.155 1
1 61 . 26 1 1 A 22 22 PHE HA H 21 4.123 4.399 -0.276 1
1 68 . 26 1 1 A 22 22 PHE C C 21 176.410 177.118 -0.708 1
1 69 . 26 1 1 A 22 22 PHE CA C 21 62.202 61.181 1.021 1
1 70 . 26 1 1 A 22 22 PHE CB C 21 39.223 38.961 0.262 1
1 75 . 26 1 1 A 22 22 PHE N N 21 121.211 120.928 0.283 1
1 76 . 26 1 1 A 23 23 ASP H H 22 8.261 8.562 -0.301 1
1 77 . 26 1 1 A 23 23 ASP HA H 22 4.041 4.410 -0.369 1
1 80 . 26 1 1 A 23 23 ASP C C 22 179.078 178.543 0.535 1
1 81 . 26 1 1 A 23 23 ASP CA C 22 57.048 57.336 -0.288 1
1 82 . 26 1 1 A 23 23 ASP CB C 22 40.154 40.254 -0.100 1
1 83 . 26 1 1 A 23 23 ASP N N 22 116.876 118.288 -1.412 1
1 84 . 26 1 1 A 24 24 ALA H H 23 7.651 7.721 -0.070 1
1 85 . 26 1 1 A 24 24 ALA HA H 23 3.785 3.927 -0.142 1
1 89 . 26 1 1 A 24 24 ALA C C 23 179.577 179.807 -0.230 1
1 90 . 26 1 1 A 24 24 ALA CA C 23 54.341 55.162 -0.821 1
1 91 . 26 1 1 A 24 24 ALA CB C 23 17.762 18.338 -0.576 1
1 92 . 26 1 1 A 24 24 ALA N N 23 121.873 122.365 -0.492 1
1 93 . 26 1 1 A 25 25 VAL H H 24 7.718 7.809 -0.091 1
1 94 . 26 1 1 A 25 25 VAL HA H 24 3.216 3.568 -0.352 1
1 102 . 26 1 1 A 25 25 VAL C C 24 177.805 178.399 -0.594 1
1 103 . 26 1 1 A 25 25 VAL CA C 24 66.789 66.538 0.251 1
1 104 . 26 1 1 A 25 25 VAL CB C 24 31.277 31.525 -0.248 1
1 107 . 26 1 1 A 25 25 VAL N N 24 117.890 118.392 -0.502 1
1 108 . 26 1 1 A 26 26 VAL H H 25 7.867 7.807 0.060 1
1 109 . 26 1 1 A 26 26 VAL HA H 25 3.274 3.560 -0.286 1
1 117 . 26 1 1 A 26 26 VAL C C 25 177.788 177.890 -0.102 1
1 118 . 26 1 1 A 26 26 VAL CA C 25 67.282 66.404 0.878 1
1 119 . 26 1 1 A 26 26 VAL CB C 25 31.266 31.434 -0.168 1
1 122 . 26 1 1 A 26 26 VAL N N 25 118.170 120.483 -2.313 1
1 123 . 26 1 1 A 27 27 GLY H H 26 7.544 7.614 -0.070 1
1 124 . 26 1 1 A 27 27 GLY HA2 H 26 3.592 3.511 0.081 1
1 125 . 26 1 1 A 27 27 GLY HA3 H 26 3.721 3.631 0.090 1
1 126 . 26 1 1 A 27 27 GLY C C 26 176.717 176.551 0.166 1
1 127 . 26 1 1 A 27 27 GLY CA C 26 47.085 47.214 -0.129 1
1 128 . 26 1 1 A 27 27 GLY N N 26 105.795 107.417 -1.622 1
1 129 . 26 1 1 A 28 28 TYR H H 27 7.625 7.489 0.136 1
1 130 . 26 1 1 A 28 28 TYR HA H 27 4.546 4.588 -0.042 1
1 137 . 26 1 1 A 28 28 TYR C C 27 178.991 178.142 0.849 1
1 138 . 26 1 1 A 28 28 TYR CA C 27 58.845 59.625 -0.780 1
1 139 . 26 1 1 A 28 28 TYR CB C 27 37.602 37.605 -0.003 1
1 144 . 26 1 1 A 28 28 TYR N N 27 119.933 122.220 -2.287 1
1 145 . 26 1 1 A 29 29 LEU H H 28 8.517 8.293 0.224 1
1 146 . 26 1 1 A 29 29 LEU HA H 28 3.728 3.817 -0.089 1
1 156 . 26 1 1 A 29 29 LEU CA C 28 58.281 58.127 0.154 1
1 157 . 26 1 1 A 29 29 LEU CB C 28 41.948 41.385 0.563 1
1 161 . 26 1 1 A 29 29 LEU N N 28 119.669 120.317 -0.648 1
1 162 . 26 1 1 A 30 30 GLU H H 29 8.072 7.975 0.097 1
1 163 . 26 1 1 A 30 30 GLU HA H 29 3.722 3.886 -0.164 1
1 168 . 26 1 1 A 30 30 GLU C C 29 177.731 178.901 -1.170 1
1 169 . 26 1 1 A 30 30 GLU CA C 29 59.763 59.880 -0.117 1
1 170 . 26 1 1 A 30 30 GLU CB C 29 28.844 29.216 -0.372 1
1 172 . 26 1 1 A 30 30 GLU N N 29 117.666 117.530 0.136 1
1 173 . 26 1 1 A 31 31 ASP H H 30 7.243 7.815 -0.572 1
1 174 . 26 1 1 A 31 31 ASP HA H 30 4.297 4.415 -0.118 1
1 177 . 26 1 1 A 31 31 ASP CA C 30 56.953 57.244 -0.291 1
1 178 . 26 1 1 A 31 31 ASP CB C 30 40.730 41.142 -0.412 1
1 179 . 26 1 1 A 31 31 ASP N N 30 116.720 119.117 -2.397 1
1 180 . 26 1 1 A 32 32 ILE H H 31 7.940 7.510 0.430 1
1 181 . 26 1 1 A 32 32 ILE HA H 31 3.640 3.641 -0.001 1
1 191 . 26 1 1 A 32 32 ILE C C 31 177.980 178.152 -0.172 1
1 192 . 26 1 1 A 32 32 ILE CA C 31 64.692 64.905 -0.213 1
1 193 . 26 1 1 A 32 32 ILE CB C 31 38.938 37.675 1.263 1
1 197 . 26 1 1 A 32 32 ILE N N 31 119.728 119.269 0.459 1
1 198 . 26 1 1 A 33 33 ILE H H 32 7.984 7.745 0.239 1
1 199 . 26 1 1 A 33 33 ILE HA H 32 3.598 3.262 0.336 1
1 209 . 26 1 1 A 33 33 ILE C C 32 176.723 177.005 -0.282 1
1 210 . 26 1 1 A 33 33 ILE CA C 32 63.241 64.456 -1.215 1
1 211 . 26 1 1 A 33 33 ILE CB C 32 37.580 37.718 -0.138 1
1 215 . 26 1 1 A 33 33 ILE N N 32 113.919 120.143 -6.224 1
1 216 . 26 1 1 A 34 34 MET H H 33 7.288 7.613 -0.325 1
1 217 . 26 1 1 A 34 34 MET HA H 33 4.496 4.699 -0.203 1
1 225 . 26 1 1 A 34 34 MET C C 33 176.423 175.749 0.674 1
1 226 . 26 1 1 A 34 34 MET CA C 33 54.634 54.120 0.514 1
1 227 . 26 1 1 A 34 34 MET CB C 33 31.934 31.879 0.055 1
1 230 . 26 1 1 A 34 34 MET N N 33 115.130 117.030 -1.900 1
1 231 . 26 1 1 A 35 35 ASP H H 34 7.405 7.731 -0.326 1
1 232 . 26 1 1 A 35 35 ASP HA H 34 4.484 4.595 -0.111 1
1 235 . 26 1 1 A 35 35 ASP C C 34 177.139 176.483 0.656 1
1 236 . 26 1 1 A 35 35 ASP CA C 34 54.625 54.570 0.055 1
1 237 . 26 1 1 A 35 35 ASP CB C 34 43.554 42.825 0.729 1
1 238 . 26 1 1 A 35 35 ASP N N 34 121.814 122.507 -0.693 1
1 239 . 26 1 1 A 36 36 ASP H H 35 8.765 9.187 -0.422 1
1 240 . 26 1 1 A 36 36 ASP HA H 35 4.235 4.247 -0.012 1
1 243 . 26 1 1 A 36 36 ASP C C 35 178.320 177.940 0.380 1
1 244 . 26 1 1 A 36 36 ASP CA C 35 57.832 58.609 -0.777 1
1 245 . 26 1 1 A 36 36 ASP CB C 35 40.914 41.407 -0.493 1
1 246 . 26 1 1 A 36 36 ASP N N 35 125.883 127.869 -1.986 1
1 247 . 26 1 1 A 37 37 GLU H H 36 8.905 8.395 0.510 1
1 248 . 26 1 1 A 37 37 GLU HA H 36 3.933 4.073 -0.140 1
1 253 . 26 1 1 A 37 37 GLU C C 36 179.304 179.165 0.139 1
1 254 . 26 1 1 A 37 37 GLU CA C 36 59.828 59.208 0.620 1
1 255 . 26 1 1 A 37 37 GLU CB C 36 29.380 29.515 -0.135 1
1 257 . 26 1 1 A 37 37 GLU N N 36 119.077 118.051 1.026 1
1 258 . 26 1 1 A 38 38 PHE H H 37 7.460 8.184 -0.724 1
1 259 . 26 1 1 A 38 38 PHE HA H 37 3.642 4.024 -0.382 1
1 267 . 26 1 1 A 38 38 PHE C C 37 176.483 177.955 -1.472 1
1 268 . 26 1 1 A 38 38 PHE CA C 37 61.411 60.806 0.605 1
1 269 . 26 1 1 A 38 38 PHE CB C 37 39.355 39.053 0.302 1
1 275 . 26 1 1 A 38 38 PHE N N 37 119.968 122.628 -2.660 1
1 276 . 26 1 1 A 39 39 GLN H H 38 7.968 8.055 -0.087 1
1 277 . 26 1 1 A 39 39 GLN HA H 38 3.712 3.785 -0.073 1
1 284 . 26 1 1 A 39 39 GLN CA C 38 59.153 58.889 0.264 1
1 285 . 26 1 1 A 39 39 GLN CB C 38 28.213 28.531 -0.318 1
1 287 . 26 1 1 A 39 39 GLN N N 38 116.433 118.682 -2.249 1
1 289 . 26 1 1 A 40 40 LEU H H 39 7.930 7.780 0.150 1
1 290 . 26 1 1 A 40 40 LEU HA H 39 3.916 4.000 -0.084 1
1 300 . 26 1 1 A 40 40 LEU C C 39 177.731 178.174 -0.443 1
1 301 . 26 1 1 A 40 40 LEU CA C 39 57.915 57.950 -0.035 1
1 302 . 26 1 1 A 40 40 LEU CB C 39 41.989 41.546 0.443 1
1 306 . 26 1 1 A 40 40 LEU N N 39 119.505 121.431 -1.926 1
1 307 . 26 1 1 A 41 41 LEU H H 40 7.174 7.789 -0.615 1
1 308 . 26 1 1 A 41 41 LEU HA H 40 3.835 3.976 -0.141 1
1 318 . 26 1 1 A 41 41 LEU C C 40 179.738 178.279 1.459 1
1 319 . 26 1 1 A 41 41 LEU CA C 40 58.266 58.353 -0.087 1
1 320 . 26 1 1 A 41 41 LEU CB C 40 42.050 41.380 0.670 1
1 324 . 26 1 1 A 41 41 LEU N N 40 120.971 119.688 1.283 1
1 325 . 26 1 1 A 42 42 GLN H H 41 8.058 7.886 0.172 1
1 326 . 26 1 1 A 42 42 GLN HA H 41 3.556 3.706 -0.150 1
1 333 . 26 1 1 A 42 42 GLN C C 41 177.642 178.453 -0.811 1
1 334 . 26 1 1 A 42 42 GLN CA C 41 59.826 59.173 0.653 1
1 335 . 26 1 1 A 42 42 GLN CB C 41 28.762 28.206 0.556 1
1 337 . 26 1 1 A 42 42 GLN N N 41 117.899 118.041 -0.142 1
1 339 . 26 1 1 A 43 43 ARG H H 42 8.179 7.658 0.521 1
1 340 . 26 1 1 A 43 43 ARG HA H 42 3.655 3.897 -0.242 1
1 347 . 26 1 1 A 43 43 ARG C C 42 178.051 178.180 -0.129 1
1 348 . 26 1 1 A 43 43 ARG CA C 42 59.766 58.625 1.141 1
1 349 . 26 1 1 A 43 43 ARG CB C 42 29.941 30.048 -0.107 1
1 352 . 26 1 1 A 43 43 ARG N N 42 119.392 119.431 -0.039 1
1 353 . 26 1 1 A 44 44 ASN H H 43 8.525 8.166 0.359 1
1 354 . 26 1 1 A 44 44 ASN HA H 43 4.332 4.343 -0.011 1
1 359 . 26 1 1 A 44 44 ASN C C 43 178.150 177.695 0.455 1
1 360 . 26 1 1 A 44 44 ASN CA C 43 55.841 56.146 -0.305 1
1 361 . 26 1 1 A 44 44 ASN CB C 43 37.632 39.261 -1.629 1
1 362 . 26 1 1 A 44 44 ASN N N 43 116.214 117.561 -1.347 1
1 364 . 26 1 1 A 45 45 PHE H H 44 7.586 7.733 -0.147 1
1 365 . 26 1 1 A 45 45 PHE HA H 44 4.132 4.300 -0.168 1
1 372 . 26 1 1 A 45 45 PHE C C 44 176.691 178.545 -1.854 1
1 373 . 26 1 1 A 45 45 PHE CA C 44 62.333 60.544 1.789 1
1 374 . 26 1 1 A 45 45 PHE CB C 44 39.449 38.779 0.670 1
1 379 . 26 1 1 A 45 45 PHE N N 44 121.501 117.823 3.678 1
1 380 . 26 1 1 A 46 46 MET H H 45 8.190 8.297 -0.107 1
1 381 . 26 1 1 A 46 46 MET HA H 45 4.060 4.322 -0.262 1
1 389 . 26 1 1 A 46 46 MET C C 45 179.754 178.212 1.542 1
1 390 . 26 1 1 A 46 46 MET CA C 45 57.742 58.008 -0.266 1
1 391 . 26 1 1 A 46 46 MET CB C 45 29.912 31.241 -1.329 1
1 394 . 26 1 1 A 46 46 MET N N 45 116.727 117.659 -0.932 1
1 395 . 26 1 1 A 47 47 ASP H H 46 8.579 8.250 0.329 1
1 396 . 26 1 1 A 47 47 ASP HA H 46 4.804 4.639 0.165 1
1 399 . 26 1 1 A 47 47 ASP C C 46 177.854 178.366 -0.512 1
1 400 . 26 1 1 A 47 47 ASP CA C 46 57.277 57.338 -0.061 1
1 401 . 26 1 1 A 47 47 ASP CB C 46 40.776 41.508 -0.732 1
1 402 . 26 1 1 A 47 47 ASP N N 46 117.798 120.686 -2.888 1
1 403 . 26 1 1 A 48 48 LYS H H 47 7.339 7.907 -0.568 1
1 404 . 26 1 1 A 48 48 LYS HA H 47 3.828 4.252 -0.424 1
1 413 . 26 1 1 A 48 48 LYS C C 47 178.812 178.644 0.168 1
1 414 . 26 1 1 A 48 48 LYS CA C 47 58.953 58.485 0.468 1
1 415 . 26 1 1 A 48 48 LYS CB C 47 32.796 33.003 -0.207 1
1 419 . 26 1 1 A 48 48 LYS N N 47 117.852 119.751 -1.899 1
1 420 . 26 1 1 A 49 49 TYR H H 48 6.841 8.738 -1.897 1
1 421 . 26 1 1 A 49 49 TYR HA H 48 4.995 4.278 0.717 1
1 428 . 26 1 1 A 49 49 TYR C C 48 178.138 178.503 -0.365 1
1 429 . 26 1 1 A 49 49 TYR CA C 48 58.620 59.853 -1.233 1
1 430 . 26 1 1 A 49 49 TYR CB C 48 42.939 38.197 4.742 1
1 435 . 26 1 1 A 49 49 TYR N N 48 112.109 119.892 -7.783 1
1 436 . 26 1 1 A 50 50 TYR H H 49 8.491 8.041 0.450 1
1 437 . 26 1 1 A 50 50 TYR HA H 49 4.598 4.091 0.507 1
1 444 . 26 1 1 A 50 50 TYR C C 49 176.015 177.853 -1.838 1
1 445 . 26 1 1 A 50 50 TYR CA C 49 62.442 59.653 2.789 1
1 446 . 26 1 1 A 50 50 TYR CB C 49 36.588 37.095 -0.507 1
1 451 . 26 1 1 A 50 50 TYR N N 49 118.294 119.381 -1.087 1
1 452 . 26 1 1 A 51 51 LEU H H 50 7.512 7.595 -0.083 1
1 453 . 26 1 1 A 51 51 LEU HA H 50 3.878 3.522 0.356 1
1 463 . 26 1 1 A 51 51 LEU C C 50 178.625 178.725 -0.100 1
1 464 . 26 1 1 A 51 51 LEU CA C 50 55.994 57.164 -1.170 1
1 465 . 26 1 1 A 51 51 LEU CB C 50 40.743 41.477 -0.734 1
1 469 . 26 1 1 A 51 51 LEU N N 50 118.478 121.561 -3.083 1
1 470 . 26 1 1 A 52 52 GLU H H 51 8.042 7.827 0.215 1
1 471 . 26 1 1 A 52 52 GLU HA H 51 4.197 3.923 0.274 1
1 476 . 26 1 1 A 52 52 GLU C C 51 177.629 177.401 0.228 1
1 477 . 26 1 1 A 52 52 GLU CA C 51 56.141 59.404 -3.263 1
1 478 . 26 1 1 A 52 52 GLU CB C 51 29.162 29.118 0.044 1
1 480 . 26 1 1 A 52 52 GLU N N 51 115.067 117.985 -2.918 1
1 481 . 26 1 1 A 53 53 PHE H H 52 7.465 8.006 -0.541 1
1 482 . 26 1 1 A 53 53 PHE HA H 52 4.431 4.680 -0.249 1
1 490 . 26 1 1 A 53 53 PHE C C 52 174.325 174.599 -0.274 1
1 491 . 26 1 1 A 53 53 PHE CA C 52 58.986 56.486 2.500 1
1 492 . 26 1 1 A 53 53 PHE CB C 52 40.183 37.018 3.165 1
1 498 . 26 1 1 A 53 53 PHE N N 52 116.768 117.842 -1.074 1
1 499 . 26 1 1 A 54 54 GLU H H 53 7.484 8.358 -0.874 1
1 500 . 26 1 1 A 54 54 GLU HA H 53 4.583 4.604 -0.021 1
1 505 . 26 1 1 A 54 54 GLU C C 53 175.722 177.430 -1.708 1
1 506 . 26 1 1 A 54 54 GLU CA C 53 54.248 55.549 -1.301 1
1 507 . 26 1 1 A 54 54 GLU CB C 53 34.409 30.664 3.745 1
1 509 . 26 1 1 A 54 54 GLU N N 53 118.844 123.533 -4.689 1
1 510 . 26 1 1 A 55 55 ASP H H 54 9.008 8.763 0.245 1
1 511 . 26 1 1 A 55 55 ASP HA H 54 4.735 4.684 0.051 1
1 514 . 26 1 1 A 55 55 ASP C C 54 175.421 176.397 -0.976 1
1 515 . 26 1 1 A 55 55 ASP CA C 54 52.888 54.173 -1.285 1
1 516 . 26 1 1 A 55 55 ASP CB C 54 38.894 40.001 -1.107 1
1 517 . 26 1 1 A 55 55 ASP N N 54 123.654 120.142 3.512 1
1 518 . 26 1 1 A 56 56 THR H H 55 7.819 7.698 0.121 1
1 519 . 26 1 1 A 56 56 THR HA H 55 4.574 4.279 0.295 1
1 524 . 26 1 1 A 56 56 THR C C 55 174.096 174.213 -0.117 1
1 525 . 26 1 1 A 56 56 THR CA C 55 59.172 61.018 -1.846 1
1 526 . 26 1 1 A 56 56 THR CB C 55 71.889 70.941 0.948 1
1 528 . 26 1 1 A 56 56 THR N N 55 112.015 112.241 -0.226 1
1 529 . 26 1 1 A 57 57 GLU H H 56 8.527 8.907 -0.380 1
1 530 . 26 1 1 A 57 57 GLU HA H 56 4.217 4.596 -0.379 1
1 535 . 26 1 1 A 57 57 GLU C C 56 177.042 176.450 0.592 1
1 536 . 26 1 1 A 57 57 GLU CA C 56 56.869 57.093 -0.224 1
1 537 . 26 1 1 A 57 57 GLU CB C 56 29.731 31.631 -1.900 1
1 539 . 26 1 1 A 57 57 GLU N N 56 117.531 119.667 -2.136 1
1 540 . 26 1 1 A 58 58 GLU H H 57 7.587 7.776 -0.189 1
1 541 . 26 1 1 A 58 58 GLU HA H 57 3.941 4.184 -0.243 1
1 546 . 26 1 1 A 58 58 GLU C C 57 176.849 176.098 0.751 1
1 547 . 26 1 1 A 58 58 GLU CA C 57 56.924 56.853 0.071 1
1 548 . 26 1 1 A 58 58 GLU CB C 57 30.251 29.826 0.425 1
1 550 . 26 1 1 A 58 58 GLU N N 57 119.183 120.640 -1.457 1
1 551 . 26 1 1 A 59 59 ASN H H 58 9.120 8.485 0.635 1
1 552 . 26 1 1 A 59 59 ASN HA H 58 4.922 4.747 0.175 1
1 557 . 26 1 1 A 59 59 ASN C C 58 174.254 175.083 -0.829 1
1 558 . 26 1 1 A 59 59 ASN CA C 58 51.956 52.755 -0.799 1
1 559 . 26 1 1 A 59 59 ASN CB C 58 37.404 39.362 -1.958 1
1 560 . 26 1 1 A 59 59 ASN N N 58 126.767 122.945 3.822 1
1 562 . 26 1 1 A 60 60 LYS H H 59 5.892 8.660 -2.768 1
1 563 . 26 1 1 A 60 60 LYS HA H 59 3.798 4.890 -1.092 1
1 572 . 26 1 1 A 60 60 LYS C C 59 177.908 176.892 1.016 1
1 573 . 26 1 1 A 60 60 LYS CA C 59 56.623 54.941 1.682 1
1 574 . 26 1 1 A 60 60 LYS CB C 59 32.279 35.615 -3.336 1
1 578 . 26 1 1 A 60 60 LYS N N 59 121.527 121.024 0.503 1
1 579 . 26 1 1 A 61 61 LEU H H 60 8.473 8.836 -0.363 1
1 580 . 26 1 1 A 61 61 LEU HA H 60 3.891 4.247 -0.356 1
1 590 . 26 1 1 A 61 61 LEU C C 60 179.843 178.677 1.166 1
1 591 . 26 1 1 A 61 61 LEU CA C 60 58.301 56.531 1.770 1
1 592 . 26 1 1 A 61 61 LEU CB C 60 41.305 41.553 -0.248 1
1 596 . 26 1 1 A 61 61 LEU N N 60 125.639 123.583 2.056 1
1 597 . 26 1 1 A 62 62 ILE H H 61 7.698 7.942 -0.244 1
1 598 . 26 1 1 A 62 62 ILE HA H 61 3.952 3.867 0.085 1
1 608 . 26 1 1 A 62 62 ILE C C 61 175.392 177.281 -1.889 1
1 609 . 26 1 1 A 62 62 ILE CA C 61 61.743 63.196 -1.453 1
1 610 . 26 1 1 A 62 62 ILE CB C 61 39.108 37.742 1.366 1
1 614 . 26 1 1 A 62 62 ILE N N 61 114.111 119.602 -5.491 1
1 615 . 26 1 1 A 63 63 TYR H H 62 7.273 7.896 -0.623 1
1 616 . 26 1 1 A 63 63 TYR HA H 62 4.343 4.222 0.121 1
1 623 . 26 1 1 A 63 63 TYR C C 62 178.264 178.670 -0.406 1
1 624 . 26 1 1 A 63 63 TYR CA C 62 57.231 61.121 -3.890 1
1 625 . 26 1 1 A 63 63 TYR CB C 62 36.332 37.456 -1.124 1
1 630 . 26 1 1 A 63 63 TYR N N 62 117.689 121.368 -3.679 1
1 631 . 26 1 1 A 64 64 THR H H 63 7.747 7.911 -0.164 1
1 632 . 26 1 1 A 64 64 THR HA H 63 4.266 4.224 0.042 1
1 637 . 26 1 1 A 64 64 THR CA C 63 69.362 67.550 1.812 1
1 638 . 26 1 1 A 64 64 THR CB C 63 66.962 67.897 -0.935 1
1 640 . 26 1 1 A 64 64 THR N N 63 113.755 116.067 -2.312 1
1 641 . 26 1 1 A 65 65 PRO HA H 64 4.372 4.383 -0.011 1
1 648 . 26 1 1 A 65 65 PRO C C 64 179.913 179.441 0.472 1
1 649 . 26 1 1 A 65 65 PRO CA C 64 66.011 66.296 -0.285 1
1 650 . 26 1 1 A 65 65 PRO CB C 64 30.642 30.666 -0.024 1
1 653 . 26 1 1 A 66 66 ILE H H 65 7.377 7.304 0.073 1
1 654 . 26 1 1 A 66 66 ILE HA H 65 3.530 3.882 -0.352 1
1 664 . 26 1 1 A 66 66 ILE C C 65 177.543 178.250 -0.707 1
1 665 . 26 1 1 A 66 66 ILE CA C 65 66.647 64.204 2.443 1
1 666 . 26 1 1 A 66 66 ILE CB C 65 38.029 37.632 0.397 1
1 670 . 26 1 1 A 66 66 ILE N N 65 118.353 116.586 1.767 1
1 671 . 26 1 1 A 67 67 PHE H H 66 8.480 8.429 0.051 1
1 672 . 26 1 1 A 67 67 PHE HA H 66 4.115 4.417 -0.302 1
1 680 . 26 1 1 A 67 67 PHE C C 66 177.293 177.835 -0.542 1
1 681 . 26 1 1 A 67 67 PHE CA C 66 59.570 62.205 -2.635 1
1 682 . 26 1 1 A 67 67 PHE CB C 66 38.865 39.648 -0.783 1
1 688 . 26 1 1 A 67 67 PHE N N 66 122.420 120.399 2.021 1
1 689 . 26 1 1 A 68 68 ASN H H 67 8.595 8.385 0.210 1
1 690 . 26 1 1 A 68 68 ASN HA H 67 4.211 4.348 -0.137 1
1 695 . 26 1 1 A 68 68 ASN C C 67 178.697 177.988 0.709 1
1 696 . 26 1 1 A 68 68 ASN CA C 67 56.056 56.260 -0.204 1
1 697 . 26 1 1 A 68 68 ASN CB C 67 37.704 38.075 -0.371 1
1 698 . 26 1 1 A 68 68 ASN N N 67 115.573 117.519 -1.946 1
1 700 . 26 1 1 A 69 69 GLU H H 68 8.414 8.014 0.400 1
1 701 . 26 1 1 A 69 69 GLU HA H 68 4.102 4.213 -0.111 1
1 706 . 26 1 1 A 69 69 GLU C C 68 177.880 178.773 -0.893 1
1 707 . 26 1 1 A 69 69 GLU CA C 68 59.399 59.379 0.020 1
1 708 . 26 1 1 A 69 69 GLU CB C 68 29.855 29.500 0.355 1
1 710 . 26 1 1 A 69 69 GLU N N 68 123.510 120.047 3.463 1
1 711 . 26 1 1 A 70 70 TYR H H 69 8.659 8.144 0.515 1
1 712 . 26 1 1 A 70 70 TYR HA H 69 3.362 4.008 -0.646 1
1 719 . 26 1 1 A 70 70 TYR C C 69 178.143 177.034 1.109 1
1 720 . 26 1 1 A 70 70 TYR CA C 69 60.686 60.903 -0.217 1
1 721 . 26 1 1 A 70 70 TYR CB C 69 38.560 38.733 -0.173 1
1 726 . 26 1 1 A 70 70 TYR N N 69 122.130 120.759 1.371 1
1 727 . 26 1 1 A 71 71 ILE H H 70 8.031 7.520 0.511 1
1 728 . 26 1 1 A 71 71 ILE HA H 70 3.265 3.680 -0.415 1
1 738 . 26 1 1 A 71 71 ILE C C 70 178.056 178.263 -0.207 1
1 739 . 26 1 1 A 71 71 ILE CA C 70 63.756 64.081 -0.325 1
1 740 . 26 1 1 A 71 71 ILE CB C 70 37.321 37.555 -0.234 1
1 744 . 26 1 1 A 71 71 ILE N N 70 118.906 120.817 -1.911 1
1 745 . 26 1 1 A 72 72 SER H H 71 7.803 8.178 -0.375 1
1 746 . 26 1 1 A 72 72 SER HA H 71 4.029 4.225 -0.196 1
1 749 . 26 1 1 A 72 72 SER CA C 71 61.380 61.583 -0.203 1
1 750 . 26 1 1 A 72 72 SER CB C 71 63.288 62.745 0.543 1
1 751 . 26 1 1 A 72 72 SER N N 71 113.735 115.009 -1.274 1
1 752 . 26 1 1 A 73 73 LEU H H 72 7.952 7.764 0.188 1
1 753 . 26 1 1 A 73 73 LEU HA H 72 4.418 4.133 0.285 1
1 763 . 26 1 1 A 73 73 LEU C C 72 177.767 178.260 -0.493 1
1 764 . 26 1 1 A 73 73 LEU CA C 72 56.543 57.438 -0.895 1
1 765 . 26 1 1 A 73 73 LEU CB C 72 44.517 41.708 2.809 1
1 769 . 26 1 1 A 73 73 LEU N N 72 119.411 123.254 -3.843 1
1 770 . 26 1 1 A 74 74 VAL H H 73 8.021 7.700 0.321 1
1 771 . 26 1 1 A 74 74 VAL HA H 73 3.532 3.355 0.177 1
1 779 . 26 1 1 A 74 74 VAL C C 73 177.126 177.965 -0.839 1
1 780 . 26 1 1 A 74 74 VAL CA C 73 66.250 66.339 -0.089 1
1 781 . 26 1 1 A 74 74 VAL CB C 73 31.212 31.151 0.061 1
1 784 . 26 1 1 A 74 74 VAL N N 73 118.747 119.236 -0.489 1
1 785 . 26 1 1 A 75 75 GLU H H 74 7.232 8.010 -0.778 1
1 786 . 26 1 1 A 75 75 GLU HA H 74 3.013 4.147 -1.134 1
1 791 . 26 1 1 A 75 75 GLU C C 74 178.804 179.046 -0.242 1
1 792 . 26 1 1 A 75 75 GLU CA C 74 60.536 59.779 0.757 1
1 793 . 26 1 1 A 75 75 GLU CB C 74 27.009 29.113 -2.104 1
1 795 . 26 1 1 A 75 75 GLU N N 74 118.660 119.752 -1.092 1
1 796 . 26 1 1 A 76 76 LYS H H 75 7.051 7.737 -0.686 1
1 797 . 26 1 1 A 76 76 LYS HA H 75 3.765 4.073 -0.308 1
1 806 . 26 1 1 A 76 76 LYS C C 75 177.765 178.402 -0.637 1
1 807 . 26 1 1 A 76 76 LYS CA C 75 58.357 58.485 -0.128 1
1 808 . 26 1 1 A 76 76 LYS CB C 75 31.939 32.588 -0.649 1
1 812 . 26 1 1 A 76 76 LYS N N 75 116.112 119.517 -3.405 1
1 813 . 26 1 1 A 77 77 TYR H H 76 7.067 7.952 -0.885 1
1 814 . 26 1 1 A 77 77 TYR HA H 76 4.036 4.091 -0.055 1
1 821 . 26 1 1 A 77 77 TYR C C 76 177.752 177.213 0.539 1
1 822 . 26 1 1 A 77 77 TYR CA C 76 61.820 61.353 0.467 1
1 823 . 26 1 1 A 77 77 TYR CB C 76 38.480 38.738 -0.258 1
1 828 . 26 1 1 A 77 77 TYR N N 76 118.434 121.783 -3.349 1
1 829 . 26 1 1 A 78 78 ILE H H 77 7.554 7.919 -0.365 1
1 830 . 26 1 1 A 78 78 ILE HA H 77 3.159 3.510 -0.351 1
1 840 . 26 1 1 A 78 78 ILE C C 77 177.341 177.823 -0.482 1
1 841 . 26 1 1 A 78 78 ILE CA C 77 65.177 64.511 0.666 1
1 842 . 26 1 1 A 78 78 ILE CB C 77 37.339 37.291 0.048 1
1 846 . 26 1 1 A 78 78 ILE N N 77 117.672 120.380 -2.708 1
1 847 . 26 1 1 A 79 79 GLU H H 78 8.296 8.023 0.273 1
1 848 . 26 1 1 A 79 79 GLU HA H 78 3.557 3.796 -0.239 1
1 853 . 26 1 1 A 79 79 GLU C C 78 177.742 178.768 -1.026 1
1 854 . 26 1 1 A 79 79 GLU CA C 78 60.847 60.108 0.739 1
1 855 . 26 1 1 A 79 79 GLU CB C 78 29.594 29.183 0.411 1
1 857 . 26 1 1 A 79 79 GLU N N 78 118.701 120.514 -1.813 1
1 858 . 26 1 1 A 80 80 GLU H H 79 8.330 8.434 -0.104 1
1 859 . 26 1 1 A 80 80 GLU HA H 79 3.774 4.010 -0.236 1
1 864 . 26 1 1 A 80 80 GLU C C 79 179.926 179.279 0.647 1
1 865 . 26 1 1 A 80 80 GLU CA C 79 59.581 58.942 0.639 1
1 866 . 26 1 1 A 80 80 GLU CB C 79 29.062 29.010 0.052 1
1 868 . 26 1 1 A 80 80 GLU N N 79 116.767 118.061 -1.294 1
1 869 . 26 1 1 A 81 81 GLN H H 80 7.634 7.617 0.017 1
1 870 . 26 1 1 A 81 81 GLN HA H 80 3.605 3.845 -0.240 1
1 877 . 26 1 1 A 81 81 GLN C C 80 179.681 178.441 1.240 1
1 878 . 26 1 1 A 81 81 GLN CA C 80 57.765 58.336 -0.571 1
1 879 . 26 1 1 A 81 81 GLN CB C 80 28.079 27.977 0.102 1
1 881 . 26 1 1 A 81 81 GLN N N 80 116.325 118.721 -2.396 1
1 883 . 26 1 1 A 82 82 LEU H H 81 8.156 7.541 0.615 1
1 884 . 26 1 1 A 82 82 LEU HA H 81 3.536 3.751 -0.215 1
1 894 . 26 1 1 A 82 82 LEU C C 81 178.945 179.328 -0.383 1
1 895 . 26 1 1 A 82 82 LEU CA C 81 57.761 56.780 0.981 1
1 896 . 26 1 1 A 82 82 LEU CB C 81 40.961 40.893 0.068 1
1 900 . 26 1 1 A 82 82 LEU N N 81 121.546 120.306 1.240 1
1 901 . 26 1 1 A 83 83 LEU H H 82 8.326 7.999 0.327 1
1 902 . 26 1 1 A 83 83 LEU HA H 82 4.198 4.173 0.025 1
1 912 . 26 1 1 A 83 83 LEU C C 82 178.631 179.234 -0.603 1
1 913 . 26 1 1 A 83 83 LEU CA C 82 57.016 57.321 -0.305 1
1 914 . 26 1 1 A 83 83 LEU CB C 82 42.182 40.833 1.349 1
1 918 . 26 1 1 A 83 83 LEU N N 82 120.426 119.304 1.122 1
1 919 . 26 1 1 A 84 84 GLN H H 83 6.992 7.611 -0.619 1
1 920 . 26 1 1 A 84 84 GLN HA H 83 3.877 4.004 -0.127 1
1 927 . 26 1 1 A 84 84 GLN C C 83 177.008 176.711 0.297 1
1 928 . 26 1 1 A 84 84 GLN CA C 83 57.543 58.287 -0.744 1
1 929 . 26 1 1 A 84 84 GLN CB C 83 28.688 28.580 0.108 1
1 931 . 26 1 1 A 84 84 GLN N N 83 114.001 117.551 -3.550 1
1 933 . 26 1 1 A 85 85 ARG H H 84 7.072 7.659 -0.587 1
1 934 . 26 1 1 A 85 85 ARG HA H 84 4.047 4.434 -0.387 1
1 942 . 26 1 1 A 85 85 ARG C C 84 175.999 175.483 0.516 1
1 943 . 26 1 1 A 85 85 ARG CA C 84 56.764 56.828 -0.064 1
1 944 . 26 1 1 A 85 85 ARG CB C 84 32.044 32.233 -0.189 1
1 947 . 26 1 1 A 85 85 ARG N N 84 115.827 119.031 -3.204 1
1 949 . 26 1 1 A 86 86 ILE H H 85 8.238 7.841 0.397 1
1 950 . 26 1 1 A 86 86 ILE HA H 85 4.389 4.459 -0.070 1
1 960 . 26 1 1 A 86 86 ILE CA C 85 58.007 57.782 0.225 1
1 961 . 26 1 1 A 86 86 ILE CB C 85 39.604 38.837 0.767 1
1 965 . 26 1 1 A 86 86 ILE N N 85 119.285 118.164 1.121 1
1 966 . 26 1 1 A 87 87 PRO HA H 86 4.392 4.559 -0.167 1
1 973 . 26 1 1 A 87 87 PRO C C 86 177.622 176.296 1.326 1
1 974 . 26 1 1 A 87 87 PRO CA C 86 64.665 64.240 0.425 1
1 975 . 26 1 1 A 87 87 PRO CB C 86 32.020 31.710 0.310 1
1 978 . 26 1 1 A 88 88 GLU H H 87 8.312 8.214 0.098 1
1 979 . 26 1 1 A 88 88 GLU HA H 87 4.208 4.586 -0.378 1
1 984 . 26 1 1 A 88 88 GLU C C 87 175.554 175.832 -0.278 1
1 985 . 26 1 1 A 88 88 GLU CA C 87 56.045 56.261 -0.216 1
1 986 . 26 1 1 A 88 88 GLU CB C 87 28.654 30.703 -2.049 1
1 988 . 26 1 1 A 88 88 GLU N N 87 114.256 116.739 -2.483 1
1 989 . 26 1 1 A 89 89 PHE H H 88 7.946 7.573 0.373 1
1 990 . 26 1 1 A 89 89 PHE HA H 88 3.993 4.532 -0.539 1
1 998 . 26 1 1 A 89 89 PHE C C 88 173.460 174.766 -1.306 1
1 999 . 26 1 1 A 89 89 PHE CA C 88 60.119 59.130 0.989 1
1 1000 . 26 1 1 A 89 89 PHE CB C 88 39.994 39.813 0.181 1
1 1006 . 26 1 1 A 89 89 PHE N N 88 121.550 123.056 -1.506 1
1 1007 . 26 1 1 A 90 90 ASN H H 89 7.266 7.853 -0.587 1
1 1008 . 26 1 1 A 90 90 ASN HA H 89 4.454 4.947 -0.493 1
1 1013 . 26 1 1 A 90 90 ASN C C 89 173.921 175.091 -1.170 1
1 1014 . 26 1 1 A 90 90 ASN CA C 89 51.839 51.373 0.466 1
1 1015 . 26 1 1 A 90 90 ASN CB C 89 40.674 39.745 0.929 1
1 1016 . 26 1 1 A 90 90 ASN N N 89 125.344 125.021 0.323 1
1 1018 . 26 1 1 A 91 91 MET H H 90 8.968 8.809 0.159 1
1 1019 . 26 1 1 A 91 91 MET HA H 90 4.049 4.217 -0.168 1
1 1027 . 26 1 1 A 91 91 MET C C 90 177.475 177.750 -0.275 1
1 1028 . 26 1 1 A 91 91 MET CA C 90 57.758 58.009 -0.251 1
1 1029 . 26 1 1 A 91 91 MET CB C 90 32.250 32.539 -0.289 1
1 1032 . 26 1 1 A 91 91 MET N N 90 127.052 125.458 1.594 1
1 1033 . 26 1 1 A 92 92 ALA H H 91 8.292 7.617 0.675 1
1 1034 . 26 1 1 A 92 92 ALA HA H 91 4.059 4.148 -0.089 1
1 1038 . 26 1 1 A 92 92 ALA C C 91 180.412 179.548 0.864 1
1 1039 . 26 1 1 A 92 92 ALA CA C 91 55.368 54.852 0.516 1
1 1040 . 26 1 1 A 92 92 ALA CB C 91 17.527 18.751 -1.224 1
1 1041 . 26 1 1 A 92 92 ALA N N 91 123.752 120.968 2.784 1
1 1042 . 26 1 1 A 93 93 ALA H H 92 7.931 8.037 -0.106 1
1 1043 . 26 1 1 A 93 93 ALA HA H 92 4.054 4.092 -0.038 1
1 1047 . 26 1 1 A 93 93 ALA C C 92 180.482 179.859 0.623 1
1 1048 . 26 1 1 A 93 93 ALA CA C 92 54.614 54.886 -0.272 1
1 1049 . 26 1 1 A 93 93 ALA CB C 92 18.098 18.148 -0.050 1
1 1050 . 26 1 1 A 93 93 ALA N N 92 121.158 120.170 0.988 1
1 1051 . 26 1 1 A 94 94 PHE H H 93 8.110 7.803 0.307 1
1 1052 . 26 1 1 A 94 94 PHE HA H 93 4.304 4.205 0.099 1
1 1060 . 26 1 1 A 94 94 PHE C C 93 177.350 177.103 0.247 1
1 1061 . 26 1 1 A 94 94 PHE CA C 93 61.641 61.607 0.034 1
1 1062 . 26 1 1 A 94 94 PHE CB C 93 40.014 39.093 0.921 1
1 1068 . 26 1 1 A 94 94 PHE N N 93 119.807 119.762 0.045 1
1 1069 . 26 1 1 A 95 95 THR H H 94 8.726 8.157 0.569 1
1 1070 . 26 1 1 A 95 95 THR HA H 94 3.569 4.001 -0.432 1
1 1075 . 26 1 1 A 95 95 THR C C 94 176.932 176.878 0.054 1
1 1076 . 26 1 1 A 95 95 THR CA C 94 66.833 65.531 1.302 1
1 1077 . 26 1 1 A 95 95 THR CB C 94 68.445 68.197 0.248 1
1 1079 . 26 1 1 A 95 95 THR N N 94 113.074 112.130 0.944 1
1 1080 . 26 1 1 A 96 96 THR H H 95 7.657 7.871 -0.214 1
1 1081 . 26 1 1 A 96 96 THR HA H 95 3.945 4.058 -0.113 1
1 1086 . 26 1 1 A 96 96 THR C C 95 176.386 176.453 -0.067 1
1 1087 . 26 1 1 A 96 96 THR CA C 95 66.550 66.017 0.533 1
1 1088 . 26 1 1 A 96 96 THR CB C 95 68.583 68.890 -0.307 1
1 1090 . 26 1 1 A 96 96 THR N N 95 117.927 117.376 0.551 1
1 1091 . 26 1 1 A 97 97 THR H H 96 7.699 7.856 -0.157 1
1 1092 . 26 1 1 A 97 97 THR HA H 96 3.905 3.969 -0.064 1
1 1097 . 26 1 1 A 97 97 THR C C 96 176.572 176.394 0.178 1
1 1098 . 26 1 1 A 97 97 THR CA C 96 65.979 66.781 -0.802 1
1 1099 . 26 1 1 A 97 97 THR CB C 96 68.553 68.197 0.356 1
1 1101 . 26 1 1 A 97 97 THR N N 96 118.518 116.221 2.297 1
1 1102 . 26 1 1 A 98 98 LEU H H 97 8.304 8.225 0.079 1
1 1103 . 26 1 1 A 98 98 LEU HA H 97 3.725 3.899 -0.174 1
1 1113 . 26 1 1 A 98 98 LEU C C 97 178.490 178.579 -0.089 1
1 1114 . 26 1 1 A 98 98 LEU CA C 97 58.517 58.036 0.481 1
1 1115 . 26 1 1 A 98 98 LEU CB C 97 41.697 41.161 0.536 1
1 1119 . 26 1 1 A 98 98 LEU N N 97 122.882 122.169 0.713 1
1 1120 . 26 1 1 A 99 99 GLN H H 98 7.639 7.774 -0.135 1
1 1121 . 26 1 1 A 99 99 GLN HA H 98 3.927 3.979 -0.052 1
1 1128 . 26 1 1 A 99 99 GLN C C 98 178.068 177.884 0.184 1
1 1129 . 26 1 1 A 99 99 GLN CA C 98 58.735 59.109 -0.374 1
1 1130 . 26 1 1 A 99 99 GLN CB C 98 27.986 28.424 -0.438 1
1 1132 . 26 1 1 A 99 99 GLN N N 98 114.302 118.288 -3.986 1
1 1134 . 26 1 1 A 100 100 HIS H H 99 7.575 7.674 -0.099 1
1 1135 . 26 1 1 A 100 100 HIS HA H 99 4.524 4.438 0.086 1
1 1139 . 26 1 1 A 100 100 HIS C C 99 174.789 177.517 -2.728 1
1 1140 . 26 1 1 A 100 100 HIS CA C 99 56.154 58.289 -2.135 1
1 1141 . 26 1 1 A 100 100 HIS CB C 99 28.946 30.944 -1.998 1
1 1143 . 26 1 1 A 100 100 HIS N N 99 114.778 118.139 -3.361 1
1 1144 . 26 1 1 A 101 101 HIS H H 100 7.773 8.144 -0.371 1
1 1145 . 26 1 1 A 101 101 HIS HA H 100 4.704 4.114 0.590 1
1 1149 . 26 1 1 A 101 101 HIS C C 100 174.818 176.940 -2.122 1
1 1150 . 26 1 1 A 101 101 HIS CA C 100 54.830 58.172 -3.342 1
1 1151 . 26 1 1 A 101 101 HIS CB C 100 29.749 30.141 -0.392 1
1 1153 . 26 1 1 A 101 101 HIS N N 100 117.397 119.155 -1.758 1
1 1154 . 26 1 1 A 102 102 LYS H H 101 7.324 8.181 -0.857 1
1 1155 . 26 1 1 A 102 102 LYS HA H 101 3.611 4.095 -0.484 1
1 1164 . 26 1 1 A 102 102 LYS C C 101 176.823 178.777 -1.954 1
1 1165 . 26 1 1 A 102 102 LYS CA C 101 59.915 58.792 1.123 1
1 1166 . 26 1 1 A 102 102 LYS CB C 101 32.825 32.264 0.561 1
1 1170 . 26 1 1 A 102 102 LYS N N 101 120.533 118.874 1.659 1
1 1171 . 26 1 1 A 103 103 ASP H H 102 8.361 8.603 -0.242 1
1 1172 . 26 1 1 A 103 103 ASP HA H 102 4.421 4.332 0.089 1
1 1175 . 26 1 1 A 103 103 ASP C C 102 176.793 177.343 -0.550 1
1 1176 . 26 1 1 A 103 103 ASP CA C 102 55.500 56.228 -0.728 1
1 1177 . 26 1 1 A 103 103 ASP CB C 102 40.178 39.387 0.791 1
1 1178 . 26 1 1 A 103 103 ASP N N 102 114.814 116.806 -1.992 1
1 1179 . 26 1 1 A 104 104 GLU H H 103 7.858 7.997 -0.139 1
1 1180 . 26 1 1 A 104 104 GLU HA H 103 4.339 4.595 -0.256 1
1 1183 . 26 1 1 A 104 104 GLU C C 103 175.777 176.935 -1.158 1
1 1184 . 26 1 1 A 104 104 GLU CA C 103 56.356 57.614 -1.258 1
1 1185 . 26 1 1 A 104 104 GLU CB C 103 31.293 32.293 -1.000 1
1 1186 . 26 1 1 A 104 104 GLU N N 103 116.826 118.057 -1.231 1
1 1187 . 26 1 1 A 105 105 VAL H H 104 7.201 7.597 -0.396 1
1 1188 . 26 1 1 A 105 105 VAL HA H 104 4.296 4.125 0.171 1
1 1196 . 26 1 1 A 105 105 VAL C C 104 174.482 176.094 -1.612 1
1 1197 . 26 1 1 A 105 105 VAL CA C 104 60.370 63.328 -2.958 1
1 1198 . 26 1 1 A 105 105 VAL CB C 104 34.341 32.119 2.222 1
1 1201 . 26 1 1 A 105 105 VAL N N 104 116.422 119.761 -3.339 1
1 1202 . 26 1 1 A 106 106 ALA H H 105 8.487 8.580 -0.093 1
1 1203 . 26 1 1 A 106 106 ALA HA H 105 4.172 4.447 -0.275 1
1 1207 . 26 1 1 A 106 106 ALA C C 105 179.030 178.837 0.193 1
1 1208 . 26 1 1 A 106 106 ALA CA C 105 52.966 52.425 0.541 1
1 1209 . 26 1 1 A 106 106 ALA CB C 105 19.371 19.276 0.095 1
1 1210 . 26 1 1 A 106 106 ALA N N 105 128.313 128.415 -0.102 1
1 1211 . 26 1 1 A 107 107 GLY H H 106 8.738 8.789 -0.051 1
1 1212 . 26 1 1 A 107 107 GLY HA2 H 106 3.773 3.874 -0.101 1
1 1213 . 26 1 1 A 107 107 GLY HA3 H 106 3.998 3.940 0.058 1
1 1214 . 26 1 1 A 107 107 GLY C C 106 174.958 175.547 -0.589 1
1 1215 . 26 1 1 A 107 107 GLY CA C 106 47.449 47.197 0.252 1
1 1216 . 26 1 1 A 107 107 GLY N N 106 110.612 110.768 -0.156 1
1 1217 . 26 1 1 A 108 108 ASP H H 107 8.535 8.320 0.215 1
1 1218 . 26 1 1 A 108 108 ASP HA H 107 4.333 4.378 -0.045 1
1 1221 . 26 1 1 A 108 108 ASP C C 107 179.133 178.596 0.537 1
1 1222 . 26 1 1 A 108 108 ASP CA C 107 56.721 57.013 -0.292 1
1 1223 . 26 1 1 A 108 108 ASP CB C 107 39.336 41.484 -2.148 1
1 1224 . 26 1 1 A 108 108 ASP N N 107 117.474 121.560 -4.086 1
1 1225 . 26 1 1 A 109 109 ILE H H 108 7.459 7.908 -0.449 1
1 1226 . 26 1 1 A 109 109 ILE HA H 108 3.688 3.832 -0.144 1
1 1236 . 26 1 1 A 109 109 ILE C C 108 176.735 178.427 -1.692 1
1 1237 . 26 1 1 A 109 109 ILE CA C 108 63.474 65.348 -1.874 1
1 1238 . 26 1 1 A 109 109 ILE CB C 108 37.340 37.755 -0.415 1
1 1242 . 26 1 1 A 109 109 ILE N N 108 119.609 119.508 0.101 1
1 1243 . 26 1 1 A 110 110 PHE H H 109 7.920 8.370 -0.450 1
1 1244 . 26 1 1 A 110 110 PHE HA H 109 3.759 4.093 -0.334 1
1 1252 . 26 1 1 A 110 110 PHE C C 109 177.132 177.347 -0.215 1
1 1253 . 26 1 1 A 110 110 PHE CA C 109 62.766 61.259 1.507 1
1 1254 . 26 1 1 A 110 110 PHE CB C 109 39.752 39.332 0.420 1
1 1260 . 26 1 1 A 110 110 PHE N N 109 120.906 120.476 0.430 1
1 1261 . 26 1 1 A 111 111 ASP H H 110 8.639 8.314 0.325 1
1 1262 . 26 1 1 A 111 111 ASP HA H 110 4.216 4.234 -0.018 1
1 1265 . 26 1 1 A 111 111 ASP C C 110 178.900 178.423 0.477 1
1 1266 . 26 1 1 A 111 111 ASP CA C 110 57.105 57.299 -0.194 1
1 1267 . 26 1 1 A 111 111 ASP CB C 110 39.697 41.839 -2.142 1
1 1268 . 26 1 1 A 111 111 ASP N N 110 117.124 118.752 -1.628 1
1 1269 . 26 1 1 A 112 112 MET H H 111 7.331 7.543 -0.212 1
1 1270 . 26 1 1 A 112 112 MET HA H 111 4.081 4.159 -0.078 1
1 1278 . 26 1 1 A 112 112 MET C C 111 179.052 178.152 0.900 1
1 1279 . 26 1 1 A 112 112 MET CA C 111 58.202 58.093 0.109 1
1 1280 . 26 1 1 A 112 112 MET CB C 111 31.827 32.399 -0.572 1
1 1283 . 26 1 1 A 112 112 MET N N 111 118.061 119.426 -1.365 1
1 1284 . 26 1 1 A 113 113 LEU H H 112 8.001 8.023 -0.022 1
1 1285 . 26 1 1 A 113 113 LEU HA H 112 3.723 3.574 0.149 1
1 1295 . 26 1 1 A 113 113 LEU C C 112 179.747 178.567 1.180 1
1 1296 . 26 1 1 A 113 113 LEU CA C 112 57.371 57.385 -0.014 1
1 1297 . 26 1 1 A 113 113 LEU CB C 112 40.671 41.141 -0.470 1
1 1301 . 26 1 1 A 113 113 LEU N N 112 120.426 119.657 0.769 1
1 1302 . 26 1 1 A 114 114 LEU H H 113 7.744 7.698 0.046 1
1 1303 . 26 1 1 A 114 114 LEU HA H 113 4.007 3.523 0.484 1
1 1313 . 26 1 1 A 114 114 LEU C C 113 179.358 178.559 0.799 1
1 1314 . 26 1 1 A 114 114 LEU CA C 113 57.202 57.541 -0.339 1
1 1315 . 26 1 1 A 114 114 LEU CB C 113 41.727 41.618 0.109 1
1 1319 . 26 1 1 A 114 114 LEU N N 113 119.584 119.646 -0.062 1
1 1320 . 26 1 1 A 115 115 THR H H 114 7.353 7.611 -0.258 1
1 1321 . 26 1 1 A 115 115 THR HA H 114 4.071 4.112 -0.041 1
1 1327 . 26 1 1 A 115 115 THR C C 114 173.591 176.458 -2.867 1
1 1328 . 26 1 1 A 115 115 THR CA C 114 65.332 64.398 0.934 1
1 1329 . 26 1 1 A 115 115 THR CB C 114 70.319 68.681 1.638 1
1 1331 . 26 1 1 A 115 115 THR N N 114 107.535 112.400 -4.865 1
1 1332 . 26 1 1 A 116 116 PHE H H 115 6.979 7.840 -0.861 1
1 1333 . 26 1 1 A 116 116 PHE HA H 115 5.022 4.268 0.754 1
1 1341 . 26 1 1 A 116 116 PHE C C 115 176.488 176.420 0.068 1
1 1342 . 26 1 1 A 116 116 PHE CA C 115 55.911 60.878 -4.967 1
1 1343 . 26 1 1 A 116 116 PHE CB C 115 38.521 39.138 -0.617 1
1 1349 . 26 1 1 A 116 116 PHE N N 115 112.366 120.043 -7.677 1
1 1350 . 26 1 1 A 117 117 THR H H 116 7.564 7.337 0.227 1
1 1351 . 26 1 1 A 117 117 THR HA H 116 4.626 4.789 -0.163 1
1 1356 . 26 1 1 A 117 117 THR C C 116 174.085 174.333 -0.248 1
1 1357 . 26 1 1 A 117 117 THR CA C 116 61.636 61.970 -0.334 1
1 1358 . 26 1 1 A 117 117 THR CB C 116 70.915 70.794 0.121 1
1 1360 . 26 1 1 A 117 117 THR N N 116 105.498 105.849 -0.351 1
1 1361 . 26 1 1 A 118 118 ASP H H 117 8.270 7.716 0.554 1
1 1362 . 26 1 1 A 118 118 ASP HA H 117 4.955 4.690 0.265 1
1 1365 . 26 1 1 A 118 118 ASP C C 117 176.328 176.450 -0.122 1
1 1366 . 26 1 1 A 118 118 ASP CA C 117 53.417 53.458 -0.041 1
1 1367 . 26 1 1 A 118 118 ASP CB C 117 43.388 40.188 3.200 1
1 1368 . 26 1 1 A 118 118 ASP N N 117 124.409 122.479 1.930 1
1 1369 . 26 1 1 A 119 119 PHE H H 118 8.973 8.842 0.131 1
1 1370 . 26 1 1 A 119 119 PHE HA H 118 3.506 4.258 -0.752 1
1 1378 . 26 1 1 A 119 119 PHE CA C 118 61.490 60.961 0.529 1
1 1379 . 26 1 1 A 119 119 PHE CB C 118 39.246 39.609 -0.363 1
1 1385 . 26 1 1 A 119 119 PHE N N 118 126.688 126.395 0.293 1
1 1386 . 26 1 1 A 120 120 LEU H H 119 8.099 8.225 -0.126 1
1 1387 . 26 1 1 A 120 120 LEU HA H 119 3.842 3.968 -0.126 1
1 1397 . 26 1 1 A 120 120 LEU C C 119 179.601 179.278 0.323 1
1 1398 . 26 1 1 A 120 120 LEU CA C 119 58.174 57.862 0.312 1
1 1399 . 26 1 1 A 120 120 LEU CB C 119 40.315 41.331 -1.016 1
1 1403 . 26 1 1 A 120 120 LEU N N 119 117.930 119.783 -1.853 1
1 1404 . 26 1 1 A 121 121 ALA H H 120 7.729 7.876 -0.147 1
1 1405 . 26 1 1 A 121 121 ALA HA H 120 3.996 4.116 -0.120 1
1 1409 . 26 1 1 A 121 121 ALA C C 120 180.995 179.595 1.400 1
1 1410 . 26 1 1 A 121 121 ALA CA C 120 54.832 54.638 0.194 1
1 1411 . 26 1 1 A 121 121 ALA CB C 120 17.706 18.351 -0.645 1
1 1412 . 26 1 1 A 121 121 ALA N N 120 123.195 121.142 2.053 1
1 1413 . 26 1 1 A 122 122 PHE H H 121 7.943 7.918 0.025 1
1 1414 . 26 1 1 A 122 122 PHE HA H 121 3.887 3.865 0.022 1
1 1419 . 26 1 1 A 122 122 PHE C C 121 175.410 177.358 -1.948 1
1 1420 . 26 1 1 A 122 122 PHE CA C 121 61.075 60.706 0.369 1
1 1421 . 26 1 1 A 122 122 PHE CB C 121 38.115 38.814 -0.699 1
1 1424 . 26 1 1 A 122 122 PHE N N 121 121.798 120.450 1.348 1
1 1425 . 26 1 1 A 123 123 LYS H H 122 8.468 7.787 0.681 1
1 1426 . 26 1 1 A 123 123 LYS HA H 122 3.077 3.799 -0.722 1
1 1435 . 26 1 1 A 123 123 LYS C C 122 178.453 178.884 -0.431 1
1 1436 . 26 1 1 A 123 123 LYS CA C 122 59.855 59.447 0.408 1
1 1437 . 26 1 1 A 123 123 LYS CB C 122 32.374 32.251 0.123 1
1 1441 . 26 1 1 A 123 123 LYS N N 122 120.614 117.823 2.791 1
1 1442 . 26 1 1 A 124 124 GLU H H 123 8.100 7.760 0.340 1
1 1443 . 26 1 1 A 124 124 GLU HA H 123 3.652 4.027 -0.375 1
1 1448 . 26 1 1 A 124 124 GLU C C 123 177.743 178.400 -0.657 1
1 1449 . 26 1 1 A 124 124 GLU CA C 123 59.406 59.609 -0.203 1
1 1450 . 26 1 1 A 124 124 GLU CB C 123 28.811 29.111 -0.300 1
1 1452 . 26 1 1 A 124 124 GLU N N 123 117.404 118.728 -1.324 1
1 1453 . 26 1 1 A 125 125 MET H H 124 7.537 7.636 -0.099 1
1 1454 . 26 1 1 A 125 125 MET HA H 124 3.860 3.882 -0.022 1
1 1462 . 26 1 1 A 125 125 MET C C 124 179.522 178.390 1.132 1
1 1463 . 26 1 1 A 125 125 MET CA C 124 58.832 58.590 0.242 1
1 1464 . 26 1 1 A 125 125 MET CB C 124 31.765 31.470 0.295 1
1 1467 . 26 1 1 A 125 125 MET N N 124 119.413 118.899 0.514 1
1 1468 . 26 1 1 A 126 126 PHE H H 125 7.148 7.526 -0.378 1
1 1469 . 26 1 1 A 126 126 PHE HA H 125 3.633 4.234 -0.601 1
1 1476 . 26 1 1 A 126 126 PHE C C 125 178.994 178.311 0.683 1
1 1477 . 26 1 1 A 126 126 PHE CA C 125 63.148 61.223 1.925 1
1 1478 . 26 1 1 A 126 126 PHE CB C 125 39.830 38.345 1.485 1
1 1483 . 26 1 1 A 126 126 PHE N N 125 120.013 118.891 1.122 1
1 1484 . 26 1 1 A 127 127 LEU H H 126 8.369 8.402 -0.033 1
1 1485 . 26 1 1 A 127 127 LEU HA H 126 3.972 4.067 -0.095 1
1 1495 . 26 1 1 A 127 127 LEU C C 126 180.621 179.380 1.241 1
1 1496 . 26 1 1 A 127 127 LEU CA C 126 57.944 57.734 0.210 1
1 1497 . 26 1 1 A 127 127 LEU CB C 126 40.543 41.005 -0.462 1
1 1501 . 26 1 1 A 127 127 LEU N N 126 119.692 119.684 0.008 1
1 1502 . 26 1 1 A 128 128 ASP H H 127 8.578 8.101 0.477 1
1 1503 . 26 1 1 A 128 128 ASP HA H 127 4.308 4.357 -0.049 1
1 1506 . 26 1 1 A 128 128 ASP C C 127 178.254 178.049 0.205 1
1 1507 . 26 1 1 A 128 128 ASP CA C 127 56.964 57.223 -0.259 1
1 1508 . 26 1 1 A 128 128 ASP CB C 127 39.735 40.997 -1.262 1
1 1509 . 26 1 1 A 128 128 ASP N N 127 121.926 120.067 1.859 1
1 1510 . 26 1 1 A 129 129 TYR H H 128 7.710 8.202 -0.492 1
1 1511 . 26 1 1 A 129 129 TYR HA H 128 3.908 4.053 -0.145 1
1 1518 . 26 1 1 A 129 129 TYR C C 128 177.633 177.612 0.021 1
1 1519 . 26 1 1 A 129 129 TYR CA C 128 61.796 61.332 0.464 1
1 1520 . 26 1 1 A 129 129 TYR CB C 128 39.372 38.739 0.633 1
1 1525 . 26 1 1 A 129 129 TYR N N 128 122.548 120.512 2.036 1
1 1526 . 26 1 1 A 130 130 ARG H H 129 8.622 8.452 0.170 1
1 1527 . 26 1 1 A 130 130 ARG HA H 129 3.722 3.987 -0.265 1
1 1535 . 26 1 1 A 130 130 ARG CA C 129 60.084 59.590 0.494 1
1 1536 . 26 1 1 A 130 130 ARG CB C 129 29.902 29.884 0.018 1
1 1539 . 26 1 1 A 130 130 ARG N N 129 118.302 119.271 -0.969 1
1 1541 . 26 1 1 A 131 131 ALA H H 130 7.936 7.952 -0.016 1
1 1542 . 26 1 1 A 131 131 ALA HA H 130 3.997 4.006 -0.009 1
1 1546 . 26 1 1 A 131 131 ALA C C 130 180.456 179.792 0.664 1
1 1547 . 26 1 1 A 131 131 ALA CA C 130 55.133 55.002 0.131 1
1 1548 . 26 1 1 A 131 131 ALA CB C 130 17.750 18.104 -0.354 1
1 1549 . 26 1 1 A 131 131 ALA N N 130 119.788 121.839 -2.051 1
1 1550 . 26 1 1 A 132 132 GLU H H 131 7.622 7.573 0.049 1
1 1551 . 26 1 1 A 132 132 GLU HA H 131 3.862 4.007 -0.145 1
1 1556 . 26 1 1 A 132 132 GLU C C 131 179.528 178.177 1.351 1
1 1557 . 26 1 1 A 132 132 GLU CA C 131 58.849 58.586 0.263 1
1 1558 . 26 1 1 A 132 132 GLU CB C 131 28.930 28.994 -0.064 1
1 1560 . 26 1 1 A 132 132 GLU N N 131 118.428 117.985 0.443 1
1 1561 . 26 1 1 A 133 133 LYS H H 132 7.853 7.657 0.196 1
1 1562 . 26 1 1 A 133 133 LYS HA H 132 3.722 4.006 -0.284 1
1 1571 . 26 1 1 A 133 133 LYS C C 132 175.725 177.616 -1.891 1
1 1572 . 26 1 1 A 133 133 LYS CA C 132 57.544 58.645 -1.101 1
1 1573 . 26 1 1 A 133 133 LYS CB C 132 31.770 32.155 -0.385 1
1 1577 . 26 1 1 A 133 133 LYS N N 132 119.473 118.850 0.623 1
1 1578 . 26 1 1 A 134 134 GLU H H 133 8.151 7.587 0.564 1
1 1579 . 26 1 1 A 134 134 GLU HA H 133 4.161 4.677 -0.516 1
1 1584 . 26 1 1 A 134 134 GLU C C 133 177.453 177.145 0.308 1
1 1585 . 26 1 1 A 134 134 GLU CA C 133 57.222 56.358 0.864 1
1 1586 . 26 1 1 A 134 134 GLU CB C 133 30.091 30.338 -0.247 1
1 1588 . 26 1 1 A 134 134 GLU N N 133 116.525 117.062 -0.537 1
1 1589 . 26 1 1 A 135 135 GLY H H 134 7.702 7.981 -0.279 1
1 1590 . 26 1 1 A 135 135 GLY HA2 H 134 3.896 3.819 0.077 1
1 1591 . 26 1 1 A 135 135 GLY HA3 H 134 3.897 3.829 0.068 1
1 1592 . 26 1 1 A 135 135 GLY C C 134 174.538 174.386 0.152 1
1 1593 . 26 1 1 A 135 135 GLY CA C 134 45.975 47.068 -1.093 1
1 1594 . 26 1 1 A 135 135 GLY N N 134 107.924 108.904 -0.980 1
1 1595 . 26 1 1 A 136 136 ARG H H 135 8.045 7.620 0.425 1
1 1596 . 26 1 1 A 136 136 ARG HA H 135 4.323 4.736 -0.413 1
1 1604 . 26 1 1 A 136 136 ARG C C 135 175.864 175.968 -0.104 1
1 1605 . 26 1 1 A 136 136 ARG CA C 135 56.016 54.671 1.345 1
1 1606 . 26 1 1 A 136 136 ARG CB C 135 30.987 31.837 -0.850 1
1 1609 . 26 1 1 A 136 136 ARG N N 135 119.708 118.885 0.823 1
1 1 . 27 1 1 A 14 14 PHE CA C 13 58.199 58.343 -0.144 1
1 2 . 27 1 1 A 14 14 PHE CB C 13 39.717 39.030 0.687 1
1 3 . 27 1 1 A 15 15 SER H H 14 8.299 8.332 -0.033 1
1 4 . 27 1 1 A 15 15 SER HA H 14 4.359 5.023 -0.664 1
1 7 . 27 1 1 A 15 15 SER CA C 14 58.249 55.902 2.347 1
1 8 . 27 1 1 A 15 15 SER CB C 14 63.936 66.053 -2.117 1
1 9 . 27 1 1 A 15 15 SER N N 14 117.379 123.691 -6.312 1
1 10 . 27 1 1 A 16 16 SER H H 15 8.255 8.836 -0.581 1
1 11 . 27 1 1 A 16 16 SER HA H 15 3.729 4.677 -0.948 1
1 14 . 27 1 1 A 16 16 SER CA C 15 58.224 58.537 -0.313 1
1 15 . 27 1 1 A 16 16 SER CB C 15 63.886 65.425 -1.539 1
1 16 . 27 1 1 A 16 16 SER N N 15 117.694 120.738 -3.044 1
1 17 . 27 1 1 A 17 17 ALA H H 16 8.333 8.098 0.235 1
1 18 . 27 1 1 A 17 17 ALA HA H 16 4.252 4.145 0.107 1
1 22 . 27 1 1 A 17 17 ALA CA C 16 53.377 54.162 -0.785 1
1 23 . 27 1 1 A 17 17 ALA CB C 16 18.896 18.626 0.270 1
1 24 . 27 1 1 A 17 17 ALA N N 16 125.462 124.306 1.156 1
1 25 . 27 1 1 A 18 18 SER H H 17 8.219 7.923 0.296 1
1 26 . 27 1 1 A 18 18 SER HA H 17 4.332 4.677 -0.345 1
1 29 . 27 1 1 A 18 18 SER CA C 17 59.105 57.850 1.255 1
1 30 . 27 1 1 A 18 18 SER CB C 17 63.592 64.717 -1.125 1
1 31 . 27 1 1 A 18 18 SER N N 17 114.821 112.147 2.674 1
1 32 . 27 1 1 A 19 19 ASP H H 18 8.309 8.249 0.060 1
1 33 . 27 1 1 A 19 19 ASP HA H 18 4.554 4.965 -0.411 1
1 36 . 27 1 1 A 19 19 ASP C C 18 176.528 176.912 -0.384 1
1 37 . 27 1 1 A 19 19 ASP CA C 18 55.272 54.497 0.775 1
1 38 . 27 1 1 A 19 19 ASP CB C 18 40.883 42.512 -1.629 1
1 39 . 27 1 1 A 19 19 ASP N N 18 123.367 120.900 2.467 1
1 40 . 27 1 1 A 20 20 ALA H H 19 8.133 8.426 -0.293 1
1 41 . 27 1 1 A 20 20 ALA HA H 19 4.170 4.050 0.120 1
1 45 . 27 1 1 A 20 20 ALA C C 19 179.857 179.126 0.731 1
1 46 . 27 1 1 A 20 20 ALA CA C 19 54.341 55.497 -1.156 1
1 47 . 27 1 1 A 20 20 ALA CB C 19 18.660 18.539 0.121 1
1 48 . 27 1 1 A 20 20 ALA N N 19 123.350 122.622 0.728 1
1 49 . 27 1 1 A 21 21 GLU H H 20 8.140 7.904 0.236 1
1 50 . 27 1 1 A 21 21 GLU HA H 20 4.128 4.094 0.034 1
1 55 . 27 1 1 A 21 21 GLU C C 20 177.675 178.581 -0.906 1
1 56 . 27 1 1 A 21 21 GLU CA C 20 58.520 59.436 -0.916 1
1 57 . 27 1 1 A 21 21 GLU CB C 20 29.765 29.583 0.182 1
1 59 . 27 1 1 A 21 21 GLU N N 20 119.063 119.165 -0.102 1
1 60 . 27 1 1 A 22 22 PHE H H 21 8.009 7.996 0.013 1
1 61 . 27 1 1 A 22 22 PHE HA H 21 4.123 4.324 -0.201 1
1 68 . 27 1 1 A 22 22 PHE C C 21 176.410 177.240 -0.830 1
1 69 . 27 1 1 A 22 22 PHE CA C 21 62.202 61.063 1.139 1
1 70 . 27 1 1 A 22 22 PHE CB C 21 39.223 39.097 0.126 1
1 75 . 27 1 1 A 22 22 PHE N N 21 121.211 120.907 0.304 1
1 76 . 27 1 1 A 23 23 ASP H H 22 8.261 8.407 -0.146 1
1 77 . 27 1 1 A 23 23 ASP HA H 22 4.041 4.399 -0.358 1
1 80 . 27 1 1 A 23 23 ASP C C 22 179.078 178.149 0.929 1
1 81 . 27 1 1 A 23 23 ASP CA C 22 57.048 57.863 -0.815 1
1 82 . 27 1 1 A 23 23 ASP CB C 22 40.154 41.998 -1.844 1
1 83 . 27 1 1 A 23 23 ASP N N 22 116.876 118.789 -1.913 1
1 84 . 27 1 1 A 24 24 ALA H H 23 7.651 7.615 0.036 1
1 85 . 27 1 1 A 24 24 ALA HA H 23 3.785 3.831 -0.046 1
1 89 . 27 1 1 A 24 24 ALA C C 23 179.577 179.757 -0.180 1
1 90 . 27 1 1 A 24 24 ALA CA C 23 54.341 55.168 -0.827 1
1 91 . 27 1 1 A 24 24 ALA CB C 23 17.762 18.142 -0.380 1
1 92 . 27 1 1 A 24 24 ALA N N 23 121.873 121.753 0.120 1
1 93 . 27 1 1 A 25 25 VAL H H 24 7.718 7.748 -0.030 1
1 94 . 27 1 1 A 25 25 VAL HA H 24 3.216 3.534 -0.318 1
1 102 . 27 1 1 A 25 25 VAL C C 24 177.805 177.873 -0.068 1
1 103 . 27 1 1 A 25 25 VAL CA C 24 66.789 66.850 -0.061 1
1 104 . 27 1 1 A 25 25 VAL CB C 24 31.277 31.154 0.123 1
1 107 . 27 1 1 A 25 25 VAL N N 24 117.890 118.589 -0.699 1
1 108 . 27 1 1 A 26 26 VAL H H 25 7.867 7.653 0.214 1
1 109 . 27 1 1 A 26 26 VAL HA H 25 3.274 3.509 -0.235 1
1 117 . 27 1 1 A 26 26 VAL C C 25 177.788 177.690 0.098 1
1 118 . 27 1 1 A 26 26 VAL CA C 25 67.282 66.346 0.936 1
1 119 . 27 1 1 A 26 26 VAL CB C 25 31.266 31.408 -0.142 1
1 122 . 27 1 1 A 26 26 VAL N N 25 118.170 119.562 -1.392 1
1 123 . 27 1 1 A 27 27 GLY H H 26 7.544 7.617 -0.073 1
1 124 . 27 1 1 A 27 27 GLY HA2 H 26 3.592 3.489 0.103 1
1 125 . 27 1 1 A 27 27 GLY HA3 H 26 3.721 3.614 0.107 1
1 126 . 27 1 1 A 27 27 GLY C C 26 176.717 176.311 0.406 1
1 127 . 27 1 1 A 27 27 GLY CA C 26 47.085 47.184 -0.099 1
1 128 . 27 1 1 A 27 27 GLY N N 26 105.795 107.522 -1.727 1
1 129 . 27 1 1 A 28 28 TYR H H 27 7.625 7.340 0.285 1
1 130 . 27 1 1 A 28 28 TYR HA H 27 4.546 4.564 -0.018 1
1 137 . 27 1 1 A 28 28 TYR C C 27 178.991 178.258 0.733 1
1 138 . 27 1 1 A 28 28 TYR CA C 27 58.845 59.843 -0.998 1
1 139 . 27 1 1 A 28 28 TYR CB C 27 37.602 37.654 -0.052 1
1 144 . 27 1 1 A 28 28 TYR N N 27 119.933 121.626 -1.693 1
1 145 . 27 1 1 A 29 29 LEU H H 28 8.517 8.197 0.320 1
1 146 . 27 1 1 A 29 29 LEU HA H 28 3.728 3.825 -0.097 1
1 156 . 27 1 1 A 29 29 LEU CA C 28 58.281 57.834 0.447 1
1 157 . 27 1 1 A 29 29 LEU CB C 28 41.948 41.438 0.510 1
1 161 . 27 1 1 A 29 29 LEU N N 28 119.669 120.586 -0.917 1
1 162 . 27 1 1 A 30 30 GLU H H 29 8.072 8.046 0.026 1
1 163 . 27 1 1 A 30 30 GLU HA H 29 3.722 3.866 -0.144 1
1 168 . 27 1 1 A 30 30 GLU C C 29 177.731 179.188 -1.457 1
1 169 . 27 1 1 A 30 30 GLU CA C 29 59.763 59.975 -0.212 1
1 170 . 27 1 1 A 30 30 GLU CB C 29 28.844 29.452 -0.608 1
1 172 . 27 1 1 A 30 30 GLU N N 29 117.666 118.052 -0.386 1
1 173 . 27 1 1 A 31 31 ASP H H 30 7.243 7.818 -0.575 1
1 174 . 27 1 1 A 31 31 ASP HA H 30 4.297 4.363 -0.066 1
1 177 . 27 1 1 A 31 31 ASP CA C 30 56.953 57.399 -0.446 1
1 178 . 27 1 1 A 31 31 ASP CB C 30 40.730 41.035 -0.305 1
1 179 . 27 1 1 A 31 31 ASP N N 30 116.720 119.374 -2.654 1
1 180 . 27 1 1 A 32 32 ILE H H 31 7.940 7.297 0.643 1
1 181 . 27 1 1 A 32 32 ILE HA H 31 3.640 3.729 -0.089 1
1 191 . 27 1 1 A 32 32 ILE C C 31 177.980 178.329 -0.349 1
1 192 . 27 1 1 A 32 32 ILE CA C 31 64.692 64.026 0.666 1
1 193 . 27 1 1 A 32 32 ILE CB C 31 38.938 36.608 2.330 1
1 197 . 27 1 1 A 32 32 ILE N N 31 119.728 120.218 -0.490 1
1 198 . 27 1 1 A 33 33 ILE H H 32 7.984 7.811 0.173 1
1 199 . 27 1 1 A 33 33 ILE HA H 32 3.598 2.844 0.754 1
1 209 . 27 1 1 A 33 33 ILE C C 32 176.723 177.123 -0.400 1
1 210 . 27 1 1 A 33 33 ILE CA C 32 63.241 64.669 -1.428 1
1 211 . 27 1 1 A 33 33 ILE CB C 32 37.580 37.641 -0.061 1
1 215 . 27 1 1 A 33 33 ILE N N 32 113.919 121.453 -7.534 1
1 216 . 27 1 1 A 34 34 MET H H 33 7.288 7.837 -0.549 1
1 217 . 27 1 1 A 34 34 MET HA H 33 4.496 4.613 -0.117 1
1 225 . 27 1 1 A 34 34 MET C C 33 176.423 175.661 0.762 1
1 226 . 27 1 1 A 34 34 MET CA C 33 54.634 54.617 0.017 1
1 227 . 27 1 1 A 34 34 MET CB C 33 31.934 31.079 0.855 1
1 230 . 27 1 1 A 34 34 MET N N 33 115.130 117.035 -1.905 1
1 231 . 27 1 1 A 35 35 ASP H H 34 7.405 7.308 0.097 1
1 232 . 27 1 1 A 35 35 ASP HA H 34 4.484 4.473 0.011 1
1 235 . 27 1 1 A 35 35 ASP C C 34 177.139 176.998 0.141 1
1 236 . 27 1 1 A 35 35 ASP CA C 34 54.625 54.857 -0.232 1
1 237 . 27 1 1 A 35 35 ASP CB C 34 43.554 42.719 0.835 1
1 238 . 27 1 1 A 35 35 ASP N N 34 121.814 122.093 -0.279 1
1 239 . 27 1 1 A 36 36 ASP H H 35 8.765 8.793 -0.028 1
1 240 . 27 1 1 A 36 36 ASP HA H 35 4.235 4.301 -0.066 1
1 243 . 27 1 1 A 36 36 ASP C C 35 178.320 178.434 -0.114 1
1 244 . 27 1 1 A 36 36 ASP CA C 35 57.832 57.958 -0.126 1
1 245 . 27 1 1 A 36 36 ASP CB C 35 40.914 40.452 0.462 1
1 246 . 27 1 1 A 36 36 ASP N N 35 125.883 125.336 0.547 1
1 247 . 27 1 1 A 37 37 GLU H H 36 8.905 8.023 0.882 1
1 248 . 27 1 1 A 37 37 GLU HA H 36 3.933 4.134 -0.201 1
1 253 . 27 1 1 A 37 37 GLU C C 36 179.304 179.004 0.300 1
1 254 . 27 1 1 A 37 37 GLU CA C 36 59.828 59.145 0.683 1
1 255 . 27 1 1 A 37 37 GLU CB C 36 29.380 29.267 0.113 1
1 257 . 27 1 1 A 37 37 GLU N N 36 119.077 120.162 -1.085 1
1 258 . 27 1 1 A 38 38 PHE H H 37 7.460 8.227 -0.767 1
1 259 . 27 1 1 A 38 38 PHE HA H 37 3.642 3.942 -0.300 1
1 267 . 27 1 1 A 38 38 PHE C C 37 176.483 178.048 -1.565 1
1 268 . 27 1 1 A 38 38 PHE CA C 37 61.411 61.131 0.280 1
1 269 . 27 1 1 A 38 38 PHE CB C 37 39.355 39.052 0.303 1
1 275 . 27 1 1 A 38 38 PHE N N 37 119.968 120.754 -0.786 1
1 276 . 27 1 1 A 39 39 GLN H H 38 7.968 7.980 -0.012 1
1 277 . 27 1 1 A 39 39 GLN HA H 38 3.712 3.889 -0.177 1
1 284 . 27 1 1 A 39 39 GLN CA C 38 59.153 58.739 0.414 1
1 285 . 27 1 1 A 39 39 GLN CB C 38 28.213 28.442 -0.229 1
1 287 . 27 1 1 A 39 39 GLN N N 38 116.433 118.482 -2.049 1
1 289 . 27 1 1 A 40 40 LEU H H 39 7.930 7.432 0.498 1
1 290 . 27 1 1 A 40 40 LEU HA H 39 3.916 3.992 -0.076 1
1 300 . 27 1 1 A 40 40 LEU C C 39 177.731 178.173 -0.442 1
1 301 . 27 1 1 A 40 40 LEU CA C 39 57.915 58.008 -0.093 1
1 302 . 27 1 1 A 40 40 LEU CB C 39 41.989 41.807 0.182 1
1 306 . 27 1 1 A 40 40 LEU N N 39 119.505 121.626 -2.121 1
1 307 . 27 1 1 A 41 41 LEU H H 40 7.174 7.874 -0.700 1
1 308 . 27 1 1 A 41 41 LEU HA H 40 3.835 4.027 -0.192 1
1 318 . 27 1 1 A 41 41 LEU C C 40 179.738 178.097 1.641 1
1 319 . 27 1 1 A 41 41 LEU CA C 40 58.266 58.141 0.125 1
1 320 . 27 1 1 A 41 41 LEU CB C 40 42.050 41.707 0.343 1
1 324 . 27 1 1 A 41 41 LEU N N 40 120.971 119.607 1.364 1
1 325 . 27 1 1 A 42 42 GLN H H 41 8.058 7.943 0.115 1
1 326 . 27 1 1 A 42 42 GLN HA H 41 3.556 3.714 -0.158 1
1 333 . 27 1 1 A 42 42 GLN C C 41 177.642 178.345 -0.703 1
1 334 . 27 1 1 A 42 42 GLN CA C 41 59.826 59.147 0.679 1
1 335 . 27 1 1 A 42 42 GLN CB C 41 28.762 27.786 0.976 1
1 337 . 27 1 1 A 42 42 GLN N N 41 117.899 118.203 -0.304 1
1 339 . 27 1 1 A 43 43 ARG H H 42 8.179 7.909 0.270 1
1 340 . 27 1 1 A 43 43 ARG HA H 42 3.655 3.976 -0.321 1
1 347 . 27 1 1 A 43 43 ARG C C 42 178.051 178.396 -0.345 1
1 348 . 27 1 1 A 43 43 ARG CA C 42 59.766 58.735 1.031 1
1 349 . 27 1 1 A 43 43 ARG CB C 42 29.941 29.930 0.011 1
1 352 . 27 1 1 A 43 43 ARG N N 42 119.392 119.821 -0.429 1
1 353 . 27 1 1 A 44 44 ASN H H 43 8.525 8.084 0.441 1
1 354 . 27 1 1 A 44 44 ASN HA H 43 4.332 4.409 -0.077 1
1 359 . 27 1 1 A 44 44 ASN C C 43 178.150 177.814 0.336 1
1 360 . 27 1 1 A 44 44 ASN CA C 43 55.841 56.237 -0.396 1
1 361 . 27 1 1 A 44 44 ASN CB C 43 37.632 39.304 -1.672 1
1 362 . 27 1 1 A 44 44 ASN N N 43 116.214 117.883 -1.669 1
1 364 . 27 1 1 A 45 45 PHE H H 44 7.586 7.944 -0.358 1
1 365 . 27 1 1 A 45 45 PHE HA H 44 4.132 4.234 -0.102 1
1 372 . 27 1 1 A 45 45 PHE C C 44 176.691 178.851 -2.160 1
1 373 . 27 1 1 A 45 45 PHE CA C 44 62.333 60.578 1.755 1
1 374 . 27 1 1 A 45 45 PHE CB C 44 39.449 38.721 0.728 1
1 379 . 27 1 1 A 45 45 PHE N N 44 121.501 117.825 3.676 1
1 380 . 27 1 1 A 46 46 MET H H 45 8.190 8.117 0.073 1
1 381 . 27 1 1 A 46 46 MET HA H 45 4.060 4.287 -0.227 1
1 389 . 27 1 1 A 46 46 MET C C 45 179.754 177.978 1.776 1
1 390 . 27 1 1 A 46 46 MET CA C 45 57.742 57.657 0.085 1
1 391 . 27 1 1 A 46 46 MET CB C 45 29.912 32.399 -2.487 1
1 394 . 27 1 1 A 46 46 MET N N 45 116.727 119.350 -2.623 1
1 395 . 27 1 1 A 47 47 ASP H H 46 8.579 8.226 0.353 1
1 396 . 27 1 1 A 47 47 ASP HA H 46 4.804 4.661 0.143 1
1 399 . 27 1 1 A 47 47 ASP C C 46 177.854 177.645 0.209 1
1 400 . 27 1 1 A 47 47 ASP CA C 46 57.277 57.316 -0.039 1
1 401 . 27 1 1 A 47 47 ASP CB C 46 40.776 41.786 -1.010 1
1 402 . 27 1 1 A 47 47 ASP N N 46 117.798 120.506 -2.708 1
1 403 . 27 1 1 A 48 48 LYS H H 47 7.339 7.695 -0.356 1
1 404 . 27 1 1 A 48 48 LYS HA H 47 3.828 4.314 -0.486 1
1 413 . 27 1 1 A 48 48 LYS C C 47 178.812 178.659 0.153 1
1 414 . 27 1 1 A 48 48 LYS CA C 47 58.953 57.547 1.406 1
1 415 . 27 1 1 A 48 48 LYS CB C 47 32.796 33.295 -0.499 1
1 419 . 27 1 1 A 48 48 LYS N N 47 117.852 118.040 -0.188 1
1 420 . 27 1 1 A 49 49 TYR H H 48 6.841 8.379 -1.538 1
1 421 . 27 1 1 A 49 49 TYR HA H 48 4.995 4.261 0.734 1
1 428 . 27 1 1 A 49 49 TYR C C 48 178.138 178.647 -0.509 1
1 429 . 27 1 1 A 49 49 TYR CA C 48 58.620 59.751 -1.131 1
1 430 . 27 1 1 A 49 49 TYR CB C 48 42.939 38.010 4.929 1
1 435 . 27 1 1 A 49 49 TYR N N 48 112.109 119.184 -7.075 1
1 436 . 27 1 1 A 50 50 TYR H H 49 8.491 8.022 0.469 1
1 437 . 27 1 1 A 50 50 TYR HA H 49 4.598 4.230 0.368 1
1 444 . 27 1 1 A 50 50 TYR C C 49 176.015 177.833 -1.818 1
1 445 . 27 1 1 A 50 50 TYR CA C 49 62.442 59.502 2.940 1
1 446 . 27 1 1 A 50 50 TYR CB C 49 36.588 36.881 -0.293 1
1 451 . 27 1 1 A 50 50 TYR N N 49 118.294 119.226 -0.932 1
1 452 . 27 1 1 A 51 51 LEU H H 50 7.512 7.458 0.054 1
1 453 . 27 1 1 A 51 51 LEU HA H 50 3.878 3.523 0.355 1
1 463 . 27 1 1 A 51 51 LEU C C 50 178.625 178.711 -0.086 1
1 464 . 27 1 1 A 51 51 LEU CA C 50 55.994 57.240 -1.246 1
1 465 . 27 1 1 A 51 51 LEU CB C 50 40.743 41.492 -0.749 1
1 469 . 27 1 1 A 51 51 LEU N N 50 118.478 121.858 -3.380 1
1 470 . 27 1 1 A 52 52 GLU H H 51 8.042 8.023 0.019 1
1 471 . 27 1 1 A 52 52 GLU HA H 51 4.197 4.004 0.193 1
1 476 . 27 1 1 A 52 52 GLU C C 51 177.629 177.663 -0.034 1
1 477 . 27 1 1 A 52 52 GLU CA C 51 56.141 59.438 -3.297 1
1 478 . 27 1 1 A 52 52 GLU CB C 51 29.162 29.329 -0.167 1
1 480 . 27 1 1 A 52 52 GLU N N 51 115.067 117.979 -2.912 1
1 481 . 27 1 1 A 53 53 PHE H H 52 7.465 8.090 -0.625 1
1 482 . 27 1 1 A 53 53 PHE HA H 52 4.431 4.859 -0.428 1
1 490 . 27 1 1 A 53 53 PHE C C 52 174.325 174.412 -0.087 1
1 491 . 27 1 1 A 53 53 PHE CA C 52 58.986 56.993 1.993 1
1 492 . 27 1 1 A 53 53 PHE CB C 52 40.183 37.261 2.922 1
1 498 . 27 1 1 A 53 53 PHE N N 52 116.768 117.984 -1.216 1
1 499 . 27 1 1 A 54 54 GLU H H 53 7.484 7.872 -0.388 1
1 500 . 27 1 1 A 54 54 GLU HA H 53 4.583 5.072 -0.489 1
1 505 . 27 1 1 A 54 54 GLU C C 53 175.722 175.178 0.544 1
1 506 . 27 1 1 A 54 54 GLU CA C 53 54.248 55.484 -1.236 1
1 507 . 27 1 1 A 54 54 GLU CB C 53 34.409 31.774 2.635 1
1 509 . 27 1 1 A 54 54 GLU N N 53 118.844 122.255 -3.411 1
1 510 . 27 1 1 A 55 55 ASP H H 54 9.008 8.745 0.263 1
1 511 . 27 1 1 A 55 55 ASP HA H 54 4.735 4.864 -0.129 1
1 514 . 27 1 1 A 55 55 ASP C C 54 175.421 175.909 -0.488 1
1 515 . 27 1 1 A 55 55 ASP CA C 54 52.888 53.779 -0.891 1
1 516 . 27 1 1 A 55 55 ASP CB C 54 38.894 40.746 -1.852 1
1 517 . 27 1 1 A 55 55 ASP N N 54 123.654 124.242 -0.588 1
1 518 . 27 1 1 A 56 56 THR H H 55 7.819 7.905 -0.086 1
1 519 . 27 1 1 A 56 56 THR HA H 55 4.574 4.963 -0.389 1
1 524 . 27 1 1 A 56 56 THR C C 55 174.096 174.346 -0.250 1
1 525 . 27 1 1 A 56 56 THR CA C 55 59.172 59.594 -0.422 1
1 526 . 27 1 1 A 56 56 THR CB C 55 71.889 72.471 -0.582 1
1 528 . 27 1 1 A 56 56 THR N N 55 112.015 117.441 -5.426 1
1 529 . 27 1 1 A 57 57 GLU H H 56 8.527 8.778 -0.251 1
1 530 . 27 1 1 A 57 57 GLU HA H 56 4.217 4.395 -0.178 1
1 535 . 27 1 1 A 57 57 GLU C C 56 177.042 175.383 1.659 1
1 536 . 27 1 1 A 57 57 GLU CA C 56 56.869 56.802 0.067 1
1 537 . 27 1 1 A 57 57 GLU CB C 56 29.731 30.476 -0.745 1
1 539 . 27 1 1 A 57 57 GLU N N 56 117.531 118.619 -1.088 1
1 540 . 27 1 1 A 58 58 GLU H H 57 7.587 7.702 -0.115 1
1 541 . 27 1 1 A 58 58 GLU HA H 57 3.941 4.753 -0.812 1
1 546 . 27 1 1 A 58 58 GLU C C 57 176.849 175.840 1.009 1
1 547 . 27 1 1 A 58 58 GLU CA C 57 56.924 55.798 1.126 1
1 548 . 27 1 1 A 58 58 GLU CB C 57 30.251 31.291 -1.040 1
1 550 . 27 1 1 A 58 58 GLU N N 57 119.183 121.373 -2.190 1
1 551 . 27 1 1 A 59 59 ASN H H 58 9.120 8.919 0.201 1
1 552 . 27 1 1 A 59 59 ASN HA H 58 4.922 5.499 -0.577 1
1 557 . 27 1 1 A 59 59 ASN C C 58 174.254 174.682 -0.428 1
1 558 . 27 1 1 A 59 59 ASN CA C 58 51.956 52.482 -0.526 1
1 559 . 27 1 1 A 59 59 ASN CB C 58 37.404 40.047 -2.643 1
1 560 . 27 1 1 A 59 59 ASN N N 58 126.767 123.848 2.919 1
1 562 . 27 1 1 A 60 60 LYS H H 59 5.892 8.852 -2.960 1
1 563 . 27 1 1 A 60 60 LYS HA H 59 3.798 4.755 -0.957 1
1 572 . 27 1 1 A 60 60 LYS C C 59 177.908 177.043 0.865 1
1 573 . 27 1 1 A 60 60 LYS CA C 59 56.623 54.649 1.974 1
1 574 . 27 1 1 A 60 60 LYS CB C 59 32.279 34.692 -2.413 1
1 578 . 27 1 1 A 60 60 LYS N N 59 121.527 122.148 -0.621 1
1 579 . 27 1 1 A 61 61 LEU H H 60 8.473 8.911 -0.438 1
1 580 . 27 1 1 A 61 61 LEU HA H 60 3.891 4.303 -0.412 1
1 590 . 27 1 1 A 61 61 LEU C C 60 179.843 177.879 1.964 1
1 591 . 27 1 1 A 61 61 LEU CA C 60 58.301 56.755 1.546 1
1 592 . 27 1 1 A 61 61 LEU CB C 60 41.305 42.312 -1.007 1
1 596 . 27 1 1 A 61 61 LEU N N 60 125.639 125.812 -0.173 1
1 597 . 27 1 1 A 62 62 ILE H H 61 7.698 7.756 -0.058 1
1 598 . 27 1 1 A 62 62 ILE HA H 61 3.952 3.847 0.105 1
1 608 . 27 1 1 A 62 62 ILE C C 61 175.392 177.141 -1.749 1
1 609 . 27 1 1 A 62 62 ILE CA C 61 61.743 63.253 -1.510 1
1 610 . 27 1 1 A 62 62 ILE CB C 61 39.108 37.671 1.437 1
1 614 . 27 1 1 A 62 62 ILE N N 61 114.111 118.964 -4.853 1
1 615 . 27 1 1 A 63 63 TYR H H 62 7.273 7.648 -0.375 1
1 616 . 27 1 1 A 63 63 TYR HA H 62 4.343 4.126 0.217 1
1 623 . 27 1 1 A 63 63 TYR C C 62 178.264 178.514 -0.250 1
1 624 . 27 1 1 A 63 63 TYR CA C 62 57.231 61.102 -3.871 1
1 625 . 27 1 1 A 63 63 TYR CB C 62 36.332 37.758 -1.426 1
1 630 . 27 1 1 A 63 63 TYR N N 62 117.689 121.290 -3.601 1
1 631 . 27 1 1 A 64 64 THR H H 63 7.747 7.918 -0.171 1
1 632 . 27 1 1 A 64 64 THR HA H 63 4.266 4.225 0.041 1
1 637 . 27 1 1 A 64 64 THR CA C 63 69.362 67.606 1.756 1
1 638 . 27 1 1 A 64 64 THR CB C 63 66.962 67.402 -0.440 1
1 640 . 27 1 1 A 64 64 THR N N 63 113.755 116.205 -2.450 1
1 641 . 27 1 1 A 65 65 PRO HA H 64 4.372 4.382 -0.010 1
1 648 . 27 1 1 A 65 65 PRO C C 64 179.913 179.379 0.534 1
1 649 . 27 1 1 A 65 65 PRO CA C 64 66.011 66.151 -0.140 1
1 650 . 27 1 1 A 65 65 PRO CB C 64 30.642 30.685 -0.043 1
1 653 . 27 1 1 A 66 66 ILE H H 65 7.377 7.383 -0.006 1
1 654 . 27 1 1 A 66 66 ILE HA H 65 3.530 3.916 -0.386 1
1 664 . 27 1 1 A 66 66 ILE C C 65 177.543 178.201 -0.658 1
1 665 . 27 1 1 A 66 66 ILE CA C 65 66.647 64.329 2.318 1
1 666 . 27 1 1 A 66 66 ILE CB C 65 38.029 37.836 0.193 1
1 670 . 27 1 1 A 66 66 ILE N N 65 118.353 116.657 1.696 1
1 671 . 27 1 1 A 67 67 PHE H H 66 8.480 8.525 -0.045 1
1 672 . 27 1 1 A 67 67 PHE HA H 66 4.115 4.281 -0.166 1
1 680 . 27 1 1 A 67 67 PHE C C 66 177.293 178.195 -0.902 1
1 681 . 27 1 1 A 67 67 PHE CA C 66 59.570 61.935 -2.365 1
1 682 . 27 1 1 A 67 67 PHE CB C 66 38.865 39.366 -0.501 1
1 688 . 27 1 1 A 67 67 PHE N N 66 122.420 120.506 1.914 1
1 689 . 27 1 1 A 68 68 ASN H H 67 8.595 8.229 0.366 1
1 690 . 27 1 1 A 68 68 ASN HA H 67 4.211 4.444 -0.233 1
1 695 . 27 1 1 A 68 68 ASN C C 67 178.697 178.111 0.586 1
1 696 . 27 1 1 A 68 68 ASN CA C 67 56.056 56.361 -0.305 1
1 697 . 27 1 1 A 68 68 ASN CB C 67 37.704 38.087 -0.383 1
1 698 . 27 1 1 A 68 68 ASN N N 67 115.573 117.286 -1.713 1
1 700 . 27 1 1 A 69 69 GLU H H 68 8.414 8.076 0.338 1
1 701 . 27 1 1 A 69 69 GLU HA H 68 4.102 4.172 -0.070 1
1 706 . 27 1 1 A 69 69 GLU C C 68 177.880 178.904 -1.024 1
1 707 . 27 1 1 A 69 69 GLU CA C 68 59.399 59.313 0.086 1
1 708 . 27 1 1 A 69 69 GLU CB C 68 29.855 29.267 0.588 1
1 710 . 27 1 1 A 69 69 GLU N N 68 123.510 120.006 3.504 1
1 711 . 27 1 1 A 70 70 TYR H H 69 8.659 7.978 0.681 1
1 712 . 27 1 1 A 70 70 TYR HA H 69 3.362 4.118 -0.756 1
1 719 . 27 1 1 A 70 70 TYR C C 69 178.143 176.832 1.311 1
1 720 . 27 1 1 A 70 70 TYR CA C 69 60.686 61.218 -0.532 1
1 721 . 27 1 1 A 70 70 TYR CB C 69 38.560 38.987 -0.427 1
1 726 . 27 1 1 A 70 70 TYR N N 69 122.130 121.231 0.899 1
1 727 . 27 1 1 A 71 71 ILE H H 70 8.031 7.825 0.206 1
1 728 . 27 1 1 A 71 71 ILE HA H 70 3.265 3.733 -0.468 1
1 738 . 27 1 1 A 71 71 ILE C C 70 178.056 178.176 -0.120 1
1 739 . 27 1 1 A 71 71 ILE CA C 70 63.756 63.968 -0.212 1
1 740 . 27 1 1 A 71 71 ILE CB C 70 37.321 36.468 0.853 1
1 744 . 27 1 1 A 71 71 ILE N N 70 118.906 120.439 -1.533 1
1 745 . 27 1 1 A 72 72 SER H H 71 7.803 7.721 0.082 1
1 746 . 27 1 1 A 72 72 SER HA H 71 4.029 4.246 -0.217 1
1 749 . 27 1 1 A 72 72 SER CA C 71 61.380 61.196 0.184 1
1 750 . 27 1 1 A 72 72 SER CB C 71 63.288 62.797 0.491 1
1 751 . 27 1 1 A 72 72 SER N N 71 113.735 117.248 -3.513 1
1 752 . 27 1 1 A 73 73 LEU H H 72 7.952 7.841 0.111 1
1 753 . 27 1 1 A 73 73 LEU HA H 72 4.418 4.155 0.263 1
1 763 . 27 1 1 A 73 73 LEU C C 72 177.767 178.164 -0.397 1
1 764 . 27 1 1 A 73 73 LEU CA C 72 56.543 57.438 -0.895 1
1 765 . 27 1 1 A 73 73 LEU CB C 72 44.517 41.770 2.747 1
1 769 . 27 1 1 A 73 73 LEU N N 72 119.411 122.404 -2.993 1
1 770 . 27 1 1 A 74 74 VAL H H 73 8.021 7.550 0.471 1
1 771 . 27 1 1 A 74 74 VAL HA H 73 3.532 3.286 0.246 1
1 779 . 27 1 1 A 74 74 VAL C C 73 177.126 178.152 -1.026 1
1 780 . 27 1 1 A 74 74 VAL CA C 73 66.250 66.513 -0.263 1
1 781 . 27 1 1 A 74 74 VAL CB C 73 31.212 30.969 0.243 1
1 784 . 27 1 1 A 74 74 VAL N N 73 118.747 119.255 -0.508 1
1 785 . 27 1 1 A 75 75 GLU H H 74 7.232 8.033 -0.801 1
1 786 . 27 1 1 A 75 75 GLU HA H 74 3.013 4.252 -1.239 1
1 791 . 27 1 1 A 75 75 GLU C C 74 178.804 178.850 -0.046 1
1 792 . 27 1 1 A 75 75 GLU CA C 74 60.536 59.701 0.835 1
1 793 . 27 1 1 A 75 75 GLU CB C 74 27.009 29.128 -2.119 1
1 795 . 27 1 1 A 75 75 GLU N N 74 118.660 119.870 -1.210 1
1 796 . 27 1 1 A 76 76 LYS H H 75 7.051 7.981 -0.930 1
1 797 . 27 1 1 A 76 76 LYS HA H 75 3.765 4.202 -0.437 1
1 806 . 27 1 1 A 76 76 LYS C C 75 177.765 178.278 -0.513 1
1 807 . 27 1 1 A 76 76 LYS CA C 75 58.357 57.914 0.443 1
1 808 . 27 1 1 A 76 76 LYS CB C 75 31.939 32.237 -0.298 1
1 812 . 27 1 1 A 76 76 LYS N N 75 116.112 119.334 -3.222 1
1 813 . 27 1 1 A 77 77 TYR H H 76 7.067 8.088 -1.021 1
1 814 . 27 1 1 A 77 77 TYR HA H 76 4.036 4.204 -0.168 1
1 821 . 27 1 1 A 77 77 TYR C C 76 177.752 176.875 0.877 1
1 822 . 27 1 1 A 77 77 TYR CA C 76 61.820 61.272 0.548 1
1 823 . 27 1 1 A 77 77 TYR CB C 76 38.480 38.755 -0.275 1
1 828 . 27 1 1 A 77 77 TYR N N 76 118.434 122.545 -4.111 1
1 829 . 27 1 1 A 78 78 ILE H H 77 7.554 8.292 -0.738 1
1 830 . 27 1 1 A 78 78 ILE HA H 77 3.159 3.682 -0.523 1
1 840 . 27 1 1 A 78 78 ILE C C 77 177.341 177.804 -0.463 1
1 841 . 27 1 1 A 78 78 ILE CA C 77 65.177 65.065 0.112 1
1 842 . 27 1 1 A 78 78 ILE CB C 77 37.339 36.896 0.443 1
1 846 . 27 1 1 A 78 78 ILE N N 77 117.672 120.992 -3.320 1
1 847 . 27 1 1 A 79 79 GLU H H 78 8.296 8.155 0.141 1
1 848 . 27 1 1 A 79 79 GLU HA H 78 3.557 3.837 -0.280 1
1 853 . 27 1 1 A 79 79 GLU C C 78 177.742 179.039 -1.297 1
1 854 . 27 1 1 A 79 79 GLU CA C 78 60.847 60.090 0.757 1
1 855 . 27 1 1 A 79 79 GLU CB C 78 29.594 29.158 0.436 1
1 857 . 27 1 1 A 79 79 GLU N N 78 118.701 121.377 -2.676 1
1 858 . 27 1 1 A 80 80 GLU H H 79 8.330 8.230 0.100 1
1 859 . 27 1 1 A 80 80 GLU HA H 79 3.774 4.067 -0.293 1
1 864 . 27 1 1 A 80 80 GLU C C 79 179.926 179.124 0.802 1
1 865 . 27 1 1 A 80 80 GLU CA C 79 59.581 58.781 0.800 1
1 866 . 27 1 1 A 80 80 GLU CB C 79 29.062 29.393 -0.331 1
1 868 . 27 1 1 A 80 80 GLU N N 79 116.767 118.581 -1.814 1
1 869 . 27 1 1 A 81 81 GLN H H 80 7.634 7.713 -0.079 1
1 870 . 27 1 1 A 81 81 GLN HA H 80 3.605 3.877 -0.272 1
1 877 . 27 1 1 A 81 81 GLN C C 80 179.681 178.729 0.952 1
1 878 . 27 1 1 A 81 81 GLN CA C 80 57.765 58.603 -0.838 1
1 879 . 27 1 1 A 81 81 GLN CB C 80 28.079 28.087 -0.008 1
1 881 . 27 1 1 A 81 81 GLN N N 80 116.325 118.826 -2.501 1
1 883 . 27 1 1 A 82 82 LEU H H 81 8.156 7.535 0.621 1
1 884 . 27 1 1 A 82 82 LEU HA H 81 3.536 3.796 -0.260 1
1 894 . 27 1 1 A 82 82 LEU C C 81 178.945 179.363 -0.418 1
1 895 . 27 1 1 A 82 82 LEU CA C 81 57.761 56.892 0.869 1
1 896 . 27 1 1 A 82 82 LEU CB C 81 40.961 40.847 0.114 1
1 900 . 27 1 1 A 82 82 LEU N N 81 121.546 120.326 1.220 1
1 901 . 27 1 1 A 83 83 LEU H H 82 8.326 7.864 0.462 1
1 902 . 27 1 1 A 83 83 LEU HA H 82 4.198 4.310 -0.112 1
1 912 . 27 1 1 A 83 83 LEU C C 82 178.631 179.321 -0.690 1
1 913 . 27 1 1 A 83 83 LEU CA C 82 57.016 57.061 -0.045 1
1 914 . 27 1 1 A 83 83 LEU CB C 82 42.182 40.746 1.436 1
1 918 . 27 1 1 A 83 83 LEU N N 82 120.426 119.274 1.152 1
1 919 . 27 1 1 A 84 84 GLN H H 83 6.992 7.602 -0.610 1
1 920 . 27 1 1 A 84 84 GLN HA H 83 3.877 3.982 -0.105 1
1 927 . 27 1 1 A 84 84 GLN C C 83 177.008 177.039 -0.031 1
1 928 . 27 1 1 A 84 84 GLN CA C 83 57.543 58.626 -1.083 1
1 929 . 27 1 1 A 84 84 GLN CB C 83 28.688 28.486 0.202 1
1 931 . 27 1 1 A 84 84 GLN N N 83 114.001 117.291 -3.290 1
1 933 . 27 1 1 A 85 85 ARG H H 84 7.072 7.407 -0.335 1
1 934 . 27 1 1 A 85 85 ARG HA H 84 4.047 4.375 -0.328 1
1 942 . 27 1 1 A 85 85 ARG C C 84 175.999 175.445 0.554 1
1 943 . 27 1 1 A 85 85 ARG CA C 84 56.764 55.920 0.844 1
1 944 . 27 1 1 A 85 85 ARG CB C 84 32.044 32.517 -0.473 1
1 947 . 27 1 1 A 85 85 ARG N N 84 115.827 116.234 -0.407 1
1 949 . 27 1 1 A 86 86 ILE H H 85 8.238 7.665 0.573 1
1 950 . 27 1 1 A 86 86 ILE HA H 85 4.389 4.549 -0.160 1
1 960 . 27 1 1 A 86 86 ILE CA C 85 58.007 57.888 0.119 1
1 961 . 27 1 1 A 86 86 ILE CB C 85 39.604 38.907 0.697 1
1 965 . 27 1 1 A 86 86 ILE N N 85 119.285 119.967 -0.682 1
1 966 . 27 1 1 A 87 87 PRO HA H 86 4.392 4.571 -0.179 1
1 973 . 27 1 1 A 87 87 PRO C C 86 177.622 176.482 1.140 1
1 974 . 27 1 1 A 87 87 PRO CA C 86 64.665 64.245 0.420 1
1 975 . 27 1 1 A 87 87 PRO CB C 86 32.020 31.657 0.363 1
1 978 . 27 1 1 A 88 88 GLU H H 87 8.312 8.198 0.114 1
1 979 . 27 1 1 A 88 88 GLU HA H 87 4.208 4.545 -0.337 1
1 984 . 27 1 1 A 88 88 GLU C C 87 175.554 175.769 -0.215 1
1 985 . 27 1 1 A 88 88 GLU CA C 87 56.045 56.257 -0.212 1
1 986 . 27 1 1 A 88 88 GLU CB C 87 28.654 30.303 -1.649 1
1 988 . 27 1 1 A 88 88 GLU N N 87 114.256 116.909 -2.653 1
1 989 . 27 1 1 A 89 89 PHE H H 88 7.946 7.564 0.382 1
1 990 . 27 1 1 A 89 89 PHE HA H 88 3.993 4.560 -0.567 1
1 998 . 27 1 1 A 89 89 PHE C C 88 173.460 174.771 -1.311 1
1 999 . 27 1 1 A 89 89 PHE CA C 88 60.119 58.967 1.152 1
1 1000 . 27 1 1 A 89 89 PHE CB C 88 39.994 39.911 0.083 1
1 1006 . 27 1 1 A 89 89 PHE N N 88 121.550 123.132 -1.582 1
1 1007 . 27 1 1 A 90 90 ASN H H 89 7.266 7.724 -0.458 1
1 1008 . 27 1 1 A 90 90 ASN HA H 89 4.454 4.967 -0.513 1
1 1013 . 27 1 1 A 90 90 ASN C C 89 173.921 175.074 -1.153 1
1 1014 . 27 1 1 A 90 90 ASN CA C 89 51.839 51.565 0.274 1
1 1015 . 27 1 1 A 90 90 ASN CB C 89 40.674 39.611 1.063 1
1 1016 . 27 1 1 A 90 90 ASN N N 89 125.344 124.913 0.431 1
1 1018 . 27 1 1 A 91 91 MET H H 90 8.968 8.775 0.193 1
1 1019 . 27 1 1 A 91 91 MET HA H 90 4.049 4.310 -0.261 1
1 1027 . 27 1 1 A 91 91 MET C C 90 177.475 177.718 -0.243 1
1 1028 . 27 1 1 A 91 91 MET CA C 90 57.758 57.726 0.032 1
1 1029 . 27 1 1 A 91 91 MET CB C 90 32.250 32.538 -0.288 1
1 1032 . 27 1 1 A 91 91 MET N N 90 127.052 125.545 1.507 1
1 1033 . 27 1 1 A 92 92 ALA H H 91 8.292 7.651 0.641 1
1 1034 . 27 1 1 A 92 92 ALA HA H 91 4.059 4.141 -0.082 1
1 1038 . 27 1 1 A 92 92 ALA C C 91 180.412 179.696 0.716 1
1 1039 . 27 1 1 A 92 92 ALA CA C 91 55.368 54.858 0.510 1
1 1040 . 27 1 1 A 92 92 ALA CB C 91 17.527 18.782 -1.255 1
1 1041 . 27 1 1 A 92 92 ALA N N 91 123.752 120.931 2.821 1
1 1042 . 27 1 1 A 93 93 ALA H H 92 7.931 7.944 -0.013 1
1 1043 . 27 1 1 A 93 93 ALA HA H 92 4.054 4.111 -0.057 1
1 1047 . 27 1 1 A 93 93 ALA C C 92 180.482 179.829 0.653 1
1 1048 . 27 1 1 A 93 93 ALA CA C 92 54.614 54.878 -0.264 1
1 1049 . 27 1 1 A 93 93 ALA CB C 92 18.098 18.096 0.002 1
1 1050 . 27 1 1 A 93 93 ALA N N 92 121.158 119.949 1.209 1
1 1051 . 27 1 1 A 94 94 PHE H H 93 8.110 7.782 0.328 1
1 1052 . 27 1 1 A 94 94 PHE HA H 93 4.304 4.179 0.125 1
1 1060 . 27 1 1 A 94 94 PHE C C 93 177.350 177.228 0.122 1
1 1061 . 27 1 1 A 94 94 PHE CA C 93 61.641 61.470 0.171 1
1 1062 . 27 1 1 A 94 94 PHE CB C 93 40.014 39.380 0.634 1
1 1068 . 27 1 1 A 94 94 PHE N N 93 119.807 120.024 -0.217 1
1 1069 . 27 1 1 A 95 95 THR H H 94 8.726 8.118 0.608 1
1 1070 . 27 1 1 A 95 95 THR HA H 94 3.569 3.946 -0.377 1
1 1075 . 27 1 1 A 95 95 THR C C 94 176.932 176.849 0.083 1
1 1076 . 27 1 1 A 95 95 THR CA C 94 66.833 65.558 1.275 1
1 1077 . 27 1 1 A 95 95 THR CB C 94 68.445 68.282 0.163 1
1 1079 . 27 1 1 A 95 95 THR N N 94 113.074 112.112 0.962 1
1 1080 . 27 1 1 A 96 96 THR H H 95 7.657 7.777 -0.120 1
1 1081 . 27 1 1 A 96 96 THR HA H 95 3.945 4.053 -0.108 1
1 1086 . 27 1 1 A 96 96 THR C C 95 176.386 176.310 0.076 1
1 1087 . 27 1 1 A 96 96 THR CA C 95 66.550 66.012 0.538 1
1 1088 . 27 1 1 A 96 96 THR CB C 95 68.583 68.808 -0.225 1
1 1090 . 27 1 1 A 96 96 THR N N 95 117.927 116.502 1.425 1
1 1091 . 27 1 1 A 97 97 THR H H 96 7.699 7.742 -0.043 1
1 1092 . 27 1 1 A 97 97 THR HA H 96 3.905 4.094 -0.189 1
1 1097 . 27 1 1 A 97 97 THR C C 96 176.572 176.154 0.418 1
1 1098 . 27 1 1 A 97 97 THR CA C 96 65.979 66.226 -0.247 1
1 1099 . 27 1 1 A 97 97 THR CB C 96 68.553 68.409 0.144 1
1 1101 . 27 1 1 A 97 97 THR N N 96 118.518 116.422 2.096 1
1 1102 . 27 1 1 A 98 98 LEU H H 97 8.304 8.064 0.240 1
1 1103 . 27 1 1 A 98 98 LEU HA H 97 3.725 3.757 -0.032 1
1 1113 . 27 1 1 A 98 98 LEU C C 97 178.490 178.458 0.032 1
1 1114 . 27 1 1 A 98 98 LEU CA C 97 58.517 57.907 0.610 1
1 1115 . 27 1 1 A 98 98 LEU CB C 97 41.697 41.009 0.688 1
1 1119 . 27 1 1 A 98 98 LEU N N 97 122.882 121.987 0.895 1
1 1120 . 27 1 1 A 99 99 GLN H H 98 7.639 7.926 -0.287 1
1 1121 . 27 1 1 A 99 99 GLN HA H 98 3.927 4.137 -0.210 1
1 1128 . 27 1 1 A 99 99 GLN C C 98 178.068 177.972 0.096 1
1 1129 . 27 1 1 A 99 99 GLN CA C 98 58.735 59.359 -0.624 1
1 1130 . 27 1 1 A 99 99 GLN CB C 98 27.986 28.343 -0.357 1
1 1132 . 27 1 1 A 99 99 GLN N N 98 114.302 118.573 -4.271 1
1 1134 . 27 1 1 A 100 100 HIS H H 99 7.575 8.008 -0.433 1
1 1135 . 27 1 1 A 100 100 HIS HA H 99 4.524 4.524 0.000 1
1 1139 . 27 1 1 A 100 100 HIS C C 99 174.789 177.434 -2.645 1
1 1140 . 27 1 1 A 100 100 HIS CA C 99 56.154 57.289 -1.135 1
1 1141 . 27 1 1 A 100 100 HIS CB C 99 28.946 30.002 -1.056 1
1 1143 . 27 1 1 A 100 100 HIS N N 99 114.778 116.913 -2.135 1
1 1144 . 27 1 1 A 101 101 HIS H H 100 7.773 7.629 0.144 1
1 1145 . 27 1 1 A 101 101 HIS HA H 100 4.704 3.956 0.748 1
1 1149 . 27 1 1 A 101 101 HIS C C 100 174.818 176.910 -2.092 1
1 1150 . 27 1 1 A 101 101 HIS CA C 100 54.830 58.007 -3.177 1
1 1151 . 27 1 1 A 101 101 HIS CB C 100 29.749 29.964 -0.215 1
1 1153 . 27 1 1 A 101 101 HIS N N 100 117.397 119.917 -2.520 1
1 1154 . 27 1 1 A 102 102 LYS H H 101 7.324 8.068 -0.744 1
1 1155 . 27 1 1 A 102 102 LYS HA H 101 3.611 4.089 -0.478 1
1 1164 . 27 1 1 A 102 102 LYS C C 101 176.823 178.813 -1.990 1
1 1165 . 27 1 1 A 102 102 LYS CA C 101 59.915 58.775 1.140 1
1 1166 . 27 1 1 A 102 102 LYS CB C 101 32.825 32.068 0.757 1
1 1170 . 27 1 1 A 102 102 LYS N N 101 120.533 118.852 1.681 1
1 1171 . 27 1 1 A 103 103 ASP H H 102 8.361 7.820 0.541 1
1 1172 . 27 1 1 A 103 103 ASP HA H 102 4.421 4.462 -0.041 1
1 1175 . 27 1 1 A 103 103 ASP C C 102 176.793 177.928 -1.135 1
1 1176 . 27 1 1 A 103 103 ASP CA C 102 55.500 56.102 -0.602 1
1 1177 . 27 1 1 A 103 103 ASP CB C 102 40.178 40.763 -0.585 1
1 1178 . 27 1 1 A 103 103 ASP N N 102 114.814 119.417 -4.603 1
1 1179 . 27 1 1 A 104 104 GLU H H 103 7.858 8.033 -0.175 1
1 1180 . 27 1 1 A 104 104 GLU HA H 103 4.339 4.290 0.049 1
1 1183 . 27 1 1 A 104 104 GLU C C 103 175.777 176.299 -0.522 1
1 1184 . 27 1 1 A 104 104 GLU CA C 103 56.356 57.892 -1.536 1
1 1185 . 27 1 1 A 104 104 GLU CB C 103 31.293 30.576 0.717 1
1 1186 . 27 1 1 A 104 104 GLU N N 103 116.826 119.038 -2.212 1
1 1187 . 27 1 1 A 105 105 VAL H H 104 7.201 7.259 -0.058 1
1 1188 . 27 1 1 A 105 105 VAL HA H 104 4.296 4.253 0.043 1
1 1196 . 27 1 1 A 105 105 VAL C C 104 174.482 175.524 -1.042 1
1 1197 . 27 1 1 A 105 105 VAL CA C 104 60.370 61.465 -1.095 1
1 1198 . 27 1 1 A 105 105 VAL CB C 104 34.341 33.672 0.669 1
1 1201 . 27 1 1 A 105 105 VAL N N 104 116.422 116.265 0.157 1
1 1202 . 27 1 1 A 106 106 ALA H H 105 8.487 8.644 -0.157 1
1 1203 . 27 1 1 A 106 106 ALA HA H 105 4.172 4.469 -0.297 1
1 1207 . 27 1 1 A 106 106 ALA C C 105 179.030 178.288 0.742 1
1 1208 . 27 1 1 A 106 106 ALA CA C 105 52.966 51.620 1.346 1
1 1209 . 27 1 1 A 106 106 ALA CB C 105 19.371 18.777 0.594 1
1 1210 . 27 1 1 A 106 106 ALA N N 105 128.313 125.223 3.090 1
1 1211 . 27 1 1 A 107 107 GLY H H 106 8.738 8.742 -0.004 1
1 1212 . 27 1 1 A 107 107 GLY HA2 H 106 3.773 3.847 -0.074 1
1 1213 . 27 1 1 A 107 107 GLY HA3 H 106 3.998 3.910 0.088 1
1 1214 . 27 1 1 A 107 107 GLY C C 106 174.958 175.917 -0.959 1
1 1215 . 27 1 1 A 107 107 GLY CA C 106 47.449 47.406 0.043 1
1 1216 . 27 1 1 A 107 107 GLY N N 106 110.612 110.581 0.031 1
1 1217 . 27 1 1 A 108 108 ASP H H 107 8.535 8.457 0.078 1
1 1218 . 27 1 1 A 108 108 ASP HA H 107 4.333 4.703 -0.370 1
1 1221 . 27 1 1 A 108 108 ASP C C 107 179.133 178.214 0.919 1
1 1222 . 27 1 1 A 108 108 ASP CA C 107 56.721 56.799 -0.078 1
1 1223 . 27 1 1 A 108 108 ASP CB C 107 39.336 39.893 -0.557 1
1 1224 . 27 1 1 A 108 108 ASP N N 107 117.474 122.046 -4.572 1
1 1225 . 27 1 1 A 109 109 ILE H H 108 7.459 7.860 -0.401 1
1 1226 . 27 1 1 A 109 109 ILE HA H 108 3.688 3.877 -0.189 1
1 1236 . 27 1 1 A 109 109 ILE C C 108 176.735 178.525 -1.790 1
1 1237 . 27 1 1 A 109 109 ILE CA C 108 63.474 65.284 -1.810 1
1 1238 . 27 1 1 A 109 109 ILE CB C 108 37.340 37.784 -0.444 1
1 1242 . 27 1 1 A 109 109 ILE N N 108 119.609 120.921 -1.312 1
1 1243 . 27 1 1 A 110 110 PHE H H 109 7.920 8.301 -0.381 1
1 1244 . 27 1 1 A 110 110 PHE HA H 109 3.759 4.085 -0.326 1
1 1252 . 27 1 1 A 110 110 PHE C C 109 177.132 177.315 -0.183 1
1 1253 . 27 1 1 A 110 110 PHE CA C 109 62.766 61.194 1.572 1
1 1254 . 27 1 1 A 110 110 PHE CB C 109 39.752 39.264 0.488 1
1 1260 . 27 1 1 A 110 110 PHE N N 109 120.906 120.275 0.631 1
1 1261 . 27 1 1 A 111 111 ASP H H 110 8.639 8.262 0.377 1
1 1262 . 27 1 1 A 111 111 ASP HA H 110 4.216 4.131 0.085 1
1 1265 . 27 1 1 A 111 111 ASP C C 110 178.900 178.625 0.275 1
1 1266 . 27 1 1 A 111 111 ASP CA C 110 57.105 57.175 -0.070 1
1 1267 . 27 1 1 A 111 111 ASP CB C 110 39.697 40.655 -0.958 1
1 1268 . 27 1 1 A 111 111 ASP N N 110 117.124 118.472 -1.348 1
1 1269 . 27 1 1 A 112 112 MET H H 111 7.331 7.599 -0.268 1
1 1270 . 27 1 1 A 112 112 MET HA H 111 4.081 4.148 -0.067 1
1 1278 . 27 1 1 A 112 112 MET C C 111 179.052 178.182 0.870 1
1 1279 . 27 1 1 A 112 112 MET CA C 111 58.202 58.128 0.074 1
1 1280 . 27 1 1 A 112 112 MET CB C 111 31.827 32.450 -0.623 1
1 1283 . 27 1 1 A 112 112 MET N N 111 118.061 119.505 -1.444 1
1 1284 . 27 1 1 A 113 113 LEU H H 112 8.001 8.101 -0.100 1
1 1285 . 27 1 1 A 113 113 LEU HA H 112 3.723 3.660 0.063 1
1 1295 . 27 1 1 A 113 113 LEU C C 112 179.747 178.879 0.868 1
1 1296 . 27 1 1 A 113 113 LEU CA C 112 57.371 57.512 -0.141 1
1 1297 . 27 1 1 A 113 113 LEU CB C 112 40.671 41.127 -0.456 1
1 1301 . 27 1 1 A 113 113 LEU N N 112 120.426 119.680 0.746 1
1 1302 . 27 1 1 A 114 114 LEU H H 113 7.744 7.478 0.266 1
1 1303 . 27 1 1 A 114 114 LEU HA H 113 4.007 3.663 0.344 1
1 1313 . 27 1 1 A 114 114 LEU C C 113 179.358 178.620 0.738 1
1 1314 . 27 1 1 A 114 114 LEU CA C 113 57.202 57.456 -0.254 1
1 1315 . 27 1 1 A 114 114 LEU CB C 113 41.727 41.144 0.583 1
1 1319 . 27 1 1 A 114 114 LEU N N 113 119.584 118.404 1.180 1
1 1320 . 27 1 1 A 115 115 THR H H 114 7.353 7.651 -0.298 1
1 1321 . 27 1 1 A 115 115 THR HA H 114 4.071 4.130 -0.059 1
1 1327 . 27 1 1 A 115 115 THR C C 114 173.591 176.761 -3.170 1
1 1328 . 27 1 1 A 115 115 THR CA C 114 65.332 64.677 0.655 1
1 1329 . 27 1 1 A 115 115 THR CB C 114 70.319 68.588 1.731 1
1 1331 . 27 1 1 A 115 115 THR N N 114 107.535 110.497 -2.962 1
1 1332 . 27 1 1 A 116 116 PHE H H 115 6.979 7.944 -0.965 1
1 1333 . 27 1 1 A 116 116 PHE HA H 115 5.022 4.362 0.660 1
1 1341 . 27 1 1 A 116 116 PHE C C 115 176.488 176.326 0.162 1
1 1342 . 27 1 1 A 116 116 PHE CA C 115 55.911 60.880 -4.969 1
1 1343 . 27 1 1 A 116 116 PHE CB C 115 38.521 39.284 -0.763 1
1 1349 . 27 1 1 A 116 116 PHE N N 115 112.366 120.269 -7.903 1
1 1350 . 27 1 1 A 117 117 THR H H 116 7.564 7.876 -0.312 1
1 1351 . 27 1 1 A 117 117 THR HA H 116 4.626 4.967 -0.341 1
1 1356 . 27 1 1 A 117 117 THR C C 116 174.085 173.907 0.178 1
1 1357 . 27 1 1 A 117 117 THR CA C 116 61.636 61.640 -0.004 1
1 1358 . 27 1 1 A 117 117 THR CB C 116 70.915 71.713 -0.798 1
1 1360 . 27 1 1 A 117 117 THR N N 116 105.498 112.483 -6.985 1
1 1361 . 27 1 1 A 118 118 ASP H H 117 8.270 7.978 0.292 1
1 1362 . 27 1 1 A 118 118 ASP HA H 117 4.955 4.725 0.230 1
1 1365 . 27 1 1 A 118 118 ASP C C 117 176.328 176.143 0.185 1
1 1366 . 27 1 1 A 118 118 ASP CA C 117 53.417 52.581 0.836 1
1 1367 . 27 1 1 A 118 118 ASP CB C 117 43.388 40.487 2.901 1
1 1368 . 27 1 1 A 118 118 ASP N N 117 124.409 122.531 1.878 1
1 1369 . 27 1 1 A 119 119 PHE H H 118 8.973 8.966 0.007 1
1 1370 . 27 1 1 A 119 119 PHE HA H 118 3.506 4.139 -0.633 1
1 1378 . 27 1 1 A 119 119 PHE CA C 118 61.490 61.285 0.205 1
1 1379 . 27 1 1 A 119 119 PHE CB C 118 39.246 39.419 -0.173 1
1 1385 . 27 1 1 A 119 119 PHE N N 118 126.688 126.483 0.205 1
1 1386 . 27 1 1 A 120 120 LEU H H 119 8.099 8.217 -0.118 1
1 1387 . 27 1 1 A 120 120 LEU HA H 119 3.842 4.061 -0.219 1
1 1397 . 27 1 1 A 120 120 LEU C C 119 179.601 178.500 1.101 1
1 1398 . 27 1 1 A 120 120 LEU CA C 119 58.174 58.069 0.105 1
1 1399 . 27 1 1 A 120 120 LEU CB C 119 40.315 41.452 -1.137 1
1 1403 . 27 1 1 A 120 120 LEU N N 119 117.930 120.424 -2.494 1
1 1404 . 27 1 1 A 121 121 ALA H H 120 7.729 7.940 -0.211 1
1 1405 . 27 1 1 A 121 121 ALA HA H 120 3.996 4.074 -0.078 1
1 1409 . 27 1 1 A 121 121 ALA C C 120 180.995 179.615 1.380 1
1 1410 . 27 1 1 A 121 121 ALA CA C 120 54.832 54.676 0.156 1
1 1411 . 27 1 1 A 121 121 ALA CB C 120 17.706 18.168 -0.462 1
1 1412 . 27 1 1 A 121 121 ALA N N 120 123.195 120.876 2.319 1
1 1413 . 27 1 1 A 122 122 PHE H H 121 7.943 7.874 0.069 1
1 1414 . 27 1 1 A 122 122 PHE HA H 121 3.887 3.772 0.115 1
1 1419 . 27 1 1 A 122 122 PHE C C 121 175.410 176.941 -1.531 1
1 1420 . 27 1 1 A 122 122 PHE CA C 121 61.075 60.717 0.358 1
1 1421 . 27 1 1 A 122 122 PHE CB C 121 38.115 38.961 -0.846 1
1 1424 . 27 1 1 A 122 122 PHE N N 121 121.798 119.919 1.879 1
1 1425 . 27 1 1 A 123 123 LYS H H 122 8.468 7.781 0.687 1
1 1426 . 27 1 1 A 123 123 LYS HA H 122 3.077 3.727 -0.650 1
1 1435 . 27 1 1 A 123 123 LYS C C 122 178.453 178.212 0.241 1
1 1436 . 27 1 1 A 123 123 LYS CA C 122 59.855 59.715 0.140 1
1 1437 . 27 1 1 A 123 123 LYS CB C 122 32.374 31.820 0.554 1
1 1441 . 27 1 1 A 123 123 LYS N N 122 120.614 118.792 1.822 1
1 1442 . 27 1 1 A 124 124 GLU H H 123 8.100 7.849 0.251 1
1 1443 . 27 1 1 A 124 124 GLU HA H 123 3.652 4.059 -0.407 1
1 1448 . 27 1 1 A 124 124 GLU C C 123 177.743 178.604 -0.861 1
1 1449 . 27 1 1 A 124 124 GLU CA C 123 59.406 59.100 0.306 1
1 1450 . 27 1 1 A 124 124 GLU CB C 123 28.811 29.110 -0.299 1
1 1452 . 27 1 1 A 124 124 GLU N N 123 117.404 118.884 -1.480 1
1 1453 . 27 1 1 A 125 125 MET H H 124 7.537 7.545 -0.008 1
1 1454 . 27 1 1 A 125 125 MET HA H 124 3.860 3.953 -0.093 1
1 1462 . 27 1 1 A 125 125 MET C C 124 179.522 178.345 1.177 1
1 1463 . 27 1 1 A 125 125 MET CA C 124 58.832 58.301 0.531 1
1 1464 . 27 1 1 A 125 125 MET CB C 124 31.765 31.447 0.318 1
1 1467 . 27 1 1 A 125 125 MET N N 124 119.413 119.092 0.321 1
1 1468 . 27 1 1 A 126 126 PHE H H 125 7.148 7.458 -0.310 1
1 1469 . 27 1 1 A 126 126 PHE HA H 125 3.633 4.220 -0.587 1
1 1476 . 27 1 1 A 126 126 PHE C C 125 178.994 178.343 0.651 1
1 1477 . 27 1 1 A 126 126 PHE CA C 125 63.148 61.135 2.013 1
1 1478 . 27 1 1 A 126 126 PHE CB C 125 39.830 38.475 1.355 1
1 1483 . 27 1 1 A 126 126 PHE N N 125 120.013 118.454 1.559 1
1 1484 . 27 1 1 A 127 127 LEU H H 126 8.369 8.609 -0.240 1
1 1485 . 27 1 1 A 127 127 LEU HA H 126 3.972 4.040 -0.068 1
1 1495 . 27 1 1 A 127 127 LEU C C 126 180.621 179.261 1.360 1
1 1496 . 27 1 1 A 127 127 LEU CA C 126 57.944 57.697 0.247 1
1 1497 . 27 1 1 A 127 127 LEU CB C 126 40.543 41.025 -0.482 1
1 1501 . 27 1 1 A 127 127 LEU N N 126 119.692 119.677 0.015 1
1 1502 . 27 1 1 A 128 128 ASP H H 127 8.578 8.010 0.568 1
1 1503 . 27 1 1 A 128 128 ASP HA H 127 4.308 4.341 -0.033 1
1 1506 . 27 1 1 A 128 128 ASP C C 127 178.254 178.223 0.031 1
1 1507 . 27 1 1 A 128 128 ASP CA C 127 56.964 57.132 -0.168 1
1 1508 . 27 1 1 A 128 128 ASP CB C 127 39.735 40.957 -1.222 1
1 1509 . 27 1 1 A 128 128 ASP N N 127 121.926 119.593 2.333 1
1 1510 . 27 1 1 A 129 129 TYR H H 128 7.710 8.033 -0.323 1
1 1511 . 27 1 1 A 129 129 TYR HA H 128 3.908 3.997 -0.089 1
1 1518 . 27 1 1 A 129 129 TYR C C 128 177.633 177.531 0.102 1
1 1519 . 27 1 1 A 129 129 TYR CA C 128 61.796 61.160 0.636 1
1 1520 . 27 1 1 A 129 129 TYR CB C 128 39.372 38.341 1.031 1
1 1525 . 27 1 1 A 129 129 TYR N N 128 122.548 120.308 2.240 1
1 1526 . 27 1 1 A 130 130 ARG H H 129 8.622 8.555 0.067 1
1 1527 . 27 1 1 A 130 130 ARG HA H 129 3.722 3.898 -0.176 1
1 1535 . 27 1 1 A 130 130 ARG CA C 129 60.084 59.706 0.378 1
1 1536 . 27 1 1 A 130 130 ARG CB C 129 29.902 30.050 -0.148 1
1 1539 . 27 1 1 A 130 130 ARG N N 129 118.302 119.347 -1.045 1
1 1541 . 27 1 1 A 131 131 ALA H H 130 7.936 7.969 -0.033 1
1 1542 . 27 1 1 A 131 131 ALA HA H 130 3.997 4.120 -0.123 1
1 1546 . 27 1 1 A 131 131 ALA C C 130 180.456 179.930 0.526 1
1 1547 . 27 1 1 A 131 131 ALA CA C 130 55.133 55.033 0.100 1
1 1548 . 27 1 1 A 131 131 ALA CB C 130 17.750 18.283 -0.533 1
1 1549 . 27 1 1 A 131 131 ALA N N 130 119.788 120.385 -0.597 1
1 1550 . 27 1 1 A 132 132 GLU H H 131 7.622 7.774 -0.152 1
1 1551 . 27 1 1 A 132 132 GLU HA H 131 3.862 3.986 -0.124 1
1 1556 . 27 1 1 A 132 132 GLU C C 131 179.528 179.052 0.476 1
1 1557 . 27 1 1 A 132 132 GLU CA C 131 58.849 59.053 -0.204 1
1 1558 . 27 1 1 A 132 132 GLU CB C 131 28.930 29.168 -0.238 1
1 1560 . 27 1 1 A 132 132 GLU N N 131 118.428 118.854 -0.426 1
1 1561 . 27 1 1 A 133 133 LYS H H 132 7.853 7.537 0.316 1
1 1562 . 27 1 1 A 133 133 LYS HA H 132 3.722 3.990 -0.268 1
1 1571 . 27 1 1 A 133 133 LYS C C 132 175.725 178.599 -2.874 1
1 1572 . 27 1 1 A 133 133 LYS CA C 132 57.544 58.898 -1.354 1
1 1573 . 27 1 1 A 133 133 LYS CB C 132 31.770 31.856 -0.086 1
1 1577 . 27 1 1 A 133 133 LYS N N 132 119.473 118.855 0.618 1
1 1578 . 27 1 1 A 134 134 GLU H H 133 8.151 7.870 0.281 1
1 1579 . 27 1 1 A 134 134 GLU HA H 133 4.161 4.220 -0.059 1
1 1584 . 27 1 1 A 134 134 GLU C C 133 177.453 178.339 -0.886 1
1 1585 . 27 1 1 A 134 134 GLU CA C 133 57.222 58.018 -0.796 1
1 1586 . 27 1 1 A 134 134 GLU CB C 133 30.091 29.411 0.680 1
1 1588 . 27 1 1 A 134 134 GLU N N 133 116.525 118.345 -1.820 1
1 1589 . 27 1 1 A 135 135 GLY H H 134 7.702 8.094 -0.392 1
1 1590 . 27 1 1 A 135 135 GLY HA2 H 134 3.896 3.947 -0.051 1
1 1591 . 27 1 1 A 135 135 GLY HA3 H 134 3.897 3.955 -0.058 1
1 1592 . 27 1 1 A 135 135 GLY C C 134 174.538 173.948 0.590 1
1 1593 . 27 1 1 A 135 135 GLY CA C 134 45.975 45.894 0.081 1
1 1594 . 27 1 1 A 135 135 GLY N N 134 107.924 108.451 -0.527 1
1 1595 . 27 1 1 A 136 136 ARG H H 135 8.045 7.784 0.261 1
1 1596 . 27 1 1 A 136 136 ARG HA H 135 4.323 4.741 -0.418 1
1 1604 . 27 1 1 A 136 136 ARG C C 135 175.864 175.685 0.179 1
1 1605 . 27 1 1 A 136 136 ARG CA C 135 56.016 55.035 0.981 1
1 1606 . 27 1 1 A 136 136 ARG CB C 135 30.987 32.020 -1.033 1
1 1609 . 27 1 1 A 136 136 ARG N N 135 119.708 119.183 0.525 1
1 1 . 28 1 1 A 14 14 PHE CA C 13 58.199 60.277 -2.078 1
1 2 . 28 1 1 A 14 14 PHE CB C 13 39.717 38.776 0.941 1
1 3 . 28 1 1 A 15 15 SER H H 14 8.299 8.157 0.142 1
1 4 . 28 1 1 A 15 15 SER HA H 14 4.359 4.862 -0.503 1
1 7 . 28 1 1 A 15 15 SER CA C 14 58.249 56.917 1.332 1
1 8 . 28 1 1 A 15 15 SER CB C 14 63.936 66.798 -2.862 1
1 9 . 28 1 1 A 15 15 SER N N 14 117.379 111.233 6.146 1
1 10 . 28 1 1 A 16 16 SER H H 15 8.255 8.531 -0.276 1
1 11 . 28 1 1 A 16 16 SER HA H 15 3.729 4.861 -1.132 1
1 14 . 28 1 1 A 16 16 SER CA C 15 58.224 57.671 0.553 1
1 15 . 28 1 1 A 16 16 SER CB C 15 63.886 65.401 -1.515 1
1 16 . 28 1 1 A 16 16 SER N N 15 117.694 114.633 3.061 1
1 17 . 28 1 1 A 17 17 ALA H H 16 8.333 8.272 0.061 1
1 18 . 28 1 1 A 17 17 ALA HA H 16 4.252 4.177 0.075 1
1 22 . 28 1 1 A 17 17 ALA CA C 16 53.377 54.315 -0.938 1
1 23 . 28 1 1 A 17 17 ALA CB C 16 18.896 18.648 0.248 1
1 24 . 28 1 1 A 17 17 ALA N N 16 125.462 125.161 0.301 1
1 25 . 28 1 1 A 18 18 SER H H 17 8.219 8.342 -0.123 1
1 26 . 28 1 1 A 18 18 SER HA H 17 4.332 4.738 -0.406 1
1 29 . 28 1 1 A 18 18 SER CA C 17 59.105 57.002 2.103 1
1 30 . 28 1 1 A 18 18 SER CB C 17 63.592 63.952 -0.360 1
1 31 . 28 1 1 A 18 18 SER N N 17 114.821 112.758 2.063 1
1 32 . 28 1 1 A 19 19 ASP H H 18 8.309 8.354 -0.045 1
1 33 . 28 1 1 A 19 19 ASP HA H 18 4.554 5.057 -0.503 1
1 36 . 28 1 1 A 19 19 ASP C C 18 176.528 176.972 -0.444 1
1 37 . 28 1 1 A 19 19 ASP CA C 18 55.272 54.462 0.810 1
1 38 . 28 1 1 A 19 19 ASP CB C 18 40.883 42.661 -1.778 1
1 39 . 28 1 1 A 19 19 ASP N N 18 123.367 121.444 1.923 1
1 40 . 28 1 1 A 20 20 ALA H H 19 8.133 8.563 -0.430 1
1 41 . 28 1 1 A 20 20 ALA HA H 19 4.170 4.104 0.066 1
1 45 . 28 1 1 A 20 20 ALA C C 19 179.857 179.034 0.823 1
1 46 . 28 1 1 A 20 20 ALA CA C 19 54.341 55.530 -1.189 1
1 47 . 28 1 1 A 20 20 ALA CB C 19 18.660 18.608 0.052 1
1 48 . 28 1 1 A 20 20 ALA N N 19 123.350 123.024 0.326 1
1 49 . 28 1 1 A 21 21 GLU H H 20 8.140 8.078 0.062 1
1 50 . 28 1 1 A 21 21 GLU HA H 20 4.128 4.101 0.027 1
1 55 . 28 1 1 A 21 21 GLU C C 20 177.675 178.701 -1.026 1
1 56 . 28 1 1 A 21 21 GLU CA C 20 58.520 59.399 -0.879 1
1 57 . 28 1 1 A 21 21 GLU CB C 20 29.765 29.633 0.132 1
1 59 . 28 1 1 A 21 21 GLU N N 20 119.063 119.320 -0.257 1
1 60 . 28 1 1 A 22 22 PHE H H 21 8.009 8.157 -0.148 1
1 61 . 28 1 1 A 22 22 PHE HA H 21 4.123 4.290 -0.167 1
1 68 . 28 1 1 A 22 22 PHE C C 21 176.410 177.499 -1.089 1
1 69 . 28 1 1 A 22 22 PHE CA C 21 62.202 61.263 0.939 1
1 70 . 28 1 1 A 22 22 PHE CB C 21 39.223 39.170 0.053 1
1 75 . 28 1 1 A 22 22 PHE N N 21 121.211 120.897 0.314 1
1 76 . 28 1 1 A 23 23 ASP H H 22 8.261 8.516 -0.255 1
1 77 . 28 1 1 A 23 23 ASP HA H 22 4.041 4.499 -0.458 1
1 80 . 28 1 1 A 23 23 ASP C C 22 179.078 178.198 0.880 1
1 81 . 28 1 1 A 23 23 ASP CA C 22 57.048 57.783 -0.735 1
1 82 . 28 1 1 A 23 23 ASP CB C 22 40.154 41.176 -1.022 1
1 83 . 28 1 1 A 23 23 ASP N N 22 116.876 118.926 -2.050 1
1 84 . 28 1 1 A 24 24 ALA H H 23 7.651 7.757 -0.106 1
1 85 . 28 1 1 A 24 24 ALA HA H 23 3.785 3.908 -0.123 1
1 89 . 28 1 1 A 24 24 ALA C C 23 179.577 179.849 -0.272 1
1 90 . 28 1 1 A 24 24 ALA CA C 23 54.341 55.205 -0.864 1
1 91 . 28 1 1 A 24 24 ALA CB C 23 17.762 18.259 -0.497 1
1 92 . 28 1 1 A 24 24 ALA N N 23 121.873 121.678 0.195 1
1 93 . 28 1 1 A 25 25 VAL H H 24 7.718 7.769 -0.051 1
1 94 . 28 1 1 A 25 25 VAL HA H 24 3.216 3.690 -0.474 1
1 102 . 28 1 1 A 25 25 VAL C C 24 177.805 178.093 -0.288 1
1 103 . 28 1 1 A 25 25 VAL CA C 24 66.789 66.982 -0.193 1
1 104 . 28 1 1 A 25 25 VAL CB C 24 31.277 31.336 -0.059 1
1 107 . 28 1 1 A 25 25 VAL N N 24 117.890 118.386 -0.496 1
1 108 . 28 1 1 A 26 26 VAL H H 25 7.867 7.796 0.071 1
1 109 . 28 1 1 A 26 26 VAL HA H 25 3.274 3.680 -0.406 1
1 117 . 28 1 1 A 26 26 VAL C C 25 177.788 177.988 -0.200 1
1 118 . 28 1 1 A 26 26 VAL CA C 25 67.282 66.204 1.078 1
1 119 . 28 1 1 A 26 26 VAL CB C 25 31.266 31.521 -0.255 1
1 122 . 28 1 1 A 26 26 VAL N N 25 118.170 119.332 -1.162 1
1 123 . 28 1 1 A 27 27 GLY H H 26 7.544 7.789 -0.245 1
1 124 . 28 1 1 A 27 27 GLY HA2 H 26 3.592 3.521 0.071 1
1 125 . 28 1 1 A 27 27 GLY HA3 H 26 3.721 3.642 0.079 1
1 126 . 28 1 1 A 27 27 GLY C C 26 176.717 176.487 0.230 1
1 127 . 28 1 1 A 27 27 GLY CA C 26 47.085 47.217 -0.132 1
1 128 . 28 1 1 A 27 27 GLY N N 26 105.795 107.785 -1.990 1
1 129 . 28 1 1 A 28 28 TYR H H 27 7.625 7.413 0.212 1
1 130 . 28 1 1 A 28 28 TYR HA H 27 4.546 4.589 -0.043 1
1 137 . 28 1 1 A 28 28 TYR C C 27 178.991 178.128 0.863 1
1 138 . 28 1 1 A 28 28 TYR CA C 27 58.845 59.669 -0.824 1
1 139 . 28 1 1 A 28 28 TYR CB C 27 37.602 37.783 -0.181 1
1 144 . 28 1 1 A 28 28 TYR N N 27 119.933 121.599 -1.666 1
1 145 . 28 1 1 A 29 29 LEU H H 28 8.517 8.458 0.059 1
1 146 . 28 1 1 A 29 29 LEU HA H 28 3.728 3.861 -0.133 1
1 156 . 28 1 1 A 29 29 LEU CA C 28 58.281 58.082 0.199 1
1 157 . 28 1 1 A 29 29 LEU CB C 28 41.948 41.566 0.382 1
1 161 . 28 1 1 A 29 29 LEU N N 28 119.669 120.340 -0.671 1
1 162 . 28 1 1 A 30 30 GLU H H 29 8.072 7.935 0.137 1
1 163 . 28 1 1 A 30 30 GLU HA H 29 3.722 3.892 -0.170 1
1 168 . 28 1 1 A 30 30 GLU C C 29 177.731 179.294 -1.563 1
1 169 . 28 1 1 A 30 30 GLU CA C 29 59.763 59.932 -0.169 1
1 170 . 28 1 1 A 30 30 GLU CB C 29 28.844 29.243 -0.399 1
1 172 . 28 1 1 A 30 30 GLU N N 29 117.666 117.769 -0.103 1
1 173 . 28 1 1 A 31 31 ASP H H 30 7.243 7.803 -0.560 1
1 174 . 28 1 1 A 31 31 ASP HA H 30 4.297 4.395 -0.098 1
1 177 . 28 1 1 A 31 31 ASP CA C 30 56.953 57.338 -0.385 1
1 178 . 28 1 1 A 31 31 ASP CB C 30 40.730 40.703 0.027 1
1 179 . 28 1 1 A 31 31 ASP N N 30 116.720 119.309 -2.589 1
1 180 . 28 1 1 A 32 32 ILE H H 31 7.940 7.599 0.341 1
1 181 . 28 1 1 A 32 32 ILE HA H 31 3.640 3.729 -0.089 1
1 191 . 28 1 1 A 32 32 ILE C C 31 177.980 177.943 0.037 1
1 192 . 28 1 1 A 32 32 ILE CA C 31 64.692 64.022 0.670 1
1 193 . 28 1 1 A 32 32 ILE CB C 31 38.938 36.365 2.573 1
1 197 . 28 1 1 A 32 32 ILE N N 31 119.728 120.238 -0.510 1
1 198 . 28 1 1 A 33 33 ILE H H 32 7.984 7.745 0.239 1
1 199 . 28 1 1 A 33 33 ILE HA H 32 3.598 3.039 0.559 1
1 209 . 28 1 1 A 33 33 ILE C C 32 176.723 176.985 -0.262 1
1 210 . 28 1 1 A 33 33 ILE CA C 32 63.241 64.487 -1.246 1
1 211 . 28 1 1 A 33 33 ILE CB C 32 37.580 37.664 -0.084 1
1 215 . 28 1 1 A 33 33 ILE N N 32 113.919 121.750 -7.831 1
1 216 . 28 1 1 A 34 34 MET H H 33 7.288 7.678 -0.390 1
1 217 . 28 1 1 A 34 34 MET HA H 33 4.496 4.639 -0.143 1
1 225 . 28 1 1 A 34 34 MET C C 33 176.423 175.793 0.630 1
1 226 . 28 1 1 A 34 34 MET CA C 33 54.634 54.471 0.163 1
1 227 . 28 1 1 A 34 34 MET CB C 33 31.934 31.322 0.612 1
1 230 . 28 1 1 A 34 34 MET N N 33 115.130 116.872 -1.742 1
1 231 . 28 1 1 A 35 35 ASP H H 34 7.405 7.511 -0.106 1
1 232 . 28 1 1 A 35 35 ASP HA H 34 4.484 4.549 -0.065 1
1 235 . 28 1 1 A 35 35 ASP C C 34 177.139 176.821 0.318 1
1 236 . 28 1 1 A 35 35 ASP CA C 34 54.625 54.708 -0.083 1
1 237 . 28 1 1 A 35 35 ASP CB C 34 43.554 42.703 0.851 1
1 238 . 28 1 1 A 35 35 ASP N N 34 121.814 122.167 -0.353 1
1 239 . 28 1 1 A 36 36 ASP H H 35 8.765 9.052 -0.287 1
1 240 . 28 1 1 A 36 36 ASP HA H 35 4.235 4.393 -0.158 1
1 243 . 28 1 1 A 36 36 ASP C C 35 178.320 178.561 -0.241 1
1 244 . 28 1 1 A 36 36 ASP CA C 35 57.832 57.276 0.556 1
1 245 . 28 1 1 A 36 36 ASP CB C 35 40.914 39.744 1.170 1
1 246 . 28 1 1 A 36 36 ASP N N 35 125.883 126.352 -0.469 1
1 247 . 28 1 1 A 37 37 GLU H H 36 8.905 8.299 0.606 1
1 248 . 28 1 1 A 37 37 GLU HA H 36 3.933 4.102 -0.169 1
1 253 . 28 1 1 A 37 37 GLU C C 36 179.304 179.047 0.257 1
1 254 . 28 1 1 A 37 37 GLU CA C 36 59.828 59.106 0.722 1
1 255 . 28 1 1 A 37 37 GLU CB C 36 29.380 29.302 0.078 1
1 257 . 28 1 1 A 37 37 GLU N N 36 119.077 120.335 -1.258 1
1 258 . 28 1 1 A 38 38 PHE H H 37 7.460 8.267 -0.807 1
1 259 . 28 1 1 A 38 38 PHE HA H 37 3.642 3.949 -0.307 1
1 267 . 28 1 1 A 38 38 PHE C C 37 176.483 177.955 -1.472 1
1 268 . 28 1 1 A 38 38 PHE CA C 37 61.411 61.191 0.220 1
1 269 . 28 1 1 A 38 38 PHE CB C 37 39.355 39.003 0.352 1
1 275 . 28 1 1 A 38 38 PHE N N 37 119.968 120.772 -0.804 1
1 276 . 28 1 1 A 39 39 GLN H H 38 7.968 7.953 0.015 1
1 277 . 28 1 1 A 39 39 GLN HA H 38 3.712 3.747 -0.035 1
1 284 . 28 1 1 A 39 39 GLN CA C 38 59.153 58.807 0.346 1
1 285 . 28 1 1 A 39 39 GLN CB C 38 28.213 28.273 -0.060 1
1 287 . 28 1 1 A 39 39 GLN N N 38 116.433 118.252 -1.819 1
1 289 . 28 1 1 A 40 40 LEU H H 39 7.930 7.430 0.500 1
1 290 . 28 1 1 A 40 40 LEU HA H 39 3.916 4.017 -0.101 1
1 300 . 28 1 1 A 40 40 LEU C C 39 177.731 178.035 -0.304 1
1 301 . 28 1 1 A 40 40 LEU CA C 39 57.915 57.954 -0.039 1
1 302 . 28 1 1 A 40 40 LEU CB C 39 41.989 41.539 0.450 1
1 306 . 28 1 1 A 40 40 LEU N N 39 119.505 121.469 -1.964 1
1 307 . 28 1 1 A 41 41 LEU H H 40 7.174 7.642 -0.468 1
1 308 . 28 1 1 A 41 41 LEU HA H 40 3.835 3.954 -0.119 1
1 318 . 28 1 1 A 41 41 LEU C C 40 179.738 178.329 1.409 1
1 319 . 28 1 1 A 41 41 LEU CA C 40 58.266 58.352 -0.086 1
1 320 . 28 1 1 A 41 41 LEU CB C 40 42.050 41.306 0.744 1
1 324 . 28 1 1 A 41 41 LEU N N 40 120.971 119.689 1.282 1
1 325 . 28 1 1 A 42 42 GLN H H 41 8.058 7.899 0.159 1
1 326 . 28 1 1 A 42 42 GLN HA H 41 3.556 3.719 -0.163 1
1 333 . 28 1 1 A 42 42 GLN C C 41 177.642 178.423 -0.781 1
1 334 . 28 1 1 A 42 42 GLN CA C 41 59.826 59.195 0.631 1
1 335 . 28 1 1 A 42 42 GLN CB C 41 28.762 27.790 0.972 1
1 337 . 28 1 1 A 42 42 GLN N N 41 117.899 117.698 0.201 1
1 339 . 28 1 1 A 43 43 ARG H H 42 8.179 7.916 0.263 1
1 340 . 28 1 1 A 43 43 ARG HA H 42 3.655 3.943 -0.288 1
1 347 . 28 1 1 A 43 43 ARG C C 42 178.051 178.316 -0.265 1
1 348 . 28 1 1 A 43 43 ARG CA C 42 59.766 58.677 1.089 1
1 349 . 28 1 1 A 43 43 ARG CB C 42 29.941 29.985 -0.044 1
1 352 . 28 1 1 A 43 43 ARG N N 42 119.392 119.594 -0.202 1
1 353 . 28 1 1 A 44 44 ASN H H 43 8.525 8.128 0.397 1
1 354 . 28 1 1 A 44 44 ASN HA H 43 4.332 4.422 -0.090 1
1 359 . 28 1 1 A 44 44 ASN C C 43 178.150 177.839 0.311 1
1 360 . 28 1 1 A 44 44 ASN CA C 43 55.841 56.250 -0.409 1
1 361 . 28 1 1 A 44 44 ASN CB C 43 37.632 39.271 -1.639 1
1 362 . 28 1 1 A 44 44 ASN N N 43 116.214 117.554 -1.340 1
1 364 . 28 1 1 A 45 45 PHE H H 44 7.586 7.906 -0.320 1
1 365 . 28 1 1 A 45 45 PHE HA H 44 4.132 4.299 -0.167 1
1 372 . 28 1 1 A 45 45 PHE C C 44 176.691 178.645 -1.954 1
1 373 . 28 1 1 A 45 45 PHE CA C 44 62.333 61.079 1.254 1
1 374 . 28 1 1 A 45 45 PHE CB C 44 39.449 38.684 0.765 1
1 379 . 28 1 1 A 45 45 PHE N N 44 121.501 117.750 3.751 1
1 380 . 28 1 1 A 46 46 MET H H 45 8.190 8.317 -0.127 1
1 381 . 28 1 1 A 46 46 MET HA H 45 4.060 4.221 -0.161 1
1 389 . 28 1 1 A 46 46 MET C C 45 179.754 178.264 1.490 1
1 390 . 28 1 1 A 46 46 MET CA C 45 57.742 58.211 -0.469 1
1 391 . 28 1 1 A 46 46 MET CB C 45 29.912 31.465 -1.553 1
1 394 . 28 1 1 A 46 46 MET N N 45 116.727 117.878 -1.151 1
1 395 . 28 1 1 A 47 47 ASP H H 46 8.579 8.208 0.371 1
1 396 . 28 1 1 A 47 47 ASP HA H 46 4.804 4.796 0.008 1
1 399 . 28 1 1 A 47 47 ASP C C 46 177.854 178.422 -0.568 1
1 400 . 28 1 1 A 47 47 ASP CA C 46 57.277 57.442 -0.165 1
1 401 . 28 1 1 A 47 47 ASP CB C 46 40.776 41.897 -1.121 1
1 402 . 28 1 1 A 47 47 ASP N N 46 117.798 120.851 -3.053 1
1 403 . 28 1 1 A 48 48 LYS H H 47 7.339 7.871 -0.532 1
1 404 . 28 1 1 A 48 48 LYS HA H 47 3.828 4.046 -0.218 1
1 413 . 28 1 1 A 48 48 LYS C C 47 178.812 178.870 -0.058 1
1 414 . 28 1 1 A 48 48 LYS CA C 47 58.953 58.502 0.451 1
1 415 . 28 1 1 A 48 48 LYS CB C 47 32.796 32.376 0.420 1
1 419 . 28 1 1 A 48 48 LYS N N 47 117.852 119.308 -1.456 1
1 420 . 28 1 1 A 49 49 TYR H H 48 6.841 8.478 -1.637 1
1 421 . 28 1 1 A 49 49 TYR HA H 48 4.995 4.268 0.727 1
1 428 . 28 1 1 A 49 49 TYR C C 48 178.138 178.696 -0.558 1
1 429 . 28 1 1 A 49 49 TYR CA C 48 58.620 59.659 -1.039 1
1 430 . 28 1 1 A 49 49 TYR CB C 48 42.939 37.976 4.963 1
1 435 . 28 1 1 A 49 49 TYR N N 48 112.109 119.778 -7.669 1
1 436 . 28 1 1 A 50 50 TYR H H 49 8.491 8.180 0.311 1
1 437 . 28 1 1 A 50 50 TYR HA H 49 4.598 4.264 0.334 1
1 444 . 28 1 1 A 50 50 TYR C C 49 176.015 178.163 -2.148 1
1 445 . 28 1 1 A 50 50 TYR CA C 49 62.442 59.544 2.898 1
1 446 . 28 1 1 A 50 50 TYR CB C 49 36.588 36.893 -0.305 1
1 451 . 28 1 1 A 50 50 TYR N N 49 118.294 118.844 -0.550 1
1 452 . 28 1 1 A 51 51 LEU H H 50 7.512 7.861 -0.349 1
1 453 . 28 1 1 A 51 51 LEU HA H 50 3.878 3.571 0.307 1
1 463 . 28 1 1 A 51 51 LEU C C 50 178.625 178.514 0.111 1
1 464 . 28 1 1 A 51 51 LEU CA C 50 55.994 57.875 -1.881 1
1 465 . 28 1 1 A 51 51 LEU CB C 50 40.743 41.315 -0.572 1
1 469 . 28 1 1 A 51 51 LEU N N 50 118.478 122.005 -3.527 1
1 470 . 28 1 1 A 52 52 GLU H H 51 8.042 7.891 0.151 1
1 471 . 28 1 1 A 52 52 GLU HA H 51 4.197 3.979 0.218 1
1 476 . 28 1 1 A 52 52 GLU C C 51 177.629 177.839 -0.210 1
1 477 . 28 1 1 A 52 52 GLU CA C 51 56.141 59.630 -3.489 1
1 478 . 28 1 1 A 52 52 GLU CB C 51 29.162 29.199 -0.037 1
1 480 . 28 1 1 A 52 52 GLU N N 51 115.067 117.517 -2.450 1
1 481 . 28 1 1 A 53 53 PHE H H 52 7.465 7.918 -0.453 1
1 482 . 28 1 1 A 53 53 PHE HA H 52 4.431 4.617 -0.186 1
1 490 . 28 1 1 A 53 53 PHE C C 52 174.325 174.964 -0.639 1
1 491 . 28 1 1 A 53 53 PHE CA C 52 58.986 56.931 2.055 1
1 492 . 28 1 1 A 53 53 PHE CB C 52 40.183 37.386 2.797 1
1 498 . 28 1 1 A 53 53 PHE N N 52 116.768 118.541 -1.773 1
1 499 . 28 1 1 A 54 54 GLU H H 53 7.484 8.444 -0.960 1
1 500 . 28 1 1 A 54 54 GLU HA H 53 4.583 4.923 -0.340 1
1 505 . 28 1 1 A 54 54 GLU C C 53 175.722 175.810 -0.088 1
1 506 . 28 1 1 A 54 54 GLU CA C 53 54.248 54.879 -0.631 1
1 507 . 28 1 1 A 54 54 GLU CB C 53 34.409 31.978 2.431 1
1 509 . 28 1 1 A 54 54 GLU N N 53 118.844 125.431 -6.587 1
1 510 . 28 1 1 A 55 55 ASP H H 54 9.008 8.813 0.195 1
1 511 . 28 1 1 A 55 55 ASP HA H 54 4.735 4.748 -0.013 1
1 514 . 28 1 1 A 55 55 ASP C C 54 175.421 175.845 -0.424 1
1 515 . 28 1 1 A 55 55 ASP CA C 54 52.888 54.290 -1.402 1
1 516 . 28 1 1 A 55 55 ASP CB C 54 38.894 40.736 -1.842 1
1 517 . 28 1 1 A 55 55 ASP N N 54 123.654 127.378 -3.724 1
1 518 . 28 1 1 A 56 56 THR H H 55 7.819 8.229 -0.410 1
1 519 . 28 1 1 A 56 56 THR HA H 55 4.574 5.004 -0.430 1
1 524 . 28 1 1 A 56 56 THR C C 55 174.096 174.128 -0.032 1
1 525 . 28 1 1 A 56 56 THR CA C 55 59.172 60.169 -0.997 1
1 526 . 28 1 1 A 56 56 THR CB C 55 71.889 71.915 -0.026 1
1 528 . 28 1 1 A 56 56 THR N N 55 112.015 117.353 -5.338 1
1 529 . 28 1 1 A 57 57 GLU H H 56 8.527 8.529 -0.002 1
1 530 . 28 1 1 A 57 57 GLU HA H 56 4.217 4.566 -0.349 1
1 535 . 28 1 1 A 57 57 GLU C C 56 177.042 176.036 1.006 1
1 536 . 28 1 1 A 57 57 GLU CA C 56 56.869 55.874 0.995 1
1 537 . 28 1 1 A 57 57 GLU CB C 56 29.731 30.632 -0.901 1
1 539 . 28 1 1 A 57 57 GLU N N 56 117.531 118.796 -1.265 1
1 540 . 28 1 1 A 58 58 GLU H H 57 7.587 7.735 -0.148 1
1 541 . 28 1 1 A 58 58 GLU HA H 57 3.941 4.677 -0.736 1
1 546 . 28 1 1 A 58 58 GLU C C 57 176.849 175.670 1.179 1
1 547 . 28 1 1 A 58 58 GLU CA C 57 56.924 56.178 0.746 1
1 548 . 28 1 1 A 58 58 GLU CB C 57 30.251 31.069 -0.818 1
1 550 . 28 1 1 A 58 58 GLU N N 57 119.183 121.698 -2.515 1
1 551 . 28 1 1 A 59 59 ASN H H 58 9.120 8.780 0.340 1
1 552 . 28 1 1 A 59 59 ASN HA H 58 4.922 5.110 -0.188 1
1 557 . 28 1 1 A 59 59 ASN C C 58 174.254 174.505 -0.251 1
1 558 . 28 1 1 A 59 59 ASN CA C 58 51.956 52.984 -1.028 1
1 559 . 28 1 1 A 59 59 ASN CB C 58 37.404 39.557 -2.153 1
1 560 . 28 1 1 A 59 59 ASN N N 58 126.767 123.840 2.927 1
1 562 . 28 1 1 A 60 60 LYS H H 59 5.892 8.825 -2.933 1
1 563 . 28 1 1 A 60 60 LYS HA H 59 3.798 4.615 -0.817 1
1 572 . 28 1 1 A 60 60 LYS C C 59 177.908 176.872 1.036 1
1 573 . 28 1 1 A 60 60 LYS CA C 59 56.623 54.381 2.242 1
1 574 . 28 1 1 A 60 60 LYS CB C 59 32.279 34.213 -1.934 1
1 578 . 28 1 1 A 60 60 LYS N N 59 121.527 124.665 -3.138 1
1 579 . 28 1 1 A 61 61 LEU H H 60 8.473 8.704 -0.231 1
1 580 . 28 1 1 A 61 61 LEU HA H 60 3.891 4.162 -0.271 1
1 590 . 28 1 1 A 61 61 LEU C C 60 179.843 178.781 1.062 1
1 591 . 28 1 1 A 61 61 LEU CA C 60 58.301 56.465 1.836 1
1 592 . 28 1 1 A 61 61 LEU CB C 60 41.305 41.471 -0.166 1
1 596 . 28 1 1 A 61 61 LEU N N 60 125.639 123.481 2.158 1
1 597 . 28 1 1 A 62 62 ILE H H 61 7.698 7.588 0.110 1
1 598 . 28 1 1 A 62 62 ILE HA H 61 3.952 3.872 0.080 1
1 608 . 28 1 1 A 62 62 ILE C C 61 175.392 177.099 -1.707 1
1 609 . 28 1 1 A 62 62 ILE CA C 61 61.743 63.283 -1.540 1
1 610 . 28 1 1 A 62 62 ILE CB C 61 39.108 37.720 1.388 1
1 614 . 28 1 1 A 62 62 ILE N N 61 114.111 119.855 -5.744 1
1 615 . 28 1 1 A 63 63 TYR H H 62 7.273 7.088 0.185 1
1 616 . 28 1 1 A 63 63 TYR HA H 62 4.343 4.249 0.094 1
1 623 . 28 1 1 A 63 63 TYR C C 62 178.264 178.262 0.002 1
1 624 . 28 1 1 A 63 63 TYR CA C 62 57.231 60.885 -3.654 1
1 625 . 28 1 1 A 63 63 TYR CB C 62 36.332 37.707 -1.375 1
1 630 . 28 1 1 A 63 63 TYR N N 62 117.689 121.803 -4.114 1
1 631 . 28 1 1 A 64 64 THR H H 63 7.747 7.962 -0.215 1
1 632 . 28 1 1 A 64 64 THR HA H 63 4.266 4.256 0.010 1
1 637 . 28 1 1 A 64 64 THR CA C 63 69.362 67.578 1.784 1
1 638 . 28 1 1 A 64 64 THR CB C 63 66.962 67.507 -0.545 1
1 640 . 28 1 1 A 64 64 THR N N 63 113.755 116.144 -2.389 1
1 641 . 28 1 1 A 65 65 PRO HA H 64 4.372 4.339 0.033 1
1 648 . 28 1 1 A 65 65 PRO C C 64 179.913 179.603 0.310 1
1 649 . 28 1 1 A 65 65 PRO CA C 64 66.011 66.351 -0.340 1
1 650 . 28 1 1 A 65 65 PRO CB C 64 30.642 30.853 -0.211 1
1 653 . 28 1 1 A 66 66 ILE H H 65 7.377 7.450 -0.073 1
1 654 . 28 1 1 A 66 66 ILE HA H 65 3.530 3.891 -0.361 1
1 664 . 28 1 1 A 66 66 ILE C C 65 177.543 178.391 -0.848 1
1 665 . 28 1 1 A 66 66 ILE CA C 65 66.647 64.209 2.438 1
1 666 . 28 1 1 A 66 66 ILE CB C 65 38.029 37.673 0.356 1
1 670 . 28 1 1 A 66 66 ILE N N 65 118.353 116.676 1.677 1
1 671 . 28 1 1 A 67 67 PHE H H 66 8.480 8.434 0.046 1
1 672 . 28 1 1 A 67 67 PHE HA H 66 4.115 4.327 -0.212 1
1 680 . 28 1 1 A 67 67 PHE C C 66 177.293 178.115 -0.822 1
1 681 . 28 1 1 A 67 67 PHE CA C 66 59.570 62.017 -2.447 1
1 682 . 28 1 1 A 67 67 PHE CB C 66 38.865 39.475 -0.610 1
1 688 . 28 1 1 A 67 67 PHE N N 66 122.420 120.509 1.911 1
1 689 . 28 1 1 A 68 68 ASN H H 67 8.595 8.264 0.331 1
1 690 . 28 1 1 A 68 68 ASN HA H 67 4.211 4.293 -0.082 1
1 695 . 28 1 1 A 68 68 ASN C C 67 178.697 177.850 0.847 1
1 696 . 28 1 1 A 68 68 ASN CA C 67 56.056 56.489 -0.433 1
1 697 . 28 1 1 A 68 68 ASN CB C 67 37.704 37.857 -0.153 1
1 698 . 28 1 1 A 68 68 ASN N N 67 115.573 116.904 -1.331 1
1 700 . 28 1 1 A 69 69 GLU H H 68 8.414 8.012 0.402 1
1 701 . 28 1 1 A 69 69 GLU HA H 68 4.102 4.192 -0.090 1
1 706 . 28 1 1 A 69 69 GLU C C 68 177.880 178.871 -0.991 1
1 707 . 28 1 1 A 69 69 GLU CA C 68 59.399 59.432 -0.033 1
1 708 . 28 1 1 A 69 69 GLU CB C 68 29.855 29.467 0.388 1
1 710 . 28 1 1 A 69 69 GLU N N 68 123.510 120.159 3.351 1
1 711 . 28 1 1 A 70 70 TYR H H 69 8.659 8.076 0.583 1
1 712 . 28 1 1 A 70 70 TYR HA H 69 3.362 4.155 -0.793 1
1 719 . 28 1 1 A 70 70 TYR C C 69 178.143 177.037 1.106 1
1 720 . 28 1 1 A 70 70 TYR CA C 69 60.686 61.053 -0.367 1
1 721 . 28 1 1 A 70 70 TYR CB C 69 38.560 39.067 -0.507 1
1 726 . 28 1 1 A 70 70 TYR N N 69 122.130 120.896 1.234 1
1 727 . 28 1 1 A 71 71 ILE H H 70 8.031 7.674 0.357 1
1 728 . 28 1 1 A 71 71 ILE HA H 70 3.265 3.731 -0.466 1
1 738 . 28 1 1 A 71 71 ILE C C 70 178.056 177.879 0.177 1
1 739 . 28 1 1 A 71 71 ILE CA C 70 63.756 63.984 -0.228 1
1 740 . 28 1 1 A 71 71 ILE CB C 70 37.321 36.582 0.739 1
1 744 . 28 1 1 A 71 71 ILE N N 70 118.906 120.139 -1.233 1
1 745 . 28 1 1 A 72 72 SER H H 71 7.803 7.925 -0.122 1
1 746 . 28 1 1 A 72 72 SER HA H 71 4.029 4.358 -0.329 1
1 749 . 28 1 1 A 72 72 SER CA C 71 61.380 61.241 0.139 1
1 750 . 28 1 1 A 72 72 SER CB C 71 63.288 63.446 -0.158 1
1 751 . 28 1 1 A 72 72 SER N N 71 113.735 118.656 -4.921 1
1 752 . 28 1 1 A 73 73 LEU H H 72 7.952 7.968 -0.016 1
1 753 . 28 1 1 A 73 73 LEU HA H 72 4.418 4.064 0.354 1
1 763 . 28 1 1 A 73 73 LEU C C 72 177.767 178.328 -0.561 1
1 764 . 28 1 1 A 73 73 LEU CA C 72 56.543 57.376 -0.833 1
1 765 . 28 1 1 A 73 73 LEU CB C 72 44.517 41.687 2.830 1
1 769 . 28 1 1 A 73 73 LEU N N 72 119.411 122.422 -3.011 1
1 770 . 28 1 1 A 74 74 VAL H H 73 8.021 7.633 0.388 1
1 771 . 28 1 1 A 74 74 VAL HA H 73 3.532 3.379 0.153 1
1 779 . 28 1 1 A 74 74 VAL C C 73 177.126 178.134 -1.008 1
1 780 . 28 1 1 A 74 74 VAL CA C 73 66.250 66.341 -0.091 1
1 781 . 28 1 1 A 74 74 VAL CB C 73 31.212 31.207 0.005 1
1 784 . 28 1 1 A 74 74 VAL N N 73 118.747 119.120 -0.373 1
1 785 . 28 1 1 A 75 75 GLU H H 74 7.232 8.021 -0.789 1
1 786 . 28 1 1 A 75 75 GLU HA H 74 3.013 4.215 -1.202 1
1 791 . 28 1 1 A 75 75 GLU C C 74 178.804 178.686 0.118 1
1 792 . 28 1 1 A 75 75 GLU CA C 74 60.536 59.572 0.964 1
1 793 . 28 1 1 A 75 75 GLU CB C 74 27.009 29.557 -2.548 1
1 795 . 28 1 1 A 75 75 GLU N N 74 118.660 119.949 -1.289 1
1 796 . 28 1 1 A 76 76 LYS H H 75 7.051 7.798 -0.747 1
1 797 . 28 1 1 A 76 76 LYS HA H 75 3.765 4.087 -0.322 1
1 806 . 28 1 1 A 76 76 LYS C C 75 177.765 178.477 -0.712 1
1 807 . 28 1 1 A 76 76 LYS CA C 75 58.357 58.841 -0.484 1
1 808 . 28 1 1 A 76 76 LYS CB C 75 31.939 32.043 -0.104 1
1 812 . 28 1 1 A 76 76 LYS N N 75 116.112 119.440 -3.328 1
1 813 . 28 1 1 A 77 77 TYR H H 76 7.067 7.777 -0.710 1
1 814 . 28 1 1 A 77 77 TYR HA H 76 4.036 4.149 -0.113 1
1 821 . 28 1 1 A 77 77 TYR C C 76 177.752 177.090 0.662 1
1 822 . 28 1 1 A 77 77 TYR CA C 76 61.820 61.332 0.488 1
1 823 . 28 1 1 A 77 77 TYR CB C 76 38.480 38.638 -0.158 1
1 828 . 28 1 1 A 77 77 TYR N N 76 118.434 120.809 -2.375 1
1 829 . 28 1 1 A 78 78 ILE H H 77 7.554 8.321 -0.767 1
1 830 . 28 1 1 A 78 78 ILE HA H 77 3.159 3.504 -0.345 1
1 840 . 28 1 1 A 78 78 ILE C C 77 177.341 177.762 -0.421 1
1 841 . 28 1 1 A 78 78 ILE CA C 77 65.177 64.971 0.206 1
1 842 . 28 1 1 A 78 78 ILE CB C 77 37.339 37.595 -0.256 1
1 846 . 28 1 1 A 78 78 ILE N N 77 117.672 121.118 -3.446 1
1 847 . 28 1 1 A 79 79 GLU H H 78 8.296 8.113 0.183 1
1 848 . 28 1 1 A 79 79 GLU HA H 78 3.557 3.769 -0.212 1
1 853 . 28 1 1 A 79 79 GLU C C 78 177.742 178.857 -1.115 1
1 854 . 28 1 1 A 79 79 GLU CA C 78 60.847 60.061 0.786 1
1 855 . 28 1 1 A 79 79 GLU CB C 78 29.594 29.211 0.383 1
1 857 . 28 1 1 A 79 79 GLU N N 78 118.701 120.822 -2.121 1
1 858 . 28 1 1 A 80 80 GLU H H 79 8.330 8.244 0.086 1
1 859 . 28 1 1 A 80 80 GLU HA H 79 3.774 4.009 -0.235 1
1 864 . 28 1 1 A 80 80 GLU C C 79 179.926 179.126 0.800 1
1 865 . 28 1 1 A 80 80 GLU CA C 79 59.581 58.926 0.655 1
1 866 . 28 1 1 A 80 80 GLU CB C 79 29.062 29.109 -0.047 1
1 868 . 28 1 1 A 80 80 GLU N N 79 116.767 118.566 -1.799 1
1 869 . 28 1 1 A 81 81 GLN H H 80 7.634 7.721 -0.087 1
1 870 . 28 1 1 A 81 81 GLN HA H 80 3.605 3.852 -0.247 1
1 877 . 28 1 1 A 81 81 GLN C C 80 179.681 178.385 1.296 1
1 878 . 28 1 1 A 81 81 GLN CA C 80 57.765 58.308 -0.543 1
1 879 . 28 1 1 A 81 81 GLN CB C 80 28.079 27.967 0.112 1
1 881 . 28 1 1 A 81 81 GLN N N 80 116.325 118.584 -2.259 1
1 883 . 28 1 1 A 82 82 LEU H H 81 8.156 7.464 0.692 1
1 884 . 28 1 1 A 82 82 LEU HA H 81 3.536 3.751 -0.215 1
1 894 . 28 1 1 A 82 82 LEU C C 81 178.945 179.352 -0.407 1
1 895 . 28 1 1 A 82 82 LEU CA C 81 57.761 56.760 1.001 1
1 896 . 28 1 1 A 82 82 LEU CB C 81 40.961 40.970 -0.009 1
1 900 . 28 1 1 A 82 82 LEU N N 81 121.546 120.249 1.297 1
1 901 . 28 1 1 A 83 83 LEU H H 82 8.326 7.824 0.502 1
1 902 . 28 1 1 A 83 83 LEU HA H 82 4.198 4.055 0.143 1
1 912 . 28 1 1 A 83 83 LEU C C 82 178.631 179.216 -0.585 1
1 913 . 28 1 1 A 83 83 LEU CA C 82 57.016 56.920 0.096 1
1 914 . 28 1 1 A 83 83 LEU CB C 82 42.182 40.863 1.319 1
1 918 . 28 1 1 A 83 83 LEU N N 82 120.426 118.857 1.569 1
1 919 . 28 1 1 A 84 84 GLN H H 83 6.992 7.504 -0.512 1
1 920 . 28 1 1 A 84 84 GLN HA H 83 3.877 4.006 -0.129 1
1 927 . 28 1 1 A 84 84 GLN C C 83 177.008 176.712 0.296 1
1 928 . 28 1 1 A 84 84 GLN CA C 83 57.543 58.213 -0.670 1
1 929 . 28 1 1 A 84 84 GLN CB C 83 28.688 28.564 0.124 1
1 931 . 28 1 1 A 84 84 GLN N N 83 114.001 117.237 -3.236 1
1 933 . 28 1 1 A 85 85 ARG H H 84 7.072 7.363 -0.291 1
1 934 . 28 1 1 A 85 85 ARG HA H 84 4.047 4.400 -0.353 1
1 942 . 28 1 1 A 85 85 ARG C C 84 175.999 174.877 1.122 1
1 943 . 28 1 1 A 85 85 ARG CA C 84 56.764 55.589 1.175 1
1 944 . 28 1 1 A 85 85 ARG CB C 84 32.044 32.047 -0.003 1
1 947 . 28 1 1 A 85 85 ARG N N 84 115.827 116.707 -0.880 1
1 949 . 28 1 1 A 86 86 ILE H H 85 8.238 7.319 0.919 1
1 950 . 28 1 1 A 86 86 ILE HA H 85 4.389 4.595 -0.206 1
1 960 . 28 1 1 A 86 86 ILE CA C 85 58.007 57.925 0.082 1
1 961 . 28 1 1 A 86 86 ILE CB C 85 39.604 38.989 0.615 1
1 965 . 28 1 1 A 86 86 ILE N N 85 119.285 118.937 0.348 1
1 966 . 28 1 1 A 87 87 PRO HA H 86 4.392 4.508 -0.116 1
1 973 . 28 1 1 A 87 87 PRO C C 86 177.622 176.524 1.098 1
1 974 . 28 1 1 A 87 87 PRO CA C 86 64.665 64.290 0.375 1
1 975 . 28 1 1 A 87 87 PRO CB C 86 32.020 31.782 0.238 1
1 978 . 28 1 1 A 88 88 GLU H H 87 8.312 8.206 0.106 1
1 979 . 28 1 1 A 88 88 GLU HA H 87 4.208 4.575 -0.367 1
1 984 . 28 1 1 A 88 88 GLU C C 87 175.554 175.710 -0.156 1
1 985 . 28 1 1 A 88 88 GLU CA C 87 56.045 56.179 -0.134 1
1 986 . 28 1 1 A 88 88 GLU CB C 87 28.654 30.494 -1.840 1
1 988 . 28 1 1 A 88 88 GLU N N 87 114.256 116.806 -2.550 1
1 989 . 28 1 1 A 89 89 PHE H H 88 7.946 7.508 0.438 1
1 990 . 28 1 1 A 89 89 PHE HA H 88 3.993 4.347 -0.354 1
1 998 . 28 1 1 A 89 89 PHE C C 88 173.460 175.184 -1.724 1
1 999 . 28 1 1 A 89 89 PHE CA C 88 60.119 59.520 0.599 1
1 1000 . 28 1 1 A 89 89 PHE CB C 88 39.994 39.665 0.329 1
1 1006 . 28 1 1 A 89 89 PHE N N 88 121.550 123.472 -1.922 1
1 1007 . 28 1 1 A 90 90 ASN H H 89 7.266 7.818 -0.552 1
1 1008 . 28 1 1 A 90 90 ASN HA H 89 4.454 4.972 -0.518 1
1 1013 . 28 1 1 A 90 90 ASN C C 89 173.921 175.021 -1.100 1
1 1014 . 28 1 1 A 90 90 ASN CA C 89 51.839 51.434 0.405 1
1 1015 . 28 1 1 A 90 90 ASN CB C 89 40.674 38.783 1.891 1
1 1016 . 28 1 1 A 90 90 ASN N N 89 125.344 124.496 0.848 1
1 1018 . 28 1 1 A 91 91 MET H H 90 8.968 8.620 0.348 1
1 1019 . 28 1 1 A 91 91 MET HA H 90 4.049 4.179 -0.130 1
1 1027 . 28 1 1 A 91 91 MET C C 90 177.475 178.039 -0.564 1
1 1028 . 28 1 1 A 91 91 MET CA C 90 57.758 58.199 -0.441 1
1 1029 . 28 1 1 A 91 91 MET CB C 90 32.250 32.360 -0.110 1
1 1032 . 28 1 1 A 91 91 MET N N 90 127.052 124.942 2.110 1
1 1033 . 28 1 1 A 92 92 ALA H H 91 8.292 8.108 0.184 1
1 1034 . 28 1 1 A 92 92 ALA HA H 91 4.059 4.133 -0.074 1
1 1038 . 28 1 1 A 92 92 ALA C C 91 180.412 179.922 0.490 1
1 1039 . 28 1 1 A 92 92 ALA CA C 91 55.368 55.100 0.268 1
1 1040 . 28 1 1 A 92 92 ALA CB C 91 17.527 18.423 -0.896 1
1 1041 . 28 1 1 A 92 92 ALA N N 91 123.752 121.583 2.169 1
1 1042 . 28 1 1 A 93 93 ALA H H 92 7.931 8.226 -0.295 1
1 1043 . 28 1 1 A 93 93 ALA HA H 92 4.054 4.121 -0.067 1
1 1047 . 28 1 1 A 93 93 ALA C C 92 180.482 179.975 0.507 1
1 1048 . 28 1 1 A 93 93 ALA CA C 92 54.614 54.878 -0.264 1
1 1049 . 28 1 1 A 93 93 ALA CB C 92 18.098 18.310 -0.212 1
1 1050 . 28 1 1 A 93 93 ALA N N 92 121.158 120.097 1.061 1
1 1051 . 28 1 1 A 94 94 PHE H H 93 8.110 7.777 0.333 1
1 1052 . 28 1 1 A 94 94 PHE HA H 93 4.304 4.196 0.108 1
1 1060 . 28 1 1 A 94 94 PHE C C 93 177.350 177.809 -0.459 1
1 1061 . 28 1 1 A 94 94 PHE CA C 93 61.641 61.421 0.220 1
1 1062 . 28 1 1 A 94 94 PHE CB C 93 40.014 39.149 0.865 1
1 1068 . 28 1 1 A 94 94 PHE N N 93 119.807 119.812 -0.005 1
1 1069 . 28 1 1 A 95 95 THR H H 94 8.726 8.379 0.347 1
1 1070 . 28 1 1 A 95 95 THR HA H 94 3.569 3.957 -0.388 1
1 1075 . 28 1 1 A 95 95 THR C C 94 176.932 176.487 0.445 1
1 1076 . 28 1 1 A 95 95 THR CA C 94 66.833 65.590 1.243 1
1 1077 . 28 1 1 A 95 95 THR CB C 94 68.445 68.213 0.232 1
1 1079 . 28 1 1 A 95 95 THR N N 94 113.074 112.816 0.258 1
1 1080 . 28 1 1 A 96 96 THR H H 95 7.657 8.043 -0.386 1
1 1081 . 28 1 1 A 96 96 THR HA H 95 3.945 4.301 -0.356 1
1 1086 . 28 1 1 A 96 96 THR C C 95 176.386 176.366 0.020 1
1 1087 . 28 1 1 A 96 96 THR CA C 95 66.550 65.618 0.932 1
1 1088 . 28 1 1 A 96 96 THR CB C 95 68.583 69.020 -0.437 1
1 1090 . 28 1 1 A 96 96 THR N N 95 117.927 117.943 -0.016 1
1 1091 . 28 1 1 A 97 97 THR H H 96 7.699 7.703 -0.004 1
1 1092 . 28 1 1 A 97 97 THR HA H 96 3.905 4.280 -0.375 1
1 1097 . 28 1 1 A 97 97 THR C C 96 176.572 176.174 0.398 1
1 1098 . 28 1 1 A 97 97 THR CA C 96 65.979 66.282 -0.303 1
1 1099 . 28 1 1 A 97 97 THR CB C 96 68.553 68.385 0.168 1
1 1101 . 28 1 1 A 97 97 THR N N 96 118.518 116.965 1.553 1
1 1102 . 28 1 1 A 98 98 LEU H H 97 8.304 8.104 0.200 1
1 1103 . 28 1 1 A 98 98 LEU HA H 97 3.725 3.770 -0.045 1
1 1113 . 28 1 1 A 98 98 LEU C C 97 178.490 178.549 -0.059 1
1 1114 . 28 1 1 A 98 98 LEU CA C 97 58.517 57.894 0.623 1
1 1115 . 28 1 1 A 98 98 LEU CB C 97 41.697 41.009 0.688 1
1 1119 . 28 1 1 A 98 98 LEU N N 97 122.882 121.850 1.032 1
1 1120 . 28 1 1 A 99 99 GLN H H 98 7.639 7.925 -0.286 1
1 1121 . 28 1 1 A 99 99 GLN HA H 98 3.927 4.261 -0.334 1
1 1128 . 28 1 1 A 99 99 GLN C C 98 178.068 178.054 0.014 1
1 1129 . 28 1 1 A 99 99 GLN CA C 98 58.735 59.069 -0.334 1
1 1130 . 28 1 1 A 99 99 GLN CB C 98 27.986 28.480 -0.494 1
1 1132 . 28 1 1 A 99 99 GLN N N 98 114.302 118.193 -3.891 1
1 1134 . 28 1 1 A 100 100 HIS H H 99 7.575 7.806 -0.231 1
1 1135 . 28 1 1 A 100 100 HIS HA H 99 4.524 4.616 -0.092 1
1 1139 . 28 1 1 A 100 100 HIS C C 99 174.789 177.348 -2.559 1
1 1140 . 28 1 1 A 100 100 HIS CA C 99 56.154 57.059 -0.905 1
1 1141 . 28 1 1 A 100 100 HIS CB C 99 28.946 30.639 -1.693 1
1 1143 . 28 1 1 A 100 100 HIS N N 99 114.778 116.761 -1.983 1
1 1144 . 28 1 1 A 101 101 HIS H H 100 7.773 7.610 0.163 1
1 1145 . 28 1 1 A 101 101 HIS HA H 100 4.704 3.945 0.759 1
1 1149 . 28 1 1 A 101 101 HIS C C 100 174.818 176.952 -2.134 1
1 1150 . 28 1 1 A 101 101 HIS CA C 100 54.830 58.044 -3.214 1
1 1151 . 28 1 1 A 101 101 HIS CB C 100 29.749 29.951 -0.202 1
1 1153 . 28 1 1 A 101 101 HIS N N 100 117.397 120.057 -2.660 1
1 1154 . 28 1 1 A 102 102 LYS H H 101 7.324 8.251 -0.927 1
1 1155 . 28 1 1 A 102 102 LYS HA H 101 3.611 3.982 -0.371 1
1 1164 . 28 1 1 A 102 102 LYS C C 101 176.823 178.530 -1.707 1
1 1165 . 28 1 1 A 102 102 LYS CA C 101 59.915 58.839 1.076 1
1 1166 . 28 1 1 A 102 102 LYS CB C 101 32.825 31.456 1.369 1
1 1170 . 28 1 1 A 102 102 LYS N N 101 120.533 117.224 3.309 1
1 1171 . 28 1 1 A 103 103 ASP H H 102 8.361 7.759 0.602 1
1 1172 . 28 1 1 A 103 103 ASP HA H 102 4.421 4.460 -0.039 1
1 1175 . 28 1 1 A 103 103 ASP C C 102 176.793 177.728 -0.935 1
1 1176 . 28 1 1 A 103 103 ASP CA C 102 55.500 56.129 -0.629 1
1 1177 . 28 1 1 A 103 103 ASP CB C 102 40.178 40.763 -0.585 1
1 1178 . 28 1 1 A 103 103 ASP N N 102 114.814 120.004 -5.190 1
1 1179 . 28 1 1 A 104 104 GLU H H 103 7.858 7.890 -0.032 1
1 1180 . 28 1 1 A 104 104 GLU HA H 103 4.339 4.311 0.028 1
1 1183 . 28 1 1 A 104 104 GLU C C 103 175.777 176.064 -0.287 1
1 1184 . 28 1 1 A 104 104 GLU CA C 103 56.356 57.873 -1.517 1
1 1185 . 28 1 1 A 104 104 GLU CB C 103 31.293 30.689 0.604 1
1 1186 . 28 1 1 A 104 104 GLU N N 103 116.826 119.430 -2.604 1
1 1187 . 28 1 1 A 105 105 VAL H H 104 7.201 7.064 0.137 1
1 1188 . 28 1 1 A 105 105 VAL HA H 104 4.296 4.194 0.102 1
1 1196 . 28 1 1 A 105 105 VAL C C 104 174.482 175.638 -1.156 1
1 1197 . 28 1 1 A 105 105 VAL CA C 104 60.370 61.538 -1.168 1
1 1198 . 28 1 1 A 105 105 VAL CB C 104 34.341 33.232 1.109 1
1 1201 . 28 1 1 A 105 105 VAL N N 104 116.422 116.260 0.162 1
1 1202 . 28 1 1 A 106 106 ALA H H 105 8.487 8.627 -0.140 1
1 1203 . 28 1 1 A 106 106 ALA HA H 105 4.172 4.379 -0.207 1
1 1207 . 28 1 1 A 106 106 ALA C C 105 179.030 178.450 0.580 1
1 1208 . 28 1 1 A 106 106 ALA CA C 105 52.966 51.929 1.037 1
1 1209 . 28 1 1 A 106 106 ALA CB C 105 19.371 18.879 0.492 1
1 1210 . 28 1 1 A 106 106 ALA N N 105 128.313 125.668 2.645 1
1 1211 . 28 1 1 A 107 107 GLY H H 106 8.738 8.762 -0.024 1
1 1212 . 28 1 1 A 107 107 GLY HA2 H 106 3.773 3.879 -0.106 1
1 1213 . 28 1 1 A 107 107 GLY HA3 H 106 3.998 3.949 0.049 1
1 1214 . 28 1 1 A 107 107 GLY C C 106 174.958 175.604 -0.646 1
1 1215 . 28 1 1 A 107 107 GLY CA C 106 47.449 47.228 0.221 1
1 1216 . 28 1 1 A 107 107 GLY N N 106 110.612 110.676 -0.064 1
1 1217 . 28 1 1 A 108 108 ASP H H 107 8.535 8.349 0.186 1
1 1218 . 28 1 1 A 108 108 ASP HA H 107 4.333 4.368 -0.035 1
1 1221 . 28 1 1 A 108 108 ASP C C 107 179.133 178.749 0.384 1
1 1222 . 28 1 1 A 108 108 ASP CA C 107 56.721 57.108 -0.387 1
1 1223 . 28 1 1 A 108 108 ASP CB C 107 39.336 41.642 -2.306 1
1 1224 . 28 1 1 A 108 108 ASP N N 107 117.474 121.602 -4.128 1
1 1225 . 28 1 1 A 109 109 ILE H H 108 7.459 7.920 -0.461 1
1 1226 . 28 1 1 A 109 109 ILE HA H 108 3.688 3.818 -0.130 1
1 1236 . 28 1 1 A 109 109 ILE C C 108 176.735 178.494 -1.759 1
1 1237 . 28 1 1 A 109 109 ILE CA C 108 63.474 65.410 -1.936 1
1 1238 . 28 1 1 A 109 109 ILE CB C 108 37.340 37.634 -0.294 1
1 1242 . 28 1 1 A 109 109 ILE N N 108 119.609 119.662 -0.053 1
1 1243 . 28 1 1 A 110 110 PHE H H 109 7.920 8.355 -0.435 1
1 1244 . 28 1 1 A 110 110 PHE HA H 109 3.759 4.092 -0.333 1
1 1252 . 28 1 1 A 110 110 PHE C C 109 177.132 177.398 -0.266 1
1 1253 . 28 1 1 A 110 110 PHE CA C 109 62.766 61.234 1.532 1
1 1254 . 28 1 1 A 110 110 PHE CB C 109 39.752 39.310 0.442 1
1 1260 . 28 1 1 A 110 110 PHE N N 109 120.906 120.442 0.464 1
1 1261 . 28 1 1 A 111 111 ASP H H 110 8.639 8.305 0.334 1
1 1262 . 28 1 1 A 111 111 ASP HA H 110 4.216 4.205 0.011 1
1 1265 . 28 1 1 A 111 111 ASP C C 110 178.900 178.377 0.523 1
1 1266 . 28 1 1 A 111 111 ASP CA C 110 57.105 57.260 -0.155 1
1 1267 . 28 1 1 A 111 111 ASP CB C 110 39.697 41.707 -2.010 1
1 1268 . 28 1 1 A 111 111 ASP N N 110 117.124 119.031 -1.907 1
1 1269 . 28 1 1 A 112 112 MET H H 111 7.331 7.558 -0.227 1
1 1270 . 28 1 1 A 112 112 MET HA H 111 4.081 4.114 -0.033 1
1 1278 . 28 1 1 A 112 112 MET C C 111 179.052 178.168 0.884 1
1 1279 . 28 1 1 A 112 112 MET CA C 111 58.202 58.107 0.095 1
1 1280 . 28 1 1 A 112 112 MET CB C 111 31.827 32.362 -0.535 1
1 1283 . 28 1 1 A 112 112 MET N N 111 118.061 119.443 -1.382 1
1 1284 . 28 1 1 A 113 113 LEU H H 112 8.001 8.049 -0.048 1
1 1285 . 28 1 1 A 113 113 LEU HA H 112 3.723 3.578 0.145 1
1 1295 . 28 1 1 A 113 113 LEU C C 112 179.747 178.675 1.072 1
1 1296 . 28 1 1 A 113 113 LEU CA C 112 57.371 57.438 -0.067 1
1 1297 . 28 1 1 A 113 113 LEU CB C 112 40.671 41.124 -0.453 1
1 1301 . 28 1 1 A 113 113 LEU N N 112 120.426 119.686 0.740 1
1 1302 . 28 1 1 A 114 114 LEU H H 113 7.744 7.676 0.068 1
1 1303 . 28 1 1 A 114 114 LEU HA H 113 4.007 3.514 0.493 1
1 1313 . 28 1 1 A 114 114 LEU C C 113 179.358 178.568 0.790 1
1 1314 . 28 1 1 A 114 114 LEU CA C 113 57.202 57.519 -0.317 1
1 1315 . 28 1 1 A 114 114 LEU CB C 113 41.727 41.560 0.167 1
1 1319 . 28 1 1 A 114 114 LEU N N 113 119.584 119.642 -0.058 1
1 1320 . 28 1 1 A 115 115 THR H H 114 7.353 7.617 -0.264 1
1 1321 . 28 1 1 A 115 115 THR HA H 114 4.071 4.177 -0.106 1
1 1327 . 28 1 1 A 115 115 THR C C 114 173.591 176.115 -2.524 1
1 1328 . 28 1 1 A 115 115 THR CA C 114 65.332 64.402 0.930 1
1 1329 . 28 1 1 A 115 115 THR CB C 114 70.319 68.726 1.593 1
1 1331 . 28 1 1 A 115 115 THR N N 114 107.535 112.339 -4.804 1
1 1332 . 28 1 1 A 116 116 PHE H H 115 6.979 7.933 -0.954 1
1 1333 . 28 1 1 A 116 116 PHE HA H 115 5.022 4.510 0.512 1
1 1341 . 28 1 1 A 116 116 PHE C C 115 176.488 175.922 0.566 1
1 1342 . 28 1 1 A 116 116 PHE CA C 115 55.911 61.134 -5.223 1
1 1343 . 28 1 1 A 116 116 PHE CB C 115 38.521 38.626 -0.105 1
1 1349 . 28 1 1 A 116 116 PHE N N 115 112.366 120.003 -7.637 1
1 1350 . 28 1 1 A 117 117 THR H H 116 7.564 8.024 -0.460 1
1 1351 . 28 1 1 A 117 117 THR HA H 116 4.626 4.834 -0.208 1
1 1356 . 28 1 1 A 117 117 THR C C 116 174.085 173.996 0.089 1
1 1357 . 28 1 1 A 117 117 THR CA C 116 61.636 62.666 -1.030 1
1 1358 . 28 1 1 A 117 117 THR CB C 116 70.915 72.447 -1.532 1
1 1360 . 28 1 1 A 117 117 THR N N 116 105.498 113.358 -7.860 1
1 1361 . 28 1 1 A 118 118 ASP H H 117 8.270 7.794 0.476 1
1 1362 . 28 1 1 A 118 118 ASP HA H 117 4.955 4.674 0.281 1
1 1365 . 28 1 1 A 118 118 ASP C C 117 176.328 176.374 -0.046 1
1 1366 . 28 1 1 A 118 118 ASP CA C 117 53.417 53.198 0.219 1
1 1367 . 28 1 1 A 118 118 ASP CB C 117 43.388 40.038 3.350 1
1 1368 . 28 1 1 A 118 118 ASP N N 117 124.409 121.913 2.496 1
1 1369 . 28 1 1 A 119 119 PHE H H 118 8.973 8.746 0.227 1
1 1370 . 28 1 1 A 119 119 PHE HA H 118 3.506 4.164 -0.658 1
1 1378 . 28 1 1 A 119 119 PHE CA C 118 61.490 61.253 0.237 1
1 1379 . 28 1 1 A 119 119 PHE CB C 118 39.246 39.469 -0.223 1
1 1385 . 28 1 1 A 119 119 PHE N N 118 126.688 126.694 -0.006 1
1 1386 . 28 1 1 A 120 120 LEU H H 119 8.099 8.356 -0.257 1
1 1387 . 28 1 1 A 120 120 LEU HA H 119 3.842 3.916 -0.074 1
1 1397 . 28 1 1 A 120 120 LEU C C 119 179.601 179.496 0.105 1
1 1398 . 28 1 1 A 120 120 LEU CA C 119 58.174 57.897 0.277 1
1 1399 . 28 1 1 A 120 120 LEU CB C 119 40.315 41.430 -1.115 1
1 1403 . 28 1 1 A 120 120 LEU N N 119 117.930 119.951 -2.021 1
1 1404 . 28 1 1 A 121 121 ALA H H 120 7.729 8.095 -0.366 1
1 1405 . 28 1 1 A 121 121 ALA HA H 120 3.996 4.113 -0.117 1
1 1409 . 28 1 1 A 121 121 ALA C C 120 180.995 179.577 1.418 1
1 1410 . 28 1 1 A 121 121 ALA CA C 120 54.832 54.565 0.267 1
1 1411 . 28 1 1 A 121 121 ALA CB C 120 17.706 18.257 -0.551 1
1 1412 . 28 1 1 A 121 121 ALA N N 120 123.195 120.375 2.820 1
1 1413 . 28 1 1 A 122 122 PHE H H 121 7.943 7.847 0.096 1
1 1414 . 28 1 1 A 122 122 PHE HA H 121 3.887 3.866 0.021 1
1 1419 . 28 1 1 A 122 122 PHE C C 121 175.410 176.958 -1.548 1
1 1420 . 28 1 1 A 122 122 PHE CA C 121 61.075 60.717 0.358 1
1 1421 . 28 1 1 A 122 122 PHE CB C 121 38.115 38.871 -0.756 1
1 1424 . 28 1 1 A 122 122 PHE N N 121 121.798 120.106 1.692 1
1 1425 . 28 1 1 A 123 123 LYS H H 122 8.468 7.744 0.724 1
1 1426 . 28 1 1 A 123 123 LYS HA H 122 3.077 3.764 -0.687 1
1 1435 . 28 1 1 A 123 123 LYS C C 122 178.453 178.592 -0.139 1
1 1436 . 28 1 1 A 123 123 LYS CA C 122 59.855 59.793 0.062 1
1 1437 . 28 1 1 A 123 123 LYS CB C 122 32.374 31.946 0.428 1
1 1441 . 28 1 1 A 123 123 LYS N N 122 120.614 118.602 2.012 1
1 1442 . 28 1 1 A 124 124 GLU H H 123 8.100 7.917 0.183 1
1 1443 . 28 1 1 A 124 124 GLU HA H 123 3.652 4.013 -0.361 1
1 1448 . 28 1 1 A 124 124 GLU C C 123 177.743 178.585 -0.842 1
1 1449 . 28 1 1 A 124 124 GLU CA C 123 59.406 59.478 -0.072 1
1 1450 . 28 1 1 A 124 124 GLU CB C 123 28.811 29.297 -0.486 1
1 1452 . 28 1 1 A 124 124 GLU N N 123 117.404 118.883 -1.479 1
1 1453 . 28 1 1 A 125 125 MET H H 124 7.537 7.524 0.013 1
1 1454 . 28 1 1 A 125 125 MET HA H 124 3.860 3.994 -0.134 1
1 1462 . 28 1 1 A 125 125 MET C C 124 179.522 178.146 1.376 1
1 1463 . 28 1 1 A 125 125 MET CA C 124 58.832 58.215 0.617 1
1 1464 . 28 1 1 A 125 125 MET CB C 124 31.765 31.716 0.049 1
1 1467 . 28 1 1 A 125 125 MET N N 124 119.413 119.138 0.275 1
1 1468 . 28 1 1 A 126 126 PHE H H 125 7.148 7.478 -0.330 1
1 1469 . 28 1 1 A 126 126 PHE HA H 125 3.633 4.173 -0.540 1
1 1476 . 28 1 1 A 126 126 PHE C C 125 178.994 178.283 0.711 1
1 1477 . 28 1 1 A 126 126 PHE CA C 125 63.148 61.021 2.127 1
1 1478 . 28 1 1 A 126 126 PHE CB C 125 39.830 38.563 1.267 1
1 1483 . 28 1 1 A 126 126 PHE N N 125 120.013 119.210 0.803 1
1 1484 . 28 1 1 A 127 127 LEU H H 126 8.369 8.556 -0.187 1
1 1485 . 28 1 1 A 127 127 LEU HA H 126 3.972 4.009 -0.037 1
1 1495 . 28 1 1 A 127 127 LEU C C 126 180.621 179.041 1.580 1
1 1496 . 28 1 1 A 127 127 LEU CA C 126 57.944 57.956 -0.012 1
1 1497 . 28 1 1 A 127 127 LEU CB C 126 40.543 41.315 -0.772 1
1 1501 . 28 1 1 A 127 127 LEU N N 126 119.692 119.655 0.037 1
1 1502 . 28 1 1 A 128 128 ASP H H 127 8.578 7.881 0.697 1
1 1503 . 28 1 1 A 128 128 ASP HA H 127 4.308 4.306 0.002 1
1 1506 . 28 1 1 A 128 128 ASP C C 127 178.254 178.101 0.153 1
1 1507 . 28 1 1 A 128 128 ASP CA C 127 56.964 57.122 -0.158 1
1 1508 . 28 1 1 A 128 128 ASP CB C 127 39.735 40.468 -0.733 1
1 1509 . 28 1 1 A 128 128 ASP N N 127 121.926 119.580 2.346 1
1 1510 . 28 1 1 A 129 129 TYR H H 128 7.710 8.216 -0.506 1
1 1511 . 28 1 1 A 129 129 TYR HA H 128 3.908 3.939 -0.031 1
1 1518 . 28 1 1 A 129 129 TYR C C 128 177.633 177.415 0.218 1
1 1519 . 28 1 1 A 129 129 TYR CA C 128 61.796 61.148 0.648 1
1 1520 . 28 1 1 A 129 129 TYR CB C 128 39.372 38.413 0.959 1
1 1525 . 28 1 1 A 129 129 TYR N N 128 122.548 120.416 2.132 1
1 1526 . 28 1 1 A 130 130 ARG H H 129 8.622 8.362 0.260 1
1 1527 . 28 1 1 A 130 130 ARG HA H 129 3.722 3.789 -0.067 1
1 1535 . 28 1 1 A 130 130 ARG CA C 129 60.084 59.628 0.456 1
1 1536 . 28 1 1 A 130 130 ARG CB C 129 29.902 29.963 -0.061 1
1 1539 . 28 1 1 A 130 130 ARG N N 129 118.302 119.366 -1.064 1
1 1541 . 28 1 1 A 131 131 ALA H H 130 7.936 7.885 0.051 1
1 1542 . 28 1 1 A 131 131 ALA HA H 130 3.997 4.039 -0.042 1
1 1546 . 28 1 1 A 131 131 ALA C C 130 180.456 180.249 0.207 1
1 1547 . 28 1 1 A 131 131 ALA CA C 130 55.133 55.019 0.114 1
1 1548 . 28 1 1 A 131 131 ALA CB C 130 17.750 18.252 -0.502 1
1 1549 . 28 1 1 A 131 131 ALA N N 130 119.788 120.682 -0.894 1
1 1550 . 28 1 1 A 132 132 GLU H H 131 7.622 7.682 -0.060 1
1 1551 . 28 1 1 A 132 132 GLU HA H 131 3.862 3.946 -0.084 1
1 1556 . 28 1 1 A 132 132 GLU C C 131 179.528 179.076 0.452 1
1 1557 . 28 1 1 A 132 132 GLU CA C 131 58.849 58.952 -0.103 1
1 1558 . 28 1 1 A 132 132 GLU CB C 131 28.930 29.335 -0.405 1
1 1560 . 28 1 1 A 132 132 GLU N N 131 118.428 119.122 -0.694 1
1 1561 . 28 1 1 A 133 133 LYS H H 132 7.853 7.578 0.275 1
1 1562 . 28 1 1 A 133 133 LYS HA H 132 3.722 4.006 -0.284 1
1 1571 . 28 1 1 A 133 133 LYS C C 132 175.725 178.638 -2.913 1
1 1572 . 28 1 1 A 133 133 LYS CA C 132 57.544 59.570 -2.026 1
1 1573 . 28 1 1 A 133 133 LYS CB C 132 31.770 31.862 -0.092 1
1 1577 . 28 1 1 A 133 133 LYS N N 132 119.473 119.054 0.419 1
1 1578 . 28 1 1 A 134 134 GLU H H 133 8.151 7.883 0.268 1
1 1579 . 28 1 1 A 134 134 GLU HA H 133 4.161 4.152 0.009 1
1 1584 . 28 1 1 A 134 134 GLU C C 133 177.453 179.420 -1.967 1
1 1585 . 28 1 1 A 134 134 GLU CA C 133 57.222 58.163 -0.941 1
1 1586 . 28 1 1 A 134 134 GLU CB C 133 30.091 29.623 0.468 1
1 1588 . 28 1 1 A 134 134 GLU N N 133 116.525 118.289 -1.764 1
1 1589 . 28 1 1 A 135 135 GLY H H 134 7.702 8.096 -0.394 1
1 1590 . 28 1 1 A 135 135 GLY HA2 H 134 3.896 3.762 0.134 1
1 1591 . 28 1 1 A 135 135 GLY HA3 H 134 3.897 3.775 0.122 1
1 1592 . 28 1 1 A 135 135 GLY C C 134 174.538 175.221 -0.683 1
1 1593 . 28 1 1 A 135 135 GLY CA C 134 45.975 46.732 -0.757 1
1 1594 . 28 1 1 A 135 135 GLY N N 134 107.924 108.750 -0.826 1
1 1595 . 28 1 1 A 136 136 ARG H H 135 8.045 7.699 0.346 1
1 1596 . 28 1 1 A 136 136 ARG HA H 135 4.323 4.435 -0.112 1
1 1604 . 28 1 1 A 136 136 ARG C C 135 175.864 175.975 -0.111 1
1 1605 . 28 1 1 A 136 136 ARG CA C 135 56.016 56.600 -0.584 1
1 1606 . 28 1 1 A 136 136 ARG CB C 135 30.987 33.056 -2.069 1
1 1609 . 28 1 1 A 136 136 ARG N N 135 119.708 118.785 0.923 1
1 1 . 29 1 1 A 14 14 PHE CA C 13 58.199 58.693 -0.494 1
1 2 . 29 1 1 A 14 14 PHE CB C 13 39.717 39.233 0.484 1
1 3 . 29 1 1 A 15 15 SER H H 14 8.299 7.732 0.567 1
1 4 . 29 1 1 A 15 15 SER HA H 14 4.359 4.735 -0.376 1
1 7 . 29 1 1 A 15 15 SER CA C 14 58.249 56.440 1.809 1
1 8 . 29 1 1 A 15 15 SER CB C 14 63.936 65.048 -1.112 1
1 9 . 29 1 1 A 15 15 SER N N 14 117.379 116.261 1.118 1
1 10 . 29 1 1 A 16 16 SER H H 15 8.255 9.021 -0.766 1
1 11 . 29 1 1 A 16 16 SER HA H 15 3.729 4.656 -0.927 1
1 14 . 29 1 1 A 16 16 SER CA C 15 58.224 59.822 -1.598 1
1 15 . 29 1 1 A 16 16 SER CB C 15 63.886 64.941 -1.055 1
1 16 . 29 1 1 A 16 16 SER N N 15 117.694 120.324 -2.630 1
1 17 . 29 1 1 A 17 17 ALA H H 16 8.333 8.432 -0.099 1
1 18 . 29 1 1 A 17 17 ALA HA H 16 4.252 3.951 0.301 1
1 22 . 29 1 1 A 17 17 ALA CA C 16 53.377 55.119 -1.742 1
1 23 . 29 1 1 A 17 17 ALA CB C 16 18.896 18.400 0.496 1
1 24 . 29 1 1 A 17 17 ALA N N 16 125.462 124.523 0.939 1
1 25 . 29 1 1 A 18 18 SER H H 17 8.219 7.927 0.292 1
1 26 . 29 1 1 A 18 18 SER HA H 17 4.332 4.486 -0.154 1
1 29 . 29 1 1 A 18 18 SER CA C 17 59.105 59.079 0.026 1
1 30 . 29 1 1 A 18 18 SER CB C 17 63.592 63.187 0.405 1
1 31 . 29 1 1 A 18 18 SER N N 17 114.821 111.511 3.310 1
1 32 . 29 1 1 A 19 19 ASP H H 18 8.309 7.792 0.517 1
1 33 . 29 1 1 A 19 19 ASP HA H 18 4.554 4.903 -0.349 1
1 36 . 29 1 1 A 19 19 ASP C C 18 176.528 176.748 -0.220 1
1 37 . 29 1 1 A 19 19 ASP CA C 18 55.272 52.950 2.322 1
1 38 . 29 1 1 A 19 19 ASP CB C 18 40.883 43.263 -2.380 1
1 39 . 29 1 1 A 19 19 ASP N N 18 123.367 123.076 0.291 1
1 40 . 29 1 1 A 20 20 ALA H H 19 8.133 8.878 -0.745 1
1 41 . 29 1 1 A 20 20 ALA HA H 19 4.170 4.062 0.108 1
1 45 . 29 1 1 A 20 20 ALA C C 19 179.857 179.578 0.279 1
1 46 . 29 1 1 A 20 20 ALA CA C 19 54.341 55.134 -0.793 1
1 47 . 29 1 1 A 20 20 ALA CB C 19 18.660 18.428 0.232 1
1 48 . 29 1 1 A 20 20 ALA N N 19 123.350 127.432 -4.082 1
1 49 . 29 1 1 A 21 21 GLU H H 20 8.140 8.215 -0.075 1
1 50 . 29 1 1 A 21 21 GLU HA H 20 4.128 4.082 0.046 1
1 55 . 29 1 1 A 21 21 GLU C C 20 177.675 178.607 -0.932 1
1 56 . 29 1 1 A 21 21 GLU CA C 20 58.520 59.439 -0.919 1
1 57 . 29 1 1 A 21 21 GLU CB C 20 29.765 29.569 0.196 1
1 59 . 29 1 1 A 21 21 GLU N N 20 119.063 119.480 -0.417 1
1 60 . 29 1 1 A 22 22 PHE H H 21 8.009 8.094 -0.085 1
1 61 . 29 1 1 A 22 22 PHE HA H 21 4.123 4.419 -0.296 1
1 68 . 29 1 1 A 22 22 PHE C C 21 176.410 176.969 -0.559 1
1 69 . 29 1 1 A 22 22 PHE CA C 21 62.202 61.550 0.652 1
1 70 . 29 1 1 A 22 22 PHE CB C 21 39.223 39.390 -0.167 1
1 75 . 29 1 1 A 22 22 PHE N N 21 121.211 120.759 0.452 1
1 76 . 29 1 1 A 23 23 ASP H H 22 8.261 8.563 -0.302 1
1 77 . 29 1 1 A 23 23 ASP HA H 22 4.041 4.291 -0.250 1
1 80 . 29 1 1 A 23 23 ASP C C 22 179.078 178.570 0.508 1
1 81 . 29 1 1 A 23 23 ASP CA C 22 57.048 57.294 -0.246 1
1 82 . 29 1 1 A 23 23 ASP CB C 22 40.154 40.084 0.070 1
1 83 . 29 1 1 A 23 23 ASP N N 22 116.876 118.411 -1.535 1
1 84 . 29 1 1 A 24 24 ALA H H 23 7.651 7.541 0.110 1
1 85 . 29 1 1 A 24 24 ALA HA H 23 3.785 3.792 -0.007 1
1 89 . 29 1 1 A 24 24 ALA C C 23 179.577 179.663 -0.086 1
1 90 . 29 1 1 A 24 24 ALA CA C 23 54.341 55.086 -0.745 1
1 91 . 29 1 1 A 24 24 ALA CB C 23 17.762 18.196 -0.434 1
1 92 . 29 1 1 A 24 24 ALA N N 23 121.873 121.692 0.181 1
1 93 . 29 1 1 A 25 25 VAL H H 24 7.718 7.900 -0.182 1
1 94 . 29 1 1 A 25 25 VAL HA H 24 3.216 3.535 -0.319 1
1 102 . 29 1 1 A 25 25 VAL C C 24 177.805 178.297 -0.492 1
1 103 . 29 1 1 A 25 25 VAL CA C 24 66.789 66.744 0.045 1
1 104 . 29 1 1 A 25 25 VAL CB C 24 31.277 31.227 0.050 1
1 107 . 29 1 1 A 25 25 VAL N N 24 117.890 118.464 -0.574 1
1 108 . 29 1 1 A 26 26 VAL H H 25 7.867 7.596 0.271 1
1 109 . 29 1 1 A 26 26 VAL HA H 25 3.274 3.505 -0.231 1
1 117 . 29 1 1 A 26 26 VAL C C 25 177.788 177.833 -0.045 1
1 118 . 29 1 1 A 26 26 VAL CA C 25 67.282 66.277 1.005 1
1 119 . 29 1 1 A 26 26 VAL CB C 25 31.266 31.377 -0.111 1
1 122 . 29 1 1 A 26 26 VAL N N 25 118.170 119.793 -1.623 1
1 123 . 29 1 1 A 27 27 GLY H H 26 7.544 7.653 -0.109 1
1 124 . 29 1 1 A 27 27 GLY HA2 H 26 3.592 3.492 0.100 1
1 125 . 29 1 1 A 27 27 GLY HA3 H 26 3.721 3.605 0.116 1
1 126 . 29 1 1 A 27 27 GLY C C 26 176.717 176.313 0.404 1
1 127 . 29 1 1 A 27 27 GLY CA C 26 47.085 47.173 -0.088 1
1 128 . 29 1 1 A 27 27 GLY N N 26 105.795 107.525 -1.730 1
1 129 . 29 1 1 A 28 28 TYR H H 27 7.625 7.355 0.270 1
1 130 . 29 1 1 A 28 28 TYR HA H 27 4.546 4.558 -0.012 1
1 137 . 29 1 1 A 28 28 TYR C C 27 178.991 178.261 0.730 1
1 138 . 29 1 1 A 28 28 TYR CA C 27 58.845 59.832 -0.987 1
1 139 . 29 1 1 A 28 28 TYR CB C 27 37.602 37.528 0.074 1
1 144 . 29 1 1 A 28 28 TYR N N 27 119.933 121.646 -1.713 1
1 145 . 29 1 1 A 29 29 LEU H H 28 8.517 8.192 0.325 1
1 146 . 29 1 1 A 29 29 LEU HA H 28 3.728 3.812 -0.084 1
1 156 . 29 1 1 A 29 29 LEU CA C 28 58.281 58.057 0.224 1
1 157 . 29 1 1 A 29 29 LEU CB C 28 41.948 41.323 0.625 1
1 161 . 29 1 1 A 29 29 LEU N N 28 119.669 120.345 -0.676 1
1 162 . 29 1 1 A 30 30 GLU H H 29 8.072 8.014 0.058 1
1 163 . 29 1 1 A 30 30 GLU HA H 29 3.722 3.875 -0.153 1
1 168 . 29 1 1 A 30 30 GLU C C 29 177.731 179.349 -1.618 1
1 169 . 29 1 1 A 30 30 GLU CA C 29 59.763 59.973 -0.210 1
1 170 . 29 1 1 A 30 30 GLU CB C 29 28.844 29.271 -0.427 1
1 172 . 29 1 1 A 30 30 GLU N N 29 117.666 117.736 -0.070 1
1 173 . 29 1 1 A 31 31 ASP H H 30 7.243 7.797 -0.554 1
1 174 . 29 1 1 A 31 31 ASP HA H 30 4.297 4.393 -0.096 1
1 177 . 29 1 1 A 31 31 ASP CA C 30 56.953 57.324 -0.371 1
1 178 . 29 1 1 A 31 31 ASP CB C 30 40.730 40.694 0.036 1
1 179 . 29 1 1 A 31 31 ASP N N 30 116.720 119.294 -2.574 1
1 180 . 29 1 1 A 32 32 ILE H H 31 7.940 7.549 0.391 1
1 181 . 29 1 1 A 32 32 ILE HA H 31 3.640 3.707 -0.067 1
1 191 . 29 1 1 A 32 32 ILE C C 31 177.980 178.119 -0.139 1
1 192 . 29 1 1 A 32 32 ILE CA C 31 64.692 64.168 0.524 1
1 193 . 29 1 1 A 32 32 ILE CB C 31 38.938 37.050 1.888 1
1 197 . 29 1 1 A 32 32 ILE N N 31 119.728 120.171 -0.443 1
1 198 . 29 1 1 A 33 33 ILE H H 32 7.984 7.831 0.153 1
1 199 . 29 1 1 A 33 33 ILE HA H 32 3.598 2.991 0.607 1
1 209 . 29 1 1 A 33 33 ILE C C 32 176.723 176.865 -0.142 1
1 210 . 29 1 1 A 33 33 ILE CA C 32 63.241 64.473 -1.232 1
1 211 . 29 1 1 A 33 33 ILE CB C 32 37.580 37.634 -0.054 1
1 215 . 29 1 1 A 33 33 ILE N N 32 113.919 120.540 -6.621 1
1 216 . 29 1 1 A 34 34 MET H H 33 7.288 7.749 -0.461 1
1 217 . 29 1 1 A 34 34 MET HA H 33 4.496 4.727 -0.231 1
1 225 . 29 1 1 A 34 34 MET C C 33 176.423 175.774 0.649 1
1 226 . 29 1 1 A 34 34 MET CA C 33 54.634 54.231 0.403 1
1 227 . 29 1 1 A 34 34 MET CB C 33 31.934 31.591 0.343 1
1 230 . 29 1 1 A 34 34 MET N N 33 115.130 116.943 -1.813 1
1 231 . 29 1 1 A 35 35 ASP H H 34 7.405 7.651 -0.246 1
1 232 . 29 1 1 A 35 35 ASP HA H 34 4.484 4.638 -0.154 1
1 235 . 29 1 1 A 35 35 ASP C C 34 177.139 176.131 1.008 1
1 236 . 29 1 1 A 35 35 ASP CA C 34 54.625 54.567 0.058 1
1 237 . 29 1 1 A 35 35 ASP CB C 34 43.554 42.932 0.622 1
1 238 . 29 1 1 A 35 35 ASP N N 34 121.814 122.378 -0.564 1
1 239 . 29 1 1 A 36 36 ASP H H 35 8.765 9.184 -0.419 1
1 240 . 29 1 1 A 36 36 ASP HA H 35 4.235 4.232 0.003 1
1 243 . 29 1 1 A 36 36 ASP C C 35 178.320 177.771 0.549 1
1 244 . 29 1 1 A 36 36 ASP CA C 35 57.832 58.532 -0.700 1
1 245 . 29 1 1 A 36 36 ASP CB C 35 40.914 41.147 -0.233 1
1 246 . 29 1 1 A 36 36 ASP N N 35 125.883 127.565 -1.682 1
1 247 . 29 1 1 A 37 37 GLU H H 36 8.905 8.427 0.478 1
1 248 . 29 1 1 A 37 37 GLU HA H 36 3.933 4.146 -0.213 1
1 253 . 29 1 1 A 37 37 GLU C C 36 179.304 178.776 0.528 1
1 254 . 29 1 1 A 37 37 GLU CA C 36 59.828 58.791 1.037 1
1 255 . 29 1 1 A 37 37 GLU CB C 36 29.380 28.712 0.668 1
1 257 . 29 1 1 A 37 37 GLU N N 36 119.077 117.183 1.894 1
1 258 . 29 1 1 A 38 38 PHE H H 37 7.460 8.255 -0.795 1
1 259 . 29 1 1 A 38 38 PHE HA H 37 3.642 4.091 -0.449 1
1 267 . 29 1 1 A 38 38 PHE C C 37 176.483 178.056 -1.573 1
1 268 . 29 1 1 A 38 38 PHE CA C 37 61.411 61.248 0.163 1
1 269 . 29 1 1 A 38 38 PHE CB C 37 39.355 39.002 0.353 1
1 275 . 29 1 1 A 38 38 PHE N N 37 119.968 121.542 -1.574 1
1 276 . 29 1 1 A 39 39 GLN H H 38 7.968 7.979 -0.011 1
1 277 . 29 1 1 A 39 39 GLN HA H 38 3.712 3.816 -0.104 1
1 284 . 29 1 1 A 39 39 GLN CA C 38 59.153 58.913 0.240 1
1 285 . 29 1 1 A 39 39 GLN CB C 38 28.213 28.543 -0.330 1
1 287 . 29 1 1 A 39 39 GLN N N 38 116.433 118.460 -2.027 1
1 289 . 29 1 1 A 40 40 LEU H H 39 7.930 7.889 0.041 1
1 290 . 29 1 1 A 40 40 LEU HA H 39 3.916 4.036 -0.120 1
1 300 . 29 1 1 A 40 40 LEU C C 39 177.731 178.107 -0.376 1
1 301 . 29 1 1 A 40 40 LEU CA C 39 57.915 58.088 -0.173 1
1 302 . 29 1 1 A 40 40 LEU CB C 39 41.989 41.231 0.758 1
1 306 . 29 1 1 A 40 40 LEU N N 39 119.505 121.874 -2.369 1
1 307 . 29 1 1 A 41 41 LEU H H 40 7.174 7.839 -0.665 1
1 308 . 29 1 1 A 41 41 LEU HA H 40 3.835 3.967 -0.132 1
1 318 . 29 1 1 A 41 41 LEU C C 40 179.738 178.483 1.255 1
1 319 . 29 1 1 A 41 41 LEU CA C 40 58.266 58.281 -0.015 1
1 320 . 29 1 1 A 41 41 LEU CB C 40 42.050 41.702 0.348 1
1 324 . 29 1 1 A 41 41 LEU N N 40 120.971 119.890 1.081 1
1 325 . 29 1 1 A 42 42 GLN H H 41 8.058 7.888 0.170 1
1 326 . 29 1 1 A 42 42 GLN HA H 41 3.556 3.757 -0.201 1
1 333 . 29 1 1 A 42 42 GLN C C 41 177.642 178.325 -0.683 1
1 334 . 29 1 1 A 42 42 GLN CA C 41 59.826 59.233 0.593 1
1 335 . 29 1 1 A 42 42 GLN CB C 41 28.762 28.485 0.277 1
1 337 . 29 1 1 A 42 42 GLN N N 41 117.899 118.221 -0.322 1
1 339 . 29 1 1 A 43 43 ARG H H 42 8.179 7.774 0.405 1
1 340 . 29 1 1 A 43 43 ARG HA H 42 3.655 3.980 -0.325 1
1 347 . 29 1 1 A 43 43 ARG C C 42 178.051 178.645 -0.594 1
1 348 . 29 1 1 A 43 43 ARG CA C 42 59.766 58.985 0.781 1
1 349 . 29 1 1 A 43 43 ARG CB C 42 29.941 29.884 0.057 1
1 352 . 29 1 1 A 43 43 ARG N N 42 119.392 118.604 0.788 1
1 353 . 29 1 1 A 44 44 ASN H H 43 8.525 7.948 0.577 1
1 354 . 29 1 1 A 44 44 ASN HA H 43 4.332 4.319 0.013 1
1 359 . 29 1 1 A 44 44 ASN C C 43 178.150 177.644 0.506 1
1 360 . 29 1 1 A 44 44 ASN CA C 43 55.841 56.098 -0.257 1
1 361 . 29 1 1 A 44 44 ASN CB C 43 37.632 39.185 -1.553 1
1 362 . 29 1 1 A 44 44 ASN N N 43 116.214 117.520 -1.306 1
1 364 . 29 1 1 A 45 45 PHE H H 44 7.586 7.720 -0.134 1
1 365 . 29 1 1 A 45 45 PHE HA H 44 4.132 4.311 -0.179 1
1 372 . 29 1 1 A 45 45 PHE C C 44 176.691 178.426 -1.735 1
1 373 . 29 1 1 A 45 45 PHE CA C 44 62.333 60.678 1.655 1
1 374 . 29 1 1 A 45 45 PHE CB C 44 39.449 38.794 0.655 1
1 379 . 29 1 1 A 45 45 PHE N N 44 121.501 117.544 3.957 1
1 380 . 29 1 1 A 46 46 MET H H 45 8.190 8.379 -0.189 1
1 381 . 29 1 1 A 46 46 MET HA H 45 4.060 4.257 -0.197 1
1 389 . 29 1 1 A 46 46 MET C C 45 179.754 178.107 1.647 1
1 390 . 29 1 1 A 46 46 MET CA C 45 57.742 57.861 -0.119 1
1 391 . 29 1 1 A 46 46 MET CB C 45 29.912 31.105 -1.193 1
1 394 . 29 1 1 A 46 46 MET N N 45 116.727 117.507 -0.780 1
1 395 . 29 1 1 A 47 47 ASP H H 46 8.579 8.168 0.411 1
1 396 . 29 1 1 A 47 47 ASP HA H 46 4.804 4.470 0.334 1
1 399 . 29 1 1 A 47 47 ASP C C 46 177.854 178.492 -0.638 1
1 400 . 29 1 1 A 47 47 ASP CA C 46 57.277 57.146 0.131 1
1 401 . 29 1 1 A 47 47 ASP CB C 46 40.776 41.814 -1.038 1
1 402 . 29 1 1 A 47 47 ASP N N 46 117.798 120.662 -2.864 1
1 403 . 29 1 1 A 48 48 LYS H H 47 7.339 7.904 -0.565 1
1 404 . 29 1 1 A 48 48 LYS HA H 47 3.828 4.220 -0.392 1
1 413 . 29 1 1 A 48 48 LYS C C 47 178.812 178.745 0.067 1
1 414 . 29 1 1 A 48 48 LYS CA C 47 58.953 58.737 0.216 1
1 415 . 29 1 1 A 48 48 LYS CB C 47 32.796 32.914 -0.118 1
1 419 . 29 1 1 A 48 48 LYS N N 47 117.852 119.572 -1.720 1
1 420 . 29 1 1 A 49 49 TYR H H 48 6.841 8.534 -1.693 1
1 421 . 29 1 1 A 49 49 TYR HA H 48 4.995 4.601 0.394 1
1 428 . 29 1 1 A 49 49 TYR C C 48 178.138 178.282 -0.144 1
1 429 . 29 1 1 A 49 49 TYR CA C 48 58.620 59.848 -1.228 1
1 430 . 29 1 1 A 49 49 TYR CB C 48 42.939 38.347 4.592 1
1 435 . 29 1 1 A 49 49 TYR N N 48 112.109 119.677 -7.568 1
1 436 . 29 1 1 A 50 50 TYR H H 49 8.491 8.191 0.300 1
1 437 . 29 1 1 A 50 50 TYR HA H 49 4.598 4.230 0.368 1
1 444 . 29 1 1 A 50 50 TYR C C 49 176.015 176.955 -0.940 1
1 445 . 29 1 1 A 50 50 TYR CA C 49 62.442 59.995 2.447 1
1 446 . 29 1 1 A 50 50 TYR CB C 49 36.588 37.591 -1.003 1
1 451 . 29 1 1 A 50 50 TYR N N 49 118.294 119.336 -1.042 1
1 452 . 29 1 1 A 51 51 LEU H H 50 7.512 7.842 -0.330 1
1 453 . 29 1 1 A 51 51 LEU HA H 50 3.878 3.574 0.304 1
1 463 . 29 1 1 A 51 51 LEU C C 50 178.625 178.045 0.580 1
1 464 . 29 1 1 A 51 51 LEU CA C 50 55.994 57.618 -1.624 1
1 465 . 29 1 1 A 51 51 LEU CB C 50 40.743 41.652 -0.909 1
1 469 . 29 1 1 A 51 51 LEU N N 50 118.478 119.697 -1.219 1
1 470 . 29 1 1 A 52 52 GLU H H 51 8.042 8.668 -0.626 1
1 471 . 29 1 1 A 52 52 GLU HA H 51 4.197 3.992 0.205 1
1 476 . 29 1 1 A 52 52 GLU C C 51 177.629 176.799 0.830 1
1 477 . 29 1 1 A 52 52 GLU CA C 51 56.141 58.996 -2.855 1
1 478 . 29 1 1 A 52 52 GLU CB C 51 29.162 28.843 0.319 1
1 480 . 29 1 1 A 52 52 GLU N N 51 115.067 118.618 -3.551 1
1 481 . 29 1 1 A 53 53 PHE H H 52 7.465 8.081 -0.616 1
1 482 . 29 1 1 A 53 53 PHE HA H 52 4.431 4.530 -0.099 1
1 490 . 29 1 1 A 53 53 PHE C C 52 174.325 174.930 -0.605 1
1 491 . 29 1 1 A 53 53 PHE CA C 52 58.986 57.810 1.176 1
1 492 . 29 1 1 A 53 53 PHE CB C 52 40.183 38.006 2.177 1
1 498 . 29 1 1 A 53 53 PHE N N 52 116.768 119.328 -2.560 1
1 499 . 29 1 1 A 54 54 GLU H H 53 7.484 8.544 -1.060 1
1 500 . 29 1 1 A 54 54 GLU HA H 53 4.583 4.906 -0.323 1
1 505 . 29 1 1 A 54 54 GLU C C 53 175.722 175.357 0.365 1
1 506 . 29 1 1 A 54 54 GLU CA C 53 54.248 54.399 -0.151 1
1 507 . 29 1 1 A 54 54 GLU CB C 53 34.409 33.123 1.286 1
1 509 . 29 1 1 A 54 54 GLU N N 53 118.844 125.618 -6.774 1
1 510 . 29 1 1 A 55 55 ASP H H 54 9.008 8.698 0.310 1
1 511 . 29 1 1 A 55 55 ASP HA H 54 4.735 4.859 -0.124 1
1 514 . 29 1 1 A 55 55 ASP C C 54 175.421 176.064 -0.643 1
1 515 . 29 1 1 A 55 55 ASP CA C 54 52.888 54.227 -1.339 1
1 516 . 29 1 1 A 55 55 ASP CB C 54 38.894 41.080 -2.186 1
1 517 . 29 1 1 A 55 55 ASP N N 54 123.654 126.854 -3.200 1
1 518 . 29 1 1 A 56 56 THR H H 55 7.819 8.510 -0.691 1
1 519 . 29 1 1 A 56 56 THR HA H 55 4.574 4.936 -0.362 1
1 524 . 29 1 1 A 56 56 THR C C 55 174.096 174.042 0.054 1
1 525 . 29 1 1 A 56 56 THR CA C 55 59.172 59.916 -0.744 1
1 526 . 29 1 1 A 56 56 THR CB C 55 71.889 72.008 -0.119 1
1 528 . 29 1 1 A 56 56 THR N N 55 112.015 118.235 -6.220 1
1 529 . 29 1 1 A 57 57 GLU H H 56 8.527 8.641 -0.114 1
1 530 . 29 1 1 A 57 57 GLU HA H 56 4.217 4.552 -0.335 1
1 535 . 29 1 1 A 57 57 GLU C C 56 177.042 175.916 1.126 1
1 536 . 29 1 1 A 57 57 GLU CA C 56 56.869 56.578 0.291 1
1 537 . 29 1 1 A 57 57 GLU CB C 56 29.731 31.052 -1.321 1
1 539 . 29 1 1 A 57 57 GLU N N 56 117.531 118.672 -1.141 1
1 540 . 29 1 1 A 58 58 GLU H H 57 7.587 8.056 -0.469 1
1 541 . 29 1 1 A 58 58 GLU HA H 57 3.941 4.806 -0.865 1
1 546 . 29 1 1 A 58 58 GLU C C 57 176.849 176.100 0.749 1
1 547 . 29 1 1 A 58 58 GLU CA C 57 56.924 54.975 1.949 1
1 548 . 29 1 1 A 58 58 GLU CB C 57 30.251 32.570 -2.319 1
1 550 . 29 1 1 A 58 58 GLU N N 57 119.183 120.232 -1.049 1
1 551 . 29 1 1 A 59 59 ASN H H 58 9.120 8.757 0.363 1
1 552 . 29 1 1 A 59 59 ASN HA H 58 4.922 4.942 -0.020 1
1 557 . 29 1 1 A 59 59 ASN C C 58 174.254 174.933 -0.679 1
1 558 . 29 1 1 A 59 59 ASN CA C 58 51.956 52.391 -0.435 1
1 559 . 29 1 1 A 59 59 ASN CB C 58 37.404 39.850 -2.446 1
1 560 . 29 1 1 A 59 59 ASN N N 58 126.767 123.210 3.557 1
1 562 . 29 1 1 A 60 60 LYS H H 59 5.892 8.628 -2.736 1
1 563 . 29 1 1 A 60 60 LYS HA H 59 3.798 5.012 -1.214 1
1 572 . 29 1 1 A 60 60 LYS C C 59 177.908 177.142 0.766 1
1 573 . 29 1 1 A 60 60 LYS CA C 59 56.623 54.961 1.662 1
1 574 . 29 1 1 A 60 60 LYS CB C 59 32.279 35.498 -3.219 1
1 578 . 29 1 1 A 60 60 LYS N N 59 121.527 119.995 1.532 1
1 579 . 29 1 1 A 61 61 LEU H H 60 8.473 8.797 -0.324 1
1 580 . 29 1 1 A 61 61 LEU HA H 60 3.891 4.318 -0.427 1
1 590 . 29 1 1 A 61 61 LEU C C 60 179.843 177.926 1.917 1
1 591 . 29 1 1 A 61 61 LEU CA C 60 58.301 57.011 1.290 1
1 592 . 29 1 1 A 61 61 LEU CB C 60 41.305 42.269 -0.964 1
1 596 . 29 1 1 A 61 61 LEU N N 60 125.639 125.447 0.192 1
1 597 . 29 1 1 A 62 62 ILE H H 61 7.698 7.865 -0.167 1
1 598 . 29 1 1 A 62 62 ILE HA H 61 3.952 3.889 0.063 1
1 608 . 29 1 1 A 62 62 ILE C C 61 175.392 177.256 -1.864 1
1 609 . 29 1 1 A 62 62 ILE CA C 61 61.743 63.202 -1.459 1
1 610 . 29 1 1 A 62 62 ILE CB C 61 39.108 37.712 1.396 1
1 614 . 29 1 1 A 62 62 ILE N N 61 114.111 118.908 -4.797 1
1 615 . 29 1 1 A 63 63 TYR H H 62 7.273 7.823 -0.550 1
1 616 . 29 1 1 A 63 63 TYR HA H 62 4.343 4.272 0.071 1
1 623 . 29 1 1 A 63 63 TYR C C 62 178.264 178.569 -0.305 1
1 624 . 29 1 1 A 63 63 TYR CA C 62 57.231 60.987 -3.756 1
1 625 . 29 1 1 A 63 63 TYR CB C 62 36.332 37.371 -1.039 1
1 630 . 29 1 1 A 63 63 TYR N N 62 117.689 121.301 -3.612 1
1 631 . 29 1 1 A 64 64 THR H H 63 7.747 7.953 -0.206 1
1 632 . 29 1 1 A 64 64 THR HA H 63 4.266 4.221 0.045 1
1 637 . 29 1 1 A 64 64 THR CA C 63 69.362 67.558 1.804 1
1 638 . 29 1 1 A 64 64 THR CB C 63 66.962 67.639 -0.677 1
1 640 . 29 1 1 A 64 64 THR N N 63 113.755 116.268 -2.513 1
1 641 . 29 1 1 A 65 65 PRO HA H 64 4.372 4.387 -0.015 1
1 648 . 29 1 1 A 65 65 PRO C C 64 179.913 179.371 0.542 1
1 649 . 29 1 1 A 65 65 PRO CA C 64 66.011 66.176 -0.165 1
1 650 . 29 1 1 A 65 65 PRO CB C 64 30.642 30.658 -0.016 1
1 653 . 29 1 1 A 66 66 ILE H H 65 7.377 7.349 0.028 1
1 654 . 29 1 1 A 66 66 ILE HA H 65 3.530 3.901 -0.371 1
1 664 . 29 1 1 A 66 66 ILE C C 65 177.543 178.154 -0.611 1
1 665 . 29 1 1 A 66 66 ILE CA C 65 66.647 64.314 2.333 1
1 666 . 29 1 1 A 66 66 ILE CB C 65 38.029 37.675 0.354 1
1 670 . 29 1 1 A 66 66 ILE N N 65 118.353 116.605 1.748 1
1 671 . 29 1 1 A 67 67 PHE H H 66 8.480 8.446 0.034 1
1 672 . 29 1 1 A 67 67 PHE HA H 66 4.115 4.464 -0.349 1
1 680 . 29 1 1 A 67 67 PHE C C 66 177.293 178.470 -1.177 1
1 681 . 29 1 1 A 67 67 PHE CA C 66 59.570 62.022 -2.452 1
1 682 . 29 1 1 A 67 67 PHE CB C 66 38.865 39.611 -0.746 1
1 688 . 29 1 1 A 67 67 PHE N N 66 122.420 120.385 2.035 1
1 689 . 29 1 1 A 68 68 ASN H H 67 8.595 8.176 0.419 1
1 690 . 29 1 1 A 68 68 ASN HA H 67 4.211 4.426 -0.215 1
1 695 . 29 1 1 A 68 68 ASN C C 67 178.697 178.169 0.528 1
1 696 . 29 1 1 A 68 68 ASN CA C 67 56.056 56.242 -0.186 1
1 697 . 29 1 1 A 68 68 ASN CB C 67 37.704 38.019 -0.315 1
1 698 . 29 1 1 A 68 68 ASN N N 67 115.573 117.142 -1.569 1
1 700 . 29 1 1 A 69 69 GLU H H 68 8.414 7.931 0.483 1
1 701 . 29 1 1 A 69 69 GLU HA H 68 4.102 4.134 -0.032 1
1 706 . 29 1 1 A 69 69 GLU C C 68 177.880 178.814 -0.934 1
1 707 . 29 1 1 A 69 69 GLU CA C 68 59.399 59.418 -0.019 1
1 708 . 29 1 1 A 69 69 GLU CB C 68 29.855 29.386 0.469 1
1 710 . 29 1 1 A 69 69 GLU N N 68 123.510 120.125 3.385 1
1 711 . 29 1 1 A 70 70 TYR H H 69 8.659 8.063 0.596 1
1 712 . 29 1 1 A 70 70 TYR HA H 69 3.362 4.015 -0.653 1
1 719 . 29 1 1 A 70 70 TYR C C 69 178.143 177.192 0.951 1
1 720 . 29 1 1 A 70 70 TYR CA C 69 60.686 61.079 -0.393 1
1 721 . 29 1 1 A 70 70 TYR CB C 69 38.560 38.808 -0.248 1
1 726 . 29 1 1 A 70 70 TYR N N 69 122.130 120.508 1.622 1
1 727 . 29 1 1 A 71 71 ILE H H 70 8.031 7.573 0.458 1
1 728 . 29 1 1 A 71 71 ILE HA H 70 3.265 3.621 -0.356 1
1 738 . 29 1 1 A 71 71 ILE C C 70 178.056 178.183 -0.127 1
1 739 . 29 1 1 A 71 71 ILE CA C 70 63.756 63.920 -0.164 1
1 740 . 29 1 1 A 71 71 ILE CB C 70 37.321 37.490 -0.169 1
1 744 . 29 1 1 A 71 71 ILE N N 70 118.906 120.436 -1.530 1
1 745 . 29 1 1 A 72 72 SER H H 71 7.803 8.002 -0.199 1
1 746 . 29 1 1 A 72 72 SER HA H 71 4.029 4.179 -0.150 1
1 749 . 29 1 1 A 72 72 SER CA C 71 61.380 60.980 0.400 1
1 750 . 29 1 1 A 72 72 SER CB C 71 63.288 63.150 0.138 1
1 751 . 29 1 1 A 72 72 SER N N 71 113.735 115.510 -1.775 1
1 752 . 29 1 1 A 73 73 LEU H H 72 7.952 7.801 0.151 1
1 753 . 29 1 1 A 73 73 LEU HA H 72 4.418 4.121 0.297 1
1 763 . 29 1 1 A 73 73 LEU C C 72 177.767 178.101 -0.334 1
1 764 . 29 1 1 A 73 73 LEU CA C 72 56.543 57.425 -0.882 1
1 765 . 29 1 1 A 73 73 LEU CB C 72 44.517 41.671 2.846 1
1 769 . 29 1 1 A 73 73 LEU N N 72 119.411 122.183 -2.772 1
1 770 . 29 1 1 A 74 74 VAL H H 73 8.021 7.739 0.282 1
1 771 . 29 1 1 A 74 74 VAL HA H 73 3.532 3.349 0.183 1
1 779 . 29 1 1 A 74 74 VAL C C 73 177.126 177.880 -0.754 1
1 780 . 29 1 1 A 74 74 VAL CA C 73 66.250 66.427 -0.177 1
1 781 . 29 1 1 A 74 74 VAL CB C 73 31.212 31.166 0.046 1
1 784 . 29 1 1 A 74 74 VAL N N 73 118.747 119.087 -0.340 1
1 785 . 29 1 1 A 75 75 GLU H H 74 7.232 7.979 -0.747 1
1 786 . 29 1 1 A 75 75 GLU HA H 74 3.013 4.036 -1.023 1
1 791 . 29 1 1 A 75 75 GLU C C 74 178.804 179.429 -0.625 1
1 792 . 29 1 1 A 75 75 GLU CA C 74 60.536 59.809 0.727 1
1 793 . 29 1 1 A 75 75 GLU CB C 74 27.009 28.925 -1.916 1
1 795 . 29 1 1 A 75 75 GLU N N 74 118.660 119.731 -1.071 1
1 796 . 29 1 1 A 76 76 LYS H H 75 7.051 7.987 -0.936 1
1 797 . 29 1 1 A 76 76 LYS HA H 75 3.765 4.097 -0.332 1
1 806 . 29 1 1 A 76 76 LYS C C 75 177.765 178.360 -0.595 1
1 807 . 29 1 1 A 76 76 LYS CA C 75 58.357 58.240 0.117 1
1 808 . 29 1 1 A 76 76 LYS CB C 75 31.939 32.416 -0.477 1
1 812 . 29 1 1 A 76 76 LYS N N 75 116.112 119.324 -3.212 1
1 813 . 29 1 1 A 77 77 TYR H H 76 7.067 7.965 -0.898 1
1 814 . 29 1 1 A 77 77 TYR HA H 76 4.036 4.118 -0.082 1
1 821 . 29 1 1 A 77 77 TYR C C 76 177.752 176.987 0.765 1
1 822 . 29 1 1 A 77 77 TYR CA C 76 61.820 61.400 0.420 1
1 823 . 29 1 1 A 77 77 TYR CB C 76 38.480 38.709 -0.229 1
1 828 . 29 1 1 A 77 77 TYR N N 76 118.434 121.923 -3.489 1
1 829 . 29 1 1 A 78 78 ILE H H 77 7.554 8.048 -0.494 1
1 830 . 29 1 1 A 78 78 ILE HA H 77 3.159 3.603 -0.444 1
1 840 . 29 1 1 A 78 78 ILE C C 77 177.341 177.798 -0.457 1
1 841 . 29 1 1 A 78 78 ILE CA C 77 65.177 64.610 0.567 1
1 842 . 29 1 1 A 78 78 ILE CB C 77 37.339 36.854 0.485 1
1 846 . 29 1 1 A 78 78 ILE N N 77 117.672 120.331 -2.659 1
1 847 . 29 1 1 A 79 79 GLU H H 78 8.296 8.105 0.191 1
1 848 . 29 1 1 A 79 79 GLU HA H 78 3.557 3.834 -0.277 1
1 853 . 29 1 1 A 79 79 GLU C C 78 177.742 178.856 -1.114 1
1 854 . 29 1 1 A 79 79 GLU CA C 78 60.847 60.119 0.728 1
1 855 . 29 1 1 A 79 79 GLU CB C 78 29.594 29.229 0.365 1
1 857 . 29 1 1 A 79 79 GLU N N 78 118.701 120.966 -2.265 1
1 858 . 29 1 1 A 80 80 GLU H H 79 8.330 8.240 0.090 1
1 859 . 29 1 1 A 80 80 GLU HA H 79 3.774 4.036 -0.262 1
1 864 . 29 1 1 A 80 80 GLU C C 79 179.926 179.358 0.568 1
1 865 . 29 1 1 A 80 80 GLU CA C 79 59.581 58.958 0.623 1
1 866 . 29 1 1 A 80 80 GLU CB C 79 29.062 29.161 -0.099 1
1 868 . 29 1 1 A 80 80 GLU N N 79 116.767 118.164 -1.397 1
1 869 . 29 1 1 A 81 81 GLN H H 80 7.634 7.702 -0.068 1
1 870 . 29 1 1 A 81 81 GLN HA H 80 3.605 3.860 -0.255 1
1 877 . 29 1 1 A 81 81 GLN C C 80 179.681 178.618 1.063 1
1 878 . 29 1 1 A 81 81 GLN CA C 80 57.765 58.444 -0.679 1
1 879 . 29 1 1 A 81 81 GLN CB C 80 28.079 28.035 0.044 1
1 881 . 29 1 1 A 81 81 GLN N N 80 116.325 118.714 -2.389 1
1 883 . 29 1 1 A 82 82 LEU H H 81 8.156 7.614 0.542 1
1 884 . 29 1 1 A 82 82 LEU HA H 81 3.536 3.800 -0.264 1
1 894 . 29 1 1 A 82 82 LEU C C 81 178.945 179.480 -0.535 1
1 895 . 29 1 1 A 82 82 LEU CA C 81 57.761 56.880 0.881 1
1 896 . 29 1 1 A 82 82 LEU CB C 81 40.961 40.890 0.071 1
1 900 . 29 1 1 A 82 82 LEU N N 81 121.546 120.364 1.182 1
1 901 . 29 1 1 A 83 83 LEU H H 82 8.326 7.939 0.387 1
1 902 . 29 1 1 A 83 83 LEU HA H 82 4.198 4.261 -0.063 1
1 912 . 29 1 1 A 83 83 LEU C C 82 178.631 179.317 -0.686 1
1 913 . 29 1 1 A 83 83 LEU CA C 82 57.016 57.254 -0.238 1
1 914 . 29 1 1 A 83 83 LEU CB C 82 42.182 40.722 1.460 1
1 918 . 29 1 1 A 83 83 LEU N N 82 120.426 119.414 1.012 1
1 919 . 29 1 1 A 84 84 GLN H H 83 6.992 7.665 -0.673 1
1 920 . 29 1 1 A 84 84 GLN HA H 83 3.877 4.011 -0.134 1
1 927 . 29 1 1 A 84 84 GLN C C 83 177.008 177.031 -0.023 1
1 928 . 29 1 1 A 84 84 GLN CA C 83 57.543 58.507 -0.964 1
1 929 . 29 1 1 A 84 84 GLN CB C 83 28.688 28.438 0.250 1
1 931 . 29 1 1 A 84 84 GLN N N 83 114.001 117.241 -3.240 1
1 933 . 29 1 1 A 85 85 ARG H H 84 7.072 7.367 -0.295 1
1 934 . 29 1 1 A 85 85 ARG HA H 84 4.047 4.366 -0.319 1
1 942 . 29 1 1 A 85 85 ARG C C 84 175.999 175.719 0.280 1
1 943 . 29 1 1 A 85 85 ARG CA C 84 56.764 56.256 0.508 1
1 944 . 29 1 1 A 85 85 ARG CB C 84 32.044 32.389 -0.345 1
1 947 . 29 1 1 A 85 85 ARG N N 84 115.827 116.646 -0.819 1
1 949 . 29 1 1 A 86 86 ILE H H 85 8.238 7.811 0.427 1
1 950 . 29 1 1 A 86 86 ILE HA H 85 4.389 4.522 -0.133 1
1 960 . 29 1 1 A 86 86 ILE CA C 85 58.007 57.828 0.179 1
1 961 . 29 1 1 A 86 86 ILE CB C 85 39.604 38.845 0.759 1
1 965 . 29 1 1 A 86 86 ILE N N 85 119.285 120.541 -1.256 1
1 966 . 29 1 1 A 87 87 PRO HA H 86 4.392 4.505 -0.113 1
1 973 . 29 1 1 A 87 87 PRO C C 86 177.622 176.739 0.883 1
1 974 . 29 1 1 A 87 87 PRO CA C 86 64.665 64.314 0.351 1
1 975 . 29 1 1 A 87 87 PRO CB C 86 32.020 31.687 0.333 1
1 978 . 29 1 1 A 88 88 GLU H H 87 8.312 8.183 0.129 1
1 979 . 29 1 1 A 88 88 GLU HA H 87 4.208 4.556 -0.348 1
1 984 . 29 1 1 A 88 88 GLU C C 87 175.554 175.911 -0.357 1
1 985 . 29 1 1 A 88 88 GLU CA C 87 56.045 56.272 -0.227 1
1 986 . 29 1 1 A 88 88 GLU CB C 87 28.654 30.715 -2.061 1
1 988 . 29 1 1 A 88 88 GLU N N 87 114.256 116.662 -2.406 1
1 989 . 29 1 1 A 89 89 PHE H H 88 7.946 7.728 0.218 1
1 990 . 29 1 1 A 89 89 PHE HA H 88 3.993 4.412 -0.419 1
1 998 . 29 1 1 A 89 89 PHE C C 88 173.460 174.736 -1.276 1
1 999 . 29 1 1 A 89 89 PHE CA C 88 60.119 59.366 0.753 1
1 1000 . 29 1 1 A 89 89 PHE CB C 88 39.994 39.554 0.440 1
1 1006 . 29 1 1 A 89 89 PHE N N 88 121.550 123.056 -1.506 1
1 1007 . 29 1 1 A 90 90 ASN H H 89 7.266 7.963 -0.697 1
1 1008 . 29 1 1 A 90 90 ASN HA H 89 4.454 4.969 -0.515 1
1 1013 . 29 1 1 A 90 90 ASN C C 89 173.921 175.139 -1.218 1
1 1014 . 29 1 1 A 90 90 ASN CA C 89 51.839 51.137 0.702 1
1 1015 . 29 1 1 A 90 90 ASN CB C 89 40.674 39.224 1.450 1
1 1016 . 29 1 1 A 90 90 ASN N N 89 125.344 125.410 -0.066 1
1 1018 . 29 1 1 A 91 91 MET H H 90 8.968 8.737 0.231 1
1 1019 . 29 1 1 A 91 91 MET HA H 90 4.049 4.183 -0.134 1
1 1027 . 29 1 1 A 91 91 MET C C 90 177.475 178.071 -0.596 1
1 1028 . 29 1 1 A 91 91 MET CA C 90 57.758 58.202 -0.444 1
1 1029 . 29 1 1 A 91 91 MET CB C 90 32.250 32.366 -0.116 1
1 1032 . 29 1 1 A 91 91 MET N N 90 127.052 125.013 2.039 1
1 1033 . 29 1 1 A 92 92 ALA H H 91 8.292 8.123 0.169 1
1 1034 . 29 1 1 A 92 92 ALA HA H 91 4.059 4.143 -0.084 1
1 1038 . 29 1 1 A 92 92 ALA C C 91 180.412 179.947 0.465 1
1 1039 . 29 1 1 A 92 92 ALA CA C 91 55.368 55.048 0.320 1
1 1040 . 29 1 1 A 92 92 ALA CB C 91 17.527 18.356 -0.829 1
1 1041 . 29 1 1 A 92 92 ALA N N 91 123.752 121.471 2.281 1
1 1042 . 29 1 1 A 93 93 ALA H H 92 7.931 8.056 -0.125 1
1 1043 . 29 1 1 A 93 93 ALA HA H 92 4.054 4.092 -0.038 1
1 1047 . 29 1 1 A 93 93 ALA C C 92 180.482 179.769 0.713 1
1 1048 . 29 1 1 A 93 93 ALA CA C 92 54.614 54.868 -0.254 1
1 1049 . 29 1 1 A 93 93 ALA CB C 92 18.098 18.317 -0.219 1
1 1050 . 29 1 1 A 93 93 ALA N N 92 121.158 120.050 1.108 1
1 1051 . 29 1 1 A 94 94 PHE H H 93 8.110 7.843 0.267 1
1 1052 . 29 1 1 A 94 94 PHE HA H 93 4.304 4.149 0.155 1
1 1060 . 29 1 1 A 94 94 PHE C C 93 177.350 177.188 0.162 1
1 1061 . 29 1 1 A 94 94 PHE CA C 93 61.641 61.491 0.150 1
1 1062 . 29 1 1 A 94 94 PHE CB C 93 40.014 39.251 0.763 1
1 1068 . 29 1 1 A 94 94 PHE N N 93 119.807 120.253 -0.446 1
1 1069 . 29 1 1 A 95 95 THR H H 94 8.726 8.406 0.320 1
1 1070 . 29 1 1 A 95 95 THR HA H 94 3.569 3.954 -0.385 1
1 1075 . 29 1 1 A 95 95 THR C C 94 176.932 176.820 0.112 1
1 1076 . 29 1 1 A 95 95 THR CA C 94 66.833 65.401 1.432 1
1 1077 . 29 1 1 A 95 95 THR CB C 94 68.445 68.134 0.311 1
1 1079 . 29 1 1 A 95 95 THR N N 94 113.074 112.376 0.698 1
1 1080 . 29 1 1 A 96 96 THR H H 95 7.657 7.792 -0.135 1
1 1081 . 29 1 1 A 96 96 THR HA H 95 3.945 4.017 -0.072 1
1 1086 . 29 1 1 A 96 96 THR C C 95 176.386 176.408 -0.022 1
1 1087 . 29 1 1 A 96 96 THR CA C 95 66.550 66.029 0.521 1
1 1088 . 29 1 1 A 96 96 THR CB C 95 68.583 68.520 0.063 1
1 1090 . 29 1 1 A 96 96 THR N N 95 117.927 117.422 0.505 1
1 1091 . 29 1 1 A 97 97 THR H H 96 7.699 7.596 0.103 1
1 1092 . 29 1 1 A 97 97 THR HA H 96 3.905 3.977 -0.072 1
1 1097 . 29 1 1 A 97 97 THR C C 96 176.572 176.432 0.140 1
1 1098 . 29 1 1 A 97 97 THR CA C 96 65.979 66.313 -0.334 1
1 1099 . 29 1 1 A 97 97 THR CB C 96 68.553 68.253 0.300 1
1 1101 . 29 1 1 A 97 97 THR N N 96 118.518 117.679 0.839 1
1 1102 . 29 1 1 A 98 98 LEU H H 97 8.304 8.080 0.224 1
1 1103 . 29 1 1 A 98 98 LEU HA H 97 3.725 3.802 -0.077 1
1 1113 . 29 1 1 A 98 98 LEU C C 97 178.490 178.451 0.039 1
1 1114 . 29 1 1 A 98 98 LEU CA C 97 58.517 57.987 0.530 1
1 1115 . 29 1 1 A 98 98 LEU CB C 97 41.697 41.032 0.665 1
1 1119 . 29 1 1 A 98 98 LEU N N 97 122.882 121.967 0.915 1
1 1120 . 29 1 1 A 99 99 GLN H H 98 7.639 7.788 -0.149 1
1 1121 . 29 1 1 A 99 99 GLN HA H 98 3.927 3.908 0.019 1
1 1128 . 29 1 1 A 99 99 GLN C C 98 178.068 178.872 -0.804 1
1 1129 . 29 1 1 A 99 99 GLN CA C 98 58.735 59.139 -0.404 1
1 1130 . 29 1 1 A 99 99 GLN CB C 98 27.986 28.165 -0.179 1
1 1132 . 29 1 1 A 99 99 GLN N N 98 114.302 118.164 -3.862 1
1 1134 . 29 1 1 A 100 100 HIS H H 99 7.575 7.795 -0.220 1
1 1135 . 29 1 1 A 100 100 HIS HA H 99 4.524 4.366 0.158 1
1 1139 . 29 1 1 A 100 100 HIS C C 99 174.789 177.972 -3.183 1
1 1140 . 29 1 1 A 100 100 HIS CA C 99 56.154 60.091 -3.937 1
1 1141 . 29 1 1 A 100 100 HIS CB C 99 28.946 30.604 -1.658 1
1 1143 . 29 1 1 A 100 100 HIS N N 99 114.778 119.373 -4.595 1
1 1144 . 29 1 1 A 101 101 HIS H H 100 7.773 8.136 -0.363 1
1 1145 . 29 1 1 A 101 101 HIS HA H 100 4.704 4.393 0.311 1
1 1149 . 29 1 1 A 101 101 HIS C C 100 174.818 177.225 -2.407 1
1 1150 . 29 1 1 A 101 101 HIS CA C 100 54.830 58.616 -3.786 1
1 1151 . 29 1 1 A 101 101 HIS CB C 100 29.749 28.597 1.152 1
1 1153 . 29 1 1 A 101 101 HIS N N 100 117.397 117.490 -0.093 1
1 1154 . 29 1 1 A 102 102 LYS H H 101 7.324 8.098 -0.774 1
1 1155 . 29 1 1 A 102 102 LYS HA H 101 3.611 4.053 -0.442 1
1 1164 . 29 1 1 A 102 102 LYS C C 101 176.823 178.113 -1.290 1
1 1165 . 29 1 1 A 102 102 LYS CA C 101 59.915 58.930 0.985 1
1 1166 . 29 1 1 A 102 102 LYS CB C 101 32.825 32.002 0.823 1
1 1170 . 29 1 1 A 102 102 LYS N N 101 120.533 121.926 -1.393 1
1 1171 . 29 1 1 A 103 103 ASP H H 102 8.361 7.716 0.645 1
1 1172 . 29 1 1 A 103 103 ASP HA H 102 4.421 4.451 -0.030 1
1 1175 . 29 1 1 A 103 103 ASP C C 102 176.793 177.374 -0.581 1
1 1176 . 29 1 1 A 103 103 ASP CA C 102 55.500 56.216 -0.716 1
1 1177 . 29 1 1 A 103 103 ASP CB C 102 40.178 40.974 -0.796 1
1 1178 . 29 1 1 A 103 103 ASP N N 102 114.814 119.417 -4.603 1
1 1179 . 29 1 1 A 104 104 GLU H H 103 7.858 7.658 0.200 1
1 1180 . 29 1 1 A 104 104 GLU HA H 103 4.339 4.441 -0.102 1
1 1183 . 29 1 1 A 104 104 GLU C C 103 175.777 176.620 -0.843 1
1 1184 . 29 1 1 A 104 104 GLU CA C 103 56.356 57.995 -1.639 1
1 1185 . 29 1 1 A 104 104 GLU CB C 103 31.293 30.819 0.474 1
1 1186 . 29 1 1 A 104 104 GLU N N 103 116.826 117.285 -0.459 1
1 1187 . 29 1 1 A 105 105 VAL H H 104 7.201 7.567 -0.366 1
1 1188 . 29 1 1 A 105 105 VAL HA H 104 4.296 4.187 0.109 1
1 1196 . 29 1 1 A 105 105 VAL C C 104 174.482 175.462 -0.980 1
1 1197 . 29 1 1 A 105 105 VAL CA C 104 60.370 61.637 -1.267 1
1 1198 . 29 1 1 A 105 105 VAL CB C 104 34.341 33.164 1.177 1
1 1201 . 29 1 1 A 105 105 VAL N N 104 116.422 117.522 -1.100 1
1 1202 . 29 1 1 A 106 106 ALA H H 105 8.487 8.582 -0.095 1
1 1203 . 29 1 1 A 106 106 ALA HA H 105 4.172 4.420 -0.248 1
1 1207 . 29 1 1 A 106 106 ALA C C 105 179.030 178.469 0.561 1
1 1208 . 29 1 1 A 106 106 ALA CA C 105 52.966 51.672 1.294 1
1 1209 . 29 1 1 A 106 106 ALA CB C 105 19.371 18.700 0.671 1
1 1210 . 29 1 1 A 106 106 ALA N N 105 128.313 125.628 2.685 1
1 1211 . 29 1 1 A 107 107 GLY H H 106 8.738 8.751 -0.013 1
1 1212 . 29 1 1 A 107 107 GLY HA2 H 106 3.773 3.874 -0.101 1
1 1213 . 29 1 1 A 107 107 GLY HA3 H 106 3.998 3.936 0.062 1
1 1214 . 29 1 1 A 107 107 GLY C C 106 174.958 175.863 -0.905 1
1 1215 . 29 1 1 A 107 107 GLY CA C 106 47.449 47.217 0.232 1
1 1216 . 29 1 1 A 107 107 GLY N N 106 110.612 110.665 -0.053 1
1 1217 . 29 1 1 A 108 108 ASP H H 107 8.535 8.475 0.060 1
1 1218 . 29 1 1 A 108 108 ASP HA H 107 4.333 4.346 -0.013 1
1 1221 . 29 1 1 A 108 108 ASP C C 107 179.133 178.342 0.791 1
1 1222 . 29 1 1 A 108 108 ASP CA C 107 56.721 56.675 0.046 1
1 1223 . 29 1 1 A 108 108 ASP CB C 107 39.336 39.661 -0.325 1
1 1224 . 29 1 1 A 108 108 ASP N N 107 117.474 120.985 -3.511 1
1 1225 . 29 1 1 A 109 109 ILE H H 108 7.459 7.880 -0.421 1
1 1226 . 29 1 1 A 109 109 ILE HA H 108 3.688 3.817 -0.129 1
1 1236 . 29 1 1 A 109 109 ILE C C 108 176.735 178.428 -1.693 1
1 1237 . 29 1 1 A 109 109 ILE CA C 108 63.474 65.380 -1.906 1
1 1238 . 29 1 1 A 109 109 ILE CB C 108 37.340 37.578 -0.238 1
1 1242 . 29 1 1 A 109 109 ILE N N 108 119.609 121.046 -1.437 1
1 1243 . 29 1 1 A 110 110 PHE H H 109 7.920 8.346 -0.426 1
1 1244 . 29 1 1 A 110 110 PHE HA H 109 3.759 4.096 -0.337 1
1 1252 . 29 1 1 A 110 110 PHE C C 109 177.132 177.399 -0.267 1
1 1253 . 29 1 1 A 110 110 PHE CA C 109 62.766 61.245 1.521 1
1 1254 . 29 1 1 A 110 110 PHE CB C 109 39.752 39.344 0.408 1
1 1260 . 29 1 1 A 110 110 PHE N N 109 120.906 120.461 0.445 1
1 1261 . 29 1 1 A 111 111 ASP H H 110 8.639 8.232 0.407 1
1 1262 . 29 1 1 A 111 111 ASP HA H 110 4.216 4.216 0.000 1
1 1265 . 29 1 1 A 111 111 ASP C C 110 178.900 178.370 0.530 1
1 1266 . 29 1 1 A 111 111 ASP CA C 110 57.105 57.263 -0.158 1
1 1267 . 29 1 1 A 111 111 ASP CB C 110 39.697 41.704 -2.007 1
1 1268 . 29 1 1 A 111 111 ASP N N 110 117.124 119.041 -1.917 1
1 1269 . 29 1 1 A 112 112 MET H H 111 7.331 7.529 -0.198 1
1 1270 . 29 1 1 A 112 112 MET HA H 111 4.081 4.120 -0.039 1
1 1278 . 29 1 1 A 112 112 MET C C 111 179.052 178.128 0.924 1
1 1279 . 29 1 1 A 112 112 MET CA C 111 58.202 58.084 0.118 1
1 1280 . 29 1 1 A 112 112 MET CB C 111 31.827 32.349 -0.522 1
1 1283 . 29 1 1 A 112 112 MET N N 111 118.061 119.432 -1.371 1
1 1284 . 29 1 1 A 113 113 LEU H H 112 8.001 8.039 -0.038 1
1 1285 . 29 1 1 A 113 113 LEU HA H 112 3.723 3.487 0.236 1
1 1295 . 29 1 1 A 113 113 LEU C C 112 179.747 178.655 1.092 1
1 1296 . 29 1 1 A 113 113 LEU CA C 112 57.371 57.393 -0.022 1
1 1297 . 29 1 1 A 113 113 LEU CB C 112 40.671 41.154 -0.483 1
1 1301 . 29 1 1 A 113 113 LEU N N 112 120.426 119.643 0.783 1
1 1302 . 29 1 1 A 114 114 LEU H H 113 7.744 7.602 0.142 1
1 1303 . 29 1 1 A 114 114 LEU HA H 113 4.007 3.517 0.490 1
1 1313 . 29 1 1 A 114 114 LEU C C 113 179.358 178.520 0.838 1
1 1314 . 29 1 1 A 114 114 LEU CA C 113 57.202 57.496 -0.294 1
1 1315 . 29 1 1 A 114 114 LEU CB C 113 41.727 41.571 0.156 1
1 1319 . 29 1 1 A 114 114 LEU N N 113 119.584 119.590 -0.006 1
1 1320 . 29 1 1 A 115 115 THR H H 114 7.353 7.522 -0.169 1
1 1321 . 29 1 1 A 115 115 THR HA H 114 4.071 4.118 -0.047 1
1 1327 . 29 1 1 A 115 115 THR C C 114 173.591 176.363 -2.772 1
1 1328 . 29 1 1 A 115 115 THR CA C 114 65.332 64.528 0.804 1
1 1329 . 29 1 1 A 115 115 THR CB C 114 70.319 68.710 1.609 1
1 1331 . 29 1 1 A 115 115 THR N N 114 107.535 112.397 -4.862 1
1 1332 . 29 1 1 A 116 116 PHE H H 115 6.979 7.949 -0.970 1
1 1333 . 29 1 1 A 116 116 PHE HA H 115 5.022 4.291 0.731 1
1 1341 . 29 1 1 A 116 116 PHE C C 115 176.488 176.376 0.112 1
1 1342 . 29 1 1 A 116 116 PHE CA C 115 55.911 61.201 -5.290 1
1 1343 . 29 1 1 A 116 116 PHE CB C 115 38.521 38.944 -0.423 1
1 1349 . 29 1 1 A 116 116 PHE N N 115 112.366 119.917 -7.551 1
1 1350 . 29 1 1 A 117 117 THR H H 116 7.564 7.481 0.083 1
1 1351 . 29 1 1 A 117 117 THR HA H 116 4.626 4.739 -0.113 1
1 1356 . 29 1 1 A 117 117 THR C C 116 174.085 174.319 -0.234 1
1 1357 . 29 1 1 A 117 117 THR CA C 116 61.636 62.395 -0.759 1
1 1358 . 29 1 1 A 117 117 THR CB C 116 70.915 70.340 0.575 1
1 1360 . 29 1 1 A 117 117 THR N N 116 105.498 106.966 -1.468 1
1 1361 . 29 1 1 A 118 118 ASP H H 117 8.270 7.699 0.571 1
1 1362 . 29 1 1 A 118 118 ASP HA H 117 4.955 4.739 0.216 1
1 1365 . 29 1 1 A 118 118 ASP C C 117 176.328 176.378 -0.050 1
1 1366 . 29 1 1 A 118 118 ASP CA C 117 53.417 53.254 0.163 1
1 1367 . 29 1 1 A 118 118 ASP CB C 117 43.388 39.998 3.390 1
1 1368 . 29 1 1 A 118 118 ASP N N 117 124.409 119.926 4.483 1
1 1369 . 29 1 1 A 119 119 PHE H H 118 8.973 8.605 0.368 1
1 1370 . 29 1 1 A 119 119 PHE HA H 118 3.506 4.186 -0.680 1
1 1378 . 29 1 1 A 119 119 PHE CA C 118 61.490 61.231 0.259 1
1 1379 . 29 1 1 A 119 119 PHE CB C 118 39.246 39.482 -0.236 1
1 1385 . 29 1 1 A 119 119 PHE N N 118 126.688 124.515 2.173 1
1 1386 . 29 1 1 A 120 120 LEU H H 119 8.099 8.382 -0.283 1
1 1387 . 29 1 1 A 120 120 LEU HA H 119 3.842 3.959 -0.117 1
1 1397 . 29 1 1 A 120 120 LEU C C 119 179.601 179.618 -0.017 1
1 1398 . 29 1 1 A 120 120 LEU CA C 119 58.174 57.931 0.243 1
1 1399 . 29 1 1 A 120 120 LEU CB C 119 40.315 41.413 -1.098 1
1 1403 . 29 1 1 A 120 120 LEU N N 119 117.930 119.932 -2.002 1
1 1404 . 29 1 1 A 121 121 ALA H H 120 7.729 7.614 0.115 1
1 1405 . 29 1 1 A 121 121 ALA HA H 120 3.996 4.092 -0.096 1
1 1409 . 29 1 1 A 121 121 ALA C C 120 180.995 179.621 1.374 1
1 1410 . 29 1 1 A 121 121 ALA CA C 120 54.832 54.624 0.208 1
1 1411 . 29 1 1 A 121 121 ALA CB C 120 17.706 18.268 -0.562 1
1 1412 . 29 1 1 A 121 121 ALA N N 120 123.195 121.255 1.940 1
1 1413 . 29 1 1 A 122 122 PHE H H 121 7.943 7.806 0.137 1
1 1414 . 29 1 1 A 122 122 PHE HA H 121 3.887 3.827 0.060 1
1 1419 . 29 1 1 A 122 122 PHE C C 121 175.410 176.767 -1.357 1
1 1420 . 29 1 1 A 122 122 PHE CA C 121 61.075 60.642 0.433 1
1 1421 . 29 1 1 A 122 122 PHE CB C 121 38.115 38.644 -0.529 1
1 1424 . 29 1 1 A 122 122 PHE N N 121 121.798 120.473 1.325 1
1 1425 . 29 1 1 A 123 123 LYS H H 122 8.468 8.004 0.464 1
1 1426 . 29 1 1 A 123 123 LYS HA H 122 3.077 3.675 -0.598 1
1 1435 . 29 1 1 A 123 123 LYS C C 122 178.453 178.896 -0.443 1
1 1436 . 29 1 1 A 123 123 LYS CA C 122 59.855 59.950 -0.095 1
1 1437 . 29 1 1 A 123 123 LYS CB C 122 32.374 32.525 -0.151 1
1 1441 . 29 1 1 A 123 123 LYS N N 122 120.614 118.189 2.425 1
1 1442 . 29 1 1 A 124 124 GLU H H 123 8.100 7.905 0.195 1
1 1443 . 29 1 1 A 124 124 GLU HA H 123 3.652 4.023 -0.371 1
1 1448 . 29 1 1 A 124 124 GLU C C 123 177.743 178.553 -0.810 1
1 1449 . 29 1 1 A 124 124 GLU CA C 123 59.406 59.552 -0.146 1
1 1450 . 29 1 1 A 124 124 GLU CB C 123 28.811 29.282 -0.471 1
1 1452 . 29 1 1 A 124 124 GLU N N 123 117.404 118.781 -1.377 1
1 1453 . 29 1 1 A 125 125 MET H H 124 7.537 7.584 -0.047 1
1 1454 . 29 1 1 A 125 125 MET HA H 124 3.860 3.963 -0.103 1
1 1462 . 29 1 1 A 125 125 MET C C 124 179.522 178.332 1.190 1
1 1463 . 29 1 1 A 125 125 MET CA C 124 58.832 58.438 0.394 1
1 1464 . 29 1 1 A 125 125 MET CB C 124 31.765 31.365 0.400 1
1 1467 . 29 1 1 A 125 125 MET N N 124 119.413 118.936 0.477 1
1 1468 . 29 1 1 A 126 126 PHE H H 125 7.148 7.453 -0.305 1
1 1469 . 29 1 1 A 126 126 PHE HA H 125 3.633 4.192 -0.559 1
1 1476 . 29 1 1 A 126 126 PHE C C 125 178.994 178.254 0.740 1
1 1477 . 29 1 1 A 126 126 PHE CA C 125 63.148 61.234 1.914 1
1 1478 . 29 1 1 A 126 126 PHE CB C 125 39.830 38.341 1.489 1
1 1483 . 29 1 1 A 126 126 PHE N N 125 120.013 119.156 0.857 1
1 1484 . 29 1 1 A 127 127 LEU H H 126 8.369 8.338 0.031 1
1 1485 . 29 1 1 A 127 127 LEU HA H 126 3.972 3.987 -0.015 1
1 1495 . 29 1 1 A 127 127 LEU C C 126 180.621 179.131 1.490 1
1 1496 . 29 1 1 A 127 127 LEU CA C 126 57.944 57.945 -0.001 1
1 1497 . 29 1 1 A 127 127 LEU CB C 126 40.543 41.387 -0.844 1
1 1501 . 29 1 1 A 127 127 LEU N N 126 119.692 119.717 -0.025 1
1 1502 . 29 1 1 A 128 128 ASP H H 127 8.578 8.035 0.543 1
1 1503 . 29 1 1 A 128 128 ASP HA H 127 4.308 4.349 -0.041 1
1 1506 . 29 1 1 A 128 128 ASP C C 127 178.254 178.016 0.238 1
1 1507 . 29 1 1 A 128 128 ASP CA C 127 56.964 57.267 -0.303 1
1 1508 . 29 1 1 A 128 128 ASP CB C 127 39.735 41.054 -1.319 1
1 1509 . 29 1 1 A 128 128 ASP N N 127 121.926 119.275 2.651 1
1 1510 . 29 1 1 A 129 129 TYR H H 128 7.710 8.329 -0.619 1
1 1511 . 29 1 1 A 129 129 TYR HA H 128 3.908 4.079 -0.171 1
1 1518 . 29 1 1 A 129 129 TYR C C 128 177.633 177.538 0.095 1
1 1519 . 29 1 1 A 129 129 TYR CA C 128 61.796 61.961 -0.165 1
1 1520 . 29 1 1 A 129 129 TYR CB C 128 39.372 38.710 0.662 1
1 1525 . 29 1 1 A 129 129 TYR N N 128 122.548 120.507 2.041 1
1 1526 . 29 1 1 A 130 130 ARG H H 129 8.622 8.635 -0.013 1
1 1527 . 29 1 1 A 130 130 ARG HA H 129 3.722 4.251 -0.529 1
1 1535 . 29 1 1 A 130 130 ARG CA C 129 60.084 59.966 0.118 1
1 1536 . 29 1 1 A 130 130 ARG CB C 129 29.902 29.944 -0.042 1
1 1539 . 29 1 1 A 130 130 ARG N N 129 118.302 119.600 -1.298 1
1 1541 . 29 1 1 A 131 131 ALA H H 130 7.936 8.267 -0.331 1
1 1542 . 29 1 1 A 131 131 ALA HA H 130 3.997 4.042 -0.045 1
1 1546 . 29 1 1 A 131 131 ALA C C 130 180.456 180.032 0.424 1
1 1547 . 29 1 1 A 131 131 ALA CA C 130 55.133 55.050 0.083 1
1 1548 . 29 1 1 A 131 131 ALA CB C 130 17.750 18.429 -0.679 1
1 1549 . 29 1 1 A 131 131 ALA N N 130 119.788 121.635 -1.847 1
1 1550 . 29 1 1 A 132 132 GLU H H 131 7.622 7.866 -0.244 1
1 1551 . 29 1 1 A 132 132 GLU HA H 131 3.862 3.922 -0.060 1
1 1556 . 29 1 1 A 132 132 GLU C C 131 179.528 179.304 0.224 1
1 1557 . 29 1 1 A 132 132 GLU CA C 131 58.849 59.560 -0.711 1
1 1558 . 29 1 1 A 132 132 GLU CB C 131 28.930 29.088 -0.158 1
1 1560 . 29 1 1 A 132 132 GLU N N 131 118.428 117.681 0.747 1
1 1561 . 29 1 1 A 133 133 LYS H H 132 7.853 7.806 0.047 1
1 1562 . 29 1 1 A 133 133 LYS HA H 132 3.722 4.060 -0.338 1
1 1571 . 29 1 1 A 133 133 LYS C C 132 175.725 178.152 -2.427 1
1 1572 . 29 1 1 A 133 133 LYS CA C 132 57.544 58.945 -1.401 1
1 1573 . 29 1 1 A 133 133 LYS CB C 132 31.770 32.045 -0.275 1
1 1577 . 29 1 1 A 133 133 LYS N N 132 119.473 119.360 0.113 1
1 1578 . 29 1 1 A 134 134 GLU H H 133 8.151 7.866 0.285 1
1 1579 . 29 1 1 A 134 134 GLU HA H 133 4.161 4.496 -0.335 1
1 1584 . 29 1 1 A 134 134 GLU C C 133 177.453 177.978 -0.525 1
1 1585 . 29 1 1 A 134 134 GLU CA C 133 57.222 56.573 0.649 1
1 1586 . 29 1 1 A 134 134 GLU CB C 133 30.091 30.216 -0.125 1
1 1588 . 29 1 1 A 134 134 GLU N N 133 116.525 116.457 0.068 1
1 1589 . 29 1 1 A 135 135 GLY H H 134 7.702 7.906 -0.204 1
1 1590 . 29 1 1 A 135 135 GLY HA2 H 134 3.896 3.977 -0.081 1
1 1591 . 29 1 1 A 135 135 GLY HA3 H 134 3.897 3.983 -0.086 1
1 1592 . 29 1 1 A 135 135 GLY C C 134 174.538 174.749 -0.211 1
1 1593 . 29 1 1 A 135 135 GLY CA C 134 45.975 45.377 0.598 1
1 1594 . 29 1 1 A 135 135 GLY N N 134 107.924 108.576 -0.652 1
1 1595 . 29 1 1 A 136 136 ARG H H 135 8.045 7.954 0.091 1
1 1596 . 29 1 1 A 136 136 ARG HA H 135 4.323 4.472 -0.149 1
1 1604 . 29 1 1 A 136 136 ARG C C 135 175.864 176.877 -1.013 1
1 1605 . 29 1 1 A 136 136 ARG CA C 135 56.016 55.019 0.997 1
1 1606 . 29 1 1 A 136 136 ARG CB C 135 30.987 30.816 0.171 1
1 1609 . 29 1 1 A 136 136 ARG N N 135 119.708 117.761 1.947 1
1 1 . 30 1 1 A 14 14 PHE CA C 13 58.199 60.570 -2.371 1
1 2 . 30 1 1 A 14 14 PHE CB C 13 39.717 39.134 0.583 1
1 3 . 30 1 1 A 15 15 SER H H 14 8.299 7.807 0.492 1
1 4 . 30 1 1 A 15 15 SER HA H 14 4.359 4.607 -0.248 1
1 7 . 30 1 1 A 15 15 SER CA C 14 58.249 59.471 -1.222 1
1 8 . 30 1 1 A 15 15 SER CB C 14 63.936 63.380 0.556 1
1 9 . 30 1 1 A 15 15 SER N N 14 117.379 113.478 3.901 1
1 10 . 30 1 1 A 16 16 SER H H 15 8.255 8.749 -0.494 1
1 11 . 30 1 1 A 16 16 SER HA H 15 3.729 4.664 -0.935 1
1 14 . 30 1 1 A 16 16 SER CA C 15 58.224 59.665 -1.441 1
1 15 . 30 1 1 A 16 16 SER CB C 15 63.886 64.759 -0.873 1
1 16 . 30 1 1 A 16 16 SER N N 15 117.694 120.890 -3.196 1
1 17 . 30 1 1 A 17 17 ALA H H 16 8.333 8.306 0.027 1
1 18 . 30 1 1 A 17 17 ALA HA H 16 4.252 4.061 0.191 1
1 22 . 30 1 1 A 17 17 ALA CA C 16 53.377 55.249 -1.872 1
1 23 . 30 1 1 A 17 17 ALA CB C 16 18.896 18.714 0.182 1
1 24 . 30 1 1 A 17 17 ALA N N 16 125.462 124.735 0.727 1
1 25 . 30 1 1 A 18 18 SER H H 17 8.219 7.684 0.535 1
1 26 . 30 1 1 A 18 18 SER HA H 17 4.332 4.450 -0.118 1
1 29 . 30 1 1 A 18 18 SER CA C 17 59.105 58.197 0.908 1
1 30 . 30 1 1 A 18 18 SER CB C 17 63.592 63.691 -0.099 1
1 31 . 30 1 1 A 18 18 SER N N 17 114.821 111.936 2.885 1
1 32 . 30 1 1 A 19 19 ASP H H 18 8.309 7.719 0.590 1
1 33 . 30 1 1 A 19 19 ASP HA H 18 4.554 4.804 -0.250 1
1 36 . 30 1 1 A 19 19 ASP C C 18 176.528 176.777 -0.249 1
1 37 . 30 1 1 A 19 19 ASP CA C 18 55.272 52.749 2.523 1
1 38 . 30 1 1 A 19 19 ASP CB C 18 40.883 43.365 -2.482 1
1 39 . 30 1 1 A 19 19 ASP N N 18 123.367 121.889 1.478 1
1 40 . 30 1 1 A 20 20 ALA H H 19 8.133 8.856 -0.723 1
1 41 . 30 1 1 A 20 20 ALA HA H 19 4.170 3.986 0.184 1
1 45 . 30 1 1 A 20 20 ALA C C 19 179.857 179.478 0.379 1
1 46 . 30 1 1 A 20 20 ALA CA C 19 54.341 55.115 -0.774 1
1 47 . 30 1 1 A 20 20 ALA CB C 19 18.660 18.459 0.201 1
1 48 . 30 1 1 A 20 20 ALA N N 19 123.350 126.975 -3.625 1
1 49 . 30 1 1 A 21 21 GLU H H 20 8.140 7.994 0.146 1
1 50 . 30 1 1 A 21 21 GLU HA H 20 4.128 4.069 0.059 1
1 55 . 30 1 1 A 21 21 GLU C C 20 177.675 178.613 -0.938 1
1 56 . 30 1 1 A 21 21 GLU CA C 20 58.520 59.460 -0.940 1
1 57 . 30 1 1 A 21 21 GLU CB C 20 29.765 29.506 0.259 1
1 59 . 30 1 1 A 21 21 GLU N N 20 119.063 119.380 -0.317 1
1 60 . 30 1 1 A 22 22 PHE H H 21 8.009 8.027 -0.018 1
1 61 . 30 1 1 A 22 22 PHE HA H 21 4.123 4.264 -0.141 1
1 68 . 30 1 1 A 22 22 PHE C C 21 176.410 177.325 -0.915 1
1 69 . 30 1 1 A 22 22 PHE CA C 21 62.202 61.133 1.069 1
1 70 . 30 1 1 A 22 22 PHE CB C 21 39.223 39.179 0.044 1
1 75 . 30 1 1 A 22 22 PHE N N 21 121.211 121.003 0.208 1
1 76 . 30 1 1 A 23 23 ASP H H 22 8.261 8.483 -0.222 1
1 77 . 30 1 1 A 23 23 ASP HA H 22 4.041 4.327 -0.286 1
1 80 . 30 1 1 A 23 23 ASP C C 22 179.078 178.084 0.994 1
1 81 . 30 1 1 A 23 23 ASP CA C 22 57.048 57.772 -0.724 1
1 82 . 30 1 1 A 23 23 ASP CB C 22 40.154 41.757 -1.603 1
1 83 . 30 1 1 A 23 23 ASP N N 22 116.876 118.788 -1.912 1
1 84 . 30 1 1 A 24 24 ALA H H 23 7.651 7.424 0.227 1
1 85 . 30 1 1 A 24 24 ALA HA H 23 3.785 3.753 0.032 1
1 89 . 30 1 1 A 24 24 ALA C C 23 179.577 179.753 -0.176 1
1 90 . 30 1 1 A 24 24 ALA CA C 23 54.341 54.984 -0.643 1
1 91 . 30 1 1 A 24 24 ALA CB C 23 17.762 18.100 -0.338 1
1 92 . 30 1 1 A 24 24 ALA N N 23 121.873 121.544 0.329 1
1 93 . 30 1 1 A 25 25 VAL H H 24 7.718 7.645 0.073 1
1 94 . 30 1 1 A 25 25 VAL HA H 24 3.216 3.400 -0.184 1
1 102 . 30 1 1 A 25 25 VAL C C 24 177.805 178.260 -0.455 1
1 103 . 30 1 1 A 25 25 VAL CA C 24 66.789 66.696 0.093 1
1 104 . 30 1 1 A 25 25 VAL CB C 24 31.277 31.148 0.129 1
1 107 . 30 1 1 A 25 25 VAL N N 24 117.890 118.552 -0.662 1
1 108 . 30 1 1 A 26 26 VAL H H 25 7.867 7.617 0.250 1
1 109 . 30 1 1 A 26 26 VAL HA H 25 3.274 3.526 -0.252 1
1 117 . 30 1 1 A 26 26 VAL C C 25 177.788 177.541 0.247 1
1 118 . 30 1 1 A 26 26 VAL CA C 25 67.282 66.170 1.112 1
1 119 . 30 1 1 A 26 26 VAL CB C 25 31.266 31.244 0.022 1
1 122 . 30 1 1 A 26 26 VAL N N 25 118.170 120.108 -1.938 1
1 123 . 30 1 1 A 27 27 GLY H H 26 7.544 7.579 -0.035 1
1 124 . 30 1 1 A 27 27 GLY HA2 H 26 3.592 3.422 0.170 1
1 125 . 30 1 1 A 27 27 GLY HA3 H 26 3.721 3.559 0.162 1
1 126 . 30 1 1 A 27 27 GLY C C 26 176.717 176.009 0.708 1
1 127 . 30 1 1 A 27 27 GLY CA C 26 47.085 47.099 -0.014 1
1 128 . 30 1 1 A 27 27 GLY N N 26 105.795 107.668 -1.873 1
1 129 . 30 1 1 A 28 28 TYR H H 27 7.625 7.203 0.422 1
1 130 . 30 1 1 A 28 28 TYR HA H 27 4.546 4.559 -0.013 1
1 137 . 30 1 1 A 28 28 TYR C C 27 178.991 178.087 0.904 1
1 138 . 30 1 1 A 28 28 TYR CA C 27 58.845 59.809 -0.964 1
1 139 . 30 1 1 A 28 28 TYR CB C 27 37.602 37.653 -0.051 1
1 144 . 30 1 1 A 28 28 TYR N N 27 119.933 121.318 -1.385 1
1 145 . 30 1 1 A 29 29 LEU H H 28 8.517 8.309 0.208 1
1 146 . 30 1 1 A 29 29 LEU HA H 28 3.728 3.850 -0.122 1
1 156 . 30 1 1 A 29 29 LEU CA C 28 58.281 58.080 0.201 1
1 157 . 30 1 1 A 29 29 LEU CB C 28 41.948 41.478 0.470 1
1 161 . 30 1 1 A 29 29 LEU N N 28 119.669 120.166 -0.497 1
1 162 . 30 1 1 A 30 30 GLU H H 29 8.072 7.873 0.199 1
1 163 . 30 1 1 A 30 30 GLU HA H 29 3.722 3.884 -0.162 1
1 168 . 30 1 1 A 30 30 GLU C C 29 177.731 179.278 -1.547 1
1 169 . 30 1 1 A 30 30 GLU CA C 29 59.763 59.904 -0.141 1
1 170 . 30 1 1 A 30 30 GLU CB C 29 28.844 29.331 -0.487 1
1 172 . 30 1 1 A 30 30 GLU N N 29 117.666 117.662 0.004 1
1 173 . 30 1 1 A 31 31 ASP H H 30 7.243 7.777 -0.534 1
1 174 . 30 1 1 A 31 31 ASP HA H 30 4.297 4.387 -0.090 1
1 177 . 30 1 1 A 31 31 ASP CA C 30 56.953 57.335 -0.382 1
1 178 . 30 1 1 A 31 31 ASP CB C 30 40.730 40.673 0.057 1
1 179 . 30 1 1 A 31 31 ASP N N 30 116.720 119.378 -2.658 1
1 180 . 30 1 1 A 32 32 ILE H H 31 7.940 7.537 0.403 1
1 181 . 30 1 1 A 32 32 ILE HA H 31 3.640 3.697 -0.057 1
1 191 . 30 1 1 A 32 32 ILE C C 31 177.980 178.233 -0.253 1
1 192 . 30 1 1 A 32 32 ILE CA C 31 64.692 64.211 0.481 1
1 193 . 30 1 1 A 32 32 ILE CB C 31 38.938 36.797 2.141 1
1 197 . 30 1 1 A 32 32 ILE N N 31 119.728 120.249 -0.521 1
1 198 . 30 1 1 A 33 33 ILE H H 32 7.984 7.799 0.185 1
1 199 . 30 1 1 A 33 33 ILE HA H 32 3.598 2.953 0.645 1
1 209 . 30 1 1 A 33 33 ILE C C 32 176.723 176.942 -0.219 1
1 210 . 30 1 1 A 33 33 ILE CA C 32 63.241 64.432 -1.191 1
1 211 . 30 1 1 A 33 33 ILE CB C 32 37.580 37.688 -0.108 1
1 215 . 30 1 1 A 33 33 ILE N N 32 113.919 120.987 -7.068 1
1 216 . 30 1 1 A 34 34 MET H H 33 7.288 7.636 -0.348 1
1 217 . 30 1 1 A 34 34 MET HA H 33 4.496 4.662 -0.166 1
1 225 . 30 1 1 A 34 34 MET C C 33 176.423 175.768 0.655 1
1 226 . 30 1 1 A 34 34 MET CA C 33 54.634 54.222 0.412 1
1 227 . 30 1 1 A 34 34 MET CB C 33 31.934 31.430 0.504 1
1 230 . 30 1 1 A 34 34 MET N N 33 115.130 116.651 -1.521 1
1 231 . 30 1 1 A 35 35 ASP H H 34 7.405 7.502 -0.097 1
1 232 . 30 1 1 A 35 35 ASP HA H 34 4.484 4.535 -0.051 1
1 235 . 30 1 1 A 35 35 ASP C C 34 177.139 176.584 0.555 1
1 236 . 30 1 1 A 35 35 ASP CA C 34 54.625 54.707 -0.082 1
1 237 . 30 1 1 A 35 35 ASP CB C 34 43.554 42.726 0.828 1
1 238 . 30 1 1 A 35 35 ASP N N 34 121.814 122.433 -0.619 1
1 239 . 30 1 1 A 36 36 ASP H H 35 8.765 9.190 -0.425 1
1 240 . 30 1 1 A 36 36 ASP HA H 35 4.235 4.239 -0.004 1
1 243 . 30 1 1 A 36 36 ASP C C 35 178.320 177.772 0.548 1
1 244 . 30 1 1 A 36 36 ASP CA C 35 57.832 58.570 -0.738 1
1 245 . 30 1 1 A 36 36 ASP CB C 35 40.914 41.128 -0.214 1
1 246 . 30 1 1 A 36 36 ASP N N 35 125.883 127.833 -1.950 1
1 247 . 30 1 1 A 37 37 GLU H H 36 8.905 8.061 0.844 1
1 248 . 30 1 1 A 37 37 GLU HA H 36 3.933 4.150 -0.217 1
1 253 . 30 1 1 A 37 37 GLU C C 36 179.304 179.030 0.274 1
1 254 . 30 1 1 A 37 37 GLU CA C 36 59.828 59.234 0.594 1
1 255 . 30 1 1 A 37 37 GLU CB C 36 29.380 29.267 0.113 1
1 257 . 30 1 1 A 37 37 GLU N N 36 119.077 119.062 0.015 1
1 258 . 30 1 1 A 38 38 PHE H H 37 7.460 8.142 -0.682 1
1 259 . 30 1 1 A 38 38 PHE HA H 37 3.642 4.026 -0.384 1
1 267 . 30 1 1 A 38 38 PHE C C 37 176.483 177.744 -1.261 1
1 268 . 30 1 1 A 38 38 PHE CA C 37 61.411 61.177 0.234 1
1 269 . 30 1 1 A 38 38 PHE CB C 37 39.355 39.009 0.346 1
1 275 . 30 1 1 A 38 38 PHE N N 37 119.968 120.825 -0.857 1
1 276 . 30 1 1 A 39 39 GLN H H 38 7.968 8.205 -0.237 1
1 277 . 30 1 1 A 39 39 GLN HA H 38 3.712 3.782 -0.070 1
1 284 . 30 1 1 A 39 39 GLN CA C 38 59.153 58.799 0.354 1
1 285 . 30 1 1 A 39 39 GLN CB C 38 28.213 28.218 -0.005 1
1 287 . 30 1 1 A 39 39 GLN N N 38 116.433 118.370 -1.937 1
1 289 . 30 1 1 A 40 40 LEU H H 39 7.930 7.602 0.328 1
1 290 . 30 1 1 A 40 40 LEU HA H 39 3.916 4.019 -0.103 1
1 300 . 30 1 1 A 40 40 LEU C C 39 177.731 178.042 -0.311 1
1 301 . 30 1 1 A 40 40 LEU CA C 39 57.915 57.983 -0.068 1
1 302 . 30 1 1 A 40 40 LEU CB C 39 41.989 41.572 0.417 1
1 306 . 30 1 1 A 40 40 LEU N N 39 119.505 121.193 -1.688 1
1 307 . 30 1 1 A 41 41 LEU H H 40 7.174 7.836 -0.662 1
1 308 . 30 1 1 A 41 41 LEU HA H 40 3.835 4.018 -0.183 1
1 318 . 30 1 1 A 41 41 LEU C C 40 179.738 178.209 1.529 1
1 319 . 30 1 1 A 41 41 LEU CA C 40 58.266 58.263 0.003 1
1 320 . 30 1 1 A 41 41 LEU CB C 40 42.050 41.628 0.422 1
1 324 . 30 1 1 A 41 41 LEU N N 40 120.971 119.801 1.170 1
1 325 . 30 1 1 A 42 42 GLN H H 41 8.058 7.952 0.106 1
1 326 . 30 1 1 A 42 42 GLN HA H 41 3.556 3.610 -0.054 1
1 333 . 30 1 1 A 42 42 GLN C C 41 177.642 178.432 -0.790 1
1 334 . 30 1 1 A 42 42 GLN CA C 41 59.826 59.071 0.755 1
1 335 . 30 1 1 A 42 42 GLN CB C 41 28.762 27.660 1.102 1
1 337 . 30 1 1 A 42 42 GLN N N 41 117.899 117.646 0.253 1
1 339 . 30 1 1 A 43 43 ARG H H 42 8.179 7.904 0.275 1
1 340 . 30 1 1 A 43 43 ARG HA H 42 3.655 3.978 -0.323 1
1 347 . 30 1 1 A 43 43 ARG C C 42 178.051 178.313 -0.262 1
1 348 . 30 1 1 A 43 43 ARG CA C 42 59.766 58.846 0.920 1
1 349 . 30 1 1 A 43 43 ARG CB C 42 29.941 29.922 0.019 1
1 352 . 30 1 1 A 43 43 ARG N N 42 119.392 119.918 -0.526 1
1 353 . 30 1 1 A 44 44 ASN H H 43 8.525 8.072 0.453 1
1 354 . 30 1 1 A 44 44 ASN HA H 43 4.332 4.423 -0.091 1
1 359 . 30 1 1 A 44 44 ASN C C 43 178.150 177.875 0.275 1
1 360 . 30 1 1 A 44 44 ASN CA C 43 55.841 56.254 -0.413 1
1 361 . 30 1 1 A 44 44 ASN CB C 43 37.632 39.318 -1.686 1
1 362 . 30 1 1 A 44 44 ASN N N 43 116.214 117.709 -1.495 1
1 364 . 30 1 1 A 45 45 PHE H H 44 7.586 8.021 -0.435 1
1 365 . 30 1 1 A 45 45 PHE HA H 44 4.132 4.290 -0.158 1
1 372 . 30 1 1 A 45 45 PHE C C 44 176.691 178.606 -1.915 1
1 373 . 30 1 1 A 45 45 PHE CA C 44 62.333 60.734 1.599 1
1 374 . 30 1 1 A 45 45 PHE CB C 44 39.449 38.442 1.007 1
1 379 . 30 1 1 A 45 45 PHE N N 44 121.501 117.670 3.831 1
1 380 . 30 1 1 A 46 46 MET H H 45 8.190 8.178 0.012 1
1 381 . 30 1 1 A 46 46 MET HA H 45 4.060 4.211 -0.151 1
1 389 . 30 1 1 A 46 46 MET C C 45 179.754 178.195 1.559 1
1 390 . 30 1 1 A 46 46 MET CA C 45 57.742 58.056 -0.314 1
1 391 . 30 1 1 A 46 46 MET CB C 45 29.912 31.371 -1.459 1
1 394 . 30 1 1 A 46 46 MET N N 45 116.727 117.903 -1.176 1
1 395 . 30 1 1 A 47 47 ASP H H 46 8.579 8.273 0.306 1
1 396 . 30 1 1 A 47 47 ASP HA H 46 4.804 4.596 0.208 1
1 399 . 30 1 1 A 47 47 ASP C C 46 177.854 178.249 -0.395 1
1 400 . 30 1 1 A 47 47 ASP CA C 46 57.277 57.224 0.053 1
1 401 . 30 1 1 A 47 47 ASP CB C 46 40.776 41.481 -0.705 1
1 402 . 30 1 1 A 47 47 ASP N N 46 117.798 120.780 -2.982 1
1 403 . 30 1 1 A 48 48 LYS H H 47 7.339 7.924 -0.585 1
1 404 . 30 1 1 A 48 48 LYS HA H 47 3.828 4.249 -0.421 1
1 413 . 30 1 1 A 48 48 LYS C C 47 178.812 178.810 0.002 1
1 414 . 30 1 1 A 48 48 LYS CA C 47 58.953 58.443 0.510 1
1 415 . 30 1 1 A 48 48 LYS CB C 47 32.796 32.843 -0.047 1
1 419 . 30 1 1 A 48 48 LYS N N 47 117.852 119.719 -1.867 1
1 420 . 30 1 1 A 49 49 TYR H H 48 6.841 8.642 -1.801 1
1 421 . 30 1 1 A 49 49 TYR HA H 48 4.995 4.273 0.722 1
1 428 . 30 1 1 A 49 49 TYR C C 48 178.138 178.669 -0.531 1
1 429 . 30 1 1 A 49 49 TYR CA C 48 58.620 59.727 -1.107 1
1 430 . 30 1 1 A 49 49 TYR CB C 48 42.939 38.047 4.892 1
1 435 . 30 1 1 A 49 49 TYR N N 48 112.109 119.819 -7.710 1
1 436 . 30 1 1 A 50 50 TYR H H 49 8.491 8.004 0.487 1
1 437 . 30 1 1 A 50 50 TYR HA H 49 4.598 4.263 0.335 1
1 444 . 30 1 1 A 50 50 TYR C C 49 176.015 177.608 -1.593 1
1 445 . 30 1 1 A 50 50 TYR CA C 49 62.442 59.458 2.984 1
1 446 . 30 1 1 A 50 50 TYR CB C 49 36.588 36.892 -0.304 1
1 451 . 30 1 1 A 50 50 TYR N N 49 118.294 119.773 -1.479 1
1 452 . 30 1 1 A 51 51 LEU H H 50 7.512 7.650 -0.138 1
1 453 . 30 1 1 A 51 51 LEU HA H 50 3.878 3.571 0.307 1
1 463 . 30 1 1 A 51 51 LEU C C 50 178.625 178.617 0.008 1
1 464 . 30 1 1 A 51 51 LEU CA C 50 55.994 57.181 -1.187 1
1 465 . 30 1 1 A 51 51 LEU CB C 50 40.743 41.516 -0.773 1
1 469 . 30 1 1 A 51 51 LEU N N 50 118.478 121.899 -3.421 1
1 470 . 30 1 1 A 52 52 GLU H H 51 8.042 8.012 0.030 1
1 471 . 30 1 1 A 52 52 GLU HA H 51 4.197 4.004 0.193 1
1 476 . 30 1 1 A 52 52 GLU C C 51 177.629 177.776 -0.147 1
1 477 . 30 1 1 A 52 52 GLU CA C 51 56.141 59.483 -3.342 1
1 478 . 30 1 1 A 52 52 GLU CB C 51 29.162 29.331 -0.169 1
1 480 . 30 1 1 A 52 52 GLU N N 51 115.067 117.802 -2.735 1
1 481 . 30 1 1 A 53 53 PHE H H 52 7.465 8.081 -0.616 1
1 482 . 30 1 1 A 53 53 PHE HA H 52 4.431 4.791 -0.360 1
1 490 . 30 1 1 A 53 53 PHE C C 52 174.325 174.880 -0.555 1
1 491 . 30 1 1 A 53 53 PHE CA C 52 58.986 57.227 1.759 1
1 492 . 30 1 1 A 53 53 PHE CB C 52 40.183 37.542 2.641 1
1 498 . 30 1 1 A 53 53 PHE N N 52 116.768 119.121 -2.353 1
1 499 . 30 1 1 A 54 54 GLU H H 53 7.484 8.881 -1.397 1
1 500 . 30 1 1 A 54 54 GLU HA H 53 4.583 4.883 -0.300 1
1 505 . 30 1 1 A 54 54 GLU C C 53 175.722 175.016 0.706 1
1 506 . 30 1 1 A 54 54 GLU CA C 53 54.248 55.392 -1.144 1
1 507 . 30 1 1 A 54 54 GLU CB C 53 34.409 31.814 2.595 1
1 509 . 30 1 1 A 54 54 GLU N N 53 118.844 124.239 -5.395 1
1 510 . 30 1 1 A 55 55 ASP H H 54 9.008 8.731 0.277 1
1 511 . 30 1 1 A 55 55 ASP HA H 54 4.735 4.948 -0.213 1
1 514 . 30 1 1 A 55 55 ASP C C 54 175.421 175.406 0.015 1
1 515 . 30 1 1 A 55 55 ASP CA C 54 52.888 53.387 -0.499 1
1 516 . 30 1 1 A 55 55 ASP CB C 54 38.894 41.025 -2.131 1
1 517 . 30 1 1 A 55 55 ASP N N 54 123.654 124.058 -0.404 1
1 518 . 30 1 1 A 56 56 THR H H 55 7.819 8.261 -0.442 1
1 519 . 30 1 1 A 56 56 THR HA H 55 4.574 4.890 -0.316 1
1 524 . 30 1 1 A 56 56 THR C C 55 174.096 174.799 -0.703 1
1 525 . 30 1 1 A 56 56 THR CA C 55 59.172 59.852 -0.680 1
1 526 . 30 1 1 A 56 56 THR CB C 55 71.889 72.245 -0.356 1
1 528 . 30 1 1 A 56 56 THR N N 55 112.015 117.457 -5.442 1
1 529 . 30 1 1 A 57 57 GLU H H 56 8.527 8.950 -0.423 1
1 530 . 30 1 1 A 57 57 GLU HA H 56 4.217 4.251 -0.034 1
1 535 . 30 1 1 A 57 57 GLU C C 56 177.042 176.503 0.539 1
1 536 . 30 1 1 A 57 57 GLU CA C 56 56.869 58.431 -1.562 1
1 537 . 30 1 1 A 57 57 GLU CB C 56 29.731 30.542 -0.811 1
1 539 . 30 1 1 A 57 57 GLU N N 56 117.531 121.293 -3.762 1
1 540 . 30 1 1 A 58 58 GLU H H 57 7.587 7.828 -0.241 1
1 541 . 30 1 1 A 58 58 GLU HA H 57 3.941 4.490 -0.549 1
1 546 . 30 1 1 A 58 58 GLU C C 57 176.849 176.368 0.481 1
1 547 . 30 1 1 A 58 58 GLU CA C 57 56.924 56.128 0.796 1
1 548 . 30 1 1 A 58 58 GLU CB C 57 30.251 30.560 -0.309 1
1 550 . 30 1 1 A 58 58 GLU N N 57 119.183 119.112 0.071 1
1 551 . 30 1 1 A 59 59 ASN H H 58 9.120 8.865 0.255 1
1 552 . 30 1 1 A 59 59 ASN HA H 58 4.922 5.419 -0.497 1
1 557 . 30 1 1 A 59 59 ASN C C 58 174.254 175.128 -0.874 1
1 558 . 30 1 1 A 59 59 ASN CA C 58 51.956 52.571 -0.615 1
1 559 . 30 1 1 A 59 59 ASN CB C 58 37.404 39.642 -2.238 1
1 560 . 30 1 1 A 59 59 ASN N N 58 126.767 123.011 3.756 1
1 562 . 30 1 1 A 60 60 LYS H H 59 5.892 8.901 -3.009 1
1 563 . 30 1 1 A 60 60 LYS HA H 59 3.798 4.567 -0.769 1
1 572 . 30 1 1 A 60 60 LYS C C 59 177.908 177.203 0.705 1
1 573 . 30 1 1 A 60 60 LYS CA C 59 56.623 54.429 2.194 1
1 574 . 30 1 1 A 60 60 LYS CB C 59 32.279 34.642 -2.363 1
1 578 . 30 1 1 A 60 60 LYS N N 59 121.527 121.906 -0.379 1
1 579 . 30 1 1 A 61 61 LEU H H 60 8.473 8.721 -0.248 1
1 580 . 30 1 1 A 61 61 LEU HA H 60 3.891 4.177 -0.286 1
1 590 . 30 1 1 A 61 61 LEU C C 60 179.843 178.346 1.497 1
1 591 . 30 1 1 A 61 61 LEU CA C 60 58.301 56.228 2.073 1
1 592 . 30 1 1 A 61 61 LEU CB C 60 41.305 41.535 -0.230 1
1 596 . 30 1 1 A 61 61 LEU N N 60 125.639 123.090 2.549 1
1 597 . 30 1 1 A 62 62 ILE H H 61 7.698 7.601 0.097 1
1 598 . 30 1 1 A 62 62 ILE HA H 61 3.952 3.836 0.116 1
1 608 . 30 1 1 A 62 62 ILE C C 61 175.392 177.036 -1.644 1
1 609 . 30 1 1 A 62 62 ILE CA C 61 61.743 63.293 -1.550 1
1 610 . 30 1 1 A 62 62 ILE CB C 61 39.108 37.640 1.468 1
1 614 . 30 1 1 A 62 62 ILE N N 61 114.111 119.854 -5.743 1
1 615 . 30 1 1 A 63 63 TYR H H 62 7.273 7.491 -0.218 1
1 616 . 30 1 1 A 63 63 TYR HA H 62 4.343 4.133 0.210 1
1 623 . 30 1 1 A 63 63 TYR C C 62 178.264 178.561 -0.297 1
1 624 . 30 1 1 A 63 63 TYR CA C 62 57.231 60.881 -3.650 1
1 625 . 30 1 1 A 63 63 TYR CB C 62 36.332 37.442 -1.110 1
1 630 . 30 1 1 A 63 63 TYR N N 62 117.689 121.357 -3.668 1
1 631 . 30 1 1 A 64 64 THR H H 63 7.747 7.989 -0.242 1
1 632 . 30 1 1 A 64 64 THR HA H 63 4.266 4.213 0.053 1
1 637 . 30 1 1 A 64 64 THR CA C 63 69.362 67.541 1.821 1
1 638 . 30 1 1 A 64 64 THR CB C 63 66.962 67.574 -0.612 1
1 640 . 30 1 1 A 64 64 THR N N 63 113.755 116.024 -2.269 1
1 641 . 30 1 1 A 65 65 PRO HA H 64 4.372 4.380 -0.008 1
1 648 . 30 1 1 A 65 65 PRO C C 64 179.913 179.455 0.458 1
1 649 . 30 1 1 A 65 65 PRO CA C 64 66.011 66.153 -0.142 1
1 650 . 30 1 1 A 65 65 PRO CB C 64 30.642 30.678 -0.036 1
1 653 . 30 1 1 A 66 66 ILE H H 65 7.377 7.343 0.034 1
1 654 . 30 1 1 A 66 66 ILE HA H 65 3.530 3.928 -0.398 1
1 664 . 30 1 1 A 66 66 ILE C C 65 177.543 178.338 -0.795 1
1 665 . 30 1 1 A 66 66 ILE CA C 65 66.647 64.236 2.411 1
1 666 . 30 1 1 A 66 66 ILE CB C 65 38.029 37.691 0.338 1
1 670 . 30 1 1 A 66 66 ILE N N 65 118.353 116.631 1.722 1
1 671 . 30 1 1 A 67 67 PHE H H 66 8.480 8.458 0.022 1
1 672 . 30 1 1 A 67 67 PHE HA H 66 4.115 4.378 -0.263 1
1 680 . 30 1 1 A 67 67 PHE C C 66 177.293 178.321 -1.028 1
1 681 . 30 1 1 A 67 67 PHE CA C 66 59.570 61.591 -2.021 1
1 682 . 30 1 1 A 67 67 PHE CB C 66 38.865 39.415 -0.550 1
1 688 . 30 1 1 A 67 67 PHE N N 66 122.420 120.105 2.315 1
1 689 . 30 1 1 A 68 68 ASN H H 67 8.595 8.044 0.551 1
1 690 . 30 1 1 A 68 68 ASN HA H 67 4.211 4.360 -0.149 1
1 695 . 30 1 1 A 68 68 ASN C C 67 178.697 178.227 0.470 1
1 696 . 30 1 1 A 68 68 ASN CA C 67 56.056 56.312 -0.256 1
1 697 . 30 1 1 A 68 68 ASN CB C 67 37.704 37.910 -0.206 1
1 698 . 30 1 1 A 68 68 ASN N N 67 115.573 117.228 -1.655 1
1 700 . 30 1 1 A 69 69 GLU H H 68 8.414 7.912 0.502 1
1 701 . 30 1 1 A 69 69 GLU HA H 68 4.102 4.218 -0.116 1
1 706 . 30 1 1 A 69 69 GLU C C 68 177.880 178.822 -0.942 1
1 707 . 30 1 1 A 69 69 GLU CA C 68 59.399 59.494 -0.095 1
1 708 . 30 1 1 A 69 69 GLU CB C 68 29.855 29.514 0.341 1
1 710 . 30 1 1 A 69 69 GLU N N 68 123.510 120.070 3.440 1
1 711 . 30 1 1 A 70 70 TYR H H 69 8.659 8.022 0.637 1
1 712 . 30 1 1 A 70 70 TYR HA H 69 3.362 4.194 -0.832 1
1 719 . 30 1 1 A 70 70 TYR C C 69 178.143 176.980 1.163 1
1 720 . 30 1 1 A 70 70 TYR CA C 69 60.686 61.483 -0.797 1
1 721 . 30 1 1 A 70 70 TYR CB C 69 38.560 38.744 -0.184 1
1 726 . 30 1 1 A 70 70 TYR N N 69 122.130 120.952 1.178 1
1 727 . 30 1 1 A 71 71 ILE H H 70 8.031 7.910 0.121 1
1 728 . 30 1 1 A 71 71 ILE HA H 70 3.265 3.749 -0.484 1
1 738 . 30 1 1 A 71 71 ILE C C 70 178.056 178.458 -0.402 1
1 739 . 30 1 1 A 71 71 ILE CA C 70 63.756 64.180 -0.424 1
1 740 . 30 1 1 A 71 71 ILE CB C 70 37.321 36.692 0.629 1
1 744 . 30 1 1 A 71 71 ILE N N 70 118.906 120.751 -1.845 1
1 745 . 30 1 1 A 72 72 SER H H 71 7.803 7.823 -0.020 1
1 746 . 30 1 1 A 72 72 SER HA H 71 4.029 4.318 -0.289 1
1 749 . 30 1 1 A 72 72 SER CA C 71 61.380 61.124 0.256 1
1 750 . 30 1 1 A 72 72 SER CB C 71 63.288 62.882 0.406 1
1 751 . 30 1 1 A 72 72 SER N N 71 113.735 117.089 -3.354 1
1 752 . 30 1 1 A 73 73 LEU H H 72 7.952 7.949 0.003 1
1 753 . 30 1 1 A 73 73 LEU HA H 72 4.418 4.172 0.246 1
1 763 . 30 1 1 A 73 73 LEU C C 72 177.767 178.331 -0.564 1
1 764 . 30 1 1 A 73 73 LEU CA C 72 56.543 57.475 -0.932 1
1 765 . 30 1 1 A 73 73 LEU CB C 72 44.517 41.792 2.725 1
1 769 . 30 1 1 A 73 73 LEU N N 72 119.411 122.372 -2.961 1
1 770 . 30 1 1 A 74 74 VAL H H 73 8.021 7.475 0.546 1
1 771 . 30 1 1 A 74 74 VAL HA H 73 3.532 3.297 0.235 1
1 779 . 30 1 1 A 74 74 VAL C C 73 177.126 178.120 -0.994 1
1 780 . 30 1 1 A 74 74 VAL CA C 73 66.250 66.740 -0.490 1
1 781 . 30 1 1 A 74 74 VAL CB C 73 31.212 31.029 0.183 1
1 784 . 30 1 1 A 74 74 VAL N N 73 118.747 119.366 -0.619 1
1 785 . 30 1 1 A 75 75 GLU H H 74 7.232 7.984 -0.752 1
1 786 . 30 1 1 A 75 75 GLU HA H 74 3.013 4.288 -1.275 1
1 791 . 30 1 1 A 75 75 GLU C C 74 178.804 179.477 -0.673 1
1 792 . 30 1 1 A 75 75 GLU CA C 74 60.536 59.980 0.556 1
1 793 . 30 1 1 A 75 75 GLU CB C 74 27.009 29.087 -2.078 1
1 795 . 30 1 1 A 75 75 GLU N N 74 118.660 119.650 -0.990 1
1 796 . 30 1 1 A 76 76 LYS H H 75 7.051 8.089 -1.038 1
1 797 . 30 1 1 A 76 76 LYS HA H 75 3.765 4.215 -0.450 1
1 806 . 30 1 1 A 76 76 LYS C C 75 177.765 178.439 -0.674 1
1 807 . 30 1 1 A 76 76 LYS CA C 75 58.357 58.110 0.247 1
1 808 . 30 1 1 A 76 76 LYS CB C 75 31.939 32.222 -0.283 1
1 812 . 30 1 1 A 76 76 LYS N N 75 116.112 119.185 -3.073 1
1 813 . 30 1 1 A 77 77 TYR H H 76 7.067 8.159 -1.092 1
1 814 . 30 1 1 A 77 77 TYR HA H 76 4.036 4.142 -0.106 1
1 821 . 30 1 1 A 77 77 TYR C C 76 177.752 176.972 0.780 1
1 822 . 30 1 1 A 77 77 TYR CA C 76 61.820 61.417 0.403 1
1 823 . 30 1 1 A 77 77 TYR CB C 76 38.480 38.740 -0.260 1
1 828 . 30 1 1 A 77 77 TYR N N 76 118.434 122.423 -3.989 1
1 829 . 30 1 1 A 78 78 ILE H H 77 7.554 8.043 -0.489 1
1 830 . 30 1 1 A 78 78 ILE HA H 77 3.159 3.650 -0.491 1
1 840 . 30 1 1 A 78 78 ILE C C 77 177.341 177.649 -0.308 1
1 841 . 30 1 1 A 78 78 ILE CA C 77 65.177 64.547 0.630 1
1 842 . 30 1 1 A 78 78 ILE CB C 77 37.339 37.106 0.233 1
1 846 . 30 1 1 A 78 78 ILE N N 77 117.672 120.408 -2.736 1
1 847 . 30 1 1 A 79 79 GLU H H 78 8.296 8.237 0.059 1
1 848 . 30 1 1 A 79 79 GLU HA H 78 3.557 3.878 -0.321 1
1 853 . 30 1 1 A 79 79 GLU C C 78 177.742 178.989 -1.247 1
1 854 . 30 1 1 A 79 79 GLU CA C 78 60.847 60.178 0.669 1
1 855 . 30 1 1 A 79 79 GLU CB C 78 29.594 29.302 0.292 1
1 857 . 30 1 1 A 79 79 GLU N N 78 118.701 121.073 -2.372 1
1 858 . 30 1 1 A 80 80 GLU H H 79 8.330 8.197 0.133 1
1 859 . 30 1 1 A 80 80 GLU HA H 79 3.774 4.081 -0.307 1
1 864 . 30 1 1 A 80 80 GLU C C 79 179.926 179.151 0.775 1
1 865 . 30 1 1 A 80 80 GLU CA C 79 59.581 58.914 0.667 1
1 866 . 30 1 1 A 80 80 GLU CB C 79 29.062 29.448 -0.386 1
1 868 . 30 1 1 A 80 80 GLU N N 79 116.767 118.770 -2.003 1
1 869 . 30 1 1 A 81 81 GLN H H 80 7.634 7.735 -0.101 1
1 870 . 30 1 1 A 81 81 GLN HA H 80 3.605 3.879 -0.274 1
1 877 . 30 1 1 A 81 81 GLN C C 80 179.681 178.544 1.137 1
1 878 . 30 1 1 A 81 81 GLN CA C 80 57.765 58.446 -0.681 1
1 879 . 30 1 1 A 81 81 GLN CB C 80 28.079 28.015 0.064 1
1 881 . 30 1 1 A 81 81 GLN N N 80 116.325 118.727 -2.402 1
1 883 . 30 1 1 A 82 82 LEU H H 81 8.156 7.680 0.476 1
1 884 . 30 1 1 A 82 82 LEU HA H 81 3.536 3.826 -0.290 1
1 894 . 30 1 1 A 82 82 LEU C C 81 178.945 179.361 -0.416 1
1 895 . 30 1 1 A 82 82 LEU CA C 81 57.761 56.970 0.791 1
1 896 . 30 1 1 A 82 82 LEU CB C 81 40.961 41.015 -0.054 1
1 900 . 30 1 1 A 82 82 LEU N N 81 121.546 120.566 0.980 1
1 901 . 30 1 1 A 83 83 LEU H H 82 8.326 8.134 0.192 1
1 902 . 30 1 1 A 83 83 LEU HA H 82 4.198 4.285 -0.087 1
1 912 . 30 1 1 A 83 83 LEU C C 82 178.631 179.469 -0.838 1
1 913 . 30 1 1 A 83 83 LEU CA C 82 57.016 57.237 -0.221 1
1 914 . 30 1 1 A 83 83 LEU CB C 82 42.182 40.721 1.461 1
1 918 . 30 1 1 A 83 83 LEU N N 82 120.426 118.784 1.642 1
1 919 . 30 1 1 A 84 84 GLN H H 83 6.992 7.707 -0.715 1
1 920 . 30 1 1 A 84 84 GLN HA H 83 3.877 4.027 -0.150 1
1 927 . 30 1 1 A 84 84 GLN C C 83 177.008 177.014 -0.006 1
1 928 . 30 1 1 A 84 84 GLN CA C 83 57.543 58.380 -0.837 1
1 929 . 30 1 1 A 84 84 GLN CB C 83 28.688 28.630 0.058 1
1 931 . 30 1 1 A 84 84 GLN N N 83 114.001 117.492 -3.491 1
1 933 . 30 1 1 A 85 85 ARG H H 84 7.072 7.476 -0.404 1
1 934 . 30 1 1 A 85 85 ARG HA H 84 4.047 4.363 -0.316 1
1 942 . 30 1 1 A 85 85 ARG C C 84 175.999 175.650 0.349 1
1 943 . 30 1 1 A 85 85 ARG CA C 84 56.764 56.142 0.622 1
1 944 . 30 1 1 A 85 85 ARG CB C 84 32.044 32.243 -0.199 1
1 947 . 30 1 1 A 85 85 ARG N N 84 115.827 116.782 -0.955 1
1 949 . 30 1 1 A 86 86 ILE H H 85 8.238 7.740 0.498 1
1 950 . 30 1 1 A 86 86 ILE HA H 85 4.389 4.545 -0.156 1
1 960 . 30 1 1 A 86 86 ILE CA C 85 58.007 57.981 0.026 1
1 961 . 30 1 1 A 86 86 ILE CB C 85 39.604 39.132 0.472 1
1 965 . 30 1 1 A 86 86 ILE N N 85 119.285 119.931 -0.646 1
1 966 . 30 1 1 A 87 87 PRO HA H 86 4.392 4.540 -0.148 1
1 973 . 30 1 1 A 87 87 PRO C C 86 177.622 176.321 1.301 1
1 974 . 30 1 1 A 87 87 PRO CA C 86 64.665 64.305 0.360 1
1 975 . 30 1 1 A 87 87 PRO CB C 86 32.020 31.656 0.364 1
1 978 . 30 1 1 A 88 88 GLU H H 87 8.312 8.209 0.103 1
1 979 . 30 1 1 A 88 88 GLU HA H 87 4.208 4.576 -0.368 1
1 984 . 30 1 1 A 88 88 GLU C C 87 175.554 175.811 -0.257 1
1 985 . 30 1 1 A 88 88 GLU CA C 87 56.045 56.283 -0.238 1
1 986 . 30 1 1 A 88 88 GLU CB C 87 28.654 30.782 -2.128 1
1 988 . 30 1 1 A 88 88 GLU N N 87 114.256 116.679 -2.423 1
1 989 . 30 1 1 A 89 89 PHE H H 88 7.946 7.713 0.233 1
1 990 . 30 1 1 A 89 89 PHE HA H 88 3.993 4.637 -0.644 1
1 998 . 30 1 1 A 89 89 PHE C C 88 173.460 174.745 -1.285 1
1 999 . 30 1 1 A 89 89 PHE CA C 88 60.119 58.865 1.254 1
1 1000 . 30 1 1 A 89 89 PHE CB C 88 39.994 39.950 0.044 1
1 1006 . 30 1 1 A 89 89 PHE N N 88 121.550 123.135 -1.585 1
1 1007 . 30 1 1 A 90 90 ASN H H 89 7.266 7.787 -0.521 1
1 1008 . 30 1 1 A 90 90 ASN HA H 89 4.454 4.965 -0.511 1
1 1013 . 30 1 1 A 90 90 ASN C C 89 173.921 175.133 -1.212 1
1 1014 . 30 1 1 A 90 90 ASN CA C 89 51.839 51.272 0.567 1
1 1015 . 30 1 1 A 90 90 ASN CB C 89 40.674 39.656 1.018 1
1 1016 . 30 1 1 A 90 90 ASN N N 89 125.344 125.229 0.115 1
1 1018 . 30 1 1 A 91 91 MET H H 90 8.968 8.760 0.208 1
1 1019 . 30 1 1 A 91 91 MET HA H 90 4.049 4.297 -0.248 1
1 1027 . 30 1 1 A 91 91 MET C C 90 177.475 177.784 -0.309 1
1 1028 . 30 1 1 A 91 91 MET CA C 90 57.758 58.053 -0.295 1
1 1029 . 30 1 1 A 91 91 MET CB C 90 32.250 32.537 -0.287 1
1 1032 . 30 1 1 A 91 91 MET N N 90 127.052 125.500 1.552 1
1 1033 . 30 1 1 A 92 92 ALA H H 91 8.292 8.041 0.251 1
1 1034 . 30 1 1 A 92 92 ALA HA H 91 4.059 4.154 -0.095 1
1 1038 . 30 1 1 A 92 92 ALA C C 91 180.412 179.609 0.803 1
1 1039 . 30 1 1 A 92 92 ALA CA C 91 55.368 54.832 0.536 1
1 1040 . 30 1 1 A 92 92 ALA CB C 91 17.527 18.451 -0.924 1
1 1041 . 30 1 1 A 92 92 ALA N N 91 123.752 121.422 2.330 1
1 1042 . 30 1 1 A 93 93 ALA H H 92 7.931 8.115 -0.184 1
1 1043 . 30 1 1 A 93 93 ALA HA H 92 4.054 4.165 -0.111 1
1 1047 . 30 1 1 A 93 93 ALA C C 92 180.482 179.855 0.627 1
1 1048 . 30 1 1 A 93 93 ALA CA C 92 54.614 54.911 -0.297 1
1 1049 . 30 1 1 A 93 93 ALA CB C 92 18.098 18.117 -0.019 1
1 1050 . 30 1 1 A 93 93 ALA N N 92 121.158 120.318 0.840 1
1 1051 . 30 1 1 A 94 94 PHE H H 93 8.110 7.845 0.265 1
1 1052 . 30 1 1 A 94 94 PHE HA H 93 4.304 4.222 0.082 1
1 1060 . 30 1 1 A 94 94 PHE C C 93 177.350 177.406 -0.056 1
1 1061 . 30 1 1 A 94 94 PHE CA C 93 61.641 61.521 0.120 1
1 1062 . 30 1 1 A 94 94 PHE CB C 93 40.014 39.322 0.692 1
1 1068 . 30 1 1 A 94 94 PHE N N 93 119.807 119.656 0.151 1
1 1069 . 30 1 1 A 95 95 THR H H 94 8.726 8.148 0.578 1
1 1070 . 30 1 1 A 95 95 THR HA H 94 3.569 3.896 -0.327 1
1 1075 . 30 1 1 A 95 95 THR C C 94 176.932 176.551 0.381 1
1 1076 . 30 1 1 A 95 95 THR CA C 94 66.833 65.472 1.361 1
1 1077 . 30 1 1 A 95 95 THR CB C 94 68.445 68.235 0.210 1
1 1079 . 30 1 1 A 95 95 THR N N 94 113.074 112.345 0.729 1
1 1080 . 30 1 1 A 96 96 THR H H 95 7.657 7.836 -0.179 1
1 1081 . 30 1 1 A 96 96 THR HA H 95 3.945 4.082 -0.137 1
1 1086 . 30 1 1 A 96 96 THR C C 95 176.386 177.383 -0.997 1
1 1087 . 30 1 1 A 96 96 THR CA C 95 66.550 65.689 0.861 1
1 1088 . 30 1 1 A 96 96 THR CB C 95 68.583 67.952 0.631 1
1 1090 . 30 1 1 A 96 96 THR N N 95 117.927 113.906 4.021 1
1 1091 . 30 1 1 A 97 97 THR H H 96 7.699 7.855 -0.156 1
1 1092 . 30 1 1 A 97 97 THR HA H 96 3.905 4.084 -0.179 1
1 1097 . 30 1 1 A 97 97 THR C C 96 176.572 176.400 0.172 1
1 1098 . 30 1 1 A 97 97 THR CA C 96 65.979 66.850 -0.871 1
1 1099 . 30 1 1 A 97 97 THR CB C 96 68.553 68.223 0.330 1
1 1101 . 30 1 1 A 97 97 THR N N 96 118.518 117.578 0.940 1
1 1102 . 30 1 1 A 98 98 LEU H H 97 8.304 8.216 0.088 1
1 1103 . 30 1 1 A 98 98 LEU HA H 97 3.725 3.953 -0.228 1
1 1113 . 30 1 1 A 98 98 LEU C C 97 178.490 178.807 -0.317 1
1 1114 . 30 1 1 A 98 98 LEU CA C 97 58.517 58.039 0.478 1
1 1115 . 30 1 1 A 98 98 LEU CB C 97 41.697 41.153 0.544 1
1 1119 . 30 1 1 A 98 98 LEU N N 97 122.882 121.950 0.932 1
1 1120 . 30 1 1 A 99 99 GLN H H 98 7.639 7.807 -0.168 1
1 1121 . 30 1 1 A 99 99 GLN HA H 98 3.927 3.942 -0.015 1
1 1128 . 30 1 1 A 99 99 GLN C C 98 178.068 178.708 -0.640 1
1 1129 . 30 1 1 A 99 99 GLN CA C 98 58.735 58.917 -0.182 1
1 1130 . 30 1 1 A 99 99 GLN CB C 98 27.986 28.080 -0.094 1
1 1132 . 30 1 1 A 99 99 GLN N N 98 114.302 117.886 -3.584 1
1 1134 . 30 1 1 A 100 100 HIS H H 99 7.575 7.298 0.277 1
1 1135 . 30 1 1 A 100 100 HIS HA H 99 4.524 4.229 0.295 1
1 1139 . 30 1 1 A 100 100 HIS C C 99 174.789 177.838 -3.049 1
1 1140 . 30 1 1 A 100 100 HIS CA C 99 56.154 59.675 -3.521 1
1 1141 . 30 1 1 A 100 100 HIS CB C 99 28.946 30.211 -1.265 1
1 1143 . 30 1 1 A 100 100 HIS N N 99 114.778 119.200 -4.422 1
1 1144 . 30 1 1 A 101 101 HIS H H 100 7.773 7.760 0.013 1
1 1145 . 30 1 1 A 101 101 HIS HA H 100 4.704 4.355 0.349 1
1 1149 . 30 1 1 A 101 101 HIS C C 100 174.818 177.220 -2.402 1
1 1150 . 30 1 1 A 101 101 HIS CA C 100 54.830 58.880 -4.050 1
1 1151 . 30 1 1 A 101 101 HIS CB C 100 29.749 28.808 0.941 1
1 1153 . 30 1 1 A 101 101 HIS N N 100 117.397 117.217 0.180 1
1 1154 . 30 1 1 A 102 102 LYS H H 101 7.324 8.097 -0.773 1
1 1155 . 30 1 1 A 102 102 LYS HA H 101 3.611 4.080 -0.469 1
1 1164 . 30 1 1 A 102 102 LYS C C 101 176.823 177.998 -1.175 1
1 1165 . 30 1 1 A 102 102 LYS CA C 101 59.915 58.720 1.195 1
1 1166 . 30 1 1 A 102 102 LYS CB C 101 32.825 32.224 0.601 1
1 1170 . 30 1 1 A 102 102 LYS N N 101 120.533 121.945 -1.412 1
1 1171 . 30 1 1 A 103 103 ASP H H 102 8.361 7.646 0.715 1
1 1172 . 30 1 1 A 103 103 ASP HA H 102 4.421 4.449 -0.028 1
1 1175 . 30 1 1 A 103 103 ASP C C 102 176.793 177.422 -0.629 1
1 1176 . 30 1 1 A 103 103 ASP CA C 102 55.500 56.334 -0.834 1
1 1177 . 30 1 1 A 103 103 ASP CB C 102 40.178 41.009 -0.831 1
1 1178 . 30 1 1 A 103 103 ASP N N 102 114.814 119.064 -4.250 1
1 1179 . 30 1 1 A 104 104 GLU H H 103 7.858 8.207 -0.349 1
1 1180 . 30 1 1 A 104 104 GLU HA H 103 4.339 4.605 -0.266 1
1 1183 . 30 1 1 A 104 104 GLU C C 103 175.777 176.761 -0.984 1
1 1184 . 30 1 1 A 104 104 GLU CA C 103 56.356 57.559 -1.203 1
1 1185 . 30 1 1 A 104 104 GLU CB C 103 31.293 30.988 0.305 1
1 1186 . 30 1 1 A 104 104 GLU N N 103 116.826 114.934 1.892 1
1 1187 . 30 1 1 A 105 105 VAL H H 104 7.201 7.857 -0.656 1
1 1188 . 30 1 1 A 105 105 VAL HA H 104 4.296 4.106 0.190 1
1 1196 . 30 1 1 A 105 105 VAL C C 104 174.482 175.585 -1.103 1
1 1197 . 30 1 1 A 105 105 VAL CA C 104 60.370 62.724 -2.354 1
1 1198 . 30 1 1 A 105 105 VAL CB C 104 34.341 32.882 1.459 1
1 1201 . 30 1 1 A 105 105 VAL N N 104 116.422 120.841 -4.419 1
1 1202 . 30 1 1 A 106 106 ALA H H 105 8.487 8.444 0.043 1
1 1203 . 30 1 1 A 106 106 ALA HA H 105 4.172 4.383 -0.211 1
1 1207 . 30 1 1 A 106 106 ALA C C 105 179.030 178.712 0.318 1
1 1208 . 30 1 1 A 106 106 ALA CA C 105 52.966 52.413 0.553 1
1 1209 . 30 1 1 A 106 106 ALA CB C 105 19.371 19.286 0.085 1
1 1210 . 30 1 1 A 106 106 ALA N N 105 128.313 128.737 -0.424 1
1 1211 . 30 1 1 A 107 107 GLY H H 106 8.738 8.780 -0.042 1
1 1212 . 30 1 1 A 107 107 GLY HA2 H 106 3.773 3.867 -0.094 1
1 1213 . 30 1 1 A 107 107 GLY HA3 H 106 3.998 3.932 0.066 1
1 1214 . 30 1 1 A 107 107 GLY C C 106 174.958 175.515 -0.557 1
1 1215 . 30 1 1 A 107 107 GLY CA C 106 47.449 47.142 0.307 1
1 1216 . 30 1 1 A 107 107 GLY N N 106 110.612 110.812 -0.200 1
1 1217 . 30 1 1 A 108 108 ASP H H 107 8.535 7.832 0.703 1
1 1218 . 30 1 1 A 108 108 ASP HA H 107 4.333 4.346 -0.013 1
1 1221 . 30 1 1 A 108 108 ASP C C 107 179.133 178.963 0.170 1
1 1222 . 30 1 1 A 108 108 ASP CA C 107 56.721 56.327 0.394 1
1 1223 . 30 1 1 A 108 108 ASP CB C 107 39.336 40.709 -1.373 1
1 1224 . 30 1 1 A 108 108 ASP N N 107 117.474 122.260 -4.786 1
1 1225 . 30 1 1 A 109 109 ILE H H 108 7.459 7.883 -0.424 1
1 1226 . 30 1 1 A 109 109 ILE HA H 108 3.688 3.784 -0.096 1
1 1236 . 30 1 1 A 109 109 ILE C C 108 176.735 178.400 -1.665 1
1 1237 . 30 1 1 A 109 109 ILE CA C 108 63.474 65.471 -1.997 1
1 1238 . 30 1 1 A 109 109 ILE CB C 108 37.340 37.729 -0.389 1
1 1242 . 30 1 1 A 109 109 ILE N N 108 119.609 119.578 0.031 1
1 1243 . 30 1 1 A 110 110 PHE H H 109 7.920 8.339 -0.419 1
1 1244 . 30 1 1 A 110 110 PHE HA H 109 3.759 4.080 -0.321 1
1 1252 . 30 1 1 A 110 110 PHE C C 109 177.132 177.381 -0.249 1
1 1253 . 30 1 1 A 110 110 PHE CA C 109 62.766 61.237 1.529 1
1 1254 . 30 1 1 A 110 110 PHE CB C 109 39.752 39.282 0.470 1
1 1260 . 30 1 1 A 110 110 PHE N N 109 120.906 120.461 0.445 1
1 1261 . 30 1 1 A 111 111 ASP H H 110 8.639 8.285 0.354 1
1 1262 . 30 1 1 A 111 111 ASP HA H 110 4.216 4.201 0.015 1
1 1265 . 30 1 1 A 111 111 ASP C C 110 178.900 178.407 0.493 1
1 1266 . 30 1 1 A 111 111 ASP CA C 110 57.105 57.258 -0.153 1
1 1267 . 30 1 1 A 111 111 ASP CB C 110 39.697 41.708 -2.011 1
1 1268 . 30 1 1 A 111 111 ASP N N 110 117.124 119.025 -1.901 1
1 1269 . 30 1 1 A 112 112 MET H H 111 7.331 7.528 -0.197 1
1 1270 . 30 1 1 A 112 112 MET HA H 111 4.081 4.138 -0.057 1
1 1278 . 30 1 1 A 112 112 MET C C 111 179.052 178.161 0.891 1
1 1279 . 30 1 1 A 112 112 MET CA C 111 58.202 58.111 0.091 1
1 1280 . 30 1 1 A 112 112 MET CB C 111 31.827 32.443 -0.616 1
1 1283 . 30 1 1 A 112 112 MET N N 111 118.061 119.430 -1.369 1
1 1284 . 30 1 1 A 113 113 LEU H H 112 8.001 8.049 -0.048 1
1 1285 . 30 1 1 A 113 113 LEU HA H 112 3.723 3.600 0.123 1
1 1295 . 30 1 1 A 113 113 LEU C C 112 179.747 178.651 1.096 1
1 1296 . 30 1 1 A 113 113 LEU CA C 112 57.371 57.421 -0.050 1
1 1297 . 30 1 1 A 113 113 LEU CB C 112 40.671 41.180 -0.509 1
1 1301 . 30 1 1 A 113 113 LEU N N 112 120.426 119.665 0.761 1
1 1302 . 30 1 1 A 114 114 LEU H H 113 7.744 7.687 0.057 1
1 1303 . 30 1 1 A 114 114 LEU HA H 113 4.007 3.523 0.484 1
1 1313 . 30 1 1 A 114 114 LEU C C 113 179.358 178.558 0.800 1
1 1314 . 30 1 1 A 114 114 LEU CA C 113 57.202 57.511 -0.309 1
1 1315 . 30 1 1 A 114 114 LEU CB C 113 41.727 41.554 0.173 1
1 1319 . 30 1 1 A 114 114 LEU N N 113 119.584 119.641 -0.057 1
1 1320 . 30 1 1 A 115 115 THR H H 114 7.353 7.648 -0.295 1
1 1321 . 30 1 1 A 115 115 THR HA H 114 4.071 4.134 -0.063 1
1 1327 . 30 1 1 A 115 115 THR C C 114 173.591 176.502 -2.911 1
1 1328 . 30 1 1 A 115 115 THR CA C 114 65.332 64.399 0.933 1
1 1329 . 30 1 1 A 115 115 THR CB C 114 70.319 68.715 1.604 1
1 1331 . 30 1 1 A 115 115 THR N N 114 107.535 112.400 -4.865 1
1 1332 . 30 1 1 A 116 116 PHE H H 115 6.979 7.821 -0.842 1
1 1333 . 30 1 1 A 116 116 PHE HA H 115 5.022 4.362 0.660 1
1 1341 . 30 1 1 A 116 116 PHE C C 115 176.488 176.520 -0.032 1
1 1342 . 30 1 1 A 116 116 PHE CA C 115 55.911 60.855 -4.944 1
1 1343 . 30 1 1 A 116 116 PHE CB C 115 38.521 39.271 -0.750 1
1 1349 . 30 1 1 A 116 116 PHE N N 115 112.366 120.097 -7.731 1
1 1350 . 30 1 1 A 117 117 THR H H 116 7.564 7.399 0.165 1
1 1351 . 30 1 1 A 117 117 THR HA H 116 4.626 4.830 -0.204 1
1 1356 . 30 1 1 A 117 117 THR C C 116 174.085 173.381 0.704 1
1 1357 . 30 1 1 A 117 117 THR CA C 116 61.636 61.547 0.089 1
1 1358 . 30 1 1 A 117 117 THR CB C 116 70.915 70.859 0.056 1
1 1360 . 30 1 1 A 117 117 THR N N 116 105.498 105.485 0.013 1
1 1361 . 30 1 1 A 118 118 ASP H H 117 8.270 7.533 0.737 1
1 1362 . 30 1 1 A 118 118 ASP HA H 117 4.955 4.986 -0.031 1
1 1365 . 30 1 1 A 118 118 ASP C C 117 176.328 176.101 0.227 1
1 1366 . 30 1 1 A 118 118 ASP CA C 117 53.417 53.283 0.134 1
1 1367 . 30 1 1 A 118 118 ASP CB C 117 43.388 39.230 4.158 1
1 1368 . 30 1 1 A 118 118 ASP N N 117 124.409 123.259 1.150 1
1 1369 . 30 1 1 A 119 119 PHE H H 118 8.973 8.920 0.053 1
1 1370 . 30 1 1 A 119 119 PHE HA H 118 3.506 4.149 -0.643 1
1 1378 . 30 1 1 A 119 119 PHE CA C 118 61.490 61.002 0.488 1
1 1379 . 30 1 1 A 119 119 PHE CB C 118 39.246 39.461 -0.215 1
1 1385 . 30 1 1 A 119 119 PHE N N 118 126.688 125.483 1.205 1
1 1386 . 30 1 1 A 120 120 LEU H H 119 8.099 8.219 -0.120 1
1 1387 . 30 1 1 A 120 120 LEU HA H 119 3.842 4.007 -0.165 1
1 1397 . 30 1 1 A 120 120 LEU C C 119 179.601 178.368 1.233 1
1 1398 . 30 1 1 A 120 120 LEU CA C 119 58.174 58.032 0.142 1
1 1399 . 30 1 1 A 120 120 LEU CB C 119 40.315 41.379 -1.064 1
1 1403 . 30 1 1 A 120 120 LEU N N 119 117.930 120.228 -2.298 1
1 1404 . 30 1 1 A 121 121 ALA H H 120 7.729 7.686 0.043 1
1 1405 . 30 1 1 A 121 121 ALA HA H 120 3.996 4.084 -0.088 1
1 1409 . 30 1 1 A 121 121 ALA C C 120 180.995 179.620 1.375 1
1 1410 . 30 1 1 A 121 121 ALA CA C 120 54.832 54.607 0.225 1
1 1411 . 30 1 1 A 121 121 ALA CB C 120 17.706 18.131 -0.425 1
1 1412 . 30 1 1 A 121 121 ALA N N 120 123.195 120.797 2.398 1
1 1413 . 30 1 1 A 122 122 PHE H H 121 7.943 7.773 0.170 1
1 1414 . 30 1 1 A 122 122 PHE HA H 121 3.887 3.850 0.037 1
1 1419 . 30 1 1 A 122 122 PHE C C 121 175.410 176.999 -1.589 1
1 1420 . 30 1 1 A 122 122 PHE CA C 121 61.075 60.688 0.387 1
1 1421 . 30 1 1 A 122 122 PHE CB C 121 38.115 38.786 -0.671 1
1 1424 . 30 1 1 A 122 122 PHE N N 121 121.798 120.114 1.684 1
1 1425 . 30 1 1 A 123 123 LYS H H 122 8.468 7.831 0.637 1
1 1426 . 30 1 1 A 123 123 LYS HA H 122 3.077 3.754 -0.677 1
1 1435 . 30 1 1 A 123 123 LYS C C 122 178.453 178.169 0.284 1
1 1436 . 30 1 1 A 123 123 LYS CA C 122 59.855 59.831 0.024 1
1 1437 . 30 1 1 A 123 123 LYS CB C 122 32.374 31.816 0.558 1
1 1441 . 30 1 1 A 123 123 LYS N N 122 120.614 118.387 2.227 1
1 1442 . 30 1 1 A 124 124 GLU H H 123 8.100 7.675 0.425 1
1 1443 . 30 1 1 A 124 124 GLU HA H 123 3.652 4.065 -0.413 1
1 1448 . 30 1 1 A 124 124 GLU C C 123 177.743 178.695 -0.952 1
1 1449 . 30 1 1 A 124 124 GLU CA C 123 59.406 59.115 0.291 1
1 1450 . 30 1 1 A 124 124 GLU CB C 123 28.811 29.005 -0.194 1
1 1452 . 30 1 1 A 124 124 GLU N N 123 117.404 118.778 -1.374 1
1 1453 . 30 1 1 A 125 125 MET H H 124 7.537 7.488 0.049 1
1 1454 . 30 1 1 A 125 125 MET HA H 124 3.860 3.928 -0.068 1
1 1462 . 30 1 1 A 125 125 MET C C 124 179.522 178.374 1.148 1
1 1463 . 30 1 1 A 125 125 MET CA C 124 58.832 58.359 0.473 1
1 1464 . 30 1 1 A 125 125 MET CB C 124 31.765 31.435 0.330 1
1 1467 . 30 1 1 A 125 125 MET N N 124 119.413 118.916 0.497 1
1 1468 . 30 1 1 A 126 126 PHE H H 125 7.148 7.489 -0.341 1
1 1469 . 30 1 1 A 126 126 PHE HA H 125 3.633 4.214 -0.581 1
1 1476 . 30 1 1 A 126 126 PHE C C 125 178.994 178.312 0.682 1
1 1477 . 30 1 1 A 126 126 PHE CA C 125 63.148 61.083 2.065 1
1 1478 . 30 1 1 A 126 126 PHE CB C 125 39.830 38.525 1.305 1
1 1483 . 30 1 1 A 126 126 PHE N N 125 120.013 118.433 1.580 1
1 1484 . 30 1 1 A 127 127 LEU H H 126 8.369 8.483 -0.114 1
1 1485 . 30 1 1 A 127 127 LEU HA H 126 3.972 4.018 -0.046 1
1 1495 . 30 1 1 A 127 127 LEU C C 126 180.621 179.319 1.302 1
1 1496 . 30 1 1 A 127 127 LEU CA C 126 57.944 57.931 0.013 1
1 1497 . 30 1 1 A 127 127 LEU CB C 126 40.543 41.434 -0.891 1
1 1501 . 30 1 1 A 127 127 LEU N N 126 119.692 119.755 -0.063 1
1 1502 . 30 1 1 A 128 128 ASP H H 127 8.578 7.997 0.581 1
1 1503 . 30 1 1 A 128 128 ASP HA H 127 4.308 4.345 -0.037 1
1 1506 . 30 1 1 A 128 128 ASP C C 127 178.254 178.176 0.078 1
1 1507 . 30 1 1 A 128 128 ASP CA C 127 56.964 57.152 -0.188 1
1 1508 . 30 1 1 A 128 128 ASP CB C 127 39.735 40.873 -1.138 1
1 1509 . 30 1 1 A 128 128 ASP N N 127 121.926 119.715 2.211 1
1 1510 . 30 1 1 A 129 129 TYR H H 128 7.710 8.083 -0.373 1
1 1511 . 30 1 1 A 129 129 TYR HA H 128 3.908 4.027 -0.119 1
1 1518 . 30 1 1 A 129 129 TYR C C 128 177.633 177.746 -0.113 1
1 1519 . 30 1 1 A 129 129 TYR CA C 128 61.796 61.487 0.309 1
1 1520 . 30 1 1 A 129 129 TYR CB C 128 39.372 38.526 0.846 1
1 1525 . 30 1 1 A 129 129 TYR N N 128 122.548 120.403 2.145 1
1 1526 . 30 1 1 A 130 130 ARG H H 129 8.622 8.524 0.098 1
1 1527 . 30 1 1 A 130 130 ARG HA H 129 3.722 4.041 -0.319 1
1 1535 . 30 1 1 A 130 130 ARG CA C 129 60.084 59.614 0.470 1
1 1536 . 30 1 1 A 130 130 ARG CB C 129 29.902 29.873 0.029 1
1 1539 . 30 1 1 A 130 130 ARG N N 129 118.302 119.272 -0.970 1
1 1541 . 30 1 1 A 131 131 ALA H H 130 7.936 7.977 -0.041 1
1 1542 . 30 1 1 A 131 131 ALA HA H 130 3.997 4.017 -0.020 1
1 1546 . 30 1 1 A 131 131 ALA C C 130 180.456 179.442 1.014 1
1 1547 . 30 1 1 A 131 131 ALA CA C 130 55.133 54.981 0.152 1
1 1548 . 30 1 1 A 131 131 ALA CB C 130 17.750 18.243 -0.493 1
1 1549 . 30 1 1 A 131 131 ALA N N 130 119.788 122.027 -2.239 1
1 1550 . 30 1 1 A 132 132 GLU H H 131 7.622 7.741 -0.119 1
1 1551 . 30 1 1 A 132 132 GLU HA H 131 3.862 3.961 -0.099 1
1 1556 . 30 1 1 A 132 132 GLU C C 131 179.528 179.131 0.397 1
1 1557 . 30 1 1 A 132 132 GLU CA C 131 58.849 58.956 -0.107 1
1 1558 . 30 1 1 A 132 132 GLU CB C 131 28.930 29.201 -0.271 1
1 1560 . 30 1 1 A 132 132 GLU N N 131 118.428 119.070 -0.642 1
1 1561 . 30 1 1 A 133 133 LYS H H 132 7.853 7.678 0.175 1
1 1562 . 30 1 1 A 133 133 LYS HA H 132 3.722 4.042 -0.320 1
1 1571 . 30 1 1 A 133 133 LYS C C 132 175.725 178.387 -2.662 1
1 1572 . 30 1 1 A 133 133 LYS CA C 132 57.544 59.189 -1.645 1
1 1573 . 30 1 1 A 133 133 LYS CB C 132 31.770 32.039 -0.269 1
1 1577 . 30 1 1 A 133 133 LYS N N 132 119.473 119.158 0.315 1
1 1578 . 30 1 1 A 134 134 GLU H H 133 8.151 7.378 0.773 1
1 1579 . 30 1 1 A 134 134 GLU HA H 133 4.161 4.352 -0.191 1
1 1584 . 30 1 1 A 134 134 GLU C C 133 177.453 176.724 0.729 1
1 1585 . 30 1 1 A 134 134 GLU CA C 133 57.222 56.262 0.960 1
1 1586 . 30 1 1 A 134 134 GLU CB C 133 30.091 29.826 0.265 1
1 1588 . 30 1 1 A 134 134 GLU N N 133 116.525 116.756 -0.231 1
1 1589 . 30 1 1 A 135 135 GLY H H 134 7.702 7.780 -0.078 1
1 1590 . 30 1 1 A 135 135 GLY HA2 H 134 3.896 4.001 -0.105 1
1 1591 . 30 1 1 A 135 135 GLY HA3 H 134 3.897 4.010 -0.113 1
1 1592 . 30 1 1 A 135 135 GLY C C 134 174.538 174.313 0.225 1
1 1593 . 30 1 1 A 135 135 GLY CA C 134 45.975 44.945 1.030 1
1 1594 . 30 1 1 A 135 135 GLY N N 134 107.924 107.445 0.479 1
1 1595 . 30 1 1 A 136 136 ARG H H 135 8.045 8.304 -0.259 1
1 1596 . 30 1 1 A 136 136 ARG HA H 135 4.323 4.038 0.285 1
1 1604 . 30 1 1 A 136 136 ARG C C 135 175.864 174.807 1.057 1
1 1605 . 30 1 1 A 136 136 ARG CA C 135 56.016 56.913 -0.897 1
1 1606 . 30 1 1 A 136 136 ARG CB C 135 30.987 29.541 1.446 1
1 1609 . 30 1 1 A 136 136 ARG N N 135 119.708 121.332 -1.624 1
1 1 . 31 1 1 A 14 14 PHE CA C 13 58.199 58.155 0.044 1
1 2 . 31 1 1 A 14 14 PHE CB C 13 39.717 37.508 2.209 1
1 3 . 31 1 1 A 15 15 SER H H 14 8.299 8.191 0.108 1
1 4 . 31 1 1 A 15 15 SER HA H 14 4.359 5.050 -0.691 1
1 7 . 31 1 1 A 15 15 SER CA C 14 58.249 56.250 1.999 1
1 8 . 31 1 1 A 15 15 SER CB C 14 63.936 65.280 -1.344 1
1 9 . 31 1 1 A 15 15 SER N N 14 117.379 119.654 -2.275 1
1 10 . 31 1 1 A 16 16 SER H H 15 8.255 9.002 -0.747 1
1 11 . 31 1 1 A 16 16 SER HA H 15 3.729 4.547 -0.818 1
1 14 . 31 1 1 A 16 16 SER CA C 15 58.224 61.536 -3.312 1
1 15 . 31 1 1 A 16 16 SER CB C 15 63.886 63.699 0.187 1
1 16 . 31 1 1 A 16 16 SER N N 15 117.694 123.926 -6.232 1
1 17 . 31 1 1 A 17 17 ALA H H 16 8.333 8.035 0.298 1
1 18 . 31 1 1 A 17 17 ALA HA H 16 4.252 4.565 -0.313 1
1 22 . 31 1 1 A 17 17 ALA CA C 16 53.377 53.501 -0.124 1
1 23 . 31 1 1 A 17 17 ALA CB C 16 18.896 18.403 0.493 1
1 24 . 31 1 1 A 17 17 ALA N N 16 125.462 124.104 1.358 1
1 25 . 31 1 1 A 18 18 SER H H 17 8.219 7.981 0.238 1
1 26 . 31 1 1 A 18 18 SER HA H 17 4.332 4.308 0.024 1
1 29 . 31 1 1 A 18 18 SER CA C 17 59.105 61.279 -2.174 1
1 30 . 31 1 1 A 18 18 SER CB C 17 63.592 62.938 0.654 1
1 31 . 31 1 1 A 18 18 SER N N 17 114.821 114.056 0.765 1
1 32 . 31 1 1 A 19 19 ASP H H 18 8.309 7.945 0.364 1
1 33 . 31 1 1 A 19 19 ASP HA H 18 4.554 4.930 -0.376 1
1 36 . 31 1 1 A 19 19 ASP C C 18 176.528 176.996 -0.468 1
1 37 . 31 1 1 A 19 19 ASP CA C 18 55.272 55.729 -0.457 1
1 38 . 31 1 1 A 19 19 ASP CB C 18 40.883 42.861 -1.978 1
1 39 . 31 1 1 A 19 19 ASP N N 18 123.367 118.978 4.389 1
1 40 . 31 1 1 A 20 20 ALA H H 19 8.133 8.454 -0.321 1
1 41 . 31 1 1 A 20 20 ALA HA H 19 4.170 4.140 0.030 1
1 45 . 31 1 1 A 20 20 ALA C C 19 179.857 178.963 0.894 1
1 46 . 31 1 1 A 20 20 ALA CA C 19 54.341 55.620 -1.279 1
1 47 . 31 1 1 A 20 20 ALA CB C 19 18.660 18.441 0.219 1
1 48 . 31 1 1 A 20 20 ALA N N 19 123.350 122.664 0.686 1
1 49 . 31 1 1 A 21 21 GLU H H 20 8.140 8.122 0.018 1
1 50 . 31 1 1 A 21 21 GLU HA H 20 4.128 4.120 0.008 1
1 55 . 31 1 1 A 21 21 GLU C C 20 177.675 178.633 -0.958 1
1 56 . 31 1 1 A 21 21 GLU CA C 20 58.520 59.507 -0.987 1
1 57 . 31 1 1 A 21 21 GLU CB C 20 29.765 29.649 0.116 1
1 59 . 31 1 1 A 21 21 GLU N N 20 119.063 118.904 0.159 1
1 60 . 31 1 1 A 22 22 PHE H H 21 8.009 8.086 -0.077 1
1 61 . 31 1 1 A 22 22 PHE HA H 21 4.123 4.223 -0.100 1
1 68 . 31 1 1 A 22 22 PHE C C 21 176.410 177.115 -0.705 1
1 69 . 31 1 1 A 22 22 PHE CA C 21 62.202 61.411 0.791 1
1 70 . 31 1 1 A 22 22 PHE CB C 21 39.223 39.280 -0.057 1
1 75 . 31 1 1 A 22 22 PHE N N 21 121.211 120.910 0.301 1
1 76 . 31 1 1 A 23 23 ASP H H 22 8.261 8.493 -0.232 1
1 77 . 31 1 1 A 23 23 ASP HA H 22 4.041 4.461 -0.420 1
1 80 . 31 1 1 A 23 23 ASP C C 22 179.078 178.186 0.892 1
1 81 . 31 1 1 A 23 23 ASP CA C 22 57.048 57.850 -0.802 1
1 82 . 31 1 1 A 23 23 ASP CB C 22 40.154 41.603 -1.449 1
1 83 . 31 1 1 A 23 23 ASP N N 22 116.876 119.027 -2.151 1
1 84 . 31 1 1 A 24 24 ALA H H 23 7.651 7.641 0.010 1
1 85 . 31 1 1 A 24 24 ALA HA H 23 3.785 3.930 -0.145 1
1 89 . 31 1 1 A 24 24 ALA C C 23 179.577 180.251 -0.674 1
1 90 . 31 1 1 A 24 24 ALA CA C 23 54.341 55.424 -1.083 1
1 91 . 31 1 1 A 24 24 ALA CB C 23 17.762 18.060 -0.298 1
1 92 . 31 1 1 A 24 24 ALA N N 23 121.873 121.825 0.048 1
1 93 . 31 1 1 A 25 25 VAL H H 24 7.718 7.995 -0.277 1
1 94 . 31 1 1 A 25 25 VAL HA H 24 3.216 3.691 -0.475 1
1 102 . 31 1 1 A 25 25 VAL C C 24 177.805 177.843 -0.038 1
1 103 . 31 1 1 A 25 25 VAL CA C 24 66.789 67.017 -0.228 1
1 104 . 31 1 1 A 25 25 VAL CB C 24 31.277 31.293 -0.016 1
1 107 . 31 1 1 A 25 25 VAL N N 24 117.890 119.028 -1.138 1
1 108 . 31 1 1 A 26 26 VAL H H 25 7.867 7.855 0.012 1
1 109 . 31 1 1 A 26 26 VAL HA H 25 3.274 3.646 -0.372 1
1 117 . 31 1 1 A 26 26 VAL C C 25 177.788 177.987 -0.199 1
1 118 . 31 1 1 A 26 26 VAL CA C 25 67.282 66.196 1.086 1
1 119 . 31 1 1 A 26 26 VAL CB C 25 31.266 31.552 -0.286 1
1 122 . 31 1 1 A 26 26 VAL N N 25 118.170 119.453 -1.283 1
1 123 . 31 1 1 A 27 27 GLY H H 26 7.544 7.783 -0.239 1
1 124 . 31 1 1 A 27 27 GLY HA2 H 26 3.592 3.539 0.053 1
1 125 . 31 1 1 A 27 27 GLY HA3 H 26 3.721 3.649 0.072 1
1 126 . 31 1 1 A 27 27 GLY C C 26 176.717 176.380 0.337 1
1 127 . 31 1 1 A 27 27 GLY CA C 26 47.085 47.228 -0.143 1
1 128 . 31 1 1 A 27 27 GLY N N 26 105.795 107.825 -2.030 1
1 129 . 31 1 1 A 28 28 TYR H H 27 7.625 7.487 0.138 1
1 130 . 31 1 1 A 28 28 TYR HA H 27 4.546 4.551 -0.005 1
1 137 . 31 1 1 A 28 28 TYR C C 27 178.991 178.104 0.887 1
1 138 . 31 1 1 A 28 28 TYR CA C 27 58.845 59.676 -0.831 1
1 139 . 31 1 1 A 28 28 TYR CB C 27 37.602 37.818 -0.216 1
1 144 . 31 1 1 A 28 28 TYR N N 27 119.933 121.555 -1.622 1
1 145 . 31 1 1 A 29 29 LEU H H 28 8.517 8.458 0.059 1
1 146 . 31 1 1 A 29 29 LEU HA H 28 3.728 3.844 -0.116 1
1 156 . 31 1 1 A 29 29 LEU CA C 28 58.281 58.075 0.206 1
1 157 . 31 1 1 A 29 29 LEU CB C 28 41.948 41.485 0.463 1
1 161 . 31 1 1 A 29 29 LEU N N 28 119.669 120.300 -0.631 1
1 162 . 31 1 1 A 30 30 GLU H H 29 8.072 8.069 0.003 1
1 163 . 31 1 1 A 30 30 GLU HA H 29 3.722 3.954 -0.232 1
1 168 . 31 1 1 A 30 30 GLU C C 29 177.731 179.057 -1.326 1
1 169 . 31 1 1 A 30 30 GLU CA C 29 59.763 59.776 -0.013 1
1 170 . 31 1 1 A 30 30 GLU CB C 29 28.844 29.172 -0.328 1
1 172 . 31 1 1 A 30 30 GLU N N 29 117.666 117.783 -0.117 1
1 173 . 31 1 1 A 31 31 ASP H H 30 7.243 7.776 -0.533 1
1 174 . 31 1 1 A 31 31 ASP HA H 30 4.297 4.369 -0.072 1
1 177 . 31 1 1 A 31 31 ASP CA C 30 56.953 57.402 -0.449 1
1 178 . 31 1 1 A 31 31 ASP CB C 30 40.730 41.013 -0.283 1
1 179 . 31 1 1 A 31 31 ASP N N 30 116.720 119.473 -2.753 1
1 180 . 31 1 1 A 32 32 ILE H H 31 7.940 7.597 0.343 1
1 181 . 31 1 1 A 32 32 ILE HA H 31 3.640 3.707 -0.067 1
1 191 . 31 1 1 A 32 32 ILE C C 31 177.980 177.987 -0.007 1
1 192 . 31 1 1 A 32 32 ILE CA C 31 64.692 63.989 0.703 1
1 193 . 31 1 1 A 32 32 ILE CB C 31 38.938 36.171 2.767 1
1 197 . 31 1 1 A 32 32 ILE N N 31 119.728 120.211 -0.483 1
1 198 . 31 1 1 A 33 33 ILE H H 32 7.984 7.828 0.156 1
1 199 . 31 1 1 A 33 33 ILE HA H 32 3.598 3.212 0.386 1
1 209 . 31 1 1 A 33 33 ILE C C 32 176.723 176.968 -0.245 1
1 210 . 31 1 1 A 33 33 ILE CA C 32 63.241 64.625 -1.384 1
1 211 . 31 1 1 A 33 33 ILE CB C 32 37.580 37.840 -0.260 1
1 215 . 31 1 1 A 33 33 ILE N N 32 113.919 121.667 -7.748 1
1 216 . 31 1 1 A 34 34 MET H H 33 7.288 7.678 -0.390 1
1 217 . 31 1 1 A 34 34 MET HA H 33 4.496 4.665 -0.169 1
1 225 . 31 1 1 A 34 34 MET C C 33 176.423 175.812 0.611 1
1 226 . 31 1 1 A 34 34 MET CA C 33 54.634 54.278 0.356 1
1 227 . 31 1 1 A 34 34 MET CB C 33 31.934 31.293 0.641 1
1 230 . 31 1 1 A 34 34 MET N N 33 115.130 116.742 -1.612 1
1 231 . 31 1 1 A 35 35 ASP H H 34 7.405 7.781 -0.376 1
1 232 . 31 1 1 A 35 35 ASP HA H 34 4.484 4.616 -0.132 1
1 235 . 31 1 1 A 35 35 ASP C C 34 177.139 176.725 0.414 1
1 236 . 31 1 1 A 35 35 ASP CA C 34 54.625 54.555 0.070 1
1 237 . 31 1 1 A 35 35 ASP CB C 34 43.554 42.621 0.933 1
1 238 . 31 1 1 A 35 35 ASP N N 34 121.814 122.426 -0.612 1
1 239 . 31 1 1 A 36 36 ASP H H 35 8.765 8.824 -0.059 1
1 240 . 31 1 1 A 36 36 ASP HA H 35 4.235 4.305 -0.070 1
1 243 . 31 1 1 A 36 36 ASP C C 35 178.320 178.422 -0.102 1
1 244 . 31 1 1 A 36 36 ASP CA C 35 57.832 57.965 -0.133 1
1 245 . 31 1 1 A 36 36 ASP CB C 35 40.914 40.423 0.491 1
1 246 . 31 1 1 A 36 36 ASP N N 35 125.883 125.577 0.306 1
1 247 . 31 1 1 A 37 37 GLU H H 36 8.905 7.971 0.934 1
1 248 . 31 1 1 A 37 37 GLU HA H 36 3.933 4.071 -0.138 1
1 253 . 31 1 1 A 37 37 GLU C C 36 179.304 179.197 0.107 1
1 254 . 31 1 1 A 37 37 GLU CA C 36 59.828 59.236 0.592 1
1 255 . 31 1 1 A 37 37 GLU CB C 36 29.380 29.211 0.169 1
1 257 . 31 1 1 A 37 37 GLU N N 36 119.077 120.014 -0.937 1
1 258 . 31 1 1 A 38 38 PHE H H 37 7.460 8.262 -0.802 1
1 259 . 31 1 1 A 38 38 PHE HA H 37 3.642 4.062 -0.420 1
1 267 . 31 1 1 A 38 38 PHE C C 37 176.483 178.080 -1.597 1
1 268 . 31 1 1 A 38 38 PHE CA C 37 61.411 60.980 0.431 1
1 269 . 31 1 1 A 38 38 PHE CB C 37 39.355 39.194 0.161 1
1 275 . 31 1 1 A 38 38 PHE N N 37 119.968 120.801 -0.833 1
1 276 . 31 1 1 A 39 39 GLN H H 38 7.968 8.201 -0.233 1
1 277 . 31 1 1 A 39 39 GLN HA H 38 3.712 3.776 -0.064 1
1 284 . 31 1 1 A 39 39 GLN CA C 38 59.153 58.517 0.636 1
1 285 . 31 1 1 A 39 39 GLN CB C 38 28.213 28.378 -0.165 1
1 287 . 31 1 1 A 39 39 GLN N N 38 116.433 118.131 -1.698 1
1 289 . 31 1 1 A 40 40 LEU H H 39 7.930 7.717 0.213 1
1 290 . 31 1 1 A 40 40 LEU HA H 39 3.916 3.997 -0.081 1
1 300 . 31 1 1 A 40 40 LEU C C 39 177.731 178.059 -0.328 1
1 301 . 31 1 1 A 40 40 LEU CA C 39 57.915 57.977 -0.062 1
1 302 . 31 1 1 A 40 40 LEU CB C 39 41.989 41.771 0.218 1
1 306 . 31 1 1 A 40 40 LEU N N 39 119.505 122.359 -2.854 1
1 307 . 31 1 1 A 41 41 LEU H H 40 7.174 7.848 -0.674 1
1 308 . 31 1 1 A 41 41 LEU HA H 40 3.835 4.007 -0.172 1
1 318 . 31 1 1 A 41 41 LEU C C 40 179.738 178.239 1.499 1
1 319 . 31 1 1 A 41 41 LEU CA C 40 58.266 58.146 0.120 1
1 320 . 31 1 1 A 41 41 LEU CB C 40 42.050 41.468 0.582 1
1 324 . 31 1 1 A 41 41 LEU N N 40 120.971 119.674 1.297 1
1 325 . 31 1 1 A 42 42 GLN H H 41 8.058 7.845 0.213 1
1 326 . 31 1 1 A 42 42 GLN HA H 41 3.556 3.748 -0.192 1
1 333 . 31 1 1 A 42 42 GLN C C 41 177.642 178.403 -0.761 1
1 334 . 31 1 1 A 42 42 GLN CA C 41 59.826 59.170 0.656 1
1 335 . 31 1 1 A 42 42 GLN CB C 41 28.762 27.847 0.915 1
1 337 . 31 1 1 A 42 42 GLN N N 41 117.899 117.926 -0.027 1
1 339 . 31 1 1 A 43 43 ARG H H 42 8.179 7.702 0.477 1
1 340 . 31 1 1 A 43 43 ARG HA H 42 3.655 3.977 -0.322 1
1 347 . 31 1 1 A 43 43 ARG C C 42 178.051 178.453 -0.402 1
1 348 . 31 1 1 A 43 43 ARG CA C 42 59.766 58.715 1.051 1
1 349 . 31 1 1 A 43 43 ARG CB C 42 29.941 29.639 0.302 1
1 352 . 31 1 1 A 43 43 ARG N N 42 119.392 120.004 -0.612 1
1 353 . 31 1 1 A 44 44 ASN H H 43 8.525 7.949 0.576 1
1 354 . 31 1 1 A 44 44 ASN HA H 43 4.332 4.380 -0.048 1
1 359 . 31 1 1 A 44 44 ASN C C 43 178.150 177.796 0.354 1
1 360 . 31 1 1 A 44 44 ASN CA C 43 55.841 56.193 -0.352 1
1 361 . 31 1 1 A 44 44 ASN CB C 43 37.632 39.208 -1.576 1
1 362 . 31 1 1 A 44 44 ASN N N 43 116.214 118.014 -1.800 1
1 364 . 31 1 1 A 45 45 PHE H H 44 7.586 8.010 -0.424 1
1 365 . 31 1 1 A 45 45 PHE HA H 44 4.132 4.281 -0.149 1
1 372 . 31 1 1 A 45 45 PHE C C 44 176.691 178.911 -2.220 1
1 373 . 31 1 1 A 45 45 PHE CA C 44 62.333 60.554 1.779 1
1 374 . 31 1 1 A 45 45 PHE CB C 44 39.449 38.774 0.675 1
1 379 . 31 1 1 A 45 45 PHE N N 44 121.501 117.859 3.642 1
1 380 . 31 1 1 A 46 46 MET H H 45 8.190 8.211 -0.021 1
1 381 . 31 1 1 A 46 46 MET HA H 45 4.060 4.409 -0.349 1
1 389 . 31 1 1 A 46 46 MET C C 45 179.754 178.053 1.701 1
1 390 . 31 1 1 A 46 46 MET CA C 45 57.742 57.672 0.070 1
1 391 . 31 1 1 A 46 46 MET CB C 45 29.912 32.369 -2.457 1
1 394 . 31 1 1 A 46 46 MET N N 45 116.727 119.389 -2.662 1
1 395 . 31 1 1 A 47 47 ASP H H 46 8.579 8.262 0.317 1
1 396 . 31 1 1 A 47 47 ASP HA H 46 4.804 4.698 0.106 1
1 399 . 31 1 1 A 47 47 ASP C C 46 177.854 178.389 -0.535 1
1 400 . 31 1 1 A 47 47 ASP CA C 46 57.277 57.276 0.001 1
1 401 . 31 1 1 A 47 47 ASP CB C 46 40.776 41.608 -0.832 1
1 402 . 31 1 1 A 47 47 ASP N N 46 117.798 120.723 -2.925 1
1 403 . 31 1 1 A 48 48 LYS H H 47 7.339 7.908 -0.569 1
1 404 . 31 1 1 A 48 48 LYS HA H 47 3.828 4.209 -0.381 1
1 413 . 31 1 1 A 48 48 LYS C C 47 178.812 178.671 0.141 1
1 414 . 31 1 1 A 48 48 LYS CA C 47 58.953 58.475 0.478 1
1 415 . 31 1 1 A 48 48 LYS CB C 47 32.796 32.834 -0.038 1
1 419 . 31 1 1 A 48 48 LYS N N 47 117.852 119.729 -1.877 1
1 420 . 31 1 1 A 49 49 TYR H H 48 6.841 8.608 -1.767 1
1 421 . 31 1 1 A 49 49 TYR HA H 48 4.995 4.232 0.763 1
1 428 . 31 1 1 A 49 49 TYR C C 48 178.138 178.550 -0.412 1
1 429 . 31 1 1 A 49 49 TYR CA C 48 58.620 59.703 -1.083 1
1 430 . 31 1 1 A 49 49 TYR CB C 48 42.939 38.141 4.798 1
1 435 . 31 1 1 A 49 49 TYR N N 48 112.109 119.823 -7.714 1
1 436 . 31 1 1 A 50 50 TYR H H 49 8.491 8.151 0.340 1
1 437 . 31 1 1 A 50 50 TYR HA H 49 4.598 4.178 0.420 1
1 444 . 31 1 1 A 50 50 TYR C C 49 176.015 178.134 -2.119 1
1 445 . 31 1 1 A 50 50 TYR CA C 49 62.442 59.595 2.847 1
1 446 . 31 1 1 A 50 50 TYR CB C 49 36.588 37.092 -0.504 1
1 451 . 31 1 1 A 50 50 TYR N N 49 118.294 119.214 -0.920 1
1 452 . 31 1 1 A 51 51 LEU H H 50 7.512 7.490 0.022 1
1 453 . 31 1 1 A 51 51 LEU HA H 50 3.878 3.506 0.372 1
1 463 . 31 1 1 A 51 51 LEU C C 50 178.625 178.832 -0.207 1
1 464 . 31 1 1 A 51 51 LEU CA C 50 55.994 57.150 -1.156 1
1 465 . 31 1 1 A 51 51 LEU CB C 50 40.743 41.080 -0.337 1
1 469 . 31 1 1 A 51 51 LEU N N 50 118.478 121.630 -3.152 1
1 470 . 31 1 1 A 52 52 GLU H H 51 8.042 7.795 0.247 1
1 471 . 31 1 1 A 52 52 GLU HA H 51 4.197 3.876 0.321 1
1 476 . 31 1 1 A 52 52 GLU C C 51 177.629 177.259 0.370 1
1 477 . 31 1 1 A 52 52 GLU CA C 51 56.141 59.181 -3.040 1
1 478 . 31 1 1 A 52 52 GLU CB C 51 29.162 29.449 -0.287 1
1 480 . 31 1 1 A 52 52 GLU N N 51 115.067 119.978 -4.911 1
1 481 . 31 1 1 A 53 53 PHE H H 52 7.465 8.020 -0.555 1
1 482 . 31 1 1 A 53 53 PHE HA H 52 4.431 4.594 -0.163 1
1 490 . 31 1 1 A 53 53 PHE C C 52 174.325 175.007 -0.682 1
1 491 . 31 1 1 A 53 53 PHE CA C 52 58.986 57.525 1.461 1
1 492 . 31 1 1 A 53 53 PHE CB C 52 40.183 37.913 2.270 1
1 498 . 31 1 1 A 53 53 PHE N N 52 116.768 117.261 -0.493 1
1 499 . 31 1 1 A 54 54 GLU H H 53 7.484 8.717 -1.233 1
1 500 . 31 1 1 A 54 54 GLU HA H 53 4.583 4.864 -0.281 1
1 505 . 31 1 1 A 54 54 GLU C C 53 175.722 175.768 -0.046 1
1 506 . 31 1 1 A 54 54 GLU CA C 53 54.248 54.934 -0.686 1
1 507 . 31 1 1 A 54 54 GLU CB C 53 34.409 31.977 2.432 1
1 509 . 31 1 1 A 54 54 GLU N N 53 118.844 124.332 -5.488 1
1 510 . 31 1 1 A 55 55 ASP H H 54 9.008 8.669 0.339 1
1 511 . 31 1 1 A 55 55 ASP HA H 54 4.735 4.745 -0.010 1
1 514 . 31 1 1 A 55 55 ASP C C 54 175.421 175.854 -0.433 1
1 515 . 31 1 1 A 55 55 ASP CA C 54 52.888 54.174 -1.286 1
1 516 . 31 1 1 A 55 55 ASP CB C 54 38.894 40.463 -1.569 1
1 517 . 31 1 1 A 55 55 ASP N N 54 123.654 123.684 -0.030 1
1 518 . 31 1 1 A 56 56 THR H H 55 7.819 8.016 -0.197 1
1 519 . 31 1 1 A 56 56 THR HA H 55 4.574 5.023 -0.449 1
1 524 . 31 1 1 A 56 56 THR C C 55 174.096 174.390 -0.294 1
1 525 . 31 1 1 A 56 56 THR CA C 55 59.172 59.573 -0.401 1
1 526 . 31 1 1 A 56 56 THR CB C 55 71.889 72.339 -0.450 1
1 528 . 31 1 1 A 56 56 THR N N 55 112.015 117.087 -5.072 1
1 529 . 31 1 1 A 57 57 GLU H H 56 8.527 8.837 -0.310 1
1 530 . 31 1 1 A 57 57 GLU HA H 56 4.217 4.410 -0.193 1
1 535 . 31 1 1 A 57 57 GLU C C 56 177.042 176.285 0.757 1
1 536 . 31 1 1 A 57 57 GLU CA C 56 56.869 57.019 -0.150 1
1 537 . 31 1 1 A 57 57 GLU CB C 56 29.731 30.331 -0.600 1
1 539 . 31 1 1 A 57 57 GLU N N 56 117.531 120.702 -3.171 1
1 540 . 31 1 1 A 58 58 GLU H H 57 7.587 7.674 -0.087 1
1 541 . 31 1 1 A 58 58 GLU HA H 57 3.941 4.692 -0.751 1
1 546 . 31 1 1 A 58 58 GLU C C 57 176.849 175.249 1.600 1
1 547 . 31 1 1 A 58 58 GLU CA C 57 56.924 56.099 0.825 1
1 548 . 31 1 1 A 58 58 GLU CB C 57 30.251 31.243 -0.992 1
1 550 . 31 1 1 A 58 58 GLU N N 57 119.183 121.359 -2.176 1
1 551 . 31 1 1 A 59 59 ASN H H 58 9.120 8.793 0.327 1
1 552 . 31 1 1 A 59 59 ASN HA H 58 4.922 5.078 -0.156 1
1 557 . 31 1 1 A 59 59 ASN C C 58 174.254 175.007 -0.753 1
1 558 . 31 1 1 A 59 59 ASN CA C 58 51.956 52.016 -0.060 1
1 559 . 31 1 1 A 59 59 ASN CB C 58 37.404 40.129 -2.725 1
1 560 . 31 1 1 A 59 59 ASN N N 58 126.767 123.885 2.882 1
1 562 . 31 1 1 A 60 60 LYS H H 59 5.892 9.079 -3.187 1
1 563 . 31 1 1 A 60 60 LYS HA H 59 3.798 4.621 -0.823 1
1 572 . 31 1 1 A 60 60 LYS C C 59 177.908 178.155 -0.247 1
1 573 . 31 1 1 A 60 60 LYS CA C 59 56.623 55.476 1.147 1
1 574 . 31 1 1 A 60 60 LYS CB C 59 32.279 33.816 -1.537 1
1 578 . 31 1 1 A 60 60 LYS N N 59 121.527 124.017 -2.490 1
1 579 . 31 1 1 A 61 61 LEU H H 60 8.473 8.825 -0.352 1
1 580 . 31 1 1 A 61 61 LEU HA H 60 3.891 4.228 -0.337 1
1 590 . 31 1 1 A 61 61 LEU C C 60 179.843 178.899 0.944 1
1 591 . 31 1 1 A 61 61 LEU CA C 60 58.301 56.581 1.720 1
1 592 . 31 1 1 A 61 61 LEU CB C 60 41.305 41.838 -0.533 1
1 596 . 31 1 1 A 61 61 LEU N N 60 125.639 122.809 2.830 1
1 597 . 31 1 1 A 62 62 ILE H H 61 7.698 7.956 -0.258 1
1 598 . 31 1 1 A 62 62 ILE HA H 61 3.952 3.894 0.058 1
1 608 . 31 1 1 A 62 62 ILE C C 61 175.392 177.250 -1.858 1
1 609 . 31 1 1 A 62 62 ILE CA C 61 61.743 63.558 -1.815 1
1 610 . 31 1 1 A 62 62 ILE CB C 61 39.108 37.828 1.280 1
1 614 . 31 1 1 A 62 62 ILE N N 61 114.111 119.779 -5.668 1
1 615 . 31 1 1 A 63 63 TYR H H 62 7.273 8.035 -0.762 1
1 616 . 31 1 1 A 63 63 TYR HA H 62 4.343 4.312 0.031 1
1 623 . 31 1 1 A 63 63 TYR C C 62 178.264 178.620 -0.356 1
1 624 . 31 1 1 A 63 63 TYR CA C 62 57.231 61.037 -3.806 1
1 625 . 31 1 1 A 63 63 TYR CB C 62 36.332 37.388 -1.056 1
1 630 . 31 1 1 A 63 63 TYR N N 62 117.689 121.329 -3.640 1
1 631 . 31 1 1 A 64 64 THR H H 63 7.747 7.948 -0.201 1
1 632 . 31 1 1 A 64 64 THR HA H 63 4.266 4.244 0.022 1
1 637 . 31 1 1 A 64 64 THR CA C 63 69.362 67.571 1.791 1
1 638 . 31 1 1 A 64 64 THR CB C 63 66.962 67.702 -0.740 1
1 640 . 31 1 1 A 64 64 THR N N 63 113.755 116.307 -2.552 1
1 641 . 31 1 1 A 65 65 PRO HA H 64 4.372 4.380 -0.008 1
1 648 . 31 1 1 A 65 65 PRO C C 64 179.913 179.313 0.600 1
1 649 . 31 1 1 A 65 65 PRO CA C 64 66.011 66.131 -0.120 1
1 650 . 31 1 1 A 65 65 PRO CB C 64 30.642 30.692 -0.050 1
1 653 . 31 1 1 A 66 66 ILE H H 65 7.377 7.326 0.051 1
1 654 . 31 1 1 A 66 66 ILE HA H 65 3.530 3.899 -0.369 1
1 664 . 31 1 1 A 66 66 ILE C C 65 177.543 178.272 -0.729 1
1 665 . 31 1 1 A 66 66 ILE CA C 65 66.647 64.333 2.314 1
1 666 . 31 1 1 A 66 66 ILE CB C 65 38.029 37.745 0.284 1
1 670 . 31 1 1 A 66 66 ILE N N 65 118.353 116.685 1.668 1
1 671 . 31 1 1 A 67 67 PHE H H 66 8.480 8.480 0.000 1
1 672 . 31 1 1 A 67 67 PHE HA H 66 4.115 4.347 -0.232 1
1 680 . 31 1 1 A 67 67 PHE C C 66 177.293 177.912 -0.619 1
1 681 . 31 1 1 A 67 67 PHE CA C 66 59.570 62.236 -2.666 1
1 682 . 31 1 1 A 67 67 PHE CB C 66 38.865 39.530 -0.665 1
1 688 . 31 1 1 A 67 67 PHE N N 66 122.420 120.495 1.925 1
1 689 . 31 1 1 A 68 68 ASN H H 67 8.595 8.204 0.391 1
1 690 . 31 1 1 A 68 68 ASN HA H 67 4.211 4.423 -0.212 1
1 695 . 31 1 1 A 68 68 ASN C C 67 178.697 178.138 0.559 1
1 696 . 31 1 1 A 68 68 ASN CA C 67 56.056 56.159 -0.103 1
1 697 . 31 1 1 A 68 68 ASN CB C 67 37.704 38.151 -0.447 1
1 698 . 31 1 1 A 68 68 ASN N N 67 115.573 117.487 -1.914 1
1 700 . 31 1 1 A 69 69 GLU H H 68 8.414 7.992 0.422 1
1 701 . 31 1 1 A 69 69 GLU HA H 68 4.102 4.088 0.014 1
1 706 . 31 1 1 A 69 69 GLU C C 68 177.880 178.797 -0.917 1
1 707 . 31 1 1 A 69 69 GLU CA C 68 59.399 59.429 -0.030 1
1 708 . 31 1 1 A 69 69 GLU CB C 68 29.855 29.540 0.315 1
1 710 . 31 1 1 A 69 69 GLU N N 68 123.510 120.070 3.440 1
1 711 . 31 1 1 A 70 70 TYR H H 69 8.659 8.143 0.516 1
1 712 . 31 1 1 A 70 70 TYR HA H 69 3.362 3.938 -0.576 1
1 719 . 31 1 1 A 70 70 TYR C C 69 178.143 177.304 0.839 1
1 720 . 31 1 1 A 70 70 TYR CA C 69 60.686 60.806 -0.120 1
1 721 . 31 1 1 A 70 70 TYR CB C 69 38.560 38.764 -0.204 1
1 726 . 31 1 1 A 70 70 TYR N N 69 122.130 120.311 1.819 1
1 727 . 31 1 1 A 71 71 ILE H H 70 8.031 7.579 0.452 1
1 728 . 31 1 1 A 71 71 ILE HA H 70 3.265 3.657 -0.392 1
1 738 . 31 1 1 A 71 71 ILE C C 70 178.056 178.132 -0.076 1
1 739 . 31 1 1 A 71 71 ILE CA C 70 63.756 64.349 -0.593 1
1 740 . 31 1 1 A 71 71 ILE CB C 70 37.321 37.444 -0.123 1
1 744 . 31 1 1 A 71 71 ILE N N 70 118.906 120.829 -1.923 1
1 745 . 31 1 1 A 72 72 SER H H 71 7.803 8.318 -0.515 1
1 746 . 31 1 1 A 72 72 SER HA H 71 4.029 4.192 -0.163 1
1 749 . 31 1 1 A 72 72 SER CA C 71 61.380 61.629 -0.249 1
1 750 . 31 1 1 A 72 72 SER CB C 71 63.288 62.840 0.448 1
1 751 . 31 1 1 A 72 72 SER N N 71 113.735 114.788 -1.053 1
1 752 . 31 1 1 A 73 73 LEU H H 72 7.952 7.714 0.238 1
1 753 . 31 1 1 A 73 73 LEU HA H 72 4.418 4.120 0.298 1
1 763 . 31 1 1 A 73 73 LEU C C 72 177.767 178.242 -0.475 1
1 764 . 31 1 1 A 73 73 LEU CA C 72 56.543 57.427 -0.884 1
1 765 . 31 1 1 A 73 73 LEU CB C 72 44.517 41.684 2.833 1
1 769 . 31 1 1 A 73 73 LEU N N 72 119.411 123.254 -3.843 1
1 770 . 31 1 1 A 74 74 VAL H H 73 8.021 7.750 0.271 1
1 771 . 31 1 1 A 74 74 VAL HA H 73 3.532 3.348 0.184 1
1 779 . 31 1 1 A 74 74 VAL C C 73 177.126 178.029 -0.903 1
1 780 . 31 1 1 A 74 74 VAL CA C 73 66.250 66.335 -0.085 1
1 781 . 31 1 1 A 74 74 VAL CB C 73 31.212 31.174 0.038 1
1 784 . 31 1 1 A 74 74 VAL N N 73 118.747 119.108 -0.361 1
1 785 . 31 1 1 A 75 75 GLU H H 74 7.232 7.981 -0.749 1
1 786 . 31 1 1 A 75 75 GLU HA H 74 3.013 4.200 -1.187 1
1 791 . 31 1 1 A 75 75 GLU C C 74 178.804 179.142 -0.338 1
1 792 . 31 1 1 A 75 75 GLU CA C 74 60.536 60.001 0.535 1
1 793 . 31 1 1 A 75 75 GLU CB C 74 27.009 29.044 -2.035 1
1 795 . 31 1 1 A 75 75 GLU N N 74 118.660 119.837 -1.177 1
1 796 . 31 1 1 A 76 76 LYS H H 75 7.051 7.928 -0.877 1
1 797 . 31 1 1 A 76 76 LYS HA H 75 3.765 3.998 -0.233 1
1 806 . 31 1 1 A 76 76 LYS C C 75 177.765 178.303 -0.538 1
1 807 . 31 1 1 A 76 76 LYS CA C 75 58.357 58.840 -0.483 1
1 808 . 31 1 1 A 76 76 LYS CB C 75 31.939 31.970 -0.031 1
1 812 . 31 1 1 A 76 76 LYS N N 75 116.112 119.754 -3.642 1
1 813 . 31 1 1 A 77 77 TYR H H 76 7.067 7.694 -0.627 1
1 814 . 31 1 1 A 77 77 TYR HA H 76 4.036 4.152 -0.116 1
1 821 . 31 1 1 A 77 77 TYR C C 76 177.752 176.950 0.802 1
1 822 . 31 1 1 A 77 77 TYR CA C 76 61.820 61.147 0.673 1
1 823 . 31 1 1 A 77 77 TYR CB C 76 38.480 38.618 -0.138 1
1 828 . 31 1 1 A 77 77 TYR N N 76 118.434 120.784 -2.350 1
1 829 . 31 1 1 A 78 78 ILE H H 77 7.554 8.334 -0.780 1
1 830 . 31 1 1 A 78 78 ILE HA H 77 3.159 3.555 -0.396 1
1 840 . 31 1 1 A 78 78 ILE C C 77 177.341 177.777 -0.436 1
1 841 . 31 1 1 A 78 78 ILE CA C 77 65.177 65.292 -0.115 1
1 842 . 31 1 1 A 78 78 ILE CB C 77 37.339 37.864 -0.525 1
1 846 . 31 1 1 A 78 78 ILE N N 77 117.672 121.381 -3.709 1
1 847 . 31 1 1 A 79 79 GLU H H 78 8.296 7.982 0.314 1
1 848 . 31 1 1 A 79 79 GLU HA H 78 3.557 3.757 -0.200 1
1 853 . 31 1 1 A 79 79 GLU C C 78 177.742 178.688 -0.946 1
1 854 . 31 1 1 A 79 79 GLU CA C 78 60.847 60.005 0.842 1
1 855 . 31 1 1 A 79 79 GLU CB C 78 29.594 29.177 0.417 1
1 857 . 31 1 1 A 79 79 GLU N N 78 118.701 120.933 -2.232 1
1 858 . 31 1 1 A 80 80 GLU H H 79 8.330 8.156 0.174 1
1 859 . 31 1 1 A 80 80 GLU HA H 79 3.774 3.999 -0.225 1
1 864 . 31 1 1 A 80 80 GLU C C 79 179.926 179.201 0.725 1
1 865 . 31 1 1 A 80 80 GLU CA C 79 59.581 58.897 0.684 1
1 866 . 31 1 1 A 80 80 GLU CB C 79 29.062 29.065 -0.003 1
1 868 . 31 1 1 A 80 80 GLU N N 79 116.767 118.182 -1.415 1
1 869 . 31 1 1 A 81 81 GLN H H 80 7.634 7.761 -0.127 1
1 870 . 31 1 1 A 81 81 GLN HA H 80 3.605 3.855 -0.250 1
1 877 . 31 1 1 A 81 81 GLN C C 80 179.681 178.428 1.253 1
1 878 . 31 1 1 A 81 81 GLN CA C 80 57.765 58.334 -0.569 1
1 879 . 31 1 1 A 81 81 GLN CB C 80 28.079 27.973 0.106 1
1 881 . 31 1 1 A 81 81 GLN N N 80 116.325 118.587 -2.262 1
1 883 . 31 1 1 A 82 82 LEU H H 81 8.156 7.468 0.688 1
1 884 . 31 1 1 A 82 82 LEU HA H 81 3.536 3.756 -0.220 1
1 894 . 31 1 1 A 82 82 LEU C C 81 178.945 179.333 -0.388 1
1 895 . 31 1 1 A 82 82 LEU CA C 81 57.761 56.744 1.017 1
1 896 . 31 1 1 A 82 82 LEU CB C 81 40.961 41.028 -0.067 1
1 900 . 31 1 1 A 82 82 LEU N N 81 121.546 120.246 1.300 1
1 901 . 31 1 1 A 83 83 LEU H H 82 8.326 7.929 0.397 1
1 902 . 31 1 1 A 83 83 LEU HA H 82 4.198 4.161 0.037 1
1 912 . 31 1 1 A 83 83 LEU C C 82 178.631 179.257 -0.626 1
1 913 . 31 1 1 A 83 83 LEU CA C 82 57.016 56.951 0.065 1
1 914 . 31 1 1 A 83 83 LEU CB C 82 42.182 41.008 1.174 1
1 918 . 31 1 1 A 83 83 LEU N N 82 120.426 119.154 1.272 1
1 919 . 31 1 1 A 84 84 GLN H H 83 6.992 7.675 -0.683 1
1 920 . 31 1 1 A 84 84 GLN HA H 83 3.877 4.005 -0.128 1
1 927 . 31 1 1 A 84 84 GLN C C 83 177.008 176.748 0.260 1
1 928 . 31 1 1 A 84 84 GLN CA C 83 57.543 58.280 -0.737 1
1 929 . 31 1 1 A 84 84 GLN CB C 83 28.688 28.577 0.111 1
1 931 . 31 1 1 A 84 84 GLN N N 83 114.001 117.313 -3.312 1
1 933 . 31 1 1 A 85 85 ARG H H 84 7.072 7.622 -0.550 1
1 934 . 31 1 1 A 85 85 ARG HA H 84 4.047 4.435 -0.388 1
1 942 . 31 1 1 A 85 85 ARG C C 84 175.999 175.512 0.487 1
1 943 . 31 1 1 A 85 85 ARG CA C 84 56.764 56.772 -0.008 1
1 944 . 31 1 1 A 85 85 ARG CB C 84 32.044 32.118 -0.074 1
1 947 . 31 1 1 A 85 85 ARG N N 84 115.827 118.982 -3.155 1
1 949 . 31 1 1 A 86 86 ILE H H 85 8.238 7.468 0.770 1
1 950 . 31 1 1 A 86 86 ILE HA H 85 4.389 4.432 -0.043 1
1 960 . 31 1 1 A 86 86 ILE CA C 85 58.007 57.678 0.329 1
1 961 . 31 1 1 A 86 86 ILE CB C 85 39.604 38.794 0.810 1
1 965 . 31 1 1 A 86 86 ILE N N 85 119.285 118.332 0.953 1
1 966 . 31 1 1 A 87 87 PRO HA H 86 4.392 4.533 -0.141 1
1 973 . 31 1 1 A 87 87 PRO C C 86 177.622 177.490 0.132 1
1 974 . 31 1 1 A 87 87 PRO CA C 86 64.665 64.241 0.424 1
1 975 . 31 1 1 A 87 87 PRO CB C 86 32.020 31.733 0.287 1
1 978 . 31 1 1 A 88 88 GLU H H 87 8.312 8.586 -0.274 1
1 979 . 31 1 1 A 88 88 GLU HA H 87 4.208 4.362 -0.154 1
1 984 . 31 1 1 A 88 88 GLU C C 87 175.554 176.554 -1.000 1
1 985 . 31 1 1 A 88 88 GLU CA C 87 56.045 55.811 0.234 1
1 986 . 31 1 1 A 88 88 GLU CB C 87 28.654 29.148 -0.494 1
1 988 . 31 1 1 A 88 88 GLU N N 87 114.256 115.736 -1.480 1
1 989 . 31 1 1 A 89 89 PHE H H 88 7.946 7.393 0.553 1
1 990 . 31 1 1 A 89 89 PHE HA H 88 3.993 4.304 -0.311 1
1 998 . 31 1 1 A 89 89 PHE C C 88 173.460 174.697 -1.237 1
1 999 . 31 1 1 A 89 89 PHE CA C 88 60.119 59.559 0.560 1
1 1000 . 31 1 1 A 89 89 PHE CB C 88 39.994 39.616 0.378 1
1 1006 . 31 1 1 A 89 89 PHE N N 88 121.550 122.453 -0.903 1
1 1007 . 31 1 1 A 90 90 ASN H H 89 7.266 7.763 -0.497 1
1 1008 . 31 1 1 A 90 90 ASN HA H 89 4.454 5.034 -0.580 1
1 1013 . 31 1 1 A 90 90 ASN C C 89 173.921 175.130 -1.209 1
1 1014 . 31 1 1 A 90 90 ASN CA C 89 51.839 51.612 0.227 1
1 1015 . 31 1 1 A 90 90 ASN CB C 89 40.674 39.555 1.119 1
1 1016 . 31 1 1 A 90 90 ASN N N 89 125.344 124.635 0.709 1
1 1018 . 31 1 1 A 91 91 MET H H 90 8.968 8.568 0.400 1
1 1019 . 31 1 1 A 91 91 MET HA H 90 4.049 4.165 -0.116 1
1 1027 . 31 1 1 A 91 91 MET C C 90 177.475 178.056 -0.581 1
1 1028 . 31 1 1 A 91 91 MET CA C 90 57.758 57.990 -0.232 1
1 1029 . 31 1 1 A 91 91 MET CB C 90 32.250 32.426 -0.176 1
1 1032 . 31 1 1 A 91 91 MET N N 90 127.052 124.391 2.661 1
1 1033 . 31 1 1 A 92 92 ALA H H 91 8.292 8.053 0.239 1
1 1034 . 31 1 1 A 92 92 ALA HA H 91 4.059 4.147 -0.088 1
1 1038 . 31 1 1 A 92 92 ALA C C 91 180.412 179.622 0.790 1
1 1039 . 31 1 1 A 92 92 ALA CA C 91 55.368 54.879 0.489 1
1 1040 . 31 1 1 A 92 92 ALA CB C 91 17.527 18.434 -0.907 1
1 1041 . 31 1 1 A 92 92 ALA N N 91 123.752 121.410 2.342 1
1 1042 . 31 1 1 A 93 93 ALA H H 92 7.931 7.982 -0.051 1
1 1043 . 31 1 1 A 93 93 ALA HA H 92 4.054 4.107 -0.053 1
1 1047 . 31 1 1 A 93 93 ALA C C 92 180.482 179.852 0.630 1
1 1048 . 31 1 1 A 93 93 ALA CA C 92 54.614 54.917 -0.303 1
1 1049 . 31 1 1 A 93 93 ALA CB C 92 18.098 18.345 -0.247 1
1 1050 . 31 1 1 A 93 93 ALA N N 92 121.158 120.265 0.893 1
1 1051 . 31 1 1 A 94 94 PHE H H 93 8.110 7.991 0.119 1
1 1052 . 31 1 1 A 94 94 PHE HA H 93 4.304 4.133 0.171 1
1 1060 . 31 1 1 A 94 94 PHE C C 93 177.350 177.382 -0.032 1
1 1061 . 31 1 1 A 94 94 PHE CA C 93 61.641 61.468 0.173 1
1 1062 . 31 1 1 A 94 94 PHE CB C 93 40.014 39.184 0.830 1
1 1068 . 31 1 1 A 94 94 PHE N N 93 119.807 120.252 -0.445 1
1 1069 . 31 1 1 A 95 95 THR H H 94 8.726 8.222 0.504 1
1 1070 . 31 1 1 A 95 95 THR HA H 94 3.569 4.010 -0.441 1
1 1075 . 31 1 1 A 95 95 THR C C 94 176.932 176.982 -0.050 1
1 1076 . 31 1 1 A 95 95 THR CA C 94 66.833 65.625 1.208 1
1 1077 . 31 1 1 A 95 95 THR CB C 94 68.445 68.301 0.144 1
1 1079 . 31 1 1 A 95 95 THR N N 94 113.074 112.300 0.774 1
1 1080 . 31 1 1 A 96 96 THR H H 95 7.657 7.829 -0.172 1
1 1081 . 31 1 1 A 96 96 THR HA H 95 3.945 4.068 -0.123 1
1 1086 . 31 1 1 A 96 96 THR C C 95 176.386 176.363 0.023 1
1 1087 . 31 1 1 A 96 96 THR CA C 95 66.550 66.074 0.476 1
1 1088 . 31 1 1 A 96 96 THR CB C 95 68.583 68.765 -0.182 1
1 1090 . 31 1 1 A 96 96 THR N N 95 117.927 116.558 1.369 1
1 1091 . 31 1 1 A 97 97 THR H H 96 7.699 7.837 -0.138 1
1 1092 . 31 1 1 A 97 97 THR HA H 96 3.905 4.116 -0.211 1
1 1097 . 31 1 1 A 97 97 THR C C 96 176.572 176.570 0.002 1
1 1098 . 31 1 1 A 97 97 THR CA C 96 65.979 66.565 -0.586 1
1 1099 . 31 1 1 A 97 97 THR CB C 96 68.553 68.489 0.064 1
1 1101 . 31 1 1 A 97 97 THR N N 96 118.518 116.684 1.834 1
1 1102 . 31 1 1 A 98 98 LEU H H 97 8.304 8.206 0.098 1
1 1103 . 31 1 1 A 98 98 LEU HA H 97 3.725 3.958 -0.233 1
1 1113 . 31 1 1 A 98 98 LEU C C 97 178.490 178.769 -0.279 1
1 1114 . 31 1 1 A 98 98 LEU CA C 97 58.517 58.143 0.374 1
1 1115 . 31 1 1 A 98 98 LEU CB C 97 41.697 41.146 0.551 1
1 1119 . 31 1 1 A 98 98 LEU N N 97 122.882 122.110 0.772 1
1 1120 . 31 1 1 A 99 99 GLN H H 98 7.639 7.879 -0.240 1
1 1121 . 31 1 1 A 99 99 GLN HA H 98 3.927 4.117 -0.190 1
1 1128 . 31 1 1 A 99 99 GLN C C 98 178.068 177.523 0.545 1
1 1129 . 31 1 1 A 99 99 GLN CA C 98 58.735 58.825 -0.090 1
1 1130 . 31 1 1 A 99 99 GLN CB C 98 27.986 28.404 -0.418 1
1 1132 . 31 1 1 A 99 99 GLN N N 98 114.302 118.148 -3.846 1
1 1134 . 31 1 1 A 100 100 HIS H H 99 7.575 7.507 0.068 1
1 1135 . 31 1 1 A 100 100 HIS HA H 99 4.524 4.455 0.069 1
1 1139 . 31 1 1 A 100 100 HIS C C 99 174.789 177.361 -2.572 1
1 1140 . 31 1 1 A 100 100 HIS CA C 99 56.154 57.922 -1.768 1
1 1141 . 31 1 1 A 100 100 HIS CB C 99 28.946 31.095 -2.149 1
1 1143 . 31 1 1 A 100 100 HIS N N 99 114.778 116.867 -2.089 1
1 1144 . 31 1 1 A 101 101 HIS H H 100 7.773 8.141 -0.368 1
1 1145 . 31 1 1 A 101 101 HIS HA H 100 4.704 3.971 0.733 1
1 1149 . 31 1 1 A 101 101 HIS C C 100 174.818 176.941 -2.123 1
1 1150 . 31 1 1 A 101 101 HIS CA C 100 54.830 58.268 -3.438 1
1 1151 . 31 1 1 A 101 101 HIS CB C 100 29.749 30.140 -0.391 1
1 1153 . 31 1 1 A 101 101 HIS N N 100 117.397 119.068 -1.671 1
1 1154 . 31 1 1 A 102 102 LYS H H 101 7.324 8.149 -0.825 1
1 1155 . 31 1 1 A 102 102 LYS HA H 101 3.611 3.954 -0.343 1
1 1164 . 31 1 1 A 102 102 LYS C C 101 176.823 178.602 -1.779 1
1 1165 . 31 1 1 A 102 102 LYS CA C 101 59.915 59.606 0.309 1
1 1166 . 31 1 1 A 102 102 LYS CB C 101 32.825 32.013 0.812 1
1 1170 . 31 1 1 A 102 102 LYS N N 101 120.533 117.830 2.703 1
1 1171 . 31 1 1 A 103 103 ASP H H 102 8.361 7.673 0.688 1
1 1172 . 31 1 1 A 103 103 ASP HA H 102 4.421 4.515 -0.094 1
1 1175 . 31 1 1 A 103 103 ASP C C 102 176.793 176.408 0.385 1
1 1176 . 31 1 1 A 103 103 ASP CA C 102 55.500 56.022 -0.522 1
1 1177 . 31 1 1 A 103 103 ASP CB C 102 40.178 40.315 -0.137 1
1 1178 . 31 1 1 A 103 103 ASP N N 102 114.814 118.169 -3.355 1
1 1179 . 31 1 1 A 104 104 GLU H H 103 7.858 8.223 -0.365 1
1 1180 . 31 1 1 A 104 104 GLU HA H 103 4.339 4.565 -0.226 1
1 1183 . 31 1 1 A 104 104 GLU C C 103 175.777 176.341 -0.564 1
1 1184 . 31 1 1 A 104 104 GLU CA C 103 56.356 57.739 -1.383 1
1 1185 . 31 1 1 A 104 104 GLU CB C 103 31.293 32.042 -0.749 1
1 1186 . 31 1 1 A 104 104 GLU N N 103 116.826 118.464 -1.638 1
1 1187 . 31 1 1 A 105 105 VAL H H 104 7.201 7.650 -0.449 1
1 1188 . 31 1 1 A 105 105 VAL HA H 104 4.296 4.177 0.119 1
1 1196 . 31 1 1 A 105 105 VAL C C 104 174.482 175.704 -1.222 1
1 1197 . 31 1 1 A 105 105 VAL CA C 104 60.370 62.617 -2.247 1
1 1198 . 31 1 1 A 105 105 VAL CB C 104 34.341 32.613 1.728 1
1 1201 . 31 1 1 A 105 105 VAL N N 104 116.422 119.598 -3.176 1
1 1202 . 31 1 1 A 106 106 ALA H H 105 8.487 8.576 -0.089 1
1 1203 . 31 1 1 A 106 106 ALA HA H 105 4.172 4.398 -0.226 1
1 1207 . 31 1 1 A 106 106 ALA C C 105 179.030 178.646 0.384 1
1 1208 . 31 1 1 A 106 106 ALA CA C 105 52.966 52.319 0.647 1
1 1209 . 31 1 1 A 106 106 ALA CB C 105 19.371 19.025 0.346 1
1 1210 . 31 1 1 A 106 106 ALA N N 105 128.313 128.684 -0.371 1
1 1211 . 31 1 1 A 107 107 GLY H H 106 8.738 8.777 -0.039 1
1 1212 . 31 1 1 A 107 107 GLY HA2 H 106 3.773 3.868 -0.095 1
1 1213 . 31 1 1 A 107 107 GLY HA3 H 106 3.998 3.937 0.061 1
1 1214 . 31 1 1 A 107 107 GLY C C 106 174.958 175.542 -0.584 1
1 1215 . 31 1 1 A 107 107 GLY CA C 106 47.449 47.214 0.235 1
1 1216 . 31 1 1 A 107 107 GLY N N 106 110.612 110.749 -0.137 1
1 1217 . 31 1 1 A 108 108 ASP H H 107 8.535 8.343 0.192 1
1 1218 . 31 1 1 A 108 108 ASP HA H 107 4.333 4.356 -0.023 1
1 1221 . 31 1 1 A 108 108 ASP C C 107 179.133 179.071 0.062 1
1 1222 . 31 1 1 A 108 108 ASP CA C 107 56.721 57.003 -0.282 1
1 1223 . 31 1 1 A 108 108 ASP CB C 107 39.336 41.062 -1.726 1
1 1224 . 31 1 1 A 108 108 ASP N N 107 117.474 121.412 -3.938 1
1 1225 . 31 1 1 A 109 109 ILE H H 108 7.459 7.948 -0.489 1
1 1226 . 31 1 1 A 109 109 ILE HA H 108 3.688 3.702 -0.014 1
1 1236 . 31 1 1 A 109 109 ILE C C 108 176.735 178.230 -1.495 1
1 1237 . 31 1 1 A 109 109 ILE CA C 108 63.474 65.627 -2.153 1
1 1238 . 31 1 1 A 109 109 ILE CB C 108 37.340 37.898 -0.558 1
1 1242 . 31 1 1 A 109 109 ILE N N 108 119.609 119.568 0.041 1
1 1243 . 31 1 1 A 110 110 PHE H H 109 7.920 8.356 -0.436 1
1 1244 . 31 1 1 A 110 110 PHE HA H 109 3.759 4.107 -0.348 1
1 1252 . 31 1 1 A 110 110 PHE C C 109 177.132 177.347 -0.215 1
1 1253 . 31 1 1 A 110 110 PHE CA C 109 62.766 61.259 1.507 1
1 1254 . 31 1 1 A 110 110 PHE CB C 109 39.752 39.324 0.428 1
1 1260 . 31 1 1 A 110 110 PHE N N 109 120.906 120.399 0.507 1
1 1261 . 31 1 1 A 111 111 ASP H H 110 8.639 8.217 0.422 1
1 1262 . 31 1 1 A 111 111 ASP HA H 110 4.216 4.228 -0.012 1
1 1265 . 31 1 1 A 111 111 ASP C C 110 178.900 178.437 0.463 1
1 1266 . 31 1 1 A 111 111 ASP CA C 110 57.105 57.307 -0.202 1
1 1267 . 31 1 1 A 111 111 ASP CB C 110 39.697 41.938 -2.241 1
1 1268 . 31 1 1 A 111 111 ASP N N 110 117.124 118.776 -1.652 1
1 1269 . 31 1 1 A 112 112 MET H H 111 7.331 7.573 -0.242 1
1 1270 . 31 1 1 A 112 112 MET HA H 111 4.081 4.151 -0.070 1
1 1278 . 31 1 1 A 112 112 MET C C 111 179.052 178.164 0.888 1
1 1279 . 31 1 1 A 112 112 MET CA C 111 58.202 58.090 0.112 1
1 1280 . 31 1 1 A 112 112 MET CB C 111 31.827 32.415 -0.588 1
1 1283 . 31 1 1 A 112 112 MET N N 111 118.061 119.434 -1.373 1
1 1284 . 31 1 1 A 113 113 LEU H H 112 8.001 8.071 -0.070 1
1 1285 . 31 1 1 A 113 113 LEU HA H 112 3.723 3.595 0.128 1
1 1295 . 31 1 1 A 113 113 LEU C C 112 179.747 178.771 0.976 1
1 1296 . 31 1 1 A 113 113 LEU CA C 112 57.371 57.438 -0.067 1
1 1297 . 31 1 1 A 113 113 LEU CB C 112 40.671 41.006 -0.335 1
1 1301 . 31 1 1 A 113 113 LEU N N 112 120.426 119.644 0.782 1
1 1302 . 31 1 1 A 114 114 LEU H H 113 7.744 7.448 0.296 1
1 1303 . 31 1 1 A 114 114 LEU HA H 113 4.007 3.592 0.415 1
1 1313 . 31 1 1 A 114 114 LEU C C 113 179.358 178.639 0.719 1
1 1314 . 31 1 1 A 114 114 LEU CA C 113 57.202 57.413 -0.211 1
1 1315 . 31 1 1 A 114 114 LEU CB C 113 41.727 41.059 0.668 1
1 1319 . 31 1 1 A 114 114 LEU N N 113 119.584 118.552 1.032 1
1 1320 . 31 1 1 A 115 115 THR H H 114 7.353 7.614 -0.261 1
1 1321 . 31 1 1 A 115 115 THR HA H 114 4.071 4.047 0.024 1
1 1327 . 31 1 1 A 115 115 THR C C 114 173.591 176.689 -3.098 1
1 1328 . 31 1 1 A 115 115 THR CA C 114 65.332 64.766 0.566 1
1 1329 . 31 1 1 A 115 115 THR CB C 114 70.319 68.438 1.881 1
1 1331 . 31 1 1 A 115 115 THR N N 114 107.535 110.502 -2.967 1
1 1332 . 31 1 1 A 116 116 PHE H H 115 6.979 7.857 -0.878 1
1 1333 . 31 1 1 A 116 116 PHE HA H 115 5.022 4.250 0.772 1
1 1341 . 31 1 1 A 116 116 PHE C C 115 176.488 176.772 -0.284 1
1 1342 . 31 1 1 A 116 116 PHE CA C 115 55.911 60.848 -4.937 1
1 1343 . 31 1 1 A 116 116 PHE CB C 115 38.521 39.196 -0.675 1
1 1349 . 31 1 1 A 116 116 PHE N N 115 112.366 119.843 -7.477 1
1 1350 . 31 1 1 A 117 117 THR H H 116 7.564 7.535 0.029 1
1 1351 . 31 1 1 A 117 117 THR HA H 116 4.626 4.889 -0.263 1
1 1356 . 31 1 1 A 117 117 THR C C 116 174.085 174.639 -0.554 1
1 1357 . 31 1 1 A 117 117 THR CA C 116 61.636 62.100 -0.464 1
1 1358 . 31 1 1 A 117 117 THR CB C 116 70.915 70.824 0.091 1
1 1360 . 31 1 1 A 117 117 THR N N 116 105.498 105.617 -0.119 1
1 1361 . 31 1 1 A 118 118 ASP H H 117 8.270 7.619 0.651 1
1 1362 . 31 1 1 A 118 118 ASP HA H 117 4.955 4.816 0.139 1
1 1365 . 31 1 1 A 118 118 ASP C C 117 176.328 176.238 0.090 1
1 1366 . 31 1 1 A 118 118 ASP CA C 117 53.417 53.931 -0.514 1
1 1367 . 31 1 1 A 118 118 ASP CB C 117 43.388 39.599 3.789 1
1 1368 . 31 1 1 A 118 118 ASP N N 117 124.409 123.455 0.954 1
1 1369 . 31 1 1 A 119 119 PHE H H 118 8.973 8.765 0.208 1
1 1370 . 31 1 1 A 119 119 PHE HA H 118 3.506 4.201 -0.695 1
1 1378 . 31 1 1 A 119 119 PHE CA C 118 61.490 61.209 0.281 1
1 1379 . 31 1 1 A 119 119 PHE CB C 118 39.246 39.569 -0.323 1
1 1385 . 31 1 1 A 119 119 PHE N N 118 126.688 126.259 0.429 1
1 1386 . 31 1 1 A 120 120 LEU H H 119 8.099 8.249 -0.150 1
1 1387 . 31 1 1 A 120 120 LEU HA H 119 3.842 3.954 -0.112 1
1 1397 . 31 1 1 A 120 120 LEU C C 119 179.601 179.375 0.226 1
1 1398 . 31 1 1 A 120 120 LEU CA C 119 58.174 57.948 0.226 1
1 1399 . 31 1 1 A 120 120 LEU CB C 119 40.315 41.248 -0.933 1
1 1403 . 31 1 1 A 120 120 LEU N N 119 117.930 119.827 -1.897 1
1 1404 . 31 1 1 A 121 121 ALA H H 120 7.729 7.603 0.126 1
1 1405 . 31 1 1 A 121 121 ALA HA H 120 3.996 4.072 -0.076 1
1 1409 . 31 1 1 A 121 121 ALA C C 120 180.995 179.558 1.437 1
1 1410 . 31 1 1 A 121 121 ALA CA C 120 54.832 54.705 0.127 1
1 1411 . 31 1 1 A 121 121 ALA CB C 120 17.706 18.300 -0.594 1
1 1412 . 31 1 1 A 121 121 ALA N N 120 123.195 121.141 2.054 1
1 1413 . 31 1 1 A 122 122 PHE H H 121 7.943 7.811 0.132 1
1 1414 . 31 1 1 A 122 122 PHE HA H 121 3.887 3.752 0.135 1
1 1419 . 31 1 1 A 122 122 PHE C C 121 175.410 176.773 -1.363 1
1 1420 . 31 1 1 A 122 122 PHE CA C 121 61.075 60.653 0.422 1
1 1421 . 31 1 1 A 122 122 PHE CB C 121 38.115 38.806 -0.691 1
1 1424 . 31 1 1 A 122 122 PHE N N 121 121.798 120.388 1.410 1
1 1425 . 31 1 1 A 123 123 LYS H H 122 8.468 7.892 0.576 1
1 1426 . 31 1 1 A 123 123 LYS HA H 122 3.077 3.688 -0.611 1
1 1435 . 31 1 1 A 123 123 LYS C C 122 178.453 178.770 -0.317 1
1 1436 . 31 1 1 A 123 123 LYS CA C 122 59.855 59.893 -0.038 1
1 1437 . 31 1 1 A 123 123 LYS CB C 122 32.374 32.276 0.098 1
1 1441 . 31 1 1 A 123 123 LYS N N 122 120.614 118.339 2.275 1
1 1442 . 31 1 1 A 124 124 GLU H H 123 8.100 7.766 0.334 1
1 1443 . 31 1 1 A 124 124 GLU HA H 123 3.652 4.009 -0.357 1
1 1448 . 31 1 1 A 124 124 GLU C C 123 177.743 178.502 -0.759 1
1 1449 . 31 1 1 A 124 124 GLU CA C 123 59.406 59.525 -0.119 1
1 1450 . 31 1 1 A 124 124 GLU CB C 123 28.811 29.045 -0.234 1
1 1452 . 31 1 1 A 124 124 GLU N N 123 117.404 118.900 -1.496 1
1 1453 . 31 1 1 A 125 125 MET H H 124 7.537 7.600 -0.063 1
1 1454 . 31 1 1 A 125 125 MET HA H 124 3.860 3.931 -0.071 1
1 1462 . 31 1 1 A 125 125 MET C C 124 179.522 178.363 1.159 1
1 1463 . 31 1 1 A 125 125 MET CA C 124 58.832 58.458 0.374 1
1 1464 . 31 1 1 A 125 125 MET CB C 124 31.765 31.276 0.489 1
1 1467 . 31 1 1 A 125 125 MET N N 124 119.413 118.745 0.668 1
1 1468 . 31 1 1 A 126 126 PHE H H 125 7.148 7.414 -0.266 1
1 1469 . 31 1 1 A 126 126 PHE HA H 125 3.633 4.270 -0.637 1
1 1476 . 31 1 1 A 126 126 PHE C C 125 178.994 178.381 0.613 1
1 1477 . 31 1 1 A 126 126 PHE CA C 125 63.148 60.873 2.275 1
1 1478 . 31 1 1 A 126 126 PHE CB C 125 39.830 38.371 1.459 1
1 1483 . 31 1 1 A 126 126 PHE N N 125 120.013 118.541 1.472 1
1 1484 . 31 1 1 A 127 127 LEU H H 126 8.369 8.670 -0.301 1
1 1485 . 31 1 1 A 127 127 LEU HA H 126 3.972 4.033 -0.061 1
1 1495 . 31 1 1 A 127 127 LEU C C 126 180.621 179.323 1.298 1
1 1496 . 31 1 1 A 127 127 LEU CA C 126 57.944 57.935 0.009 1
1 1497 . 31 1 1 A 127 127 LEU CB C 126 40.543 41.117 -0.574 1
1 1501 . 31 1 1 A 127 127 LEU N N 126 119.692 119.747 -0.055 1
1 1502 . 31 1 1 A 128 128 ASP H H 127 8.578 8.100 0.478 1
1 1503 . 31 1 1 A 128 128 ASP HA H 127 4.308 4.364 -0.056 1
1 1506 . 31 1 1 A 128 128 ASP C C 127 178.254 178.135 0.119 1
1 1507 . 31 1 1 A 128 128 ASP CA C 127 56.964 57.269 -0.305 1
1 1508 . 31 1 1 A 128 128 ASP CB C 127 39.735 40.976 -1.241 1
1 1509 . 31 1 1 A 128 128 ASP N N 127 121.926 119.728 2.198 1
1 1510 . 31 1 1 A 129 129 TYR H H 128 7.710 8.145 -0.435 1
1 1511 . 31 1 1 A 129 129 TYR HA H 128 3.908 3.995 -0.087 1
1 1518 . 31 1 1 A 129 129 TYR C C 128 177.633 177.570 0.063 1
1 1519 . 31 1 1 A 129 129 TYR CA C 128 61.796 61.179 0.617 1
1 1520 . 31 1 1 A 129 129 TYR CB C 128 39.372 38.370 1.002 1
1 1525 . 31 1 1 A 129 129 TYR N N 128 122.548 120.196 2.352 1
1 1526 . 31 1 1 A 130 130 ARG H H 129 8.622 8.484 0.138 1
1 1527 . 31 1 1 A 130 130 ARG HA H 129 3.722 3.908 -0.186 1
1 1535 . 31 1 1 A 130 130 ARG CA C 129 60.084 59.867 0.217 1
1 1536 . 31 1 1 A 130 130 ARG CB C 129 29.902 29.975 -0.073 1
1 1539 . 31 1 1 A 130 130 ARG N N 129 118.302 119.325 -1.023 1
1 1541 . 31 1 1 A 131 131 ALA H H 130 7.936 7.913 0.023 1
1 1542 . 31 1 1 A 131 131 ALA HA H 130 3.997 4.041 -0.044 1
1 1546 . 31 1 1 A 131 131 ALA C C 130 180.456 180.287 0.169 1
1 1547 . 31 1 1 A 131 131 ALA CA C 130 55.133 55.039 0.094 1
1 1548 . 31 1 1 A 131 131 ALA CB C 130 17.750 18.288 -0.538 1
1 1549 . 31 1 1 A 131 131 ALA N N 130 119.788 120.293 -0.505 1
1 1550 . 31 1 1 A 132 132 GLU H H 131 7.622 7.613 0.009 1
1 1551 . 31 1 1 A 132 132 GLU HA H 131 3.862 4.014 -0.152 1
1 1556 . 31 1 1 A 132 132 GLU C C 131 179.528 178.739 0.789 1
1 1557 . 31 1 1 A 132 132 GLU CA C 131 58.849 58.698 0.151 1
1 1558 . 31 1 1 A 132 132 GLU CB C 131 28.930 29.244 -0.314 1
1 1560 . 31 1 1 A 132 132 GLU N N 131 118.428 118.619 -0.191 1
1 1561 . 31 1 1 A 133 133 LYS H H 132 7.853 7.617 0.236 1
1 1562 . 31 1 1 A 133 133 LYS HA H 132 3.722 3.979 -0.257 1
1 1571 . 31 1 1 A 133 133 LYS C C 132 175.725 178.646 -2.921 1
1 1572 . 31 1 1 A 133 133 LYS CA C 132 57.544 58.836 -1.292 1
1 1573 . 31 1 1 A 133 133 LYS CB C 132 31.770 32.043 -0.273 1
1 1577 . 31 1 1 A 133 133 LYS N N 132 119.473 118.578 0.895 1
1 1578 . 31 1 1 A 134 134 GLU H H 133 8.151 7.666 0.485 1
1 1579 . 31 1 1 A 134 134 GLU HA H 133 4.161 4.261 -0.100 1
1 1584 . 31 1 1 A 134 134 GLU C C 133 177.453 176.458 0.995 1
1 1585 . 31 1 1 A 134 134 GLU CA C 133 57.222 56.499 0.723 1
1 1586 . 31 1 1 A 134 134 GLU CB C 133 30.091 29.863 0.228 1
1 1588 . 31 1 1 A 134 134 GLU N N 133 116.525 117.278 -0.753 1
1 1589 . 31 1 1 A 135 135 GLY H H 134 7.702 7.744 -0.042 1
1 1590 . 31 1 1 A 135 135 GLY HA2 H 134 3.896 3.998 -0.102 1
1 1591 . 31 1 1 A 135 135 GLY HA3 H 134 3.897 4.008 -0.111 1
1 1592 . 31 1 1 A 135 135 GLY C C 134 174.538 173.926 0.612 1
1 1593 . 31 1 1 A 135 135 GLY CA C 134 45.975 45.412 0.563 1
1 1594 . 31 1 1 A 135 135 GLY N N 134 107.924 107.743 0.181 1
1 1595 . 31 1 1 A 136 136 ARG H H 135 8.045 8.035 0.010 1
1 1596 . 31 1 1 A 136 136 ARG HA H 135 4.323 4.583 -0.260 1
1 1604 . 31 1 1 A 136 136 ARG C C 135 175.864 176.305 -0.441 1
1 1605 . 31 1 1 A 136 136 ARG CA C 135 56.016 56.830 -0.814 1
1 1606 . 31 1 1 A 136 136 ARG CB C 135 30.987 33.496 -2.509 1
1 1609 . 31 1 1 A 136 136 ARG N N 135 119.708 120.895 -1.187 1
1 1 . 32 1 1 A 14 14 PHE CA C 13 58.199 57.764 0.435 1
1 2 . 32 1 1 A 14 14 PHE CB C 13 39.717 41.173 -1.456 1
1 3 . 32 1 1 A 15 15 SER H H 14 8.299 8.902 -0.603 1
1 4 . 32 1 1 A 15 15 SER HA H 14 4.359 4.897 -0.538 1
1 7 . 32 1 1 A 15 15 SER CA C 14 58.249 56.855 1.394 1
1 8 . 32 1 1 A 15 15 SER CB C 14 63.936 65.769 -1.833 1
1 9 . 32 1 1 A 15 15 SER N N 14 117.379 118.008 -0.629 1
1 10 . 32 1 1 A 16 16 SER H H 15 8.255 8.477 -0.222 1
1 11 . 32 1 1 A 16 16 SER HA H 15 3.729 4.683 -0.954 1
1 14 . 32 1 1 A 16 16 SER CA C 15 58.224 58.711 -0.487 1
1 15 . 32 1 1 A 16 16 SER CB C 15 63.886 64.901 -1.015 1
1 16 . 32 1 1 A 16 16 SER N N 15 117.694 114.633 3.061 1
1 17 . 32 1 1 A 17 17 ALA H H 16 8.333 8.277 0.056 1
1 18 . 32 1 1 A 17 17 ALA HA H 16 4.252 4.200 0.052 1
1 22 . 32 1 1 A 17 17 ALA CA C 16 53.377 55.321 -1.944 1
1 23 . 32 1 1 A 17 17 ALA CB C 16 18.896 18.338 0.558 1
1 24 . 32 1 1 A 17 17 ALA N N 16 125.462 124.172 1.290 1
1 25 . 32 1 1 A 18 18 SER H H 17 8.219 7.866 0.353 1
1 26 . 32 1 1 A 18 18 SER HA H 17 4.332 4.520 -0.188 1
1 29 . 32 1 1 A 18 18 SER CA C 17 59.105 58.978 0.127 1
1 30 . 32 1 1 A 18 18 SER CB C 17 63.592 63.861 -0.269 1
1 31 . 32 1 1 A 18 18 SER N N 17 114.821 110.879 3.942 1
1 32 . 32 1 1 A 19 19 ASP H H 18 8.309 7.758 0.551 1
1 33 . 32 1 1 A 19 19 ASP HA H 18 4.554 4.734 -0.180 1
1 36 . 32 1 1 A 19 19 ASP C C 18 176.528 176.740 -0.212 1
1 37 . 32 1 1 A 19 19 ASP CA C 18 55.272 53.475 1.797 1
1 38 . 32 1 1 A 19 19 ASP CB C 18 40.883 42.657 -1.774 1
1 39 . 32 1 1 A 19 19 ASP N N 18 123.367 122.971 0.396 1
1 40 . 32 1 1 A 20 20 ALA H H 19 8.133 8.838 -0.705 1
1 41 . 32 1 1 A 20 20 ALA HA H 19 4.170 4.023 0.147 1
1 45 . 32 1 1 A 20 20 ALA C C 19 179.857 179.595 0.262 1
1 46 . 32 1 1 A 20 20 ALA CA C 19 54.341 55.095 -0.754 1
1 47 . 32 1 1 A 20 20 ALA CB C 19 18.660 18.376 0.284 1
1 48 . 32 1 1 A 20 20 ALA N N 19 123.350 127.225 -3.875 1
1 49 . 32 1 1 A 21 21 GLU H H 20 8.140 8.075 0.065 1
1 50 . 32 1 1 A 21 21 GLU HA H 20 4.128 4.066 0.062 1
1 55 . 32 1 1 A 21 21 GLU C C 20 177.675 178.593 -0.918 1
1 56 . 32 1 1 A 21 21 GLU CA C 20 58.520 59.431 -0.911 1
1 57 . 32 1 1 A 21 21 GLU CB C 20 29.765 29.534 0.231 1
1 59 . 32 1 1 A 21 21 GLU N N 20 119.063 119.413 -0.350 1
1 60 . 32 1 1 A 22 22 PHE H H 21 8.009 8.010 -0.001 1
1 61 . 32 1 1 A 22 22 PHE HA H 21 4.123 4.366 -0.243 1
1 68 . 32 1 1 A 22 22 PHE C C 21 176.410 177.842 -1.432 1
1 69 . 32 1 1 A 22 22 PHE CA C 21 62.202 61.008 1.194 1
1 70 . 32 1 1 A 22 22 PHE CB C 21 39.223 39.219 0.004 1
1 75 . 32 1 1 A 22 22 PHE N N 21 121.211 120.949 0.262 1
1 76 . 32 1 1 A 23 23 ASP H H 22 8.261 8.571 -0.310 1
1 77 . 32 1 1 A 23 23 ASP HA H 22 4.041 4.574 -0.533 1
1 80 . 32 1 1 A 23 23 ASP C C 22 179.078 178.382 0.696 1
1 81 . 32 1 1 A 23 23 ASP CA C 22 57.048 57.609 -0.561 1
1 82 . 32 1 1 A 23 23 ASP CB C 22 40.154 41.771 -1.617 1
1 83 . 32 1 1 A 23 23 ASP N N 22 116.876 119.368 -2.492 1
1 84 . 32 1 1 A 24 24 ALA H H 23 7.651 7.804 -0.153 1
1 85 . 32 1 1 A 24 24 ALA HA H 23 3.785 3.878 -0.093 1
1 89 . 32 1 1 A 24 24 ALA C C 23 179.577 179.472 0.105 1
1 90 . 32 1 1 A 24 24 ALA CA C 23 54.341 54.947 -0.606 1
1 91 . 32 1 1 A 24 24 ALA CB C 23 17.762 18.234 -0.472 1
1 92 . 32 1 1 A 24 24 ALA N N 23 121.873 121.305 0.568 1
1 93 . 32 1 1 A 25 25 VAL H H 24 7.718 7.664 0.054 1
1 94 . 32 1 1 A 25 25 VAL HA H 24 3.216 3.394 -0.178 1
1 102 . 32 1 1 A 25 25 VAL C C 24 177.805 177.775 0.030 1
1 103 . 32 1 1 A 25 25 VAL CA C 24 66.789 66.640 0.149 1
1 104 . 32 1 1 A 25 25 VAL CB C 24 31.277 31.136 0.141 1
1 107 . 32 1 1 A 25 25 VAL N N 24 117.890 118.134 -0.244 1
1 108 . 32 1 1 A 26 26 VAL H H 25 7.867 8.057 -0.190 1
1 109 . 32 1 1 A 26 26 VAL HA H 25 3.274 3.720 -0.446 1
1 117 . 32 1 1 A 26 26 VAL C C 25 177.788 177.910 -0.122 1
1 118 . 32 1 1 A 26 26 VAL CA C 25 67.282 65.900 1.382 1
1 119 . 32 1 1 A 26 26 VAL CB C 25 31.266 30.955 0.311 1
1 122 . 32 1 1 A 26 26 VAL N N 25 118.170 120.293 -2.123 1
1 123 . 32 1 1 A 27 27 GLY H H 26 7.544 7.870 -0.326 1
1 124 . 32 1 1 A 27 27 GLY HA2 H 26 3.592 3.511 0.081 1
1 125 . 32 1 1 A 27 27 GLY HA3 H 26 3.721 3.627 0.094 1
1 126 . 32 1 1 A 27 27 GLY C C 26 176.717 176.551 0.166 1
1 127 . 32 1 1 A 27 27 GLY CA C 26 47.085 47.203 -0.118 1
1 128 . 32 1 1 A 27 27 GLY N N 26 105.795 108.788 -2.993 1
1 129 . 32 1 1 A 28 28 TYR H H 27 7.625 7.365 0.260 1
1 130 . 32 1 1 A 28 28 TYR HA H 27 4.546 4.558 -0.012 1
1 137 . 32 1 1 A 28 28 TYR C C 27 178.991 178.087 0.904 1
1 138 . 32 1 1 A 28 28 TYR CA C 27 58.845 59.678 -0.833 1
1 139 . 32 1 1 A 28 28 TYR CB C 27 37.602 37.604 -0.002 1
1 144 . 32 1 1 A 28 28 TYR N N 27 119.933 121.580 -1.647 1
1 145 . 32 1 1 A 29 29 LEU H H 28 8.517 8.207 0.310 1
1 146 . 32 1 1 A 29 29 LEU HA H 28 3.728 3.824 -0.096 1
1 156 . 32 1 1 A 29 29 LEU CA C 28 58.281 58.129 0.152 1
1 157 . 32 1 1 A 29 29 LEU CB C 28 41.948 41.491 0.457 1
1 161 . 32 1 1 A 29 29 LEU N N 28 119.669 120.200 -0.531 1
1 162 . 32 1 1 A 30 30 GLU H H 29 8.072 7.887 0.185 1
1 163 . 32 1 1 A 30 30 GLU HA H 29 3.722 3.885 -0.163 1
1 168 . 32 1 1 A 30 30 GLU C C 29 177.731 178.622 -0.891 1
1 169 . 32 1 1 A 30 30 GLU CA C 29 59.763 59.910 -0.147 1
1 170 . 32 1 1 A 30 30 GLU CB C 29 28.844 29.307 -0.463 1
1 172 . 32 1 1 A 30 30 GLU N N 29 117.666 117.649 0.017 1
1 173 . 32 1 1 A 31 31 ASP H H 30 7.243 7.981 -0.738 1
1 174 . 32 1 1 A 31 31 ASP HA H 30 4.297 4.336 -0.039 1
1 177 . 32 1 1 A 31 31 ASP CA C 30 56.953 57.569 -0.616 1
1 178 . 32 1 1 A 31 31 ASP CB C 30 40.730 42.386 -1.656 1
1 179 . 32 1 1 A 31 31 ASP N N 30 116.720 119.368 -2.648 1
1 180 . 32 1 1 A 32 32 ILE H H 31 7.940 7.510 0.430 1
1 181 . 32 1 1 A 32 32 ILE HA H 31 3.640 3.691 -0.051 1
1 191 . 32 1 1 A 32 32 ILE C C 31 177.980 178.061 -0.081 1
1 192 . 32 1 1 A 32 32 ILE CA C 31 64.692 64.157 0.535 1
1 193 . 32 1 1 A 32 32 ILE CB C 31 38.938 36.855 2.083 1
1 197 . 32 1 1 A 32 32 ILE N N 31 119.728 119.283 0.445 1
1 198 . 32 1 1 A 33 33 ILE H H 32 7.984 7.816 0.168 1
1 199 . 32 1 1 A 33 33 ILE HA H 32 3.598 2.831 0.767 1
1 209 . 32 1 1 A 33 33 ILE C C 32 176.723 176.857 -0.134 1
1 210 . 32 1 1 A 33 33 ILE CA C 32 63.241 64.490 -1.249 1
1 211 . 32 1 1 A 33 33 ILE CB C 32 37.580 37.611 -0.031 1
1 215 . 32 1 1 A 33 33 ILE N N 32 113.919 122.010 -8.091 1
1 216 . 32 1 1 A 34 34 MET H H 33 7.288 7.659 -0.371 1
1 217 . 32 1 1 A 34 34 MET HA H 33 4.496 4.628 -0.132 1
1 225 . 32 1 1 A 34 34 MET C C 33 176.423 175.811 0.612 1
1 226 . 32 1 1 A 34 34 MET CA C 33 54.634 54.463 0.171 1
1 227 . 32 1 1 A 34 34 MET CB C 33 31.934 31.344 0.590 1
1 230 . 32 1 1 A 34 34 MET N N 33 115.130 116.775 -1.645 1
1 231 . 32 1 1 A 35 35 ASP H H 34 7.405 7.645 -0.240 1
1 232 . 32 1 1 A 35 35 ASP HA H 34 4.484 4.548 -0.064 1
1 235 . 32 1 1 A 35 35 ASP C C 34 177.139 176.785 0.354 1
1 236 . 32 1 1 A 35 35 ASP CA C 34 54.625 54.573 0.052 1
1 237 . 32 1 1 A 35 35 ASP CB C 34 43.554 42.711 0.843 1
1 238 . 32 1 1 A 35 35 ASP N N 34 121.814 121.920 -0.106 1
1 239 . 32 1 1 A 36 36 ASP H H 35 8.765 8.781 -0.016 1
1 240 . 32 1 1 A 36 36 ASP HA H 35 4.235 4.319 -0.084 1
1 243 . 32 1 1 A 36 36 ASP C C 35 178.320 178.501 -0.181 1
1 244 . 32 1 1 A 36 36 ASP CA C 35 57.832 57.902 -0.070 1
1 245 . 32 1 1 A 36 36 ASP CB C 35 40.914 40.523 0.391 1
1 246 . 32 1 1 A 36 36 ASP N N 35 125.883 125.339 0.544 1
1 247 . 32 1 1 A 37 37 GLU H H 36 8.905 8.200 0.705 1
1 248 . 32 1 1 A 37 37 GLU HA H 36 3.933 4.117 -0.184 1
1 253 . 32 1 1 A 37 37 GLU C C 36 179.304 179.134 0.170 1
1 254 . 32 1 1 A 37 37 GLU CA C 36 59.828 59.141 0.687 1
1 255 . 32 1 1 A 37 37 GLU CB C 36 29.380 29.271 0.109 1
1 257 . 32 1 1 A 37 37 GLU N N 36 119.077 119.681 -0.604 1
1 258 . 32 1 1 A 38 38 PHE H H 37 7.460 8.521 -1.061 1
1 259 . 32 1 1 A 38 38 PHE HA H 37 3.642 4.003 -0.361 1
1 267 . 32 1 1 A 38 38 PHE C C 37 176.483 177.862 -1.379 1
1 268 . 32 1 1 A 38 38 PHE CA C 37 61.411 60.969 0.442 1
1 269 . 32 1 1 A 38 38 PHE CB C 37 39.355 39.112 0.243 1
1 275 . 32 1 1 A 38 38 PHE N N 37 119.968 120.831 -0.863 1
1 276 . 32 1 1 A 39 39 GLN H H 38 7.968 8.158 -0.190 1
1 277 . 32 1 1 A 39 39 GLN HA H 38 3.712 3.743 -0.031 1
1 284 . 32 1 1 A 39 39 GLN CA C 38 59.153 58.724 0.429 1
1 285 . 32 1 1 A 39 39 GLN CB C 38 28.213 27.952 0.261 1
1 287 . 32 1 1 A 39 39 GLN N N 38 116.433 118.495 -2.062 1
1 289 . 32 1 1 A 40 40 LEU H H 39 7.930 7.683 0.247 1
1 290 . 32 1 1 A 40 40 LEU HA H 39 3.916 4.028 -0.112 1
1 300 . 32 1 1 A 40 40 LEU C C 39 177.731 178.062 -0.331 1
1 301 . 32 1 1 A 40 40 LEU CA C 39 57.915 57.915 0.000 1
1 302 . 32 1 1 A 40 40 LEU CB C 39 41.989 41.428 0.561 1
1 306 . 32 1 1 A 40 40 LEU N N 39 119.505 121.552 -2.047 1
1 307 . 32 1 1 A 41 41 LEU H H 40 7.174 7.695 -0.521 1
1 308 . 32 1 1 A 41 41 LEU HA H 40 3.835 3.948 -0.113 1
1 318 . 32 1 1 A 41 41 LEU C C 40 179.738 178.280 1.458 1
1 319 . 32 1 1 A 41 41 LEU CA C 40 58.266 58.251 0.015 1
1 320 . 32 1 1 A 41 41 LEU CB C 40 42.050 41.433 0.617 1
1 324 . 32 1 1 A 41 41 LEU N N 40 120.971 119.792 1.179 1
1 325 . 32 1 1 A 42 42 GLN H H 41 8.058 7.935 0.123 1
1 326 . 32 1 1 A 42 42 GLN HA H 41 3.556 3.751 -0.195 1
1 333 . 32 1 1 A 42 42 GLN C C 41 177.642 178.654 -1.012 1
1 334 . 32 1 1 A 42 42 GLN CA C 41 59.826 59.224 0.602 1
1 335 . 32 1 1 A 42 42 GLN CB C 41 28.762 27.957 0.805 1
1 337 . 32 1 1 A 42 42 GLN N N 41 117.899 117.728 0.171 1
1 339 . 32 1 1 A 43 43 ARG H H 42 8.179 7.881 0.298 1
1 340 . 32 1 1 A 43 43 ARG HA H 42 3.655 4.010 -0.355 1
1 347 . 32 1 1 A 43 43 ARG C C 42 178.051 178.667 -0.616 1
1 348 . 32 1 1 A 43 43 ARG CA C 42 59.766 58.973 0.793 1
1 349 . 32 1 1 A 43 43 ARG CB C 42 29.941 29.825 0.116 1
1 352 . 32 1 1 A 43 43 ARG N N 42 119.392 118.865 0.527 1
1 353 . 32 1 1 A 44 44 ASN H H 43 8.525 8.125 0.400 1
1 354 . 32 1 1 A 44 44 ASN HA H 43 4.332 4.383 -0.051 1
1 359 . 32 1 1 A 44 44 ASN C C 43 178.150 177.736 0.414 1
1 360 . 32 1 1 A 44 44 ASN CA C 43 55.841 56.206 -0.365 1
1 361 . 32 1 1 A 44 44 ASN CB C 43 37.632 39.282 -1.650 1
1 362 . 32 1 1 A 44 44 ASN N N 43 116.214 117.587 -1.373 1
1 364 . 32 1 1 A 45 45 PHE H H 44 7.586 7.768 -0.182 1
1 365 . 32 1 1 A 45 45 PHE HA H 44 4.132 4.257 -0.125 1
1 372 . 32 1 1 A 45 45 PHE C C 44 176.691 178.398 -1.707 1
1 373 . 32 1 1 A 45 45 PHE CA C 44 62.333 60.477 1.856 1
1 374 . 32 1 1 A 45 45 PHE CB C 44 39.449 38.708 0.741 1
1 379 . 32 1 1 A 45 45 PHE N N 44 121.501 117.355 4.146 1
1 380 . 32 1 1 A 46 46 MET H H 45 8.190 8.382 -0.192 1
1 381 . 32 1 1 A 46 46 MET HA H 45 4.060 4.264 -0.204 1
1 389 . 32 1 1 A 46 46 MET C C 45 179.754 178.159 1.595 1
1 390 . 32 1 1 A 46 46 MET CA C 45 57.742 57.878 -0.136 1
1 391 . 32 1 1 A 46 46 MET CB C 45 29.912 31.151 -1.239 1
1 394 . 32 1 1 A 46 46 MET N N 45 116.727 117.581 -0.854 1
1 395 . 32 1 1 A 47 47 ASP H H 46 8.579 8.237 0.342 1
1 396 . 32 1 1 A 47 47 ASP HA H 46 4.804 4.625 0.179 1
1 399 . 32 1 1 A 47 47 ASP C C 46 177.854 178.281 -0.427 1
1 400 . 32 1 1 A 47 47 ASP CA C 46 57.277 57.242 0.035 1
1 401 . 32 1 1 A 47 47 ASP CB C 46 40.776 41.591 -0.815 1
1 402 . 32 1 1 A 47 47 ASP N N 46 117.798 120.688 -2.890 1
1 403 . 32 1 1 A 48 48 LYS H H 47 7.339 7.843 -0.504 1
1 404 . 32 1 1 A 48 48 LYS HA H 47 3.828 4.308 -0.480 1
1 413 . 32 1 1 A 48 48 LYS C C 47 178.812 178.666 0.146 1
1 414 . 32 1 1 A 48 48 LYS CA C 47 58.953 58.364 0.589 1
1 415 . 32 1 1 A 48 48 LYS CB C 47 32.796 33.167 -0.371 1
1 419 . 32 1 1 A 48 48 LYS N N 47 117.852 119.527 -1.675 1
1 420 . 32 1 1 A 49 49 TYR H H 48 6.841 8.778 -1.937 1
1 421 . 32 1 1 A 49 49 TYR HA H 48 4.995 4.212 0.783 1
1 428 . 32 1 1 A 49 49 TYR C C 48 178.138 178.462 -0.324 1
1 429 . 32 1 1 A 49 49 TYR CA C 48 58.620 59.743 -1.123 1
1 430 . 32 1 1 A 49 49 TYR CB C 48 42.939 38.130 4.809 1
1 435 . 32 1 1 A 49 49 TYR N N 48 112.109 119.843 -7.734 1
1 436 . 32 1 1 A 50 50 TYR H H 49 8.491 8.028 0.463 1
1 437 . 32 1 1 A 50 50 TYR HA H 49 4.598 4.179 0.419 1
1 444 . 32 1 1 A 50 50 TYR C C 49 176.015 177.925 -1.910 1
1 445 . 32 1 1 A 50 50 TYR CA C 49 62.442 59.528 2.914 1
1 446 . 32 1 1 A 50 50 TYR CB C 49 36.588 36.962 -0.374 1
1 451 . 32 1 1 A 50 50 TYR N N 49 118.294 119.480 -1.186 1
1 452 . 32 1 1 A 51 51 LEU H H 50 7.512 7.739 -0.227 1
1 453 . 32 1 1 A 51 51 LEU HA H 50 3.878 3.462 0.416 1
1 463 . 32 1 1 A 51 51 LEU C C 50 178.625 179.227 -0.602 1
1 464 . 32 1 1 A 51 51 LEU CA C 50 55.994 57.449 -1.455 1
1 465 . 32 1 1 A 51 51 LEU CB C 50 40.743 41.463 -0.720 1
1 469 . 32 1 1 A 51 51 LEU N N 50 118.478 121.411 -2.933 1
1 470 . 32 1 1 A 52 52 GLU H H 51 8.042 7.833 0.209 1
1 471 . 32 1 1 A 52 52 GLU HA H 51 4.197 3.964 0.233 1
1 476 . 32 1 1 A 52 52 GLU C C 51 177.629 177.431 0.198 1
1 477 . 32 1 1 A 52 52 GLU CA C 51 56.141 59.192 -3.051 1
1 478 . 32 1 1 A 52 52 GLU CB C 51 29.162 29.151 0.011 1
1 480 . 32 1 1 A 52 52 GLU N N 51 115.067 117.444 -2.377 1
1 481 . 32 1 1 A 53 53 PHE H H 52 7.465 7.696 -0.231 1
1 482 . 32 1 1 A 53 53 PHE HA H 52 4.431 4.531 -0.100 1
1 490 . 32 1 1 A 53 53 PHE C C 52 174.325 174.569 -0.244 1
1 491 . 32 1 1 A 53 53 PHE CA C 52 58.986 56.876 2.110 1
1 492 . 32 1 1 A 53 53 PHE CB C 52 40.183 37.229 2.954 1
1 498 . 32 1 1 A 53 53 PHE N N 52 116.768 118.375 -1.607 1
1 499 . 32 1 1 A 54 54 GLU H H 53 7.484 7.748 -0.264 1
1 500 . 32 1 1 A 54 54 GLU HA H 53 4.583 4.943 -0.360 1
1 505 . 32 1 1 A 54 54 GLU C C 53 175.722 175.279 0.443 1
1 506 . 32 1 1 A 54 54 GLU CA C 53 54.248 55.611 -1.363 1
1 507 . 32 1 1 A 54 54 GLU CB C 53 34.409 31.216 3.193 1
1 509 . 32 1 1 A 54 54 GLU N N 53 118.844 122.476 -3.632 1
1 510 . 32 1 1 A 55 55 ASP H H 54 9.008 8.807 0.201 1
1 511 . 32 1 1 A 55 55 ASP HA H 54 4.735 4.722 0.013 1
1 514 . 32 1 1 A 55 55 ASP C C 54 175.421 175.528 -0.107 1
1 515 . 32 1 1 A 55 55 ASP CA C 54 52.888 54.015 -1.127 1
1 516 . 32 1 1 A 55 55 ASP CB C 54 38.894 40.580 -1.686 1
1 517 . 32 1 1 A 55 55 ASP N N 54 123.654 123.800 -0.146 1
1 518 . 32 1 1 A 56 56 THR H H 55 7.819 8.164 -0.345 1
1 519 . 32 1 1 A 56 56 THR HA H 55 4.574 5.003 -0.429 1
1 524 . 32 1 1 A 56 56 THR C C 55 174.096 173.759 0.337 1
1 525 . 32 1 1 A 56 56 THR CA C 55 59.172 60.010 -0.838 1
1 526 . 32 1 1 A 56 56 THR CB C 55 71.889 72.267 -0.378 1
1 528 . 32 1 1 A 56 56 THR N N 55 112.015 116.832 -4.817 1
1 529 . 32 1 1 A 57 57 GLU H H 56 8.527 8.649 -0.122 1
1 530 . 32 1 1 A 57 57 GLU HA H 56 4.217 4.642 -0.425 1
1 535 . 32 1 1 A 57 57 GLU C C 56 177.042 176.061 0.981 1
1 536 . 32 1 1 A 57 57 GLU CA C 56 56.869 56.288 0.581 1
1 537 . 32 1 1 A 57 57 GLU CB C 56 29.731 30.328 -0.597 1
1 539 . 32 1 1 A 57 57 GLU N N 56 117.531 118.056 -0.525 1
1 540 . 32 1 1 A 58 58 GLU H H 57 7.587 7.740 -0.153 1
1 541 . 32 1 1 A 58 58 GLU HA H 57 3.941 4.680 -0.739 1
1 546 . 32 1 1 A 58 58 GLU C C 57 176.849 175.572 1.277 1
1 547 . 32 1 1 A 58 58 GLU CA C 57 56.924 55.671 1.253 1
1 548 . 32 1 1 A 58 58 GLU CB C 57 30.251 31.331 -1.080 1
1 550 . 32 1 1 A 58 58 GLU N N 57 119.183 122.416 -3.233 1
1 551 . 32 1 1 A 59 59 ASN H H 58 9.120 8.574 0.546 1
1 552 . 32 1 1 A 59 59 ASN HA H 58 4.922 4.822 0.100 1
1 557 . 32 1 1 A 59 59 ASN C C 58 174.254 175.272 -1.018 1
1 558 . 32 1 1 A 59 59 ASN CA C 58 51.956 53.408 -1.452 1
1 559 . 32 1 1 A 59 59 ASN CB C 58 37.404 39.012 -1.608 1
1 560 . 32 1 1 A 59 59 ASN N N 58 126.767 125.527 1.240 1
1 562 . 32 1 1 A 60 60 LYS H H 59 5.892 8.706 -2.814 1
1 563 . 32 1 1 A 60 60 LYS HA H 59 3.798 4.843 -1.045 1
1 572 . 32 1 1 A 60 60 LYS C C 59 177.908 177.182 0.726 1
1 573 . 32 1 1 A 60 60 LYS CA C 59 56.623 54.867 1.756 1
1 574 . 32 1 1 A 60 60 LYS CB C 59 32.279 35.139 -2.860 1
1 578 . 32 1 1 A 60 60 LYS N N 59 121.527 122.667 -1.140 1
1 579 . 32 1 1 A 61 61 LEU H H 60 8.473 8.836 -0.363 1
1 580 . 32 1 1 A 61 61 LEU HA H 60 3.891 4.216 -0.325 1
1 590 . 32 1 1 A 61 61 LEU C C 60 179.843 178.060 1.783 1
1 591 . 32 1 1 A 61 61 LEU CA C 60 58.301 57.334 0.967 1
1 592 . 32 1 1 A 61 61 LEU CB C 60 41.305 41.915 -0.610 1
1 596 . 32 1 1 A 61 61 LEU N N 60 125.639 125.464 0.175 1
1 597 . 32 1 1 A 62 62 ILE H H 61 7.698 8.036 -0.338 1
1 598 . 32 1 1 A 62 62 ILE HA H 61 3.952 3.876 0.076 1
1 608 . 32 1 1 A 62 62 ILE C C 61 175.392 177.218 -1.826 1
1 609 . 32 1 1 A 62 62 ILE CA C 61 61.743 63.533 -1.790 1
1 610 . 32 1 1 A 62 62 ILE CB C 61 39.108 37.815 1.293 1
1 614 . 32 1 1 A 62 62 ILE N N 61 114.111 118.803 -4.692 1
1 615 . 32 1 1 A 63 63 TYR H H 62 7.273 8.003 -0.730 1
1 616 . 32 1 1 A 63 63 TYR HA H 62 4.343 4.213 0.130 1
1 623 . 32 1 1 A 63 63 TYR C C 62 178.264 178.590 -0.326 1
1 624 . 32 1 1 A 63 63 TYR CA C 62 57.231 61.045 -3.814 1
1 625 . 32 1 1 A 63 63 TYR CB C 62 36.332 37.667 -1.335 1
1 630 . 32 1 1 A 63 63 TYR N N 62 117.689 121.395 -3.706 1
1 631 . 32 1 1 A 64 64 THR H H 63 7.747 8.033 -0.286 1
1 632 . 32 1 1 A 64 64 THR HA H 63 4.266 4.216 0.050 1
1 637 . 32 1 1 A 64 64 THR CA C 63 69.362 67.620 1.742 1
1 638 . 32 1 1 A 64 64 THR CB C 63 66.962 67.184 -0.222 1
1 640 . 32 1 1 A 64 64 THR N N 63 113.755 116.658 -2.903 1
1 641 . 32 1 1 A 65 65 PRO HA H 64 4.372 4.404 -0.032 1
1 648 . 32 1 1 A 65 65 PRO C C 64 179.913 179.292 0.621 1
1 649 . 32 1 1 A 65 65 PRO CA C 64 66.011 65.952 0.059 1
1 650 . 32 1 1 A 65 65 PRO CB C 64 30.642 30.720 -0.078 1
1 653 . 32 1 1 A 66 66 ILE H H 65 7.377 7.319 0.058 1
1 654 . 32 1 1 A 66 66 ILE HA H 65 3.530 3.854 -0.324 1
1 664 . 32 1 1 A 66 66 ILE C C 65 177.543 178.452 -0.909 1
1 665 . 32 1 1 A 66 66 ILE CA C 65 66.647 64.093 2.554 1
1 666 . 32 1 1 A 66 66 ILE CB C 65 38.029 37.489 0.540 1
1 670 . 32 1 1 A 66 66 ILE N N 65 118.353 116.599 1.754 1
1 671 . 32 1 1 A 67 67 PHE H H 66 8.480 8.318 0.162 1
1 672 . 32 1 1 A 67 67 PHE HA H 66 4.115 4.409 -0.294 1
1 680 . 32 1 1 A 67 67 PHE C C 66 177.293 177.858 -0.565 1
1 681 . 32 1 1 A 67 67 PHE CA C 66 59.570 61.746 -2.176 1
1 682 . 32 1 1 A 67 67 PHE CB C 66 38.865 39.361 -0.496 1
1 688 . 32 1 1 A 67 67 PHE N N 66 122.420 121.380 1.040 1
1 689 . 32 1 1 A 68 68 ASN H H 67 8.595 8.753 -0.158 1
1 690 . 32 1 1 A 68 68 ASN HA H 67 4.211 4.404 -0.193 1
1 695 . 32 1 1 A 68 68 ASN C C 67 178.697 177.703 0.994 1
1 696 . 32 1 1 A 68 68 ASN CA C 67 56.056 55.715 0.341 1
1 697 . 32 1 1 A 68 68 ASN CB C 67 37.704 37.352 0.352 1
1 698 . 32 1 1 A 68 68 ASN N N 67 115.573 117.150 -1.577 1
1 700 . 32 1 1 A 69 69 GLU H H 68 8.414 8.161 0.253 1
1 701 . 32 1 1 A 69 69 GLU HA H 68 4.102 4.189 -0.087 1
1 706 . 32 1 1 A 69 69 GLU C C 68 177.880 178.751 -0.871 1
1 707 . 32 1 1 A 69 69 GLU CA C 68 59.399 59.409 -0.010 1
1 708 . 32 1 1 A 69 69 GLU CB C 68 29.855 29.476 0.379 1
1 710 . 32 1 1 A 69 69 GLU N N 68 123.510 120.670 2.840 1
1 711 . 32 1 1 A 70 70 TYR H H 69 8.659 8.054 0.605 1
1 712 . 32 1 1 A 70 70 TYR HA H 69 3.362 4.038 -0.676 1
1 719 . 32 1 1 A 70 70 TYR C C 69 178.143 177.179 0.964 1
1 720 . 32 1 1 A 70 70 TYR CA C 69 60.686 61.084 -0.398 1
1 721 . 32 1 1 A 70 70 TYR CB C 69 38.560 38.907 -0.347 1
1 726 . 32 1 1 A 70 70 TYR N N 69 122.130 120.618 1.512 1
1 727 . 32 1 1 A 71 71 ILE H H 70 8.031 7.539 0.492 1
1 728 . 32 1 1 A 71 71 ILE HA H 70 3.265 3.641 -0.376 1
1 738 . 32 1 1 A 71 71 ILE C C 70 178.056 178.249 -0.193 1
1 739 . 32 1 1 A 71 71 ILE CA C 70 63.756 63.938 -0.182 1
1 740 . 32 1 1 A 71 71 ILE CB C 70 37.321 37.599 -0.278 1
1 744 . 32 1 1 A 71 71 ILE N N 70 118.906 120.539 -1.633 1
1 745 . 32 1 1 A 72 72 SER H H 71 7.803 8.105 -0.302 1
1 746 . 32 1 1 A 72 72 SER HA H 71 4.029 4.192 -0.163 1
1 749 . 32 1 1 A 72 72 SER CA C 71 61.380 61.544 -0.164 1
1 750 . 32 1 1 A 72 72 SER CB C 71 63.288 62.804 0.484 1
1 751 . 32 1 1 A 72 72 SER N N 71 113.735 114.950 -1.215 1
1 752 . 32 1 1 A 73 73 LEU H H 72 7.952 7.903 0.049 1
1 753 . 32 1 1 A 73 73 LEU HA H 72 4.418 4.133 0.285 1
1 763 . 32 1 1 A 73 73 LEU C C 72 177.767 178.346 -0.579 1
1 764 . 32 1 1 A 73 73 LEU CA C 72 56.543 57.433 -0.890 1
1 765 . 32 1 1 A 73 73 LEU CB C 72 44.517 41.704 2.813 1
1 769 . 32 1 1 A 73 73 LEU N N 72 119.411 123.256 -3.845 1
1 770 . 32 1 1 A 74 74 VAL H H 73 8.021 7.659 0.362 1
1 771 . 32 1 1 A 74 74 VAL HA H 73 3.532 3.312 0.220 1
1 779 . 32 1 1 A 74 74 VAL C C 73 177.126 177.912 -0.786 1
1 780 . 32 1 1 A 74 74 VAL CA C 73 66.250 66.291 -0.041 1
1 781 . 32 1 1 A 74 74 VAL CB C 73 31.212 31.146 0.066 1
1 784 . 32 1 1 A 74 74 VAL N N 73 118.747 119.070 -0.323 1
1 785 . 32 1 1 A 75 75 GLU H H 74 7.232 7.924 -0.692 1
1 786 . 32 1 1 A 75 75 GLU HA H 74 3.013 4.183 -1.170 1
1 791 . 32 1 1 A 75 75 GLU C C 74 178.804 179.055 -0.251 1
1 792 . 32 1 1 A 75 75 GLU CA C 74 60.536 59.827 0.709 1
1 793 . 32 1 1 A 75 75 GLU CB C 74 27.009 29.148 -2.139 1
1 795 . 32 1 1 A 75 75 GLU N N 74 118.660 119.827 -1.167 1
1 796 . 32 1 1 A 76 76 LYS H H 75 7.051 7.710 -0.659 1
1 797 . 32 1 1 A 76 76 LYS HA H 75 3.765 4.011 -0.246 1
1 806 . 32 1 1 A 76 76 LYS C C 75 177.765 178.707 -0.942 1
1 807 . 32 1 1 A 76 76 LYS CA C 75 58.357 58.964 -0.607 1
1 808 . 32 1 1 A 76 76 LYS CB C 75 31.939 31.951 -0.012 1
1 812 . 32 1 1 A 76 76 LYS N N 75 116.112 119.581 -3.469 1
1 813 . 32 1 1 A 77 77 TYR H H 76 7.067 7.799 -0.732 1
1 814 . 32 1 1 A 77 77 TYR HA H 76 4.036 4.104 -0.068 1
1 821 . 32 1 1 A 77 77 TYR C C 76 177.752 177.043 0.709 1
1 822 . 32 1 1 A 77 77 TYR CA C 76 61.820 61.367 0.453 1
1 823 . 32 1 1 A 77 77 TYR CB C 76 38.480 38.836 -0.356 1
1 828 . 32 1 1 A 77 77 TYR N N 76 118.434 120.811 -2.377 1
1 829 . 32 1 1 A 78 78 ILE H H 77 7.554 7.982 -0.428 1
1 830 . 32 1 1 A 78 78 ILE HA H 77 3.159 3.605 -0.446 1
1 840 . 32 1 1 A 78 78 ILE C C 77 177.341 177.756 -0.415 1
1 841 . 32 1 1 A 78 78 ILE CA C 77 65.177 64.880 0.297 1
1 842 . 32 1 1 A 78 78 ILE CB C 77 37.339 37.367 -0.028 1
1 846 . 32 1 1 A 78 78 ILE N N 77 117.672 120.332 -2.660 1
1 847 . 32 1 1 A 79 79 GLU H H 78 8.296 8.092 0.204 1
1 848 . 32 1 1 A 79 79 GLU HA H 78 3.557 3.923 -0.366 1
1 853 . 32 1 1 A 79 79 GLU C C 78 177.742 178.888 -1.146 1
1 854 . 32 1 1 A 79 79 GLU CA C 78 60.847 59.991 0.856 1
1 855 . 32 1 1 A 79 79 GLU CB C 78 29.594 29.155 0.439 1
1 857 . 32 1 1 A 79 79 GLU N N 78 118.701 120.977 -2.276 1
1 858 . 32 1 1 A 80 80 GLU H H 79 8.330 8.259 0.071 1
1 859 . 32 1 1 A 80 80 GLU HA H 79 3.774 4.040 -0.266 1
1 864 . 32 1 1 A 80 80 GLU C C 79 179.926 179.205 0.721 1
1 865 . 32 1 1 A 80 80 GLU CA C 79 59.581 58.945 0.636 1
1 866 . 32 1 1 A 80 80 GLU CB C 79 29.062 29.082 -0.020 1
1 868 . 32 1 1 A 80 80 GLU N N 79 116.767 118.771 -2.004 1
1 869 . 32 1 1 A 81 81 GLN H H 80 7.634 7.629 0.005 1
1 870 . 32 1 1 A 81 81 GLN HA H 80 3.605 3.835 -0.230 1
1 877 . 32 1 1 A 81 81 GLN C C 80 179.681 178.963 0.718 1
1 878 . 32 1 1 A 81 81 GLN CA C 80 57.765 58.557 -0.792 1
1 879 . 32 1 1 A 81 81 GLN CB C 80 28.079 27.876 0.203 1
1 881 . 32 1 1 A 81 81 GLN N N 80 116.325 118.739 -2.414 1
1 883 . 32 1 1 A 82 82 LEU H H 81 8.156 7.730 0.426 1
1 884 . 32 1 1 A 82 82 LEU HA H 81 3.536 3.778 -0.242 1
1 894 . 32 1 1 A 82 82 LEU C C 81 178.945 179.396 -0.451 1
1 895 . 32 1 1 A 82 82 LEU CA C 81 57.761 57.410 0.351 1
1 896 . 32 1 1 A 82 82 LEU CB C 81 40.961 40.987 -0.026 1
1 900 . 32 1 1 A 82 82 LEU N N 81 121.546 120.175 1.371 1
1 901 . 32 1 1 A 83 83 LEU H H 82 8.326 8.118 0.208 1
1 902 . 32 1 1 A 83 83 LEU HA H 82 4.198 4.299 -0.101 1
1 912 . 32 1 1 A 83 83 LEU C C 82 178.631 179.216 -0.585 1
1 913 . 32 1 1 A 83 83 LEU CA C 82 57.016 57.116 -0.100 1
1 914 . 32 1 1 A 83 83 LEU CB C 82 42.182 40.691 1.491 1
1 918 . 32 1 1 A 83 83 LEU N N 82 120.426 119.199 1.227 1
1 919 . 32 1 1 A 84 84 GLN H H 83 6.992 7.650 -0.658 1
1 920 . 32 1 1 A 84 84 GLN HA H 83 3.877 3.986 -0.109 1
1 927 . 32 1 1 A 84 84 GLN C C 83 177.008 177.080 -0.072 1
1 928 . 32 1 1 A 84 84 GLN CA C 83 57.543 58.612 -1.069 1
1 929 . 32 1 1 A 84 84 GLN CB C 83 28.688 28.291 0.397 1
1 931 . 32 1 1 A 84 84 GLN N N 83 114.001 117.454 -3.453 1
1 933 . 32 1 1 A 85 85 ARG H H 84 7.072 7.526 -0.454 1
1 934 . 32 1 1 A 85 85 ARG HA H 84 4.047 4.278 -0.231 1
1 942 . 32 1 1 A 85 85 ARG C C 84 175.999 175.550 0.449 1
1 943 . 32 1 1 A 85 85 ARG CA C 84 56.764 56.932 -0.168 1
1 944 . 32 1 1 A 85 85 ARG CB C 84 32.044 31.755 0.289 1
1 947 . 32 1 1 A 85 85 ARG N N 84 115.827 119.065 -3.238 1
1 949 . 32 1 1 A 86 86 ILE H H 85 8.238 7.452 0.786 1
1 950 . 32 1 1 A 86 86 ILE HA H 85 4.389 4.418 -0.029 1
1 960 . 32 1 1 A 86 86 ILE CA C 85 58.007 57.780 0.227 1
1 961 . 32 1 1 A 86 86 ILE CB C 85 39.604 39.296 0.308 1
1 965 . 32 1 1 A 86 86 ILE N N 85 119.285 117.596 1.689 1
1 966 . 32 1 1 A 87 87 PRO HA H 86 4.392 4.560 -0.168 1
1 973 . 32 1 1 A 87 87 PRO C C 86 177.622 176.402 1.220 1
1 974 . 32 1 1 A 87 87 PRO CA C 86 64.665 64.260 0.405 1
1 975 . 32 1 1 A 87 87 PRO CB C 86 32.020 31.718 0.302 1
1 978 . 32 1 1 A 88 88 GLU H H 87 8.312 8.221 0.091 1
1 979 . 32 1 1 A 88 88 GLU HA H 87 4.208 4.580 -0.372 1
1 984 . 32 1 1 A 88 88 GLU C C 87 175.554 175.810 -0.256 1
1 985 . 32 1 1 A 88 88 GLU CA C 87 56.045 56.215 -0.170 1
1 986 . 32 1 1 A 88 88 GLU CB C 87 28.654 30.671 -2.017 1
1 988 . 32 1 1 A 88 88 GLU N N 87 114.256 116.773 -2.517 1
1 989 . 32 1 1 A 89 89 PHE H H 88 7.946 7.568 0.378 1
1 990 . 32 1 1 A 89 89 PHE HA H 88 3.993 4.451 -0.458 1
1 998 . 32 1 1 A 89 89 PHE C C 88 173.460 174.601 -1.141 1
1 999 . 32 1 1 A 89 89 PHE CA C 88 60.119 59.112 1.007 1
1 1000 . 32 1 1 A 89 89 PHE CB C 88 39.994 39.654 0.340 1
1 1006 . 32 1 1 A 89 89 PHE N N 88 121.550 123.115 -1.565 1
1 1007 . 32 1 1 A 90 90 ASN H H 89 7.266 7.713 -0.447 1
1 1008 . 32 1 1 A 90 90 ASN HA H 89 4.454 4.739 -0.285 1
1 1013 . 32 1 1 A 90 90 ASN C C 89 173.921 174.804 -0.883 1
1 1014 . 32 1 1 A 90 90 ASN CA C 89 51.839 50.954 0.885 1
1 1015 . 32 1 1 A 90 90 ASN CB C 89 40.674 39.192 1.482 1
1 1016 . 32 1 1 A 90 90 ASN N N 89 125.344 125.007 0.337 1
1 1018 . 32 1 1 A 91 91 MET H H 90 8.968 8.462 0.506 1
1 1019 . 32 1 1 A 91 91 MET HA H 90 4.049 3.942 0.107 1
1 1027 . 32 1 1 A 91 91 MET C C 90 177.475 177.843 -0.368 1
1 1028 . 32 1 1 A 91 91 MET CA C 90 57.758 57.986 -0.228 1
1 1029 . 32 1 1 A 91 91 MET CB C 90 32.250 32.320 -0.070 1
1 1032 . 32 1 1 A 91 91 MET N N 90 127.052 125.141 1.911 1
1 1033 . 32 1 1 A 92 92 ALA H H 91 8.292 7.954 0.338 1
1 1034 . 32 1 1 A 92 92 ALA HA H 91 4.059 4.036 0.023 1
1 1038 . 32 1 1 A 92 92 ALA C C 91 180.412 179.716 0.696 1
1 1039 . 32 1 1 A 92 92 ALA CA C 91 55.368 54.983 0.385 1
1 1040 . 32 1 1 A 92 92 ALA CB C 91 17.527 18.355 -0.828 1
1 1041 . 32 1 1 A 92 92 ALA N N 91 123.752 121.241 2.511 1
1 1042 . 32 1 1 A 93 93 ALA H H 92 7.931 7.922 0.009 1
1 1043 . 32 1 1 A 93 93 ALA HA H 92 4.054 4.030 0.024 1
1 1047 . 32 1 1 A 93 93 ALA C C 92 180.482 179.939 0.543 1
1 1048 . 32 1 1 A 93 93 ALA CA C 92 54.614 54.851 -0.237 1
1 1049 . 32 1 1 A 93 93 ALA CB C 92 18.098 18.344 -0.246 1
1 1050 . 32 1 1 A 93 93 ALA N N 92 121.158 121.098 0.060 1
1 1051 . 32 1 1 A 94 94 PHE H H 93 8.110 7.718 0.392 1
1 1052 . 32 1 1 A 94 94 PHE HA H 93 4.304 4.219 0.085 1
1 1060 . 32 1 1 A 94 94 PHE C C 93 177.350 177.193 0.157 1
1 1061 . 32 1 1 A 94 94 PHE CA C 93 61.641 61.464 0.177 1
1 1062 . 32 1 1 A 94 94 PHE CB C 93 40.014 39.387 0.627 1
1 1068 . 32 1 1 A 94 94 PHE N N 93 119.807 119.516 0.291 1
1 1069 . 32 1 1 A 95 95 THR H H 94 8.726 8.224 0.502 1
1 1070 . 32 1 1 A 95 95 THR HA H 94 3.569 4.119 -0.550 1
1 1075 . 32 1 1 A 95 95 THR C C 94 176.932 176.586 0.346 1
1 1076 . 32 1 1 A 95 95 THR CA C 94 66.833 65.346 1.487 1
1 1077 . 32 1 1 A 95 95 THR CB C 94 68.445 67.966 0.479 1
1 1079 . 32 1 1 A 95 95 THR N N 94 113.074 112.613 0.461 1
1 1080 . 32 1 1 A 96 96 THR H H 95 7.657 7.872 -0.215 1
1 1081 . 32 1 1 A 96 96 THR HA H 95 3.945 4.379 -0.434 1
1 1086 . 32 1 1 A 96 96 THR C C 95 176.386 177.233 -0.847 1
1 1087 . 32 1 1 A 96 96 THR CA C 95 66.550 65.760 0.790 1
1 1088 . 32 1 1 A 96 96 THR CB C 95 68.583 67.993 0.590 1
1 1090 . 32 1 1 A 96 96 THR N N 95 117.927 113.661 4.266 1
1 1091 . 32 1 1 A 97 97 THR H H 96 7.699 7.833 -0.134 1
1 1092 . 32 1 1 A 97 97 THR HA H 96 3.905 4.308 -0.403 1
1 1097 . 32 1 1 A 97 97 THR C C 96 176.572 176.489 0.083 1
1 1098 . 32 1 1 A 97 97 THR CA C 96 65.979 66.606 -0.627 1
1 1099 . 32 1 1 A 97 97 THR CB C 96 68.553 67.982 0.571 1
1 1101 . 32 1 1 A 97 97 THR N N 96 118.518 117.934 0.584 1
1 1102 . 32 1 1 A 98 98 LEU H H 97 8.304 8.130 0.174 1
1 1103 . 32 1 1 A 98 98 LEU HA H 97 3.725 3.773 -0.048 1
1 1113 . 32 1 1 A 98 98 LEU C C 97 178.490 178.529 -0.039 1
1 1114 . 32 1 1 A 98 98 LEU CA C 97 58.517 57.902 0.615 1
1 1115 . 32 1 1 A 98 98 LEU CB C 97 41.697 40.983 0.714 1
1 1119 . 32 1 1 A 98 98 LEU N N 97 122.882 121.639 1.243 1
1 1120 . 32 1 1 A 99 99 GLN H H 98 7.639 7.876 -0.237 1
1 1121 . 32 1 1 A 99 99 GLN HA H 98 3.927 4.055 -0.128 1
1 1128 . 32 1 1 A 99 99 GLN C C 98 178.068 177.928 0.140 1
1 1129 . 32 1 1 A 99 99 GLN CA C 98 58.735 59.440 -0.705 1
1 1130 . 32 1 1 A 99 99 GLN CB C 98 27.986 28.357 -0.371 1
1 1132 . 32 1 1 A 99 99 GLN N N 98 114.302 118.721 -4.419 1
1 1134 . 32 1 1 A 100 100 HIS H H 99 7.575 8.074 -0.499 1
1 1135 . 32 1 1 A 100 100 HIS HA H 99 4.524 4.496 0.028 1
1 1139 . 32 1 1 A 100 100 HIS C C 99 174.789 177.247 -2.458 1
1 1140 . 32 1 1 A 100 100 HIS CA C 99 56.154 57.748 -1.594 1
1 1141 . 32 1 1 A 100 100 HIS CB C 99 28.946 29.679 -0.733 1
1 1143 . 32 1 1 A 100 100 HIS N N 99 114.778 116.512 -1.734 1
1 1144 . 32 1 1 A 101 101 HIS H H 100 7.773 7.453 0.320 1
1 1145 . 32 1 1 A 101 101 HIS HA H 100 4.704 3.929 0.775 1
1 1149 . 32 1 1 A 101 101 HIS C C 100 174.818 176.851 -2.033 1
1 1150 . 32 1 1 A 101 101 HIS CA C 100 54.830 58.074 -3.244 1
1 1151 . 32 1 1 A 101 101 HIS CB C 100 29.749 29.920 -0.171 1
1 1153 . 32 1 1 A 101 101 HIS N N 100 117.397 119.893 -2.496 1
1 1154 . 32 1 1 A 102 102 LYS H H 101 7.324 8.043 -0.719 1
1 1155 . 32 1 1 A 102 102 LYS HA H 101 3.611 4.028 -0.417 1
1 1164 . 32 1 1 A 102 102 LYS C C 101 176.823 178.552 -1.729 1
1 1165 . 32 1 1 A 102 102 LYS CA C 101 59.915 58.872 1.043 1
1 1166 . 32 1 1 A 102 102 LYS CB C 101 32.825 32.065 0.760 1
1 1170 . 32 1 1 A 102 102 LYS N N 101 120.533 118.599 1.934 1
1 1171 . 32 1 1 A 103 103 ASP H H 102 8.361 8.692 -0.331 1
1 1172 . 32 1 1 A 103 103 ASP HA H 102 4.421 4.391 0.030 1
1 1175 . 32 1 1 A 103 103 ASP C C 102 176.793 177.211 -0.418 1
1 1176 . 32 1 1 A 103 103 ASP CA C 102 55.500 55.216 0.284 1
1 1177 . 32 1 1 A 103 103 ASP CB C 102 40.178 39.186 0.992 1
1 1178 . 32 1 1 A 103 103 ASP N N 102 114.814 116.671 -1.857 1
1 1179 . 32 1 1 A 104 104 GLU H H 103 7.858 7.934 -0.076 1
1 1180 . 32 1 1 A 104 104 GLU HA H 103 4.339 4.493 -0.154 1
1 1183 . 32 1 1 A 104 104 GLU C C 103 175.777 175.880 -0.103 1
1 1184 . 32 1 1 A 104 104 GLU CA C 103 56.356 57.948 -1.592 1
1 1185 . 32 1 1 A 104 104 GLU CB C 103 31.293 31.595 -0.302 1
1 1186 . 32 1 1 A 104 104 GLU N N 103 116.826 118.530 -1.704 1
1 1187 . 32 1 1 A 105 105 VAL H H 104 7.201 7.036 0.165 1
1 1188 . 32 1 1 A 105 105 VAL HA H 104 4.296 4.211 0.085 1
1 1196 . 32 1 1 A 105 105 VAL C C 104 174.482 175.537 -1.055 1
1 1197 . 32 1 1 A 105 105 VAL CA C 104 60.370 61.564 -1.194 1
1 1198 . 32 1 1 A 105 105 VAL CB C 104 34.341 33.169 1.172 1
1 1201 . 32 1 1 A 105 105 VAL N N 104 116.422 116.443 -0.021 1
1 1202 . 32 1 1 A 106 106 ALA H H 105 8.487 8.590 -0.103 1
1 1203 . 32 1 1 A 106 106 ALA HA H 105 4.172 4.392 -0.220 1
1 1207 . 32 1 1 A 106 106 ALA C C 105 179.030 178.375 0.655 1
1 1208 . 32 1 1 A 106 106 ALA CA C 105 52.966 51.639 1.327 1
1 1209 . 32 1 1 A 106 106 ALA CB C 105 19.371 18.733 0.638 1
1 1210 . 32 1 1 A 106 106 ALA N N 105 128.313 125.952 2.361 1
1 1211 . 32 1 1 A 107 107 GLY H H 106 8.738 8.754 -0.016 1
1 1212 . 32 1 1 A 107 107 GLY HA2 H 106 3.773 3.883 -0.110 1
1 1213 . 32 1 1 A 107 107 GLY HA3 H 106 3.998 3.942 0.056 1
1 1214 . 32 1 1 A 107 107 GLY C C 106 174.958 175.823 -0.865 1
1 1215 . 32 1 1 A 107 107 GLY CA C 106 47.449 47.221 0.228 1
1 1216 . 32 1 1 A 107 107 GLY N N 106 110.612 110.546 0.066 1
1 1217 . 32 1 1 A 108 108 ASP H H 107 8.535 8.464 0.071 1
1 1218 . 32 1 1 A 108 108 ASP HA H 107 4.333 4.355 -0.022 1
1 1221 . 32 1 1 A 108 108 ASP C C 107 179.133 178.243 0.890 1
1 1222 . 32 1 1 A 108 108 ASP CA C 107 56.721 56.770 -0.049 1
1 1223 . 32 1 1 A 108 108 ASP CB C 107 39.336 39.754 -0.418 1
1 1224 . 32 1 1 A 108 108 ASP N N 107 117.474 120.987 -3.513 1
1 1225 . 32 1 1 A 109 109 ILE H H 108 7.459 7.663 -0.204 1
1 1226 . 32 1 1 A 109 109 ILE HA H 108 3.688 3.835 -0.147 1
1 1236 . 32 1 1 A 109 109 ILE C C 108 176.735 178.523 -1.788 1
1 1237 . 32 1 1 A 109 109 ILE CA C 108 63.474 65.437 -1.963 1
1 1238 . 32 1 1 A 109 109 ILE CB C 108 37.340 37.617 -0.277 1
1 1242 . 32 1 1 A 109 109 ILE N N 108 119.609 120.971 -1.362 1
1 1243 . 32 1 1 A 110 110 PHE H H 109 7.920 8.297 -0.377 1
1 1244 . 32 1 1 A 110 110 PHE HA H 109 3.759 4.111 -0.352 1
1 1252 . 32 1 1 A 110 110 PHE C C 109 177.132 177.291 -0.159 1
1 1253 . 32 1 1 A 110 110 PHE CA C 109 62.766 61.206 1.560 1
1 1254 . 32 1 1 A 110 110 PHE CB C 109 39.752 39.310 0.442 1
1 1260 . 32 1 1 A 110 110 PHE N N 109 120.906 120.288 0.618 1
1 1261 . 32 1 1 A 111 111 ASP H H 110 8.639 8.235 0.404 1
1 1262 . 32 1 1 A 111 111 ASP HA H 110 4.216 4.247 -0.031 1
1 1265 . 32 1 1 A 111 111 ASP C C 110 178.900 178.345 0.555 1
1 1266 . 32 1 1 A 111 111 ASP CA C 110 57.105 57.331 -0.226 1
1 1267 . 32 1 1 A 111 111 ASP CB C 110 39.697 42.089 -2.392 1
1 1268 . 32 1 1 A 111 111 ASP N N 110 117.124 118.780 -1.656 1
1 1269 . 32 1 1 A 112 112 MET H H 111 7.331 7.622 -0.291 1
1 1270 . 32 1 1 A 112 112 MET HA H 111 4.081 4.145 -0.064 1
1 1278 . 32 1 1 A 112 112 MET C C 111 179.052 178.138 0.914 1
1 1279 . 32 1 1 A 112 112 MET CA C 111 58.202 58.032 0.170 1
1 1280 . 32 1 1 A 112 112 MET CB C 111 31.827 32.375 -0.548 1
1 1283 . 32 1 1 A 112 112 MET N N 111 118.061 119.398 -1.337 1
1 1284 . 32 1 1 A 113 113 LEU H H 112 8.001 7.991 0.010 1
1 1285 . 32 1 1 A 113 113 LEU HA H 112 3.723 3.576 0.147 1
1 1295 . 32 1 1 A 113 113 LEU C C 112 179.747 178.757 0.990 1
1 1296 . 32 1 1 A 113 113 LEU CA C 112 57.371 57.425 -0.054 1
1 1297 . 32 1 1 A 113 113 LEU CB C 112 40.671 40.946 -0.275 1
1 1301 . 32 1 1 A 113 113 LEU N N 112 120.426 119.575 0.851 1
1 1302 . 32 1 1 A 114 114 LEU H H 113 7.744 7.463 0.281 1
1 1303 . 32 1 1 A 114 114 LEU HA H 113 4.007 3.611 0.396 1
1 1313 . 32 1 1 A 114 114 LEU C C 113 179.358 178.597 0.761 1
1 1314 . 32 1 1 A 114 114 LEU CA C 113 57.202 57.431 -0.229 1
1 1315 . 32 1 1 A 114 114 LEU CB C 113 41.727 41.156 0.571 1
1 1319 . 32 1 1 A 114 114 LEU N N 113 119.584 118.348 1.236 1
1 1320 . 32 1 1 A 115 115 THR H H 114 7.353 7.624 -0.271 1
1 1321 . 32 1 1 A 115 115 THR HA H 114 4.071 4.109 -0.038 1
1 1327 . 32 1 1 A 115 115 THR C C 114 173.591 176.738 -3.147 1
1 1328 . 32 1 1 A 115 115 THR CA C 114 65.332 64.649 0.683 1
1 1329 . 32 1 1 A 115 115 THR CB C 114 70.319 68.577 1.742 1
1 1331 . 32 1 1 A 115 115 THR N N 114 107.535 110.474 -2.939 1
1 1332 . 32 1 1 A 116 116 PHE H H 115 6.979 7.799 -0.820 1
1 1333 . 32 1 1 A 116 116 PHE HA H 115 5.022 4.270 0.752 1
1 1341 . 32 1 1 A 116 116 PHE C C 115 176.488 176.495 -0.007 1
1 1342 . 32 1 1 A 116 116 PHE CA C 115 55.911 60.844 -4.933 1
1 1343 . 32 1 1 A 116 116 PHE CB C 115 38.521 39.181 -0.660 1
1 1349 . 32 1 1 A 116 116 PHE N N 115 112.366 120.005 -7.639 1
1 1350 . 32 1 1 A 117 117 THR H H 116 7.564 7.443 0.121 1
1 1351 . 32 1 1 A 117 117 THR HA H 116 4.626 4.815 -0.189 1
1 1356 . 32 1 1 A 117 117 THR C C 116 174.085 174.379 -0.294 1
1 1357 . 32 1 1 A 117 117 THR CA C 116 61.636 61.906 -0.270 1
1 1358 . 32 1 1 A 117 117 THR CB C 116 70.915 70.834 0.081 1
1 1360 . 32 1 1 A 117 117 THR N N 116 105.498 105.551 -0.053 1
1 1361 . 32 1 1 A 118 118 ASP H H 117 8.270 7.787 0.483 1
1 1362 . 32 1 1 A 118 118 ASP HA H 117 4.955 4.702 0.253 1
1 1365 . 32 1 1 A 118 118 ASP C C 117 176.328 176.436 -0.108 1
1 1366 . 32 1 1 A 118 118 ASP CA C 117 53.417 53.422 -0.005 1
1 1367 . 32 1 1 A 118 118 ASP CB C 117 43.388 40.482 2.906 1
1 1368 . 32 1 1 A 118 118 ASP N N 117 124.409 122.254 2.155 1
1 1369 . 32 1 1 A 119 119 PHE H H 118 8.973 8.839 0.134 1
1 1370 . 32 1 1 A 119 119 PHE HA H 118 3.506 4.242 -0.736 1
1 1378 . 32 1 1 A 119 119 PHE CA C 118 61.490 61.070 0.420 1
1 1379 . 32 1 1 A 119 119 PHE CB C 118 39.246 39.595 -0.349 1
1 1385 . 32 1 1 A 119 119 PHE N N 118 126.688 126.430 0.258 1
1 1386 . 32 1 1 A 120 120 LEU H H 119 8.099 8.265 -0.166 1
1 1387 . 32 1 1 A 120 120 LEU HA H 119 3.842 3.985 -0.143 1
1 1397 . 32 1 1 A 120 120 LEU C C 119 179.601 179.680 -0.079 1
1 1398 . 32 1 1 A 120 120 LEU CA C 119 58.174 57.729 0.445 1
1 1399 . 32 1 1 A 120 120 LEU CB C 119 40.315 40.840 -0.525 1
1 1403 . 32 1 1 A 120 120 LEU N N 119 117.930 119.801 -1.871 1
1 1404 . 32 1 1 A 121 121 ALA H H 120 7.729 7.894 -0.165 1
1 1405 . 32 1 1 A 121 121 ALA HA H 120 3.996 4.137 -0.141 1
1 1409 . 32 1 1 A 121 121 ALA C C 120 180.995 179.704 1.291 1
1 1410 . 32 1 1 A 121 121 ALA CA C 120 54.832 54.639 0.193 1
1 1411 . 32 1 1 A 121 121 ALA CB C 120 17.706 18.282 -0.576 1
1 1412 . 32 1 1 A 121 121 ALA N N 120 123.195 121.299 1.896 1
1 1413 . 32 1 1 A 122 122 PHE H H 121 7.943 7.793 0.150 1
1 1414 . 32 1 1 A 122 122 PHE HA H 121 3.887 3.817 0.070 1
1 1419 . 32 1 1 A 122 122 PHE C C 121 175.410 176.879 -1.469 1
1 1420 . 32 1 1 A 122 122 PHE CA C 121 61.075 60.816 0.259 1
1 1421 . 32 1 1 A 122 122 PHE CB C 121 38.115 38.921 -0.806 1
1 1424 . 32 1 1 A 122 122 PHE N N 121 121.798 120.002 1.796 1
1 1425 . 32 1 1 A 123 123 LYS H H 122 8.468 7.890 0.578 1
1 1426 . 32 1 1 A 123 123 LYS HA H 122 3.077 3.873 -0.796 1
1 1435 . 32 1 1 A 123 123 LYS C C 122 178.453 178.748 -0.295 1
1 1436 . 32 1 1 A 123 123 LYS CA C 122 59.855 59.944 -0.089 1
1 1437 . 32 1 1 A 123 123 LYS CB C 122 32.374 32.351 0.023 1
1 1441 . 32 1 1 A 123 123 LYS N N 122 120.614 118.625 1.989 1
1 1442 . 32 1 1 A 124 124 GLU H H 123 8.100 7.864 0.236 1
1 1443 . 32 1 1 A 124 124 GLU HA H 123 3.652 4.040 -0.388 1
1 1448 . 32 1 1 A 124 124 GLU C C 123 177.743 178.455 -0.712 1
1 1449 . 32 1 1 A 124 124 GLU CA C 123 59.406 59.569 -0.163 1
1 1450 . 32 1 1 A 124 124 GLU CB C 123 28.811 29.273 -0.462 1
1 1452 . 32 1 1 A 124 124 GLU N N 123 117.404 118.823 -1.419 1
1 1453 . 32 1 1 A 125 125 MET H H 124 7.537 7.441 0.096 1
1 1454 . 32 1 1 A 125 125 MET HA H 124 3.860 3.966 -0.106 1
1 1462 . 32 1 1 A 125 125 MET C C 124 179.522 178.357 1.165 1
1 1463 . 32 1 1 A 125 125 MET CA C 124 58.832 58.475 0.357 1
1 1464 . 32 1 1 A 125 125 MET CB C 124 31.765 31.358 0.407 1
1 1467 . 32 1 1 A 125 125 MET N N 124 119.413 118.961 0.452 1
1 1468 . 32 1 1 A 126 126 PHE H H 125 7.148 7.481 -0.333 1
1 1469 . 32 1 1 A 126 126 PHE HA H 125 3.633 4.202 -0.569 1
1 1476 . 32 1 1 A 126 126 PHE C C 125 178.994 178.215 0.779 1
1 1477 . 32 1 1 A 126 126 PHE CA C 125 63.148 60.806 2.342 1
1 1478 . 32 1 1 A 126 126 PHE CB C 125 39.830 38.333 1.497 1
1 1483 . 32 1 1 A 126 126 PHE N N 125 120.013 118.880 1.133 1
1 1484 . 32 1 1 A 127 127 LEU H H 126 8.369 8.291 0.078 1
1 1485 . 32 1 1 A 127 127 LEU HA H 126 3.972 4.004 -0.032 1
1 1495 . 32 1 1 A 127 127 LEU C C 126 180.621 178.501 2.120 1
1 1496 . 32 1 1 A 127 127 LEU CA C 126 57.944 58.272 -0.328 1
1 1497 . 32 1 1 A 127 127 LEU CB C 126 40.543 41.478 -0.935 1
1 1501 . 32 1 1 A 127 127 LEU N N 126 119.692 119.835 -0.143 1
1 1502 . 32 1 1 A 128 128 ASP H H 127 8.578 8.431 0.147 1
1 1503 . 32 1 1 A 128 128 ASP HA H 127 4.308 4.304 0.004 1
1 1506 . 32 1 1 A 128 128 ASP C C 127 178.254 177.924 0.330 1
1 1507 . 32 1 1 A 128 128 ASP CA C 127 56.964 57.458 -0.494 1
1 1508 . 32 1 1 A 128 128 ASP CB C 127 39.735 41.209 -1.474 1
1 1509 . 32 1 1 A 128 128 ASP N N 127 121.926 118.972 2.954 1
1 1510 . 32 1 1 A 129 129 TYR H H 128 7.710 8.329 -0.619 1
1 1511 . 32 1 1 A 129 129 TYR HA H 128 3.908 4.224 -0.316 1
1 1518 . 32 1 1 A 129 129 TYR C C 128 177.633 177.771 -0.138 1
1 1519 . 32 1 1 A 129 129 TYR CA C 128 61.796 61.569 0.227 1
1 1520 . 32 1 1 A 129 129 TYR CB C 128 39.372 38.816 0.556 1
1 1525 . 32 1 1 A 129 129 TYR N N 128 122.548 120.329 2.219 1
1 1526 . 32 1 1 A 130 130 ARG H H 129 8.622 8.365 0.257 1
1 1527 . 32 1 1 A 130 130 ARG HA H 129 3.722 3.988 -0.266 1
1 1535 . 32 1 1 A 130 130 ARG CA C 129 60.084 59.583 0.501 1
1 1536 . 32 1 1 A 130 130 ARG CB C 129 29.902 29.967 -0.065 1
1 1539 . 32 1 1 A 130 130 ARG N N 129 118.302 119.432 -1.130 1
1 1541 . 32 1 1 A 131 131 ALA H H 130 7.936 7.922 0.014 1
1 1542 . 32 1 1 A 131 131 ALA HA H 130 3.997 4.053 -0.056 1
1 1546 . 32 1 1 A 131 131 ALA C C 130 180.456 179.651 0.805 1
1 1547 . 32 1 1 A 131 131 ALA CA C 130 55.133 55.029 0.104 1
1 1548 . 32 1 1 A 131 131 ALA CB C 130 17.750 18.264 -0.514 1
1 1549 . 32 1 1 A 131 131 ALA N N 130 119.788 121.779 -1.991 1
1 1550 . 32 1 1 A 132 132 GLU H H 131 7.622 7.539 0.083 1
1 1551 . 32 1 1 A 132 132 GLU HA H 131 3.862 4.090 -0.228 1
1 1556 . 32 1 1 A 132 132 GLU C C 131 179.528 178.003 1.525 1
1 1557 . 32 1 1 A 132 132 GLU CA C 131 58.849 58.451 0.398 1
1 1558 . 32 1 1 A 132 132 GLU CB C 131 28.930 29.136 -0.206 1
1 1560 . 32 1 1 A 132 132 GLU N N 131 118.428 117.959 0.469 1
1 1561 . 32 1 1 A 133 133 LYS H H 132 7.853 7.485 0.368 1
1 1562 . 32 1 1 A 133 133 LYS HA H 132 3.722 4.100 -0.378 1
1 1571 . 32 1 1 A 133 133 LYS C C 132 175.725 178.804 -3.079 1
1 1572 . 32 1 1 A 133 133 LYS CA C 132 57.544 58.604 -1.060 1
1 1573 . 32 1 1 A 133 133 LYS CB C 132 31.770 32.339 -0.569 1
1 1577 . 32 1 1 A 133 133 LYS N N 132 119.473 118.881 0.592 1
1 1578 . 32 1 1 A 134 134 GLU H H 133 8.151 7.539 0.612 1
1 1579 . 32 1 1 A 134 134 GLU HA H 133 4.161 4.225 -0.064 1
1 1584 . 32 1 1 A 134 134 GLU C C 133 177.453 177.244 0.209 1
1 1585 . 32 1 1 A 134 134 GLU CA C 133 57.222 56.555 0.667 1
1 1586 . 32 1 1 A 134 134 GLU CB C 133 30.091 29.758 0.333 1
1 1588 . 32 1 1 A 134 134 GLU N N 133 116.525 117.623 -1.098 1
1 1589 . 32 1 1 A 135 135 GLY H H 134 7.702 8.573 -0.871 1
1 1590 . 32 1 1 A 135 135 GLY HA2 H 134 3.896 3.922 -0.026 1
1 1591 . 32 1 1 A 135 135 GLY HA3 H 134 3.897 3.933 -0.036 1
1 1592 . 32 1 1 A 135 135 GLY C C 134 174.538 173.542 0.996 1
1 1593 . 32 1 1 A 135 135 GLY CA C 134 45.975 46.503 -0.528 1
1 1594 . 32 1 1 A 135 135 GLY N N 134 107.924 109.388 -1.464 1
1 1595 . 32 1 1 A 136 136 ARG H H 135 8.045 7.690 0.355 1
1 1596 . 32 1 1 A 136 136 ARG HA H 135 4.323 4.529 -0.206 1
1 1604 . 32 1 1 A 136 136 ARG C C 135 175.864 175.307 0.557 1
1 1605 . 32 1 1 A 136 136 ARG CA C 135 56.016 55.948 0.068 1
1 1606 . 32 1 1 A 136 136 ARG CB C 135 30.987 33.047 -2.060 1
1 1609 . 32 1 1 A 136 136 ARG N N 135 119.708 119.089 0.619 1
1 1 . 33 1 1 A 14 14 PHE CA C 13 58.199 60.476 -2.277 1
1 2 . 33 1 1 A 14 14 PHE CB C 13 39.717 40.348 -0.631 1
1 3 . 33 1 1 A 15 15 SER H H 14 8.299 7.954 0.345 1
1 4 . 33 1 1 A 15 15 SER HA H 14 4.359 4.253 0.106 1
1 7 . 33 1 1 A 15 15 SER CA C 14 58.249 57.608 0.641 1
1 8 . 33 1 1 A 15 15 SER CB C 14 63.936 63.910 0.026 1
1 9 . 33 1 1 A 15 15 SER N N 14 117.379 112.047 5.332 1
1 10 . 33 1 1 A 16 16 SER H H 15 8.255 8.850 -0.595 1
1 11 . 33 1 1 A 16 16 SER HA H 15 3.729 4.765 -1.036 1
1 14 . 33 1 1 A 16 16 SER CA C 15 58.224 59.197 -0.973 1
1 15 . 33 1 1 A 16 16 SER CB C 15 63.886 65.880 -1.994 1
1 16 . 33 1 1 A 16 16 SER N N 15 117.694 117.068 0.626 1
1 17 . 33 1 1 A 17 17 ALA H H 16 8.333 8.269 0.064 1
1 18 . 33 1 1 A 17 17 ALA HA H 16 4.252 4.297 -0.045 1
1 22 . 33 1 1 A 17 17 ALA CA C 16 53.377 53.844 -0.467 1
1 23 . 33 1 1 A 17 17 ALA CB C 16 18.896 18.358 0.538 1
1 24 . 33 1 1 A 17 17 ALA N N 16 125.462 124.660 0.802 1
1 25 . 33 1 1 A 18 18 SER H H 17 8.219 8.426 -0.207 1
1 26 . 33 1 1 A 18 18 SER HA H 17 4.332 4.689 -0.357 1
1 29 . 33 1 1 A 18 18 SER CA C 17 59.105 57.236 1.869 1
1 30 . 33 1 1 A 18 18 SER CB C 17 63.592 63.877 -0.285 1
1 31 . 33 1 1 A 18 18 SER N N 17 114.821 113.171 1.650 1
1 32 . 33 1 1 A 19 19 ASP H H 18 8.309 8.228 0.081 1
1 33 . 33 1 1 A 19 19 ASP HA H 18 4.554 4.928 -0.374 1
1 36 . 33 1 1 A 19 19 ASP C C 18 176.528 176.589 -0.061 1
1 37 . 33 1 1 A 19 19 ASP CA C 18 55.272 55.459 -0.187 1
1 38 . 33 1 1 A 19 19 ASP CB C 18 40.883 41.012 -0.129 1
1 39 . 33 1 1 A 19 19 ASP N N 18 123.367 120.177 3.190 1
1 40 . 33 1 1 A 20 20 ALA H H 19 8.133 8.658 -0.525 1
1 41 . 33 1 1 A 20 20 ALA HA H 19 4.170 4.128 0.042 1
1 45 . 33 1 1 A 20 20 ALA C C 19 179.857 179.009 0.848 1
1 46 . 33 1 1 A 20 20 ALA CA C 19 54.341 55.565 -1.224 1
1 47 . 33 1 1 A 20 20 ALA CB C 19 18.660 18.392 0.268 1
1 48 . 33 1 1 A 20 20 ALA N N 19 123.350 123.555 -0.205 1
1 49 . 33 1 1 A 21 21 GLU H H 20 8.140 7.996 0.144 1
1 50 . 33 1 1 A 21 21 GLU HA H 20 4.128 4.116 0.012 1
1 55 . 33 1 1 A 21 21 GLU C C 20 177.675 178.716 -1.041 1
1 56 . 33 1 1 A 21 21 GLU CA C 20 58.520 59.407 -0.887 1
1 57 . 33 1 1 A 21 21 GLU CB C 20 29.765 29.407 0.358 1
1 59 . 33 1 1 A 21 21 GLU N N 20 119.063 118.880 0.183 1
1 60 . 33 1 1 A 22 22 PHE H H 21 8.009 8.112 -0.103 1
1 61 . 33 1 1 A 22 22 PHE HA H 21 4.123 4.428 -0.305 1
1 68 . 33 1 1 A 22 22 PHE C C 21 176.410 177.133 -0.723 1
1 69 . 33 1 1 A 22 22 PHE CA C 21 62.202 61.482 0.720 1
1 70 . 33 1 1 A 22 22 PHE CB C 21 39.223 39.480 -0.257 1
1 75 . 33 1 1 A 22 22 PHE N N 21 121.211 120.965 0.246 1
1 76 . 33 1 1 A 23 23 ASP H H 22 8.261 8.406 -0.145 1
1 77 . 33 1 1 A 23 23 ASP HA H 22 4.041 4.318 -0.277 1
1 80 . 33 1 1 A 23 23 ASP C C 22 179.078 178.701 0.377 1
1 81 . 33 1 1 A 23 23 ASP CA C 22 57.048 57.382 -0.334 1
1 82 . 33 1 1 A 23 23 ASP CB C 22 40.154 40.100 0.054 1
1 83 . 33 1 1 A 23 23 ASP N N 22 116.876 118.624 -1.748 1
1 84 . 33 1 1 A 24 24 ALA H H 23 7.651 7.623 0.028 1
1 85 . 33 1 1 A 24 24 ALA HA H 23 3.785 3.972 -0.187 1
1 89 . 33 1 1 A 24 24 ALA C C 23 179.577 179.581 -0.004 1
1 90 . 33 1 1 A 24 24 ALA CA C 23 54.341 55.105 -0.764 1
1 91 . 33 1 1 A 24 24 ALA CB C 23 17.762 18.389 -0.627 1
1 92 . 33 1 1 A 24 24 ALA N N 23 121.873 123.133 -1.260 1
1 93 . 33 1 1 A 25 25 VAL H H 24 7.718 7.970 -0.252 1
1 94 . 33 1 1 A 25 25 VAL HA H 24 3.216 3.493 -0.277 1
1 102 . 33 1 1 A 25 25 VAL C C 24 177.805 178.261 -0.456 1
1 103 . 33 1 1 A 25 25 VAL CA C 24 66.789 66.743 0.046 1
1 104 . 33 1 1 A 25 25 VAL CB C 24 31.277 31.149 0.128 1
1 107 . 33 1 1 A 25 25 VAL N N 24 117.890 118.165 -0.275 1
1 108 . 33 1 1 A 26 26 VAL H H 25 7.867 7.590 0.277 1
1 109 . 33 1 1 A 26 26 VAL HA H 25 3.274 3.466 -0.192 1
1 117 . 33 1 1 A 26 26 VAL C C 25 177.788 177.868 -0.080 1
1 118 . 33 1 1 A 26 26 VAL CA C 25 67.282 66.407 0.875 1
1 119 . 33 1 1 A 26 26 VAL CB C 25 31.266 31.425 -0.159 1
1 122 . 33 1 1 A 26 26 VAL N N 25 118.170 119.823 -1.653 1
1 123 . 33 1 1 A 27 27 GLY H H 26 7.544 7.576 -0.032 1
1 124 . 33 1 1 A 27 27 GLY HA2 H 26 3.592 3.490 0.102 1
1 125 . 33 1 1 A 27 27 GLY HA3 H 26 3.721 3.607 0.114 1
1 126 . 33 1 1 A 27 27 GLY C C 26 176.717 176.546 0.171 1
1 127 . 33 1 1 A 27 27 GLY CA C 26 47.085 47.185 -0.100 1
1 128 . 33 1 1 A 27 27 GLY N N 26 105.795 107.412 -1.617 1
1 129 . 33 1 1 A 28 28 TYR H H 27 7.625 7.442 0.183 1
1 130 . 33 1 1 A 28 28 TYR HA H 27 4.546 4.575 -0.029 1
1 137 . 33 1 1 A 28 28 TYR C C 27 178.991 178.105 0.886 1
1 138 . 33 1 1 A 28 28 TYR CA C 27 58.845 59.653 -0.808 1
1 139 . 33 1 1 A 28 28 TYR CB C 27 37.602 37.582 0.020 1
1 144 . 33 1 1 A 28 28 TYR N N 27 119.933 121.899 -1.966 1
1 145 . 33 1 1 A 29 29 LEU H H 28 8.517 8.346 0.171 1
1 146 . 33 1 1 A 29 29 LEU HA H 28 3.728 3.795 -0.067 1
1 156 . 33 1 1 A 29 29 LEU CA C 28 58.281 58.123 0.158 1
1 157 . 33 1 1 A 29 29 LEU CB C 28 41.948 41.367 0.581 1
1 161 . 33 1 1 A 29 29 LEU N N 28 119.669 120.318 -0.649 1
1 162 . 33 1 1 A 30 30 GLU H H 29 8.072 7.926 0.146 1
1 163 . 33 1 1 A 30 30 GLU HA H 29 3.722 3.844 -0.122 1
1 168 . 33 1 1 A 30 30 GLU C C 29 177.731 178.963 -1.232 1
1 169 . 33 1 1 A 30 30 GLU CA C 29 59.763 59.969 -0.206 1
1 170 . 33 1 1 A 30 30 GLU CB C 29 28.844 29.346 -0.502 1
1 172 . 33 1 1 A 30 30 GLU N N 29 117.666 117.577 0.089 1
1 173 . 33 1 1 A 31 31 ASP H H 30 7.243 7.995 -0.752 1
1 174 . 33 1 1 A 31 31 ASP HA H 30 4.297 4.362 -0.065 1
1 177 . 33 1 1 A 31 31 ASP CA C 30 56.953 57.341 -0.388 1
1 178 . 33 1 1 A 31 31 ASP CB C 30 40.730 42.205 -1.475 1
1 179 . 33 1 1 A 31 31 ASP N N 30 116.720 119.038 -2.318 1
1 180 . 33 1 1 A 32 32 ILE H H 31 7.940 7.494 0.446 1
1 181 . 33 1 1 A 32 32 ILE HA H 31 3.640 3.678 -0.038 1
1 191 . 33 1 1 A 32 32 ILE C C 31 177.980 178.012 -0.032 1
1 192 . 33 1 1 A 32 32 ILE CA C 31 64.692 64.264 0.428 1
1 193 . 33 1 1 A 32 32 ILE CB C 31 38.938 37.216 1.722 1
1 197 . 33 1 1 A 32 32 ILE N N 31 119.728 118.866 0.862 1
1 198 . 33 1 1 A 33 33 ILE H H 32 7.984 7.706 0.278 1
1 199 . 33 1 1 A 33 33 ILE HA H 32 3.598 3.261 0.337 1
1 209 . 33 1 1 A 33 33 ILE C C 32 176.723 176.965 -0.242 1
1 210 . 33 1 1 A 33 33 ILE CA C 32 63.241 64.669 -1.428 1
1 211 . 33 1 1 A 33 33 ILE CB C 32 37.580 37.990 -0.410 1
1 215 . 33 1 1 A 33 33 ILE N N 32 113.919 120.550 -6.631 1
1 216 . 33 1 1 A 34 34 MET H H 33 7.288 7.529 -0.241 1
1 217 . 33 1 1 A 34 34 MET HA H 33 4.496 4.690 -0.194 1
1 225 . 33 1 1 A 34 34 MET C C 33 176.423 175.726 0.697 1
1 226 . 33 1 1 A 34 34 MET CA C 33 54.634 54.188 0.446 1
1 227 . 33 1 1 A 34 34 MET CB C 33 31.934 32.290 -0.356 1
1 230 . 33 1 1 A 34 34 MET N N 33 115.130 116.886 -1.756 1
1 231 . 33 1 1 A 35 35 ASP H H 34 7.405 7.773 -0.368 1
1 232 . 33 1 1 A 35 35 ASP HA H 34 4.484 4.711 -0.227 1
1 235 . 33 1 1 A 35 35 ASP C C 34 177.139 176.594 0.545 1
1 236 . 33 1 1 A 35 35 ASP CA C 34 54.625 54.273 0.352 1
1 237 . 33 1 1 A 35 35 ASP CB C 34 43.554 43.043 0.511 1
1 238 . 33 1 1 A 35 35 ASP N N 34 121.814 122.702 -0.888 1
1 239 . 33 1 1 A 36 36 ASP H H 35 8.765 8.868 -0.103 1
1 240 . 33 1 1 A 36 36 ASP HA H 35 4.235 4.320 -0.085 1
1 243 . 33 1 1 A 36 36 ASP C C 35 178.320 178.439 -0.119 1
1 244 . 33 1 1 A 36 36 ASP CA C 35 57.832 57.990 -0.158 1
1 245 . 33 1 1 A 36 36 ASP CB C 35 40.914 40.347 0.567 1
1 246 . 33 1 1 A 36 36 ASP N N 35 125.883 125.311 0.572 1
1 247 . 33 1 1 A 37 37 GLU H H 36 8.905 8.350 0.555 1
1 248 . 33 1 1 A 37 37 GLU HA H 36 3.933 4.027 -0.094 1
1 253 . 33 1 1 A 37 37 GLU C C 36 179.304 179.058 0.246 1
1 254 . 33 1 1 A 37 37 GLU CA C 36 59.828 59.246 0.582 1
1 255 . 33 1 1 A 37 37 GLU CB C 36 29.380 29.414 -0.034 1
1 257 . 33 1 1 A 37 37 GLU N N 36 119.077 120.462 -1.385 1
1 258 . 33 1 1 A 38 38 PHE H H 37 7.460 8.117 -0.657 1
1 259 . 33 1 1 A 38 38 PHE HA H 37 3.642 4.049 -0.407 1
1 267 . 33 1 1 A 38 38 PHE C C 37 176.483 178.103 -1.620 1
1 268 . 33 1 1 A 38 38 PHE CA C 37 61.411 61.208 0.203 1
1 269 . 33 1 1 A 38 38 PHE CB C 37 39.355 39.189 0.166 1
1 275 . 33 1 1 A 38 38 PHE N N 37 119.968 120.604 -0.636 1
1 276 . 33 1 1 A 39 39 GLN H H 38 7.968 8.013 -0.045 1
1 277 . 33 1 1 A 39 39 GLN HA H 38 3.712 3.840 -0.128 1
1 284 . 33 1 1 A 39 39 GLN CA C 38 59.153 58.706 0.447 1
1 285 . 33 1 1 A 39 39 GLN CB C 38 28.213 28.374 -0.161 1
1 287 . 33 1 1 A 39 39 GLN N N 38 116.433 118.440 -2.007 1
1 289 . 33 1 1 A 40 40 LEU H H 39 7.930 7.502 0.428 1
1 290 . 33 1 1 A 40 40 LEU HA H 39 3.916 4.032 -0.116 1
1 300 . 33 1 1 A 40 40 LEU C C 39 177.731 177.993 -0.262 1
1 301 . 33 1 1 A 40 40 LEU CA C 39 57.915 57.976 -0.061 1
1 302 . 33 1 1 A 40 40 LEU CB C 39 41.989 41.648 0.341 1
1 306 . 33 1 1 A 40 40 LEU N N 39 119.505 121.562 -2.057 1
1 307 . 33 1 1 A 41 41 LEU H H 40 7.174 7.733 -0.559 1
1 308 . 33 1 1 A 41 41 LEU HA H 40 3.835 3.974 -0.139 1
1 318 . 33 1 1 A 41 41 LEU C C 40 179.738 178.245 1.493 1
1 319 . 33 1 1 A 41 41 LEU CA C 40 58.266 58.250 0.016 1
1 320 . 33 1 1 A 41 41 LEU CB C 40 42.050 41.499 0.551 1
1 324 . 33 1 1 A 41 41 LEU N N 40 120.971 119.757 1.214 1
1 325 . 33 1 1 A 42 42 GLN H H 41 8.058 7.805 0.253 1
1 326 . 33 1 1 A 42 42 GLN HA H 41 3.556 3.726 -0.170 1
1 333 . 33 1 1 A 42 42 GLN C C 41 177.642 178.425 -0.783 1
1 334 . 33 1 1 A 42 42 GLN CA C 41 59.826 59.191 0.635 1
1 335 . 33 1 1 A 42 42 GLN CB C 41 28.762 27.945 0.817 1
1 337 . 33 1 1 A 42 42 GLN N N 41 117.899 117.723 0.176 1
1 339 . 33 1 1 A 43 43 ARG H H 42 8.179 7.851 0.328 1
1 340 . 33 1 1 A 43 43 ARG HA H 42 3.655 3.970 -0.315 1
1 347 . 33 1 1 A 43 43 ARG C C 42 178.051 178.351 -0.300 1
1 348 . 33 1 1 A 43 43 ARG CA C 42 59.766 58.927 0.839 1
1 349 . 33 1 1 A 43 43 ARG CB C 42 29.941 29.633 0.308 1
1 352 . 33 1 1 A 43 43 ARG N N 42 119.392 119.546 -0.154 1
1 353 . 33 1 1 A 44 44 ASN H H 43 8.525 8.100 0.425 1
1 354 . 33 1 1 A 44 44 ASN HA H 43 4.332 4.379 -0.047 1
1 359 . 33 1 1 A 44 44 ASN C C 43 178.150 177.845 0.305 1
1 360 . 33 1 1 A 44 44 ASN CA C 43 55.841 56.196 -0.355 1
1 361 . 33 1 1 A 44 44 ASN CB C 43 37.632 39.365 -1.733 1
1 362 . 33 1 1 A 44 44 ASN N N 43 116.214 117.656 -1.442 1
1 364 . 33 1 1 A 45 45 PHE H H 44 7.586 7.921 -0.335 1
1 365 . 33 1 1 A 45 45 PHE HA H 44 4.132 4.293 -0.161 1
1 372 . 33 1 1 A 45 45 PHE C C 44 176.691 178.572 -1.881 1
1 373 . 33 1 1 A 45 45 PHE CA C 44 62.333 60.560 1.773 1
1 374 . 33 1 1 A 45 45 PHE CB C 44 39.449 38.799 0.650 1
1 379 . 33 1 1 A 45 45 PHE N N 44 121.501 117.786 3.715 1
1 380 . 33 1 1 A 46 46 MET H H 45 8.190 8.461 -0.271 1
1 381 . 33 1 1 A 46 46 MET HA H 45 4.060 4.306 -0.246 1
1 389 . 33 1 1 A 46 46 MET C C 45 179.754 178.171 1.583 1
1 390 . 33 1 1 A 46 46 MET CA C 45 57.742 57.762 -0.020 1
1 391 . 33 1 1 A 46 46 MET CB C 45 29.912 31.143 -1.231 1
1 394 . 33 1 1 A 46 46 MET N N 45 116.727 117.572 -0.845 1
1 395 . 33 1 1 A 47 47 ASP H H 46 8.579 8.269 0.310 1
1 396 . 33 1 1 A 47 47 ASP HA H 46 4.804 4.556 0.248 1
1 399 . 33 1 1 A 47 47 ASP C C 46 177.854 178.399 -0.545 1
1 400 . 33 1 1 A 47 47 ASP CA C 46 57.277 57.233 0.044 1
1 401 . 33 1 1 A 47 47 ASP CB C 46 40.776 41.764 -0.988 1
1 402 . 33 1 1 A 47 47 ASP N N 46 117.798 120.855 -3.057 1
1 403 . 33 1 1 A 48 48 LYS H H 47 7.339 7.861 -0.522 1
1 404 . 33 1 1 A 48 48 LYS HA H 47 3.828 4.247 -0.419 1
1 413 . 33 1 1 A 48 48 LYS C C 47 178.812 178.686 0.126 1
1 414 . 33 1 1 A 48 48 LYS CA C 47 58.953 58.563 0.390 1
1 415 . 33 1 1 A 48 48 LYS CB C 47 32.796 32.980 -0.184 1
1 419 . 33 1 1 A 48 48 LYS N N 47 117.852 119.690 -1.838 1
1 420 . 33 1 1 A 49 49 TYR H H 48 6.841 8.596 -1.755 1
1 421 . 33 1 1 A 49 49 TYR HA H 48 4.995 4.330 0.665 1
1 428 . 33 1 1 A 49 49 TYR C C 48 178.138 178.125 0.013 1
1 429 . 33 1 1 A 49 49 TYR CA C 48 58.620 59.862 -1.242 1
1 430 . 33 1 1 A 49 49 TYR CB C 48 42.939 38.279 4.660 1
1 435 . 33 1 1 A 49 49 TYR N N 48 112.109 119.609 -7.500 1
1 436 . 33 1 1 A 50 50 TYR H H 49 8.491 8.181 0.310 1
1 437 . 33 1 1 A 50 50 TYR HA H 49 4.598 4.069 0.529 1
1 444 . 33 1 1 A 50 50 TYR C C 49 176.015 176.760 -0.745 1
1 445 . 33 1 1 A 50 50 TYR CA C 49 62.442 60.146 2.296 1
1 446 . 33 1 1 A 50 50 TYR CB C 49 36.588 37.686 -1.098 1
1 451 . 33 1 1 A 50 50 TYR N N 49 118.294 119.416 -1.122 1
1 452 . 33 1 1 A 51 51 LEU H H 50 7.512 7.288 0.224 1
1 453 . 33 1 1 A 51 51 LEU HA H 50 3.878 3.526 0.352 1
1 463 . 33 1 1 A 51 51 LEU C C 50 178.625 178.487 0.138 1
1 464 . 33 1 1 A 51 51 LEU CA C 50 55.994 57.351 -1.357 1
1 465 . 33 1 1 A 51 51 LEU CB C 50 40.743 41.047 -0.304 1
1 469 . 33 1 1 A 51 51 LEU N N 50 118.478 118.936 -0.458 1
1 470 . 33 1 1 A 52 52 GLU H H 51 8.042 7.831 0.211 1
1 471 . 33 1 1 A 52 52 GLU HA H 51 4.197 4.004 0.193 1
1 476 . 33 1 1 A 52 52 GLU C C 51 177.629 177.083 0.546 1
1 477 . 33 1 1 A 52 52 GLU CA C 51 56.141 58.954 -2.813 1
1 478 . 33 1 1 A 52 52 GLU CB C 51 29.162 30.266 -1.104 1
1 480 . 33 1 1 A 52 52 GLU N N 51 115.067 119.121 -4.054 1
1 481 . 33 1 1 A 53 53 PHE H H 52 7.465 8.342 -0.877 1
1 482 . 33 1 1 A 53 53 PHE HA H 52 4.431 4.645 -0.214 1
1 490 . 33 1 1 A 53 53 PHE C C 52 174.325 174.868 -0.543 1
1 491 . 33 1 1 A 53 53 PHE CA C 52 58.986 56.915 2.071 1
1 492 . 33 1 1 A 53 53 PHE CB C 52 40.183 37.218 2.965 1
1 498 . 33 1 1 A 53 53 PHE N N 52 116.768 117.450 -0.682 1
1 499 . 33 1 1 A 54 54 GLU H H 53 7.484 8.433 -0.949 1
1 500 . 33 1 1 A 54 54 GLU HA H 53 4.583 4.783 -0.200 1
1 505 . 33 1 1 A 54 54 GLU C C 53 175.722 175.718 0.004 1
1 506 . 33 1 1 A 54 54 GLU CA C 53 54.248 55.320 -1.072 1
1 507 . 33 1 1 A 54 54 GLU CB C 53 34.409 31.413 2.996 1
1 509 . 33 1 1 A 54 54 GLU N N 53 118.844 125.326 -6.482 1
1 510 . 33 1 1 A 55 55 ASP H H 54 9.008 8.585 0.423 1
1 511 . 33 1 1 A 55 55 ASP HA H 54 4.735 4.792 -0.057 1
1 514 . 33 1 1 A 55 55 ASP C C 54 175.421 176.070 -0.649 1
1 515 . 33 1 1 A 55 55 ASP CA C 54 52.888 54.010 -1.122 1
1 516 . 33 1 1 A 55 55 ASP CB C 54 38.894 40.642 -1.748 1
1 517 . 33 1 1 A 55 55 ASP N N 54 123.654 125.078 -1.424 1
1 518 . 33 1 1 A 56 56 THR H H 55 7.819 8.276 -0.457 1
1 519 . 33 1 1 A 56 56 THR HA H 55 4.574 4.914 -0.340 1
1 524 . 33 1 1 A 56 56 THR C C 55 174.096 174.631 -0.535 1
1 525 . 33 1 1 A 56 56 THR CA C 55 59.172 59.576 -0.404 1
1 526 . 33 1 1 A 56 56 THR CB C 55 71.889 72.301 -0.412 1
1 528 . 33 1 1 A 56 56 THR N N 55 112.015 114.492 -2.477 1
1 529 . 33 1 1 A 57 57 GLU H H 56 8.527 8.828 -0.301 1
1 530 . 33 1 1 A 57 57 GLU HA H 56 4.217 4.415 -0.198 1
1 535 . 33 1 1 A 57 57 GLU C C 56 177.042 176.509 0.533 1
1 536 . 33 1 1 A 57 57 GLU CA C 56 56.869 57.588 -0.719 1
1 537 . 33 1 1 A 57 57 GLU CB C 56 29.731 30.914 -1.183 1
1 539 . 33 1 1 A 57 57 GLU N N 56 117.531 118.859 -1.328 1
1 540 . 33 1 1 A 58 58 GLU H H 57 7.587 7.732 -0.145 1
1 541 . 33 1 1 A 58 58 GLU HA H 57 3.941 4.523 -0.582 1
1 546 . 33 1 1 A 58 58 GLU C C 57 176.849 176.054 0.795 1
1 547 . 33 1 1 A 58 58 GLU CA C 57 56.924 56.245 0.679 1
1 548 . 33 1 1 A 58 58 GLU CB C 57 30.251 30.470 -0.219 1
1 550 . 33 1 1 A 58 58 GLU N N 57 119.183 120.176 -0.993 1
1 551 . 33 1 1 A 59 59 ASN H H 58 9.120 8.824 0.296 1
1 552 . 33 1 1 A 59 59 ASN HA H 58 4.922 5.278 -0.356 1
1 557 . 33 1 1 A 59 59 ASN C C 58 174.254 174.784 -0.530 1
1 558 . 33 1 1 A 59 59 ASN CA C 58 51.956 52.778 -0.822 1
1 559 . 33 1 1 A 59 59 ASN CB C 58 37.404 39.810 -2.406 1
1 560 . 33 1 1 A 59 59 ASN N N 58 126.767 124.279 2.488 1
1 562 . 33 1 1 A 60 60 LYS H H 59 5.892 9.218 -3.326 1
1 563 . 33 1 1 A 60 60 LYS HA H 59 3.798 4.484 -0.686 1
1 572 . 33 1 1 A 60 60 LYS C C 59 177.908 177.813 0.095 1
1 573 . 33 1 1 A 60 60 LYS CA C 59 56.623 54.929 1.694 1
1 574 . 33 1 1 A 60 60 LYS CB C 59 32.279 33.871 -1.592 1
1 578 . 33 1 1 A 60 60 LYS N N 59 121.527 123.105 -1.578 1
1 579 . 33 1 1 A 61 61 LEU H H 60 8.473 8.843 -0.370 1
1 580 . 33 1 1 A 61 61 LEU HA H 60 3.891 4.263 -0.372 1
1 590 . 33 1 1 A 61 61 LEU C C 60 179.843 177.861 1.982 1
1 591 . 33 1 1 A 61 61 LEU CA C 60 58.301 56.925 1.376 1
1 592 . 33 1 1 A 61 61 LEU CB C 60 41.305 42.116 -0.811 1
1 596 . 33 1 1 A 61 61 LEU N N 60 125.639 125.510 0.129 1
1 597 . 33 1 1 A 62 62 ILE H H 61 7.698 7.632 0.066 1
1 598 . 33 1 1 A 62 62 ILE HA H 61 3.952 3.852 0.100 1
1 608 . 33 1 1 A 62 62 ILE C C 61 175.392 177.148 -1.756 1
1 609 . 33 1 1 A 62 62 ILE CA C 61 61.743 63.358 -1.615 1
1 610 . 33 1 1 A 62 62 ILE CB C 61 39.108 37.717 1.391 1
1 614 . 33 1 1 A 62 62 ILE N N 61 114.111 118.775 -4.664 1
1 615 . 33 1 1 A 63 63 TYR H H 62 7.273 7.540 -0.267 1
1 616 . 33 1 1 A 63 63 TYR HA H 62 4.343 4.189 0.154 1
1 623 . 33 1 1 A 63 63 TYR C C 62 178.264 178.552 -0.288 1
1 624 . 33 1 1 A 63 63 TYR CA C 62 57.231 60.920 -3.689 1
1 625 . 33 1 1 A 63 63 TYR CB C 62 36.332 37.391 -1.059 1
1 630 . 33 1 1 A 63 63 TYR N N 62 117.689 121.272 -3.583 1
1 631 . 33 1 1 A 64 64 THR H H 63 7.747 8.088 -0.341 1
1 632 . 33 1 1 A 64 64 THR HA H 63 4.266 4.226 0.040 1
1 637 . 33 1 1 A 64 64 THR CA C 63 69.362 67.575 1.787 1
1 638 . 33 1 1 A 64 64 THR CB C 63 66.962 67.406 -0.444 1
1 640 . 33 1 1 A 64 64 THR N N 63 113.755 116.092 -2.337 1
1 641 . 33 1 1 A 65 65 PRO HA H 64 4.372 4.388 -0.016 1
1 648 . 33 1 1 A 65 65 PRO C C 64 179.913 179.479 0.434 1
1 649 . 33 1 1 A 65 65 PRO CA C 64 66.011 66.228 -0.217 1
1 650 . 33 1 1 A 65 65 PRO CB C 64 30.642 30.652 -0.010 1
1 653 . 33 1 1 A 66 66 ILE H H 65 7.377 7.391 -0.014 1
1 654 . 33 1 1 A 66 66 ILE HA H 65 3.530 3.971 -0.441 1
1 664 . 33 1 1 A 66 66 ILE C C 65 177.543 178.417 -0.874 1
1 665 . 33 1 1 A 66 66 ILE CA C 65 66.647 64.257 2.390 1
1 666 . 33 1 1 A 66 66 ILE CB C 65 38.029 37.782 0.247 1
1 670 . 33 1 1 A 66 66 ILE N N 65 118.353 116.656 1.697 1
1 671 . 33 1 1 A 67 67 PHE H H 66 8.480 8.516 -0.036 1
1 672 . 33 1 1 A 67 67 PHE HA H 66 4.115 4.457 -0.342 1
1 680 . 33 1 1 A 67 67 PHE C C 66 177.293 178.057 -0.764 1
1 681 . 33 1 1 A 67 67 PHE CA C 66 59.570 62.143 -2.573 1
1 682 . 33 1 1 A 67 67 PHE CB C 66 38.865 39.574 -0.709 1
1 688 . 33 1 1 A 67 67 PHE N N 66 122.420 121.004 1.416 1
1 689 . 33 1 1 A 68 68 ASN H H 67 8.595 8.142 0.453 1
1 690 . 33 1 1 A 68 68 ASN HA H 67 4.211 4.355 -0.144 1
1 695 . 33 1 1 A 68 68 ASN C C 67 178.697 178.043 0.654 1
1 696 . 33 1 1 A 68 68 ASN CA C 67 56.056 56.385 -0.329 1
1 697 . 33 1 1 A 68 68 ASN CB C 67 37.704 37.947 -0.243 1
1 698 . 33 1 1 A 68 68 ASN N N 67 115.573 117.312 -1.739 1
1 700 . 33 1 1 A 69 69 GLU H H 68 8.414 8.023 0.391 1
1 701 . 33 1 1 A 69 69 GLU HA H 68 4.102 4.140 -0.038 1
1 706 . 33 1 1 A 69 69 GLU C C 68 177.880 178.624 -0.744 1
1 707 . 33 1 1 A 69 69 GLU CA C 68 59.399 59.502 -0.103 1
1 708 . 33 1 1 A 69 69 GLU CB C 68 29.855 29.743 0.112 1
1 710 . 33 1 1 A 69 69 GLU N N 68 123.510 120.048 3.462 1
1 711 . 33 1 1 A 70 70 TYR H H 69 8.659 8.151 0.508 1
1 712 . 33 1 1 A 70 70 TYR HA H 69 3.362 3.963 -0.601 1
1 719 . 33 1 1 A 70 70 TYR C C 69 178.143 177.208 0.935 1
1 720 . 33 1 1 A 70 70 TYR CA C 69 60.686 60.868 -0.182 1
1 721 . 33 1 1 A 70 70 TYR CB C 69 38.560 38.703 -0.143 1
1 726 . 33 1 1 A 70 70 TYR N N 69 122.130 120.514 1.616 1
1 727 . 33 1 1 A 71 71 ILE H H 70 8.031 7.568 0.463 1
1 728 . 33 1 1 A 71 71 ILE HA H 70 3.265 3.605 -0.340 1
1 738 . 33 1 1 A 71 71 ILE C C 70 178.056 178.117 -0.061 1
1 739 . 33 1 1 A 71 71 ILE CA C 70 63.756 64.334 -0.578 1
1 740 . 33 1 1 A 71 71 ILE CB C 70 37.321 37.448 -0.127 1
1 744 . 33 1 1 A 71 71 ILE N N 70 118.906 120.814 -1.908 1
1 745 . 33 1 1 A 72 72 SER H H 71 7.803 8.037 -0.234 1
1 746 . 33 1 1 A 72 72 SER HA H 71 4.029 4.165 -0.136 1
1 749 . 33 1 1 A 72 72 SER CA C 71 61.380 60.891 0.489 1
1 750 . 33 1 1 A 72 72 SER CB C 71 63.288 63.292 -0.004 1
1 751 . 33 1 1 A 72 72 SER N N 71 113.735 115.324 -1.589 1
1 752 . 33 1 1 A 73 73 LEU H H 72 7.952 7.696 0.256 1
1 753 . 33 1 1 A 73 73 LEU HA H 72 4.418 4.115 0.303 1
1 763 . 33 1 1 A 73 73 LEU C C 72 177.767 178.066 -0.299 1
1 764 . 33 1 1 A 73 73 LEU CA C 72 56.543 57.418 -0.875 1
1 765 . 33 1 1 A 73 73 LEU CB C 72 44.517 41.695 2.822 1
1 769 . 33 1 1 A 73 73 LEU N N 72 119.411 122.335 -2.924 1
1 770 . 33 1 1 A 74 74 VAL H H 73 8.021 7.704 0.317 1
1 771 . 33 1 1 A 74 74 VAL HA H 73 3.532 3.293 0.239 1
1 779 . 33 1 1 A 74 74 VAL C C 73 177.126 177.874 -0.748 1
1 780 . 33 1 1 A 74 74 VAL CA C 73 66.250 66.269 -0.019 1
1 781 . 33 1 1 A 74 74 VAL CB C 73 31.212 31.041 0.171 1
1 784 . 33 1 1 A 74 74 VAL N N 73 118.747 119.063 -0.316 1
1 785 . 33 1 1 A 75 75 GLU H H 74 7.232 7.928 -0.696 1
1 786 . 33 1 1 A 75 75 GLU HA H 74 3.013 4.199 -1.186 1
1 791 . 33 1 1 A 75 75 GLU C C 74 178.804 179.123 -0.319 1
1 792 . 33 1 1 A 75 75 GLU CA C 74 60.536 59.943 0.593 1
1 793 . 33 1 1 A 75 75 GLU CB C 74 27.009 29.068 -2.059 1
1 795 . 33 1 1 A 75 75 GLU N N 74 118.660 119.751 -1.091 1
1 796 . 33 1 1 A 76 76 LYS H H 75 7.051 7.855 -0.804 1
1 797 . 33 1 1 A 76 76 LYS HA H 75 3.765 3.994 -0.229 1
1 806 . 33 1 1 A 76 76 LYS C C 75 177.765 178.496 -0.731 1
1 807 . 33 1 1 A 76 76 LYS CA C 75 58.357 58.971 -0.614 1
1 808 . 33 1 1 A 76 76 LYS CB C 75 31.939 31.934 0.005 1
1 812 . 33 1 1 A 76 76 LYS N N 75 116.112 119.643 -3.531 1
1 813 . 33 1 1 A 77 77 TYR H H 76 7.067 7.648 -0.581 1
1 814 . 33 1 1 A 77 77 TYR HA H 76 4.036 4.163 -0.127 1
1 821 . 33 1 1 A 77 77 TYR C C 76 177.752 177.225 0.527 1
1 822 . 33 1 1 A 77 77 TYR CA C 76 61.820 61.366 0.454 1
1 823 . 33 1 1 A 77 77 TYR CB C 76 38.480 38.700 -0.220 1
1 828 . 33 1 1 A 77 77 TYR N N 76 118.434 120.768 -2.334 1
1 829 . 33 1 1 A 78 78 ILE H H 77 7.554 8.345 -0.791 1
1 830 . 33 1 1 A 78 78 ILE HA H 77 3.159 3.559 -0.400 1
1 840 . 33 1 1 A 78 78 ILE C C 77 177.341 177.978 -0.637 1
1 841 . 33 1 1 A 78 78 ILE CA C 77 65.177 65.373 -0.196 1
1 842 . 33 1 1 A 78 78 ILE CB C 77 37.339 38.002 -0.663 1
1 846 . 33 1 1 A 78 78 ILE N N 77 117.672 121.660 -3.988 1
1 847 . 33 1 1 A 79 79 GLU H H 78 8.296 7.902 0.394 1
1 848 . 33 1 1 A 79 79 GLU HA H 78 3.557 3.863 -0.306 1
1 853 . 33 1 1 A 79 79 GLU C C 78 177.742 179.013 -1.271 1
1 854 . 33 1 1 A 79 79 GLU CA C 78 60.847 59.917 0.930 1
1 855 . 33 1 1 A 79 79 GLU CB C 78 29.594 29.040 0.554 1
1 857 . 33 1 1 A 79 79 GLU N N 78 118.701 120.659 -1.958 1
1 858 . 33 1 1 A 80 80 GLU H H 79 8.330 8.332 -0.002 1
1 859 . 33 1 1 A 80 80 GLU HA H 79 3.774 4.040 -0.266 1
1 864 . 33 1 1 A 80 80 GLU C C 79 179.926 179.109 0.817 1
1 865 . 33 1 1 A 80 80 GLU CA C 79 59.581 58.935 0.646 1
1 866 . 33 1 1 A 80 80 GLU CB C 79 29.062 29.311 -0.249 1
1 868 . 33 1 1 A 80 80 GLU N N 79 116.767 118.660 -1.893 1
1 869 . 33 1 1 A 81 81 GLN H H 80 7.634 7.828 -0.194 1
1 870 . 33 1 1 A 81 81 GLN HA H 80 3.605 3.725 -0.120 1
1 877 . 33 1 1 A 81 81 GLN C C 80 179.681 178.949 0.732 1
1 878 . 33 1 1 A 81 81 GLN CA C 80 57.765 58.557 -0.792 1
1 879 . 33 1 1 A 81 81 GLN CB C 80 28.079 27.722 0.357 1
1 881 . 33 1 1 A 81 81 GLN N N 80 116.325 118.779 -2.454 1
1 883 . 33 1 1 A 82 82 LEU H H 81 8.156 7.539 0.617 1
1 884 . 33 1 1 A 82 82 LEU HA H 81 3.536 3.736 -0.200 1
1 894 . 33 1 1 A 82 82 LEU C C 81 178.945 179.498 -0.553 1
1 895 . 33 1 1 A 82 82 LEU CA C 81 57.761 57.217 0.544 1
1 896 . 33 1 1 A 82 82 LEU CB C 81 40.961 40.679 0.282 1
1 900 . 33 1 1 A 82 82 LEU N N 81 121.546 119.933 1.613 1
1 901 . 33 1 1 A 83 83 LEU H H 82 8.326 7.974 0.352 1
1 902 . 33 1 1 A 83 83 LEU HA H 82 4.198 4.142 0.056 1
1 912 . 33 1 1 A 83 83 LEU C C 82 178.631 179.332 -0.701 1
1 913 . 33 1 1 A 83 83 LEU CA C 82 57.016 57.168 -0.152 1
1 914 . 33 1 1 A 83 83 LEU CB C 82 42.182 40.922 1.260 1
1 918 . 33 1 1 A 83 83 LEU N N 82 120.426 119.764 0.662 1
1 919 . 33 1 1 A 84 84 GLN H H 83 6.992 7.558 -0.566 1
1 920 . 33 1 1 A 84 84 GLN HA H 83 3.877 4.014 -0.137 1
1 927 . 33 1 1 A 84 84 GLN C C 83 177.008 176.948 0.060 1
1 928 . 33 1 1 A 84 84 GLN CA C 83 57.543 58.357 -0.814 1
1 929 . 33 1 1 A 84 84 GLN CB C 83 28.688 28.831 -0.143 1
1 931 . 33 1 1 A 84 84 GLN N N 83 114.001 117.598 -3.597 1
1 933 . 33 1 1 A 85 85 ARG H H 84 7.072 7.454 -0.382 1
1 934 . 33 1 1 A 85 85 ARG HA H 84 4.047 4.360 -0.313 1
1 942 . 33 1 1 A 85 85 ARG C C 84 175.999 175.438 0.561 1
1 943 . 33 1 1 A 85 85 ARG CA C 84 56.764 55.769 0.995 1
1 944 . 33 1 1 A 85 85 ARG CB C 84 32.044 32.355 -0.311 1
1 947 . 33 1 1 A 85 85 ARG N N 84 115.827 116.742 -0.915 1
1 949 . 33 1 1 A 86 86 ILE H H 85 8.238 7.771 0.467 1
1 950 . 33 1 1 A 86 86 ILE HA H 85 4.389 4.581 -0.192 1
1 960 . 33 1 1 A 86 86 ILE CA C 85 58.007 57.928 0.079 1
1 961 . 33 1 1 A 86 86 ILE CB C 85 39.604 38.722 0.882 1
1 965 . 33 1 1 A 86 86 ILE N N 85 119.285 119.451 -0.166 1
1 966 . 33 1 1 A 87 87 PRO HA H 86 4.392 4.457 -0.065 1
1 973 . 33 1 1 A 87 87 PRO C C 86 177.622 176.713 0.909 1
1 974 . 33 1 1 A 87 87 PRO CA C 86 64.665 64.306 0.359 1
1 975 . 33 1 1 A 87 87 PRO CB C 86 32.020 31.773 0.247 1
1 978 . 33 1 1 A 88 88 GLU H H 87 8.312 8.168 0.144 1
1 979 . 33 1 1 A 88 88 GLU HA H 87 4.208 4.526 -0.318 1
1 984 . 33 1 1 A 88 88 GLU C C 87 175.554 175.753 -0.199 1
1 985 . 33 1 1 A 88 88 GLU CA C 87 56.045 56.236 -0.191 1
1 986 . 33 1 1 A 88 88 GLU CB C 87 28.654 30.341 -1.687 1
1 988 . 33 1 1 A 88 88 GLU N N 87 114.256 116.891 -2.635 1
1 989 . 33 1 1 A 89 89 PHE H H 88 7.946 7.811 0.135 1
1 990 . 33 1 1 A 89 89 PHE HA H 88 3.993 4.613 -0.620 1
1 998 . 33 1 1 A 89 89 PHE C C 88 173.460 174.746 -1.286 1
1 999 . 33 1 1 A 89 89 PHE CA C 88 60.119 58.806 1.313 1
1 1000 . 33 1 1 A 89 89 PHE CB C 88 39.994 39.933 0.061 1
1 1006 . 33 1 1 A 89 89 PHE N N 88 121.550 123.124 -1.574 1
1 1007 . 33 1 1 A 90 90 ASN H H 89 7.266 7.716 -0.450 1
1 1008 . 33 1 1 A 90 90 ASN HA H 89 4.454 4.906 -0.452 1
1 1013 . 33 1 1 A 90 90 ASN C C 89 173.921 175.030 -1.109 1
1 1014 . 33 1 1 A 90 90 ASN CA C 89 51.839 51.282 0.557 1
1 1015 . 33 1 1 A 90 90 ASN CB C 89 40.674 39.518 1.156 1
1 1016 . 33 1 1 A 90 90 ASN N N 89 125.344 124.919 0.425 1
1 1018 . 33 1 1 A 91 91 MET H H 90 8.968 8.678 0.290 1
1 1019 . 33 1 1 A 91 91 MET HA H 90 4.049 4.197 -0.148 1
1 1027 . 33 1 1 A 91 91 MET C C 90 177.475 177.951 -0.476 1
1 1028 . 33 1 1 A 91 91 MET CA C 90 57.758 58.101 -0.343 1
1 1029 . 33 1 1 A 91 91 MET CB C 90 32.250 32.262 -0.012 1
1 1032 . 33 1 1 A 91 91 MET N N 90 127.052 125.170 1.882 1
1 1033 . 33 1 1 A 92 92 ALA H H 91 8.292 7.710 0.582 1
1 1034 . 33 1 1 A 92 92 ALA HA H 91 4.059 4.107 -0.048 1
1 1038 . 33 1 1 A 92 92 ALA C C 91 180.412 179.650 0.762 1
1 1039 . 33 1 1 A 92 92 ALA CA C 91 55.368 54.951 0.417 1
1 1040 . 33 1 1 A 92 92 ALA CB C 91 17.527 18.321 -0.794 1
1 1041 . 33 1 1 A 92 92 ALA N N 91 123.752 121.404 2.348 1
1 1042 . 33 1 1 A 93 93 ALA H H 92 7.931 7.966 -0.035 1
1 1043 . 33 1 1 A 93 93 ALA HA H 92 4.054 4.060 -0.006 1
1 1047 . 33 1 1 A 93 93 ALA C C 92 180.482 179.860 0.622 1
1 1048 . 33 1 1 A 93 93 ALA CA C 92 54.614 54.897 -0.283 1
1 1049 . 33 1 1 A 93 93 ALA CB C 92 18.098 18.338 -0.240 1
1 1050 . 33 1 1 A 93 93 ALA N N 92 121.158 120.182 0.976 1
1 1051 . 33 1 1 A 94 94 PHE H H 93 8.110 7.900 0.210 1
1 1052 . 33 1 1 A 94 94 PHE HA H 93 4.304 4.073 0.231 1
1 1060 . 33 1 1 A 94 94 PHE C C 93 177.350 177.406 -0.056 1
1 1061 . 33 1 1 A 94 94 PHE CA C 93 61.641 61.454 0.187 1
1 1062 . 33 1 1 A 94 94 PHE CB C 93 40.014 39.240 0.774 1
1 1068 . 33 1 1 A 94 94 PHE N N 93 119.807 120.079 -0.272 1
1 1069 . 33 1 1 A 95 95 THR H H 94 8.726 8.333 0.393 1
1 1070 . 33 1 1 A 95 95 THR HA H 94 3.569 4.055 -0.486 1
1 1075 . 33 1 1 A 95 95 THR C C 94 176.932 176.877 0.055 1
1 1076 . 33 1 1 A 95 95 THR CA C 94 66.833 65.638 1.195 1
1 1077 . 33 1 1 A 95 95 THR CB C 94 68.445 68.364 0.081 1
1 1079 . 33 1 1 A 95 95 THR N N 94 113.074 112.511 0.563 1
1 1080 . 33 1 1 A 96 96 THR H H 95 7.657 7.785 -0.128 1
1 1081 . 33 1 1 A 96 96 THR HA H 95 3.945 4.045 -0.100 1
1 1086 . 33 1 1 A 96 96 THR C C 95 176.386 176.446 -0.060 1
1 1087 . 33 1 1 A 96 96 THR CA C 95 66.550 66.015 0.535 1
1 1088 . 33 1 1 A 96 96 THR CB C 95 68.583 68.783 -0.200 1
1 1090 . 33 1 1 A 96 96 THR N N 95 117.927 117.139 0.788 1
1 1091 . 33 1 1 A 97 97 THR H H 96 7.699 7.838 -0.139 1
1 1092 . 33 1 1 A 97 97 THR HA H 96 3.905 4.011 -0.106 1
1 1097 . 33 1 1 A 97 97 THR C C 96 176.572 176.178 0.394 1
1 1098 . 33 1 1 A 97 97 THR CA C 96 65.979 66.635 -0.656 1
1 1099 . 33 1 1 A 97 97 THR CB C 96 68.553 68.151 0.402 1
1 1101 . 33 1 1 A 97 97 THR N N 96 118.518 116.738 1.780 1
1 1102 . 33 1 1 A 98 98 LEU H H 97 8.304 8.046 0.258 1
1 1103 . 33 1 1 A 98 98 LEU HA H 97 3.725 3.767 -0.042 1
1 1113 . 33 1 1 A 98 98 LEU C C 97 178.490 178.703 -0.213 1
1 1114 . 33 1 1 A 98 98 LEU CA C 97 58.517 58.030 0.487 1
1 1115 . 33 1 1 A 98 98 LEU CB C 97 41.697 41.191 0.506 1
1 1119 . 33 1 1 A 98 98 LEU N N 97 122.882 121.813 1.069 1
1 1120 . 33 1 1 A 99 99 GLN H H 98 7.639 7.869 -0.230 1
1 1121 . 33 1 1 A 99 99 GLN HA H 98 3.927 4.049 -0.122 1
1 1128 . 33 1 1 A 99 99 GLN C C 98 178.068 178.158 -0.090 1
1 1129 . 33 1 1 A 99 99 GLN CA C 98 58.735 58.994 -0.259 1
1 1130 . 33 1 1 A 99 99 GLN CB C 98 27.986 28.254 -0.268 1
1 1132 . 33 1 1 A 99 99 GLN N N 98 114.302 118.235 -3.933 1
1 1134 . 33 1 1 A 100 100 HIS H H 99 7.575 7.391 0.184 1
1 1135 . 33 1 1 A 100 100 HIS HA H 99 4.524 4.475 0.049 1
1 1139 . 33 1 1 A 100 100 HIS C C 99 174.789 177.244 -2.455 1
1 1140 . 33 1 1 A 100 100 HIS CA C 99 56.154 59.302 -3.148 1
1 1141 . 33 1 1 A 100 100 HIS CB C 99 28.946 30.935 -1.989 1
1 1143 . 33 1 1 A 100 100 HIS N N 99 114.778 118.524 -3.746 1
1 1144 . 33 1 1 A 101 101 HIS H H 100 7.773 8.159 -0.386 1
1 1145 . 33 1 1 A 101 101 HIS HA H 100 4.704 4.393 0.311 1
1 1149 . 33 1 1 A 101 101 HIS C C 100 174.818 177.235 -2.417 1
1 1150 . 33 1 1 A 101 101 HIS CA C 100 54.830 58.798 -3.968 1
1 1151 . 33 1 1 A 101 101 HIS CB C 100 29.749 28.709 1.040 1
1 1153 . 33 1 1 A 101 101 HIS N N 100 117.397 117.640 -0.243 1
1 1154 . 33 1 1 A 102 102 LYS H H 101 7.324 8.168 -0.844 1
1 1155 . 33 1 1 A 102 102 LYS HA H 101 3.611 4.047 -0.436 1
1 1164 . 33 1 1 A 102 102 LYS C C 101 176.823 178.309 -1.486 1
1 1165 . 33 1 1 A 102 102 LYS CA C 101 59.915 58.948 0.967 1
1 1166 . 33 1 1 A 102 102 LYS CB C 101 32.825 32.038 0.787 1
1 1170 . 33 1 1 A 102 102 LYS N N 101 120.533 121.786 -1.253 1
1 1171 . 33 1 1 A 103 103 ASP H H 102 8.361 7.583 0.778 1
1 1172 . 33 1 1 A 103 103 ASP HA H 102 4.421 4.512 -0.091 1
1 1175 . 33 1 1 A 103 103 ASP C C 102 176.793 177.722 -0.929 1
1 1176 . 33 1 1 A 103 103 ASP CA C 102 55.500 55.859 -0.359 1
1 1177 . 33 1 1 A 103 103 ASP CB C 102 40.178 40.612 -0.434 1
1 1178 . 33 1 1 A 103 103 ASP N N 102 114.814 119.408 -4.594 1
1 1179 . 33 1 1 A 104 104 GLU H H 103 7.858 8.264 -0.406 1
1 1180 . 33 1 1 A 104 104 GLU HA H 103 4.339 4.622 -0.283 1
1 1183 . 33 1 1 A 104 104 GLU C C 103 175.777 176.590 -0.813 1
1 1184 . 33 1 1 A 104 104 GLU CA C 103 56.356 58.075 -1.719 1
1 1185 . 33 1 1 A 104 104 GLU CB C 103 31.293 31.866 -0.573 1
1 1186 . 33 1 1 A 104 104 GLU N N 103 116.826 118.802 -1.976 1
1 1187 . 33 1 1 A 105 105 VAL H H 104 7.201 7.743 -0.542 1
1 1188 . 33 1 1 A 105 105 VAL HA H 104 4.296 4.131 0.165 1
1 1196 . 33 1 1 A 105 105 VAL C C 104 174.482 175.620 -1.138 1
1 1197 . 33 1 1 A 105 105 VAL CA C 104 60.370 62.745 -2.375 1
1 1198 . 33 1 1 A 105 105 VAL CB C 104 34.341 32.949 1.392 1
1 1201 . 33 1 1 A 105 105 VAL N N 104 116.422 119.815 -3.393 1
1 1202 . 33 1 1 A 106 106 ALA H H 105 8.487 8.459 0.028 1
1 1203 . 33 1 1 A 106 106 ALA HA H 105 4.172 4.333 -0.161 1
1 1207 . 33 1 1 A 106 106 ALA C C 105 179.030 178.874 0.156 1
1 1208 . 33 1 1 A 106 106 ALA CA C 105 52.966 52.664 0.302 1
1 1209 . 33 1 1 A 106 106 ALA CB C 105 19.371 19.646 -0.275 1
1 1210 . 33 1 1 A 106 106 ALA N N 105 128.313 128.708 -0.395 1
1 1211 . 33 1 1 A 107 107 GLY H H 106 8.738 8.797 -0.059 1
1 1212 . 33 1 1 A 107 107 GLY HA2 H 106 3.773 3.869 -0.096 1
1 1213 . 33 1 1 A 107 107 GLY HA3 H 106 3.998 3.928 0.070 1
1 1214 . 33 1 1 A 107 107 GLY C C 106 174.958 175.450 -0.492 1
1 1215 . 33 1 1 A 107 107 GLY CA C 106 47.449 47.178 0.271 1
1 1216 . 33 1 1 A 107 107 GLY N N 106 110.612 110.884 -0.272 1
1 1217 . 33 1 1 A 108 108 ASP H H 107 8.535 7.833 0.702 1
1 1218 . 33 1 1 A 108 108 ASP HA H 107 4.333 4.375 -0.042 1
1 1221 . 33 1 1 A 108 108 ASP C C 107 179.133 178.939 0.194 1
1 1222 . 33 1 1 A 108 108 ASP CA C 107 56.721 56.455 0.266 1
1 1223 . 33 1 1 A 108 108 ASP CB C 107 39.336 40.419 -1.083 1
1 1224 . 33 1 1 A 108 108 ASP N N 107 117.474 122.119 -4.645 1
1 1225 . 33 1 1 A 109 109 ILE H H 108 7.459 7.853 -0.394 1
1 1226 . 33 1 1 A 109 109 ILE HA H 108 3.688 3.802 -0.114 1
1 1236 . 33 1 1 A 109 109 ILE C C 108 176.735 178.511 -1.776 1
1 1237 . 33 1 1 A 109 109 ILE CA C 108 63.474 65.425 -1.951 1
1 1238 . 33 1 1 A 109 109 ILE CB C 108 37.340 37.571 -0.231 1
1 1242 . 33 1 1 A 109 109 ILE N N 108 119.609 119.751 -0.142 1
1 1243 . 33 1 1 A 110 110 PHE H H 109 7.920 8.345 -0.425 1
1 1244 . 33 1 1 A 110 110 PHE HA H 109 3.759 4.078 -0.319 1
1 1252 . 33 1 1 A 110 110 PHE C C 109 177.132 177.288 -0.156 1
1 1253 . 33 1 1 A 110 110 PHE CA C 109 62.766 61.222 1.544 1
1 1254 . 33 1 1 A 110 110 PHE CB C 109 39.752 39.302 0.450 1
1 1260 . 33 1 1 A 110 110 PHE N N 109 120.906 120.302 0.604 1
1 1261 . 33 1 1 A 111 111 ASP H H 110 8.639 8.218 0.421 1
1 1262 . 33 1 1 A 111 111 ASP HA H 110 4.216 4.220 -0.004 1
1 1265 . 33 1 1 A 111 111 ASP C C 110 178.900 178.295 0.605 1
1 1266 . 33 1 1 A 111 111 ASP CA C 110 57.105 57.395 -0.290 1
1 1267 . 33 1 1 A 111 111 ASP CB C 110 39.697 42.038 -2.341 1
1 1268 . 33 1 1 A 111 111 ASP N N 110 117.124 118.784 -1.660 1
1 1269 . 33 1 1 A 112 112 MET H H 111 7.331 7.628 -0.297 1
1 1270 . 33 1 1 A 112 112 MET HA H 111 4.081 4.142 -0.061 1
1 1278 . 33 1 1 A 112 112 MET C C 111 179.052 178.126 0.926 1
1 1279 . 33 1 1 A 112 112 MET CA C 111 58.202 57.916 0.286 1
1 1280 . 33 1 1 A 112 112 MET CB C 111 31.827 32.293 -0.466 1
1 1283 . 33 1 1 A 112 112 MET N N 111 118.061 119.240 -1.179 1
1 1284 . 33 1 1 A 113 113 LEU H H 112 8.001 7.939 0.062 1
1 1285 . 33 1 1 A 113 113 LEU HA H 112 3.723 3.595 0.128 1
1 1295 . 33 1 1 A 113 113 LEU C C 112 179.747 178.737 1.010 1
1 1296 . 33 1 1 A 113 113 LEU CA C 112 57.371 57.420 -0.049 1
1 1297 . 33 1 1 A 113 113 LEU CB C 112 40.671 40.910 -0.239 1
1 1301 . 33 1 1 A 113 113 LEU N N 112 120.426 119.655 0.771 1
1 1302 . 33 1 1 A 114 114 LEU H H 113 7.744 7.491 0.253 1
1 1303 . 33 1 1 A 114 114 LEU HA H 113 4.007 3.601 0.406 1
1 1313 . 33 1 1 A 114 114 LEU C C 113 179.358 178.603 0.755 1
1 1314 . 33 1 1 A 114 114 LEU CA C 113 57.202 57.420 -0.218 1
1 1315 . 33 1 1 A 114 114 LEU CB C 113 41.727 41.139 0.588 1
1 1319 . 33 1 1 A 114 114 LEU N N 113 119.584 118.127 1.457 1
1 1320 . 33 1 1 A 115 115 THR H H 114 7.353 7.602 -0.249 1
1 1321 . 33 1 1 A 115 115 THR HA H 114 4.071 4.062 0.009 1
1 1327 . 33 1 1 A 115 115 THR C C 114 173.591 176.696 -3.105 1
1 1328 . 33 1 1 A 115 115 THR CA C 114 65.332 64.614 0.718 1
1 1329 . 33 1 1 A 115 115 THR CB C 114 70.319 68.478 1.841 1
1 1331 . 33 1 1 A 115 115 THR N N 114 107.535 110.586 -3.051 1
1 1332 . 33 1 1 A 116 116 PHE H H 115 6.979 7.744 -0.765 1
1 1333 . 33 1 1 A 116 116 PHE HA H 115 5.022 4.236 0.786 1
1 1341 . 33 1 1 A 116 116 PHE C C 115 176.488 176.609 -0.121 1
1 1342 . 33 1 1 A 116 116 PHE CA C 115 55.911 60.833 -4.922 1
1 1343 . 33 1 1 A 116 116 PHE CB C 115 38.521 39.170 -0.649 1
1 1349 . 33 1 1 A 116 116 PHE N N 115 112.366 120.197 -7.831 1
1 1350 . 33 1 1 A 117 117 THR H H 116 7.564 7.488 0.076 1
1 1351 . 33 1 1 A 117 117 THR HA H 116 4.626 4.928 -0.302 1
1 1356 . 33 1 1 A 117 117 THR C C 116 174.085 174.351 -0.266 1
1 1357 . 33 1 1 A 117 117 THR CA C 116 61.636 62.034 -0.398 1
1 1358 . 33 1 1 A 117 117 THR CB C 116 70.915 70.954 -0.039 1
1 1360 . 33 1 1 A 117 117 THR N N 116 105.498 105.645 -0.147 1
1 1361 . 33 1 1 A 118 118 ASP H H 117 8.270 7.750 0.520 1
1 1362 . 33 1 1 A 118 118 ASP HA H 117 4.955 4.670 0.285 1
1 1365 . 33 1 1 A 118 118 ASP C C 117 176.328 176.386 -0.058 1
1 1366 . 33 1 1 A 118 118 ASP CA C 117 53.417 53.404 0.013 1
1 1367 . 33 1 1 A 118 118 ASP CB C 117 43.388 40.446 2.942 1
1 1368 . 33 1 1 A 118 118 ASP N N 117 124.409 122.429 1.980 1
1 1369 . 33 1 1 A 119 119 PHE H H 118 8.973 8.769 0.204 1
1 1370 . 33 1 1 A 119 119 PHE HA H 118 3.506 4.202 -0.696 1
1 1378 . 33 1 1 A 119 119 PHE CA C 118 61.490 61.010 0.480 1
1 1379 . 33 1 1 A 119 119 PHE CB C 118 39.246 39.531 -0.285 1
1 1385 . 33 1 1 A 119 119 PHE N N 118 126.688 126.419 0.269 1
1 1386 . 33 1 1 A 120 120 LEU H H 119 8.099 8.150 -0.051 1
1 1387 . 33 1 1 A 120 120 LEU HA H 119 3.842 4.057 -0.215 1
1 1397 . 33 1 1 A 120 120 LEU C C 119 179.601 178.405 1.196 1
1 1398 . 33 1 1 A 120 120 LEU CA C 119 58.174 57.920 0.254 1
1 1399 . 33 1 1 A 120 120 LEU CB C 119 40.315 41.245 -0.930 1
1 1403 . 33 1 1 A 120 120 LEU N N 119 117.930 120.167 -2.237 1
1 1404 . 33 1 1 A 121 121 ALA H H 120 7.729 7.977 -0.248 1
1 1405 . 33 1 1 A 121 121 ALA HA H 120 3.996 4.073 -0.077 1
1 1409 . 33 1 1 A 121 121 ALA C C 120 180.995 179.649 1.346 1
1 1410 . 33 1 1 A 121 121 ALA CA C 120 54.832 54.710 0.122 1
1 1411 . 33 1 1 A 121 121 ALA CB C 120 17.706 18.309 -0.603 1
1 1412 . 33 1 1 A 121 121 ALA N N 120 123.195 120.949 2.246 1
1 1413 . 33 1 1 A 122 122 PHE H H 121 7.943 7.842 0.101 1
1 1414 . 33 1 1 A 122 122 PHE HA H 121 3.887 3.814 0.073 1
1 1419 . 33 1 1 A 122 122 PHE C C 121 175.410 176.823 -1.413 1
1 1420 . 33 1 1 A 122 122 PHE CA C 121 61.075 60.653 0.422 1
1 1421 . 33 1 1 A 122 122 PHE CB C 121 38.115 39.012 -0.897 1
1 1424 . 33 1 1 A 122 122 PHE N N 121 121.798 120.406 1.392 1
1 1425 . 33 1 1 A 123 123 LYS H H 122 8.468 7.935 0.533 1
1 1426 . 33 1 1 A 123 123 LYS HA H 122 3.077 3.718 -0.641 1
1 1435 . 33 1 1 A 123 123 LYS C C 122 178.453 178.737 -0.284 1
1 1436 . 33 1 1 A 123 123 LYS CA C 122 59.855 59.873 -0.018 1
1 1437 . 33 1 1 A 123 123 LYS CB C 122 32.374 32.221 0.153 1
1 1441 . 33 1 1 A 123 123 LYS N N 122 120.614 118.219 2.395 1
1 1442 . 33 1 1 A 124 124 GLU H H 123 8.100 7.780 0.320 1
1 1443 . 33 1 1 A 124 124 GLU HA H 123 3.652 4.000 -0.348 1
1 1448 . 33 1 1 A 124 124 GLU C C 123 177.743 178.497 -0.754 1
1 1449 . 33 1 1 A 124 124 GLU CA C 123 59.406 59.459 -0.053 1
1 1450 . 33 1 1 A 124 124 GLU CB C 123 28.811 29.259 -0.448 1
1 1452 . 33 1 1 A 124 124 GLU N N 123 117.404 118.949 -1.545 1
1 1453 . 33 1 1 A 125 125 MET H H 124 7.537 7.387 0.150 1
1 1454 . 33 1 1 A 125 125 MET HA H 124 3.860 3.948 -0.088 1
1 1462 . 33 1 1 A 125 125 MET C C 124 179.522 178.368 1.154 1
1 1463 . 33 1 1 A 125 125 MET CA C 124 58.832 58.479 0.353 1
1 1464 . 33 1 1 A 125 125 MET CB C 124 31.765 31.470 0.295 1
1 1467 . 33 1 1 A 125 125 MET N N 124 119.413 118.930 0.483 1
1 1468 . 33 1 1 A 126 126 PHE H H 125 7.148 7.469 -0.321 1
1 1469 . 33 1 1 A 126 126 PHE HA H 125 3.633 4.236 -0.603 1
1 1476 . 33 1 1 A 126 126 PHE C C 125 178.994 178.210 0.784 1
1 1477 . 33 1 1 A 126 126 PHE CA C 125 63.148 61.106 2.042 1
1 1478 . 33 1 1 A 126 126 PHE CB C 125 39.830 38.381 1.449 1
1 1483 . 33 1 1 A 126 126 PHE N N 125 120.013 118.930 1.083 1
1 1484 . 33 1 1 A 127 127 LEU H H 126 8.369 8.295 0.074 1
1 1485 . 33 1 1 A 127 127 LEU HA H 126 3.972 3.969 0.003 1
1 1495 . 33 1 1 A 127 127 LEU C C 126 180.621 178.901 1.720 1
1 1496 . 33 1 1 A 127 127 LEU CA C 126 57.944 57.946 -0.002 1
1 1497 . 33 1 1 A 127 127 LEU CB C 126 40.543 41.384 -0.841 1
1 1501 . 33 1 1 A 127 127 LEU N N 126 119.692 119.602 0.090 1
1 1502 . 33 1 1 A 128 128 ASP H H 127 8.578 7.975 0.603 1
1 1503 . 33 1 1 A 128 128 ASP HA H 127 4.308 4.350 -0.042 1
1 1506 . 33 1 1 A 128 128 ASP C C 127 178.254 178.157 0.097 1
1 1507 . 33 1 1 A 128 128 ASP CA C 127 56.964 57.068 -0.104 1
1 1508 . 33 1 1 A 128 128 ASP CB C 127 39.735 40.509 -0.774 1
1 1509 . 33 1 1 A 128 128 ASP N N 127 121.926 119.444 2.482 1
1 1510 . 33 1 1 A 129 129 TYR H H 128 7.710 8.337 -0.627 1
1 1511 . 33 1 1 A 129 129 TYR HA H 128 3.908 4.084 -0.176 1
1 1518 . 33 1 1 A 129 129 TYR C C 128 177.633 177.362 0.271 1
1 1519 . 33 1 1 A 129 129 TYR CA C 128 61.796 61.297 0.499 1
1 1520 . 33 1 1 A 129 129 TYR CB C 128 39.372 38.802 0.570 1
1 1525 . 33 1 1 A 129 129 TYR N N 128 122.548 120.668 1.880 1
1 1526 . 33 1 1 A 130 130 ARG H H 129 8.622 8.571 0.051 1
1 1527 . 33 1 1 A 130 130 ARG HA H 129 3.722 4.050 -0.328 1
1 1535 . 33 1 1 A 130 130 ARG CA C 129 60.084 59.839 0.245 1
1 1536 . 33 1 1 A 130 130 ARG CB C 129 29.902 29.924 -0.022 1
1 1539 . 33 1 1 A 130 130 ARG N N 129 118.302 119.582 -1.280 1
1 1541 . 33 1 1 A 131 131 ALA H H 130 7.936 7.992 -0.056 1
1 1542 . 33 1 1 A 131 131 ALA HA H 130 3.997 4.030 -0.033 1
1 1546 . 33 1 1 A 131 131 ALA C C 130 180.456 179.634 0.822 1
1 1547 . 33 1 1 A 131 131 ALA CA C 130 55.133 54.983 0.150 1
1 1548 . 33 1 1 A 131 131 ALA CB C 130 17.750 18.232 -0.482 1
1 1549 . 33 1 1 A 131 131 ALA N N 130 119.788 121.512 -1.724 1
1 1550 . 33 1 1 A 132 132 GLU H H 131 7.622 7.709 -0.087 1
1 1551 . 33 1 1 A 132 132 GLU HA H 131 3.862 4.017 -0.155 1
1 1556 . 33 1 1 A 132 132 GLU C C 131 179.528 178.960 0.568 1
1 1557 . 33 1 1 A 132 132 GLU CA C 131 58.849 58.828 0.021 1
1 1558 . 33 1 1 A 132 132 GLU CB C 131 28.930 29.383 -0.453 1
1 1560 . 33 1 1 A 132 132 GLU N N 131 118.428 119.189 -0.761 1
1 1561 . 33 1 1 A 133 133 LYS H H 132 7.853 7.701 0.152 1
1 1562 . 33 1 1 A 133 133 LYS HA H 132 3.722 4.007 -0.285 1
1 1571 . 33 1 1 A 133 133 LYS C C 132 175.725 178.768 -3.043 1
1 1572 . 33 1 1 A 133 133 LYS CA C 132 57.544 59.693 -2.149 1
1 1573 . 33 1 1 A 133 133 LYS CB C 132 31.770 32.016 -0.246 1
1 1577 . 33 1 1 A 133 133 LYS N N 132 119.473 119.279 0.194 1
1 1578 . 33 1 1 A 134 134 GLU H H 133 8.151 7.860 0.291 1
1 1579 . 33 1 1 A 134 134 GLU HA H 133 4.161 4.200 -0.039 1
1 1584 . 33 1 1 A 134 134 GLU C C 133 177.453 178.228 -0.775 1
1 1585 . 33 1 1 A 134 134 GLU CA C 133 57.222 57.212 0.010 1
1 1586 . 33 1 1 A 134 134 GLU CB C 133 30.091 29.377 0.714 1
1 1588 . 33 1 1 A 134 134 GLU N N 133 116.525 118.241 -1.716 1
1 1589 . 33 1 1 A 135 135 GLY H H 134 7.702 8.235 -0.533 1
1 1590 . 33 1 1 A 135 135 GLY HA2 H 134 3.896 3.943 -0.047 1
1 1591 . 33 1 1 A 135 135 GLY HA3 H 134 3.897 3.953 -0.056 1
1 1592 . 33 1 1 A 135 135 GLY C C 134 174.538 174.471 0.067 1
1 1593 . 33 1 1 A 135 135 GLY CA C 134 45.975 46.755 -0.780 1
1 1594 . 33 1 1 A 135 135 GLY N N 134 107.924 109.704 -1.780 1
1 1595 . 33 1 1 A 136 136 ARG H H 135 8.045 7.736 0.309 1
1 1596 . 33 1 1 A 136 136 ARG HA H 135 4.323 4.338 -0.015 1
1 1604 . 33 1 1 A 136 136 ARG C C 135 175.864 176.158 -0.294 1
1 1605 . 33 1 1 A 136 136 ARG CA C 135 56.016 56.699 -0.683 1
1 1606 . 33 1 1 A 136 136 ARG CB C 135 30.987 30.818 0.169 1
1 1609 . 33 1 1 A 136 136 ARG N N 135 119.708 119.779 -0.071 1
1 1 . 34 1 1 A 14 14 PHE CA C 13 58.199 56.981 1.218 1
1 2 . 34 1 1 A 14 14 PHE CB C 13 39.717 40.958 -1.241 1
1 3 . 34 1 1 A 15 15 SER H H 14 8.299 9.012 -0.713 1
1 4 . 34 1 1 A 15 15 SER HA H 14 4.359 4.452 -0.093 1
1 7 . 34 1 1 A 15 15 SER CA C 14 58.249 60.152 -1.903 1
1 8 . 34 1 1 A 15 15 SER CB C 14 63.936 63.426 0.510 1
1 9 . 34 1 1 A 15 15 SER N N 14 117.379 115.778 1.601 1
1 10 . 34 1 1 A 16 16 SER H H 15 8.255 8.798 -0.543 1
1 11 . 34 1 1 A 16 16 SER HA H 15 3.729 4.665 -0.936 1
1 14 . 34 1 1 A 16 16 SER CA C 15 58.224 59.573 -1.349 1
1 15 . 34 1 1 A 16 16 SER CB C 15 63.886 64.367 -0.481 1
1 16 . 34 1 1 A 16 16 SER N N 15 117.694 122.366 -4.672 1
1 17 . 34 1 1 A 17 17 ALA H H 16 8.333 8.203 0.130 1
1 18 . 34 1 1 A 17 17 ALA HA H 16 4.252 4.296 -0.044 1
1 22 . 34 1 1 A 17 17 ALA CA C 16 53.377 53.324 0.053 1
1 23 . 34 1 1 A 17 17 ALA CB C 16 18.896 18.556 0.340 1
1 24 . 34 1 1 A 17 17 ALA N N 16 125.462 124.120 1.342 1
1 25 . 34 1 1 A 18 18 SER H H 17 8.219 7.972 0.247 1
1 26 . 34 1 1 A 18 18 SER HA H 17 4.332 4.151 0.181 1
1 29 . 34 1 1 A 18 18 SER CA C 17 59.105 61.579 -2.474 1
1 30 . 34 1 1 A 18 18 SER CB C 17 63.592 63.648 -0.056 1
1 31 . 34 1 1 A 18 18 SER N N 17 114.821 114.758 0.063 1
1 32 . 34 1 1 A 19 19 ASP H H 18 8.309 8.158 0.151 1
1 33 . 34 1 1 A 19 19 ASP HA H 18 4.554 5.071 -0.517 1
1 36 . 34 1 1 A 19 19 ASP C C 18 176.528 177.024 -0.496 1
1 37 . 34 1 1 A 19 19 ASP CA C 18 55.272 55.091 0.181 1
1 38 . 34 1 1 A 19 19 ASP CB C 18 40.883 44.099 -3.216 1
1 39 . 34 1 1 A 19 19 ASP N N 18 123.367 119.390 3.977 1
1 40 . 34 1 1 A 20 20 ALA H H 19 8.133 8.342 -0.209 1
1 41 . 34 1 1 A 20 20 ALA HA H 19 4.170 4.052 0.118 1
1 45 . 34 1 1 A 20 20 ALA C C 19 179.857 178.829 1.028 1
1 46 . 34 1 1 A 20 20 ALA CA C 19 54.341 55.636 -1.295 1
1 47 . 34 1 1 A 20 20 ALA CB C 19 18.660 18.614 0.046 1
1 48 . 34 1 1 A 20 20 ALA N N 19 123.350 122.419 0.931 1
1 49 . 34 1 1 A 21 21 GLU H H 20 8.140 8.211 -0.071 1
1 50 . 34 1 1 A 21 21 GLU HA H 20 4.128 4.195 -0.067 1
1 55 . 34 1 1 A 21 21 GLU C C 20 177.675 178.772 -1.097 1
1 56 . 34 1 1 A 21 21 GLU CA C 20 58.520 59.599 -1.079 1
1 57 . 34 1 1 A 21 21 GLU CB C 20 29.765 29.710 0.055 1
1 59 . 34 1 1 A 21 21 GLU N N 20 119.063 118.777 0.286 1
1 60 . 34 1 1 A 22 22 PHE H H 21 8.009 8.156 -0.147 1
1 61 . 34 1 1 A 22 22 PHE HA H 21 4.123 4.375 -0.252 1
1 68 . 34 1 1 A 22 22 PHE C C 21 176.410 177.096 -0.686 1
1 69 . 34 1 1 A 22 22 PHE CA C 21 62.202 61.447 0.755 1
1 70 . 34 1 1 A 22 22 PHE CB C 21 39.223 39.312 -0.089 1
1 75 . 34 1 1 A 22 22 PHE N N 21 121.211 121.120 0.091 1
1 76 . 34 1 1 A 23 23 ASP H H 22 8.261 8.445 -0.184 1
1 77 . 34 1 1 A 23 23 ASP HA H 22 4.041 4.294 -0.253 1
1 80 . 34 1 1 A 23 23 ASP C C 22 179.078 178.000 1.078 1
1 81 . 34 1 1 A 23 23 ASP CA C 22 57.048 57.721 -0.673 1
1 82 . 34 1 1 A 23 23 ASP CB C 22 40.154 41.442 -1.288 1
1 83 . 34 1 1 A 23 23 ASP N N 22 116.876 119.136 -2.260 1
1 84 . 34 1 1 A 24 24 ALA H H 23 7.651 7.704 -0.053 1
1 85 . 34 1 1 A 24 24 ALA HA H 23 3.785 3.921 -0.136 1
1 89 . 34 1 1 A 24 24 ALA C C 23 179.577 179.835 -0.258 1
1 90 . 34 1 1 A 24 24 ALA CA C 23 54.341 55.293 -0.952 1
1 91 . 34 1 1 A 24 24 ALA CB C 23 17.762 18.308 -0.546 1
1 92 . 34 1 1 A 24 24 ALA N N 23 121.873 121.555 0.318 1
1 93 . 34 1 1 A 25 25 VAL H H 24 7.718 8.023 -0.305 1
1 94 . 34 1 1 A 25 25 VAL HA H 24 3.216 3.474 -0.258 1
1 102 . 34 1 1 A 25 25 VAL C C 24 177.805 178.396 -0.591 1
1 103 . 34 1 1 A 25 25 VAL CA C 24 66.789 66.725 0.064 1
1 104 . 34 1 1 A 25 25 VAL CB C 24 31.277 31.230 0.047 1
1 107 . 34 1 1 A 25 25 VAL N N 24 117.890 118.518 -0.628 1
1 108 . 34 1 1 A 26 26 VAL H H 25 7.867 7.687 0.180 1
1 109 . 34 1 1 A 26 26 VAL HA H 25 3.274 3.487 -0.213 1
1 117 . 34 1 1 A 26 26 VAL C C 25 177.788 177.875 -0.087 1
1 118 . 34 1 1 A 26 26 VAL CA C 25 67.282 66.275 1.007 1
1 119 . 34 1 1 A 26 26 VAL CB C 25 31.266 31.395 -0.129 1
1 122 . 34 1 1 A 26 26 VAL N N 25 118.170 119.974 -1.804 1
1 123 . 34 1 1 A 27 27 GLY H H 26 7.544 7.680 -0.136 1
1 124 . 34 1 1 A 27 27 GLY HA2 H 26 3.592 3.484 0.108 1
1 125 . 34 1 1 A 27 27 GLY HA3 H 26 3.721 3.601 0.120 1
1 126 . 34 1 1 A 27 27 GLY C C 26 176.717 176.405 0.312 1
1 127 . 34 1 1 A 27 27 GLY CA C 26 47.085 47.188 -0.103 1
1 128 . 34 1 1 A 27 27 GLY N N 26 105.795 107.692 -1.897 1
1 129 . 34 1 1 A 28 28 TYR H H 27 7.625 7.443 0.182 1
1 130 . 34 1 1 A 28 28 TYR HA H 27 4.546 4.557 -0.011 1
1 137 . 34 1 1 A 28 28 TYR C C 27 178.991 178.541 0.450 1
1 138 . 34 1 1 A 28 28 TYR CA C 27 58.845 59.916 -1.071 1
1 139 . 34 1 1 A 28 28 TYR CB C 27 37.602 37.342 0.260 1
1 144 . 34 1 1 A 28 28 TYR N N 27 119.933 121.695 -1.762 1
1 145 . 34 1 1 A 29 29 LEU H H 28 8.517 8.168 0.349 1
1 146 . 34 1 1 A 29 29 LEU HA H 28 3.728 3.864 -0.136 1
1 156 . 34 1 1 A 29 29 LEU CA C 28 58.281 57.967 0.314 1
1 157 . 34 1 1 A 29 29 LEU CB C 28 41.948 41.570 0.378 1
1 161 . 34 1 1 A 29 29 LEU N N 28 119.669 120.870 -1.201 1
1 162 . 34 1 1 A 30 30 GLU H H 29 8.072 8.155 -0.083 1
1 163 . 34 1 1 A 30 30 GLU HA H 29 3.722 3.841 -0.119 1
1 168 . 34 1 1 A 30 30 GLU C C 29 177.731 179.004 -1.273 1
1 169 . 34 1 1 A 30 30 GLU CA C 29 59.763 59.948 -0.185 1
1 170 . 34 1 1 A 30 30 GLU CB C 29 28.844 29.133 -0.289 1
1 172 . 34 1 1 A 30 30 GLU N N 29 117.666 117.660 0.006 1
1 173 . 34 1 1 A 31 31 ASP H H 30 7.243 8.031 -0.788 1
1 174 . 34 1 1 A 31 31 ASP HA H 30 4.297 4.372 -0.075 1
1 177 . 34 1 1 A 31 31 ASP CA C 30 56.953 57.258 -0.305 1
1 178 . 34 1 1 A 31 31 ASP CB C 30 40.730 42.172 -1.442 1
1 179 . 34 1 1 A 31 31 ASP N N 30 116.720 119.055 -2.335 1
1 180 . 34 1 1 A 32 32 ILE H H 31 7.940 7.553 0.387 1
1 181 . 34 1 1 A 32 32 ILE HA H 31 3.640 3.730 -0.090 1
1 191 . 34 1 1 A 32 32 ILE C C 31 177.980 178.181 -0.201 1
1 192 . 34 1 1 A 32 32 ILE CA C 31 64.692 64.062 0.630 1
1 193 . 34 1 1 A 32 32 ILE CB C 31 38.938 36.857 2.081 1
1 197 . 34 1 1 A 32 32 ILE N N 31 119.728 118.069 1.659 1
1 198 . 34 1 1 A 33 33 ILE H H 32 7.984 7.717 0.267 1
1 199 . 34 1 1 A 33 33 ILE HA H 32 3.598 2.989 0.609 1
1 209 . 34 1 1 A 33 33 ILE C C 32 176.723 176.871 -0.148 1
1 210 . 34 1 1 A 33 33 ILE CA C 32 63.241 64.486 -1.245 1
1 211 . 34 1 1 A 33 33 ILE CB C 32 37.580 37.555 0.025 1
1 215 . 34 1 1 A 33 33 ILE N N 32 113.919 120.825 -6.906 1
1 216 . 34 1 1 A 34 34 MET H H 33 7.288 7.756 -0.468 1
1 217 . 34 1 1 A 34 34 MET HA H 33 4.496 4.695 -0.199 1
1 225 . 34 1 1 A 34 34 MET C C 33 176.423 175.725 0.698 1
1 226 . 34 1 1 A 34 34 MET CA C 33 54.634 54.157 0.477 1
1 227 . 34 1 1 A 34 34 MET CB C 33 31.934 31.480 0.454 1
1 230 . 34 1 1 A 34 34 MET N N 33 115.130 116.831 -1.701 1
1 231 . 34 1 1 A 35 35 ASP H H 34 7.405 7.513 -0.108 1
1 232 . 34 1 1 A 35 35 ASP HA H 34 4.484 4.606 -0.122 1
1 235 . 34 1 1 A 35 35 ASP C C 34 177.139 176.646 0.493 1
1 236 . 34 1 1 A 35 35 ASP CA C 34 54.625 54.660 -0.035 1
1 237 . 34 1 1 A 35 35 ASP CB C 34 43.554 42.866 0.688 1
1 238 . 34 1 1 A 35 35 ASP N N 34 121.814 122.620 -0.806 1
1 239 . 34 1 1 A 36 36 ASP H H 35 8.765 8.856 -0.091 1
1 240 . 34 1 1 A 36 36 ASP HA H 35 4.235 4.350 -0.115 1
1 243 . 34 1 1 A 36 36 ASP C C 35 178.320 178.538 -0.218 1
1 244 . 34 1 1 A 36 36 ASP CA C 35 57.832 58.045 -0.213 1
1 245 . 34 1 1 A 36 36 ASP CB C 35 40.914 40.403 0.511 1
1 246 . 34 1 1 A 36 36 ASP N N 35 125.883 125.337 0.546 1
1 247 . 34 1 1 A 37 37 GLU H H 36 8.905 8.091 0.814 1
1 248 . 34 1 1 A 37 37 GLU HA H 36 3.933 4.131 -0.198 1
1 253 . 34 1 1 A 37 37 GLU C C 36 179.304 179.102 0.202 1
1 254 . 34 1 1 A 37 37 GLU CA C 36 59.828 59.100 0.728 1
1 255 . 34 1 1 A 37 37 GLU CB C 36 29.380 29.442 -0.062 1
1 257 . 34 1 1 A 37 37 GLU N N 36 119.077 120.324 -1.247 1
1 258 . 34 1 1 A 38 38 PHE H H 37 7.460 8.110 -0.650 1
1 259 . 34 1 1 A 38 38 PHE HA H 37 3.642 4.013 -0.371 1
1 267 . 34 1 1 A 38 38 PHE C C 37 176.483 178.030 -1.547 1
1 268 . 34 1 1 A 38 38 PHE CA C 37 61.411 61.214 0.197 1
1 269 . 34 1 1 A 38 38 PHE CB C 37 39.355 38.955 0.400 1
1 275 . 34 1 1 A 38 38 PHE N N 37 119.968 120.802 -0.834 1
1 276 . 34 1 1 A 39 39 GLN H H 38 7.968 7.946 0.022 1
1 277 . 34 1 1 A 39 39 GLN HA H 38 3.712 3.807 -0.095 1
1 284 . 34 1 1 A 39 39 GLN CA C 38 59.153 58.821 0.332 1
1 285 . 34 1 1 A 39 39 GLN CB C 38 28.213 28.492 -0.279 1
1 287 . 34 1 1 A 39 39 GLN N N 38 116.433 118.252 -1.819 1
1 289 . 34 1 1 A 40 40 LEU H H 39 7.930 7.590 0.340 1
1 290 . 34 1 1 A 40 40 LEU HA H 39 3.916 4.020 -0.104 1
1 300 . 34 1 1 A 40 40 LEU C C 39 177.731 178.038 -0.307 1
1 301 . 34 1 1 A 40 40 LEU CA C 39 57.915 57.975 -0.060 1
1 302 . 34 1 1 A 40 40 LEU CB C 39 41.989 41.549 0.440 1
1 306 . 34 1 1 A 40 40 LEU N N 39 119.505 121.595 -2.090 1
1 307 . 34 1 1 A 41 41 LEU H H 40 7.174 7.903 -0.729 1
1 308 . 34 1 1 A 41 41 LEU HA H 40 3.835 4.015 -0.180 1
1 318 . 34 1 1 A 41 41 LEU C C 40 179.738 178.416 1.322 1
1 319 . 34 1 1 A 41 41 LEU CA C 40 58.266 58.272 -0.006 1
1 320 . 34 1 1 A 41 41 LEU CB C 40 42.050 41.746 0.304 1
1 324 . 34 1 1 A 41 41 LEU N N 40 120.971 119.827 1.144 1
1 325 . 34 1 1 A 42 42 GLN H H 41 8.058 7.861 0.197 1
1 326 . 34 1 1 A 42 42 GLN HA H 41 3.556 3.647 -0.091 1
1 333 . 34 1 1 A 42 42 GLN C C 41 177.642 178.466 -0.824 1
1 334 . 34 1 1 A 42 42 GLN CA C 41 59.826 59.139 0.687 1
1 335 . 34 1 1 A 42 42 GLN CB C 41 28.762 28.344 0.418 1
1 337 . 34 1 1 A 42 42 GLN N N 41 117.899 118.005 -0.106 1
1 339 . 34 1 1 A 43 43 ARG H H 42 8.179 7.709 0.470 1
1 340 . 34 1 1 A 43 43 ARG HA H 42 3.655 3.920 -0.265 1
1 347 . 34 1 1 A 43 43 ARG C C 42 178.051 178.257 -0.206 1
1 348 . 34 1 1 A 43 43 ARG CA C 42 59.766 58.699 1.067 1
1 349 . 34 1 1 A 43 43 ARG CB C 42 29.941 29.833 0.108 1
1 352 . 34 1 1 A 43 43 ARG N N 42 119.392 119.515 -0.123 1
1 353 . 34 1 1 A 44 44 ASN H H 43 8.525 8.129 0.396 1
1 354 . 34 1 1 A 44 44 ASN HA H 43 4.332 4.357 -0.025 1
1 359 . 34 1 1 A 44 44 ASN C C 43 178.150 177.735 0.415 1
1 360 . 34 1 1 A 44 44 ASN CA C 43 55.841 56.208 -0.367 1
1 361 . 34 1 1 A 44 44 ASN CB C 43 37.632 39.474 -1.842 1
1 362 . 34 1 1 A 44 44 ASN N N 43 116.214 117.540 -1.326 1
1 364 . 34 1 1 A 45 45 PHE H H 44 7.586 7.940 -0.354 1
1 365 . 34 1 1 A 45 45 PHE HA H 44 4.132 4.307 -0.175 1
1 372 . 34 1 1 A 45 45 PHE C C 44 176.691 178.409 -1.718 1
1 373 . 34 1 1 A 45 45 PHE CA C 44 62.333 60.631 1.702 1
1 374 . 34 1 1 A 45 45 PHE CB C 44 39.449 38.527 0.922 1
1 379 . 34 1 1 A 45 45 PHE N N 44 121.501 117.652 3.849 1
1 380 . 34 1 1 A 46 46 MET H H 45 8.190 8.236 -0.046 1
1 381 . 34 1 1 A 46 46 MET HA H 45 4.060 4.289 -0.229 1
1 389 . 34 1 1 A 46 46 MET C C 45 179.754 178.157 1.597 1
1 390 . 34 1 1 A 46 46 MET CA C 45 57.742 58.076 -0.334 1
1 391 . 34 1 1 A 46 46 MET CB C 45 29.912 31.297 -1.385 1
1 394 . 34 1 1 A 46 46 MET N N 45 116.727 117.487 -0.760 1
1 395 . 34 1 1 A 47 47 ASP H H 46 8.579 8.243 0.336 1
1 396 . 34 1 1 A 47 47 ASP HA H 46 4.804 4.583 0.221 1
1 399 . 34 1 1 A 47 47 ASP C C 46 177.854 177.899 -0.045 1
1 400 . 34 1 1 A 47 47 ASP CA C 46 57.277 57.286 -0.009 1
1 401 . 34 1 1 A 47 47 ASP CB C 46 40.776 41.284 -0.508 1
1 402 . 34 1 1 A 47 47 ASP N N 46 117.798 120.576 -2.778 1
1 403 . 34 1 1 A 48 48 LYS H H 47 7.339 7.899 -0.560 1
1 404 . 34 1 1 A 48 48 LYS HA H 47 3.828 4.265 -0.437 1
1 413 . 34 1 1 A 48 48 LYS C C 47 178.812 178.863 -0.051 1
1 414 . 34 1 1 A 48 48 LYS CA C 47 58.953 58.374 0.579 1
1 415 . 34 1 1 A 48 48 LYS CB C 47 32.796 33.367 -0.571 1
1 419 . 34 1 1 A 48 48 LYS N N 47 117.852 118.889 -1.037 1
1 420 . 34 1 1 A 49 49 TYR H H 48 6.841 8.920 -2.079 1
1 421 . 34 1 1 A 49 49 TYR HA H 48 4.995 4.238 0.757 1
1 428 . 34 1 1 A 49 49 TYR C C 48 178.138 178.794 -0.656 1
1 429 . 34 1 1 A 49 49 TYR CA C 48 58.620 60.109 -1.489 1
1 430 . 34 1 1 A 49 49 TYR CB C 48 42.939 38.281 4.658 1
1 435 . 34 1 1 A 49 49 TYR N N 48 112.109 119.707 -7.598 1
1 436 . 34 1 1 A 50 50 TYR H H 49 8.491 8.079 0.412 1
1 437 . 34 1 1 A 50 50 TYR HA H 49 4.598 4.330 0.268 1
1 444 . 34 1 1 A 50 50 TYR C C 49 176.015 177.838 -1.823 1
1 445 . 34 1 1 A 50 50 TYR CA C 49 62.442 59.823 2.619 1
1 446 . 34 1 1 A 50 50 TYR CB C 49 36.588 37.096 -0.508 1
1 451 . 34 1 1 A 50 50 TYR N N 49 118.294 119.620 -1.326 1
1 452 . 34 1 1 A 51 51 LEU H H 50 7.512 7.459 0.053 1
1 453 . 34 1 1 A 51 51 LEU HA H 50 3.878 3.556 0.322 1
1 463 . 34 1 1 A 51 51 LEU C C 50 178.625 178.619 0.006 1
1 464 . 34 1 1 A 51 51 LEU CA C 50 55.994 57.215 -1.221 1
1 465 . 34 1 1 A 51 51 LEU CB C 50 40.743 41.261 -0.518 1
1 469 . 34 1 1 A 51 51 LEU N N 50 118.478 121.649 -3.171 1
1 470 . 34 1 1 A 52 52 GLU H H 51 8.042 7.782 0.260 1
1 471 . 34 1 1 A 52 52 GLU HA H 51 4.197 3.854 0.343 1
1 476 . 34 1 1 A 52 52 GLU C C 51 177.629 177.795 -0.166 1
1 477 . 34 1 1 A 52 52 GLU CA C 51 56.141 59.595 -3.454 1
1 478 . 34 1 1 A 52 52 GLU CB C 51 29.162 29.165 -0.003 1
1 480 . 34 1 1 A 52 52 GLU N N 51 115.067 118.301 -3.234 1
1 481 . 34 1 1 A 53 53 PHE H H 52 7.465 8.038 -0.573 1
1 482 . 34 1 1 A 53 53 PHE HA H 52 4.431 4.717 -0.286 1
1 490 . 34 1 1 A 53 53 PHE C C 52 174.325 175.112 -0.787 1
1 491 . 34 1 1 A 53 53 PHE CA C 52 58.986 57.318 1.668 1
1 492 . 34 1 1 A 53 53 PHE CB C 52 40.183 37.572 2.611 1
1 498 . 34 1 1 A 53 53 PHE N N 52 116.768 119.072 -2.304 1
1 499 . 34 1 1 A 54 54 GLU H H 53 7.484 8.842 -1.358 1
1 500 . 34 1 1 A 54 54 GLU HA H 53 4.583 4.854 -0.271 1
1 505 . 34 1 1 A 54 54 GLU C C 53 175.722 175.488 0.234 1
1 506 . 34 1 1 A 54 54 GLU CA C 53 54.248 54.941 -0.693 1
1 507 . 34 1 1 A 54 54 GLU CB C 53 34.409 31.928 2.481 1
1 509 . 34 1 1 A 54 54 GLU N N 53 118.844 123.879 -5.035 1
1 510 . 34 1 1 A 55 55 ASP H H 54 9.008 8.758 0.250 1
1 511 . 34 1 1 A 55 55 ASP HA H 54 4.735 4.853 -0.118 1
1 514 . 34 1 1 A 55 55 ASP C C 54 175.421 175.499 -0.078 1
1 515 . 34 1 1 A 55 55 ASP CA C 54 52.888 53.656 -0.768 1
1 516 . 34 1 1 A 55 55 ASP CB C 54 38.894 40.435 -1.541 1
1 517 . 34 1 1 A 55 55 ASP N N 54 123.654 124.612 -0.958 1
1 518 . 34 1 1 A 56 56 THR H H 55 7.819 8.060 -0.241 1
1 519 . 34 1 1 A 56 56 THR HA H 55 4.574 4.869 -0.295 1
1 524 . 34 1 1 A 56 56 THR C C 55 174.096 174.033 0.063 1
1 525 . 34 1 1 A 56 56 THR CA C 55 59.172 60.039 -0.867 1
1 526 . 34 1 1 A 56 56 THR CB C 55 71.889 72.142 -0.253 1
1 528 . 34 1 1 A 56 56 THR N N 55 112.015 117.062 -5.047 1
1 529 . 34 1 1 A 57 57 GLU H H 56 8.527 8.743 -0.216 1
1 530 . 34 1 1 A 57 57 GLU HA H 56 4.217 4.537 -0.320 1
1 535 . 34 1 1 A 57 57 GLU C C 56 177.042 176.357 0.685 1
1 536 . 34 1 1 A 57 57 GLU CA C 56 56.869 56.206 0.663 1
1 537 . 34 1 1 A 57 57 GLU CB C 56 29.731 30.206 -0.475 1
1 539 . 34 1 1 A 57 57 GLU N N 56 117.531 118.618 -1.087 1
1 540 . 34 1 1 A 58 58 GLU H H 57 7.587 7.586 0.001 1
1 541 . 34 1 1 A 58 58 GLU HA H 57 3.941 4.389 -0.448 1
1 546 . 34 1 1 A 58 58 GLU C C 57 176.849 175.669 1.180 1
1 547 . 34 1 1 A 58 58 GLU CA C 57 56.924 56.850 0.074 1
1 548 . 34 1 1 A 58 58 GLU CB C 57 30.251 29.986 0.265 1
1 550 . 34 1 1 A 58 58 GLU N N 57 119.183 120.149 -0.966 1
1 551 . 34 1 1 A 59 59 ASN H H 58 9.120 8.764 0.356 1
1 552 . 34 1 1 A 59 59 ASN HA H 58 4.922 5.247 -0.325 1
1 557 . 34 1 1 A 59 59 ASN C C 58 174.254 174.173 0.081 1
1 558 . 34 1 1 A 59 59 ASN CA C 58 51.956 52.098 -0.142 1
1 559 . 34 1 1 A 59 59 ASN CB C 58 37.404 40.279 -2.875 1
1 560 . 34 1 1 A 59 59 ASN N N 58 126.767 123.098 3.669 1
1 562 . 34 1 1 A 60 60 LYS H H 59 5.892 9.164 -3.272 1
1 563 . 34 1 1 A 60 60 LYS HA H 59 3.798 4.809 -1.011 1
1 572 . 34 1 1 A 60 60 LYS C C 59 177.908 176.979 0.929 1
1 573 . 34 1 1 A 60 60 LYS CA C 59 56.623 54.660 1.963 1
1 574 . 34 1 1 A 60 60 LYS CB C 59 32.279 34.774 -2.495 1
1 578 . 34 1 1 A 60 60 LYS N N 59 121.527 125.952 -4.425 1
1 579 . 34 1 1 A 61 61 LEU H H 60 8.473 8.786 -0.313 1
1 580 . 34 1 1 A 61 61 LEU HA H 60 3.891 4.229 -0.338 1
1 590 . 34 1 1 A 61 61 LEU C C 60 179.843 178.398 1.445 1
1 591 . 34 1 1 A 61 61 LEU CA C 60 58.301 56.152 2.149 1
1 592 . 34 1 1 A 61 61 LEU CB C 60 41.305 41.587 -0.282 1
1 596 . 34 1 1 A 61 61 LEU N N 60 125.639 123.507 2.132 1
1 597 . 34 1 1 A 62 62 ILE H H 61 7.698 7.689 0.009 1
1 598 . 34 1 1 A 62 62 ILE HA H 61 3.952 3.863 0.089 1
1 608 . 34 1 1 A 62 62 ILE C C 61 175.392 176.878 -1.486 1
1 609 . 34 1 1 A 62 62 ILE CA C 61 61.743 63.273 -1.530 1
1 610 . 34 1 1 A 62 62 ILE CB C 61 39.108 37.714 1.394 1
1 614 . 34 1 1 A 62 62 ILE N N 61 114.111 119.930 -5.819 1
1 615 . 34 1 1 A 63 63 TYR H H 62 7.273 7.617 -0.344 1
1 616 . 34 1 1 A 63 63 TYR HA H 62 4.343 4.178 0.165 1
1 623 . 34 1 1 A 63 63 TYR C C 62 178.264 178.634 -0.370 1
1 624 . 34 1 1 A 63 63 TYR CA C 62 57.231 61.094 -3.863 1
1 625 . 34 1 1 A 63 63 TYR CB C 62 36.332 37.675 -1.343 1
1 630 . 34 1 1 A 63 63 TYR N N 62 117.689 121.264 -3.575 1
1 631 . 34 1 1 A 64 64 THR H H 63 7.747 8.031 -0.284 1
1 632 . 34 1 1 A 64 64 THR HA H 63 4.266 4.213 0.053 1
1 637 . 34 1 1 A 64 64 THR CA C 63 69.362 67.539 1.823 1
1 638 . 34 1 1 A 64 64 THR CB C 63 66.962 67.683 -0.721 1
1 640 . 34 1 1 A 64 64 THR N N 63 113.755 116.025 -2.270 1
1 641 . 34 1 1 A 65 65 PRO HA H 64 4.372 4.380 -0.008 1
1 648 . 34 1 1 A 65 65 PRO C C 64 179.913 179.387 0.526 1
1 649 . 34 1 1 A 65 65 PRO CA C 64 66.011 66.281 -0.270 1
1 650 . 34 1 1 A 65 65 PRO CB C 64 30.642 30.744 -0.102 1
1 653 . 34 1 1 A 66 66 ILE H H 65 7.377 7.308 0.069 1
1 654 . 34 1 1 A 66 66 ILE HA H 65 3.530 3.881 -0.351 1
1 664 . 34 1 1 A 66 66 ILE C C 65 177.543 178.192 -0.649 1
1 665 . 34 1 1 A 66 66 ILE CA C 65 66.647 64.199 2.448 1
1 666 . 34 1 1 A 66 66 ILE CB C 65 38.029 37.662 0.367 1
1 670 . 34 1 1 A 66 66 ILE N N 65 118.353 116.568 1.785 1
1 671 . 34 1 1 A 67 67 PHE H H 66 8.480 8.418 0.062 1
1 672 . 34 1 1 A 67 67 PHE HA H 66 4.115 4.398 -0.283 1
1 680 . 34 1 1 A 67 67 PHE C C 66 177.293 178.069 -0.776 1
1 681 . 34 1 1 A 67 67 PHE CA C 66 59.570 62.052 -2.482 1
1 682 . 34 1 1 A 67 67 PHE CB C 66 38.865 39.652 -0.787 1
1 688 . 34 1 1 A 67 67 PHE N N 66 122.420 120.272 2.148 1
1 689 . 34 1 1 A 68 68 ASN H H 67 8.595 8.176 0.419 1
1 690 . 34 1 1 A 68 68 ASN HA H 67 4.211 4.405 -0.194 1
1 695 . 34 1 1 A 68 68 ASN C C 67 178.697 178.245 0.452 1
1 696 . 34 1 1 A 68 68 ASN CA C 67 56.056 56.178 -0.122 1
1 697 . 34 1 1 A 68 68 ASN CB C 67 37.704 37.892 -0.188 1
1 698 . 34 1 1 A 68 68 ASN N N 67 115.573 117.034 -1.461 1
1 700 . 34 1 1 A 69 69 GLU H H 68 8.414 8.000 0.414 1
1 701 . 34 1 1 A 69 69 GLU HA H 68 4.102 4.397 -0.295 1
1 706 . 34 1 1 A 69 69 GLU C C 68 177.880 178.864 -0.984 1
1 707 . 34 1 1 A 69 69 GLU CA C 68 59.399 59.437 -0.038 1
1 708 . 34 1 1 A 69 69 GLU CB C 68 29.855 29.503 0.352 1
1 710 . 34 1 1 A 69 69 GLU N N 68 123.510 120.004 3.506 1
1 711 . 34 1 1 A 70 70 TYR H H 69 8.659 8.043 0.616 1
1 712 . 34 1 1 A 70 70 TYR HA H 69 3.362 4.147 -0.785 1
1 719 . 34 1 1 A 70 70 TYR C C 69 178.143 177.020 1.123 1
1 720 . 34 1 1 A 70 70 TYR CA C 69 60.686 61.176 -0.490 1
1 721 . 34 1 1 A 70 70 TYR CB C 69 38.560 38.829 -0.269 1
1 726 . 34 1 1 A 70 70 TYR N N 69 122.130 120.801 1.329 1
1 727 . 34 1 1 A 71 71 ILE H H 70 8.031 7.881 0.150 1
1 728 . 34 1 1 A 71 71 ILE HA H 70 3.265 3.775 -0.510 1
1 738 . 34 1 1 A 71 71 ILE C C 70 178.056 177.732 0.324 1
1 739 . 34 1 1 A 71 71 ILE CA C 70 63.756 64.012 -0.256 1
1 740 . 34 1 1 A 71 71 ILE CB C 70 37.321 36.653 0.668 1
1 744 . 34 1 1 A 71 71 ILE N N 70 118.906 120.373 -1.467 1
1 745 . 34 1 1 A 72 72 SER H H 71 7.803 7.950 -0.147 1
1 746 . 34 1 1 A 72 72 SER HA H 71 4.029 4.297 -0.268 1
1 749 . 34 1 1 A 72 72 SER CA C 71 61.380 60.934 0.446 1
1 750 . 34 1 1 A 72 72 SER CB C 71 63.288 63.222 0.066 1
1 751 . 34 1 1 A 72 72 SER N N 71 113.735 114.776 -1.041 1
1 752 . 34 1 1 A 73 73 LEU H H 72 7.952 8.092 -0.140 1
1 753 . 34 1 1 A 73 73 LEU HA H 72 4.418 4.181 0.237 1
1 763 . 34 1 1 A 73 73 LEU C C 72 177.767 178.385 -0.618 1
1 764 . 34 1 1 A 73 73 LEU CA C 72 56.543 57.469 -0.926 1
1 765 . 34 1 1 A 73 73 LEU CB C 72 44.517 41.805 2.712 1
1 769 . 34 1 1 A 73 73 LEU N N 72 119.411 123.543 -4.132 1
1 770 . 34 1 1 A 74 74 VAL H H 73 8.021 7.513 0.508 1
1 771 . 34 1 1 A 74 74 VAL HA H 73 3.532 3.324 0.208 1
1 779 . 34 1 1 A 74 74 VAL C C 73 177.126 178.139 -1.013 1
1 780 . 34 1 1 A 74 74 VAL CA C 73 66.250 66.592 -0.342 1
1 781 . 34 1 1 A 74 74 VAL CB C 73 31.212 31.045 0.167 1
1 784 . 34 1 1 A 74 74 VAL N N 73 118.747 119.289 -0.542 1
1 785 . 34 1 1 A 75 75 GLU H H 74 7.232 8.025 -0.793 1
1 786 . 34 1 1 A 75 75 GLU HA H 74 3.013 4.229 -1.216 1
1 791 . 34 1 1 A 75 75 GLU C C 74 178.804 179.111 -0.307 1
1 792 . 34 1 1 A 75 75 GLU CA C 74 60.536 59.806 0.730 1
1 793 . 34 1 1 A 75 75 GLU CB C 74 27.009 29.105 -2.096 1
1 795 . 34 1 1 A 75 75 GLU N N 74 118.660 119.899 -1.239 1
1 796 . 34 1 1 A 76 76 LYS H H 75 7.051 8.046 -0.995 1
1 797 . 34 1 1 A 76 76 LYS HA H 75 3.765 4.211 -0.446 1
1 806 . 34 1 1 A 76 76 LYS C C 75 177.765 178.363 -0.598 1
1 807 . 34 1 1 A 76 76 LYS CA C 75 58.357 58.020 0.337 1
1 808 . 34 1 1 A 76 76 LYS CB C 75 31.939 32.232 -0.293 1
1 812 . 34 1 1 A 76 76 LYS N N 75 116.112 119.641 -3.529 1
1 813 . 34 1 1 A 77 77 TYR H H 76 7.067 8.065 -0.998 1
1 814 . 34 1 1 A 77 77 TYR HA H 76 4.036 4.186 -0.150 1
1 821 . 34 1 1 A 77 77 TYR C C 76 177.752 176.982 0.770 1
1 822 . 34 1 1 A 77 77 TYR CA C 76 61.820 61.305 0.515 1
1 823 . 34 1 1 A 77 77 TYR CB C 76 38.480 38.825 -0.345 1
1 828 . 34 1 1 A 77 77 TYR N N 76 118.434 122.541 -4.107 1
1 829 . 34 1 1 A 78 78 ILE H H 77 7.554 8.362 -0.808 1
1 830 . 34 1 1 A 78 78 ILE HA H 77 3.159 3.639 -0.480 1
1 840 . 34 1 1 A 78 78 ILE C C 77 177.341 177.773 -0.432 1
1 841 . 34 1 1 A 78 78 ILE CA C 77 65.177 65.126 0.051 1
1 842 . 34 1 1 A 78 78 ILE CB C 77 37.339 37.200 0.139 1
1 846 . 34 1 1 A 78 78 ILE N N 77 117.672 121.328 -3.656 1
1 847 . 34 1 1 A 79 79 GLU H H 78 8.296 8.190 0.106 1
1 848 . 34 1 1 A 79 79 GLU HA H 78 3.557 3.862 -0.305 1
1 853 . 34 1 1 A 79 79 GLU C C 78 177.742 178.968 -1.226 1
1 854 . 34 1 1 A 79 79 GLU CA C 78 60.847 60.158 0.689 1
1 855 . 34 1 1 A 79 79 GLU CB C 78 29.594 29.273 0.321 1
1 857 . 34 1 1 A 79 79 GLU N N 78 118.701 121.195 -2.494 1
1 858 . 34 1 1 A 80 80 GLU H H 79 8.330 8.331 -0.001 1
1 859 . 34 1 1 A 80 80 GLU HA H 79 3.774 4.045 -0.271 1
1 864 . 34 1 1 A 80 80 GLU C C 79 179.926 179.178 0.748 1
1 865 . 34 1 1 A 80 80 GLU CA C 79 59.581 59.067 0.514 1
1 866 . 34 1 1 A 80 80 GLU CB C 79 29.062 29.448 -0.386 1
1 868 . 34 1 1 A 80 80 GLU N N 79 116.767 118.005 -1.238 1
1 869 . 34 1 1 A 81 81 GLN H H 80 7.634 7.678 -0.044 1
1 870 . 34 1 1 A 81 81 GLN HA H 80 3.605 4.024 -0.419 1
1 877 . 34 1 1 A 81 81 GLN C C 80 179.681 178.621 1.060 1
1 878 . 34 1 1 A 81 81 GLN CA C 80 57.765 58.608 -0.843 1
1 879 . 34 1 1 A 81 81 GLN CB C 80 28.079 28.088 -0.009 1
1 881 . 34 1 1 A 81 81 GLN N N 80 116.325 118.742 -2.417 1
1 883 . 34 1 1 A 82 82 LEU H H 81 8.156 7.637 0.519 1
1 884 . 34 1 1 A 82 82 LEU HA H 81 3.536 3.802 -0.266 1
1 894 . 34 1 1 A 82 82 LEU C C 81 178.945 179.445 -0.500 1
1 895 . 34 1 1 A 82 82 LEU CA C 81 57.761 56.873 0.888 1
1 896 . 34 1 1 A 82 82 LEU CB C 81 40.961 40.908 0.053 1
1 900 . 34 1 1 A 82 82 LEU N N 81 121.546 120.250 1.296 1
1 901 . 34 1 1 A 83 83 LEU H H 82 8.326 8.061 0.265 1
1 902 . 34 1 1 A 83 83 LEU HA H 82 4.198 4.201 -0.003 1
1 912 . 34 1 1 A 83 83 LEU C C 82 178.631 179.451 -0.820 1
1 913 . 34 1 1 A 83 83 LEU CA C 82 57.016 57.376 -0.360 1
1 914 . 34 1 1 A 83 83 LEU CB C 82 42.182 40.912 1.270 1
1 918 . 34 1 1 A 83 83 LEU N N 82 120.426 119.837 0.589 1
1 919 . 34 1 1 A 84 84 GLN H H 83 6.992 7.790 -0.798 1
1 920 . 34 1 1 A 84 84 GLN HA H 83 3.877 3.987 -0.110 1
1 927 . 34 1 1 A 84 84 GLN C C 83 177.008 177.069 -0.061 1
1 928 . 34 1 1 A 84 84 GLN CA C 83 57.543 58.817 -1.274 1
1 929 . 34 1 1 A 84 84 GLN CB C 83 28.688 28.506 0.182 1
1 931 . 34 1 1 A 84 84 GLN N N 83 114.001 117.720 -3.719 1
1 933 . 34 1 1 A 85 85 ARG H H 84 7.072 7.505 -0.433 1
1 934 . 34 1 1 A 85 85 ARG HA H 84 4.047 4.231 -0.184 1
1 942 . 34 1 1 A 85 85 ARG C C 84 175.999 175.876 0.123 1
1 943 . 34 1 1 A 85 85 ARG CA C 84 56.764 56.994 -0.230 1
1 944 . 34 1 1 A 85 85 ARG CB C 84 32.044 31.427 0.617 1
1 947 . 34 1 1 A 85 85 ARG N N 84 115.827 118.948 -3.121 1
1 949 . 34 1 1 A 86 86 ILE H H 85 8.238 7.845 0.393 1
1 950 . 34 1 1 A 86 86 ILE HA H 85 4.389 4.589 -0.200 1
1 960 . 34 1 1 A 86 86 ILE CA C 85 58.007 57.950 0.057 1
1 961 . 34 1 1 A 86 86 ILE CB C 85 39.604 39.052 0.552 1
1 965 . 34 1 1 A 86 86 ILE N N 85 119.285 117.520 1.765 1
1 966 . 34 1 1 A 87 87 PRO HA H 86 4.392 4.484 -0.092 1
1 973 . 34 1 1 A 87 87 PRO C C 86 177.622 176.784 0.838 1
1 974 . 34 1 1 A 87 87 PRO CA C 86 64.665 64.311 0.354 1
1 975 . 34 1 1 A 87 87 PRO CB C 86 32.020 31.800 0.220 1
1 978 . 34 1 1 A 88 88 GLU H H 87 8.312 8.190 0.122 1
1 979 . 34 1 1 A 88 88 GLU HA H 87 4.208 4.537 -0.329 1
1 984 . 34 1 1 A 88 88 GLU C C 87 175.554 175.899 -0.345 1
1 985 . 34 1 1 A 88 88 GLU CA C 87 56.045 56.264 -0.219 1
1 986 . 34 1 1 A 88 88 GLU CB C 87 28.654 30.522 -1.868 1
1 988 . 34 1 1 A 88 88 GLU N N 87 114.256 116.922 -2.666 1
1 989 . 34 1 1 A 89 89 PHE H H 88 7.946 7.810 0.136 1
1 990 . 34 1 1 A 89 89 PHE HA H 88 3.993 4.588 -0.595 1
1 998 . 34 1 1 A 89 89 PHE C C 88 173.460 174.333 -0.873 1
1 999 . 34 1 1 A 89 89 PHE CA C 88 60.119 58.958 1.161 1
1 1000 . 34 1 1 A 89 89 PHE CB C 88 39.994 39.911 0.083 1
1 1006 . 34 1 1 A 89 89 PHE N N 88 121.550 123.113 -1.563 1
1 1007 . 34 1 1 A 90 90 ASN H H 89 7.266 7.808 -0.542 1
1 1008 . 34 1 1 A 90 90 ASN HA H 89 4.454 4.998 -0.544 1
1 1013 . 34 1 1 A 90 90 ASN C C 89 173.921 175.220 -1.299 1
1 1014 . 34 1 1 A 90 90 ASN CA C 89 51.839 51.387 0.452 1
1 1015 . 34 1 1 A 90 90 ASN CB C 89 40.674 39.258 1.416 1
1 1016 . 34 1 1 A 90 90 ASN N N 89 125.344 124.768 0.576 1
1 1018 . 34 1 1 A 91 91 MET H H 90 8.968 8.709 0.259 1
1 1019 . 34 1 1 A 91 91 MET HA H 90 4.049 4.246 -0.197 1
1 1027 . 34 1 1 A 91 91 MET C C 90 177.475 177.790 -0.315 1
1 1028 . 34 1 1 A 91 91 MET CA C 90 57.758 57.833 -0.075 1
1 1029 . 34 1 1 A 91 91 MET CB C 90 32.250 32.453 -0.203 1
1 1032 . 34 1 1 A 91 91 MET N N 90 127.052 125.180 1.872 1
1 1033 . 34 1 1 A 92 92 ALA H H 91 8.292 8.026 0.266 1
1 1034 . 34 1 1 A 92 92 ALA HA H 91 4.059 4.077 -0.018 1
1 1038 . 34 1 1 A 92 92 ALA C C 91 180.412 179.633 0.779 1
1 1039 . 34 1 1 A 92 92 ALA CA C 91 55.368 54.856 0.512 1
1 1040 . 34 1 1 A 92 92 ALA CB C 91 17.527 18.331 -0.804 1
1 1041 . 34 1 1 A 92 92 ALA N N 91 123.752 121.264 2.488 1
1 1042 . 34 1 1 A 93 93 ALA H H 92 7.931 7.986 -0.055 1
1 1043 . 34 1 1 A 93 93 ALA HA H 92 4.054 4.059 -0.005 1
1 1047 . 34 1 1 A 93 93 ALA C C 92 180.482 179.866 0.616 1
1 1048 . 34 1 1 A 93 93 ALA CA C 92 54.614 54.826 -0.212 1
1 1049 . 34 1 1 A 93 93 ALA CB C 92 18.098 18.168 -0.070 1
1 1050 . 34 1 1 A 93 93 ALA N N 92 121.158 120.226 0.932 1
1 1051 . 34 1 1 A 94 94 PHE H H 93 8.110 7.744 0.366 1
1 1052 . 34 1 1 A 94 94 PHE HA H 93 4.304 4.170 0.134 1
1 1060 . 34 1 1 A 94 94 PHE C C 93 177.350 177.438 -0.088 1
1 1061 . 34 1 1 A 94 94 PHE CA C 93 61.641 61.434 0.207 1
1 1062 . 34 1 1 A 94 94 PHE CB C 93 40.014 39.326 0.688 1
1 1068 . 34 1 1 A 94 94 PHE N N 93 119.807 119.762 0.045 1
1 1069 . 34 1 1 A 95 95 THR H H 94 8.726 8.277 0.449 1
1 1070 . 34 1 1 A 95 95 THR HA H 94 3.569 4.056 -0.487 1
1 1075 . 34 1 1 A 95 95 THR C C 94 176.932 177.112 -0.180 1
1 1076 . 34 1 1 A 95 95 THR CA C 94 66.833 65.574 1.259 1
1 1077 . 34 1 1 A 95 95 THR CB C 94 68.445 68.261 0.184 1
1 1079 . 34 1 1 A 95 95 THR N N 94 113.074 112.492 0.582 1
1 1080 . 34 1 1 A 96 96 THR H H 95 7.657 7.876 -0.219 1
1 1081 . 34 1 1 A 96 96 THR HA H 95 3.945 4.024 -0.079 1
1 1086 . 34 1 1 A 96 96 THR C C 95 176.386 176.389 -0.003 1
1 1087 . 34 1 1 A 96 96 THR CA C 95 66.550 66.127 0.423 1
1 1088 . 34 1 1 A 96 96 THR CB C 95 68.583 68.268 0.315 1
1 1090 . 34 1 1 A 96 96 THR N N 95 117.927 116.632 1.295 1
1 1091 . 34 1 1 A 97 97 THR H H 96 7.699 7.595 0.104 1
1 1092 . 34 1 1 A 97 97 THR HA H 96 3.905 3.886 0.019 1
1 1097 . 34 1 1 A 97 97 THR C C 96 176.572 176.278 0.294 1
1 1098 . 34 1 1 A 97 97 THR CA C 96 65.979 66.284 -0.305 1
1 1099 . 34 1 1 A 97 97 THR CB C 96 68.553 68.121 0.432 1
1 1101 . 34 1 1 A 97 97 THR N N 96 118.518 117.199 1.319 1
1 1102 . 34 1 1 A 98 98 LEU H H 97 8.304 8.160 0.144 1
1 1103 . 34 1 1 A 98 98 LEU HA H 97 3.725 3.738 -0.013 1
1 1113 . 34 1 1 A 98 98 LEU C C 97 178.490 178.643 -0.153 1
1 1114 . 34 1 1 A 98 98 LEU CA C 97 58.517 57.963 0.554 1
1 1115 . 34 1 1 A 98 98 LEU CB C 97 41.697 40.995 0.702 1
1 1119 . 34 1 1 A 98 98 LEU N N 97 122.882 121.838 1.044 1
1 1120 . 34 1 1 A 99 99 GLN H H 98 7.639 7.837 -0.198 1
1 1121 . 34 1 1 A 99 99 GLN HA H 98 3.927 4.165 -0.238 1
1 1128 . 34 1 1 A 99 99 GLN C C 98 178.068 177.425 0.643 1
1 1129 . 34 1 1 A 99 99 GLN CA C 98 58.735 58.844 -0.109 1
1 1130 . 34 1 1 A 99 99 GLN CB C 98 27.986 28.600 -0.614 1
1 1132 . 34 1 1 A 99 99 GLN N N 98 114.302 118.104 -3.802 1
1 1134 . 34 1 1 A 100 100 HIS H H 99 7.575 7.524 0.051 1
1 1135 . 34 1 1 A 100 100 HIS HA H 99 4.524 4.540 -0.016 1
1 1139 . 34 1 1 A 100 100 HIS C C 99 174.789 177.027 -2.238 1
1 1140 . 34 1 1 A 100 100 HIS CA C 99 56.154 57.779 -1.625 1
1 1141 . 34 1 1 A 100 100 HIS CB C 99 28.946 31.169 -2.223 1
1 1143 . 34 1 1 A 100 100 HIS N N 99 114.778 116.435 -1.657 1
1 1144 . 34 1 1 A 101 101 HIS H H 100 7.773 8.377 -0.604 1
1 1145 . 34 1 1 A 101 101 HIS HA H 100 4.704 4.355 0.349 1
1 1149 . 34 1 1 A 101 101 HIS C C 100 174.818 177.171 -2.353 1
1 1150 . 34 1 1 A 101 101 HIS CA C 100 54.830 58.762 -3.932 1
1 1151 . 34 1 1 A 101 101 HIS CB C 100 29.749 28.601 1.148 1
1 1153 . 34 1 1 A 101 101 HIS N N 100 117.397 117.867 -0.470 1
1 1154 . 34 1 1 A 102 102 LYS H H 101 7.324 8.478 -1.154 1
1 1155 . 34 1 1 A 102 102 LYS HA H 101 3.611 4.073 -0.462 1
1 1164 . 34 1 1 A 102 102 LYS C C 101 176.823 177.609 -0.786 1
1 1165 . 34 1 1 A 102 102 LYS CA C 101 59.915 58.684 1.231 1
1 1166 . 34 1 1 A 102 102 LYS CB C 101 32.825 31.514 1.311 1
1 1170 . 34 1 1 A 102 102 LYS N N 101 120.533 118.236 2.297 1
1 1171 . 34 1 1 A 103 103 ASP H H 102 8.361 7.701 0.660 1
1 1172 . 34 1 1 A 103 103 ASP HA H 102 4.421 4.567 -0.146 1
1 1175 . 34 1 1 A 103 103 ASP C C 102 176.793 177.210 -0.417 1
1 1176 . 34 1 1 A 103 103 ASP CA C 102 55.500 56.519 -1.019 1
1 1177 . 34 1 1 A 103 103 ASP CB C 102 40.178 40.589 -0.411 1
1 1178 . 34 1 1 A 103 103 ASP N N 102 114.814 119.420 -4.606 1
1 1179 . 34 1 1 A 104 104 GLU H H 103 7.858 8.098 -0.240 1
1 1180 . 34 1 1 A 104 104 GLU HA H 103 4.339 4.446 -0.107 1
1 1183 . 34 1 1 A 104 104 GLU C C 103 175.777 176.653 -0.876 1
1 1184 . 34 1 1 A 104 104 GLU CA C 103 56.356 57.849 -1.493 1
1 1185 . 34 1 1 A 104 104 GLU CB C 103 31.293 31.407 -0.114 1
1 1186 . 34 1 1 A 104 104 GLU N N 103 116.826 119.003 -2.177 1
1 1187 . 34 1 1 A 105 105 VAL H H 104 7.201 7.746 -0.545 1
1 1188 . 34 1 1 A 105 105 VAL HA H 104 4.296 4.168 0.128 1
1 1196 . 34 1 1 A 105 105 VAL C C 104 174.482 175.685 -1.203 1
1 1197 . 34 1 1 A 105 105 VAL CA C 104 60.370 62.621 -2.251 1
1 1198 . 34 1 1 A 105 105 VAL CB C 104 34.341 32.895 1.446 1
1 1201 . 34 1 1 A 105 105 VAL N N 104 116.422 119.634 -3.212 1
1 1202 . 34 1 1 A 106 106 ALA H H 105 8.487 8.333 0.154 1
1 1203 . 34 1 1 A 106 106 ALA HA H 105 4.172 4.325 -0.153 1
1 1207 . 34 1 1 A 106 106 ALA C C 105 179.030 179.212 -0.182 1
1 1208 . 34 1 1 A 106 106 ALA CA C 105 52.966 52.713 0.253 1
1 1209 . 34 1 1 A 106 106 ALA CB C 105 19.371 19.657 -0.286 1
1 1210 . 34 1 1 A 106 106 ALA N N 105 128.313 128.602 -0.289 1
1 1211 . 34 1 1 A 107 107 GLY H H 106 8.738 8.819 -0.081 1
1 1212 . 34 1 1 A 107 107 GLY HA2 H 106 3.773 3.876 -0.103 1
1 1213 . 34 1 1 A 107 107 GLY HA3 H 106 3.998 3.946 0.052 1
1 1214 . 34 1 1 A 107 107 GLY C C 106 174.958 175.463 -0.505 1
1 1215 . 34 1 1 A 107 107 GLY CA C 106 47.449 47.181 0.268 1
1 1216 . 34 1 1 A 107 107 GLY N N 106 110.612 111.013 -0.401 1
1 1217 . 34 1 1 A 108 108 ASP H H 107 8.535 7.840 0.695 1
1 1218 . 34 1 1 A 108 108 ASP HA H 107 4.333 4.367 -0.034 1
1 1221 . 34 1 1 A 108 108 ASP C C 107 179.133 178.874 0.259 1
1 1222 . 34 1 1 A 108 108 ASP CA C 107 56.721 56.379 0.342 1
1 1223 . 34 1 1 A 108 108 ASP CB C 107 39.336 40.582 -1.246 1
1 1224 . 34 1 1 A 108 108 ASP N N 107 117.474 122.178 -4.704 1
1 1225 . 34 1 1 A 109 109 ILE H H 108 7.459 7.910 -0.451 1
1 1226 . 34 1 1 A 109 109 ILE HA H 108 3.688 3.856 -0.168 1
1 1236 . 34 1 1 A 109 109 ILE C C 108 176.735 178.490 -1.755 1
1 1237 . 34 1 1 A 109 109 ILE CA C 108 63.474 65.332 -1.858 1
1 1238 . 34 1 1 A 109 109 ILE CB C 108 37.340 37.760 -0.420 1
1 1242 . 34 1 1 A 109 109 ILE N N 108 119.609 119.914 -0.305 1
1 1243 . 34 1 1 A 110 110 PHE H H 109 7.920 8.358 -0.438 1
1 1244 . 34 1 1 A 110 110 PHE HA H 109 3.759 4.100 -0.341 1
1 1252 . 34 1 1 A 110 110 PHE C C 109 177.132 177.400 -0.268 1
1 1253 . 34 1 1 A 110 110 PHE CA C 109 62.766 61.245 1.521 1
1 1254 . 34 1 1 A 110 110 PHE CB C 109 39.752 39.328 0.424 1
1 1260 . 34 1 1 A 110 110 PHE N N 109 120.906 120.463 0.443 1
1 1261 . 34 1 1 A 111 111 ASP H H 110 8.639 8.252 0.387 1
1 1262 . 34 1 1 A 111 111 ASP HA H 110 4.216 4.197 0.019 1
1 1265 . 34 1 1 A 111 111 ASP C C 110 178.900 178.381 0.519 1
1 1266 . 34 1 1 A 111 111 ASP CA C 110 57.105 57.271 -0.166 1
1 1267 . 34 1 1 A 111 111 ASP CB C 110 39.697 41.800 -2.103 1
1 1268 . 34 1 1 A 111 111 ASP N N 110 117.124 119.038 -1.914 1
1 1269 . 34 1 1 A 112 112 MET H H 111 7.331 7.554 -0.223 1
1 1270 . 34 1 1 A 112 112 MET HA H 111 4.081 4.139 -0.058 1
1 1278 . 34 1 1 A 112 112 MET C C 111 179.052 178.183 0.869 1
1 1279 . 34 1 1 A 112 112 MET CA C 111 58.202 58.135 0.067 1
1 1280 . 34 1 1 A 112 112 MET CB C 111 31.827 32.460 -0.633 1
1 1283 . 34 1 1 A 112 112 MET N N 111 118.061 119.441 -1.380 1
1 1284 . 34 1 1 A 113 113 LEU H H 112 8.001 8.082 -0.081 1
1 1285 . 34 1 1 A 113 113 LEU HA H 112 3.723 3.656 0.067 1
1 1295 . 34 1 1 A 113 113 LEU C C 112 179.747 178.675 1.072 1
1 1296 . 34 1 1 A 113 113 LEU CA C 112 57.371 57.528 -0.157 1
1 1297 . 34 1 1 A 113 113 LEU CB C 112 40.671 41.317 -0.646 1
1 1301 . 34 1 1 A 113 113 LEU N N 112 120.426 119.700 0.726 1
1 1302 . 34 1 1 A 114 114 LEU H H 113 7.744 7.727 0.017 1
1 1303 . 34 1 1 A 114 114 LEU HA H 113 4.007 3.549 0.458 1
1 1313 . 34 1 1 A 114 114 LEU C C 113 179.358 178.473 0.885 1
1 1314 . 34 1 1 A 114 114 LEU CA C 113 57.202 57.520 -0.318 1
1 1315 . 34 1 1 A 114 114 LEU CB C 113 41.727 41.569 0.158 1
1 1319 . 34 1 1 A 114 114 LEU N N 113 119.584 119.675 -0.091 1
1 1320 . 34 1 1 A 115 115 THR H H 114 7.353 7.621 -0.268 1
1 1321 . 34 1 1 A 115 115 THR HA H 114 4.071 4.093 -0.022 1
1 1327 . 34 1 1 A 115 115 THR C C 114 173.591 176.313 -2.722 1
1 1328 . 34 1 1 A 115 115 THR CA C 114 65.332 64.387 0.945 1
1 1329 . 34 1 1 A 115 115 THR CB C 114 70.319 68.661 1.658 1
1 1331 . 34 1 1 A 115 115 THR N N 114 107.535 112.396 -4.861 1
1 1332 . 34 1 1 A 116 116 PHE H H 115 6.979 7.866 -0.887 1
1 1333 . 34 1 1 A 116 116 PHE HA H 115 5.022 4.322 0.700 1
1 1341 . 34 1 1 A 116 116 PHE C C 115 176.488 176.536 -0.048 1
1 1342 . 34 1 1 A 116 116 PHE CA C 115 55.911 61.029 -5.118 1
1 1343 . 34 1 1 A 116 116 PHE CB C 115 38.521 39.098 -0.577 1
1 1349 . 34 1 1 A 116 116 PHE N N 115 112.366 119.982 -7.616 1
1 1350 . 34 1 1 A 117 117 THR H H 116 7.564 7.470 0.094 1
1 1351 . 34 1 1 A 117 117 THR HA H 116 4.626 4.823 -0.197 1
1 1356 . 34 1 1 A 117 117 THR C C 116 174.085 174.295 -0.210 1
1 1357 . 34 1 1 A 117 117 THR CA C 116 61.636 61.878 -0.242 1
1 1358 . 34 1 1 A 117 117 THR CB C 116 70.915 70.859 0.056 1
1 1360 . 34 1 1 A 117 117 THR N N 116 105.498 105.890 -0.392 1
1 1361 . 34 1 1 A 118 118 ASP H H 117 8.270 7.777 0.493 1
1 1362 . 34 1 1 A 118 118 ASP HA H 117 4.955 4.673 0.282 1
1 1365 . 34 1 1 A 118 118 ASP C C 117 176.328 176.384 -0.056 1
1 1366 . 34 1 1 A 118 118 ASP CA C 117 53.417 53.433 -0.016 1
1 1367 . 34 1 1 A 118 118 ASP CB C 117 43.388 40.174 3.214 1
1 1368 . 34 1 1 A 118 118 ASP N N 117 124.409 122.494 1.915 1
1 1369 . 34 1 1 A 119 119 PHE H H 118 8.973 8.804 0.169 1
1 1370 . 34 1 1 A 119 119 PHE HA H 118 3.506 4.190 -0.684 1
1 1378 . 34 1 1 A 119 119 PHE CA C 118 61.490 61.116 0.374 1
1 1379 . 34 1 1 A 119 119 PHE CB C 118 39.246 39.533 -0.287 1
1 1385 . 34 1 1 A 119 119 PHE N N 118 126.688 126.373 0.315 1
1 1386 . 34 1 1 A 120 120 LEU H H 119 8.099 8.259 -0.160 1
1 1387 . 34 1 1 A 120 120 LEU HA H 119 3.842 3.994 -0.152 1
1 1397 . 34 1 1 A 120 120 LEU C C 119 179.601 178.628 0.973 1
1 1398 . 34 1 1 A 120 120 LEU CA C 119 58.174 58.006 0.168 1
1 1399 . 34 1 1 A 120 120 LEU CB C 119 40.315 41.278 -0.963 1
1 1403 . 34 1 1 A 120 120 LEU N N 119 117.930 120.388 -2.458 1
1 1404 . 34 1 1 A 121 121 ALA H H 120 7.729 7.853 -0.124 1
1 1405 . 34 1 1 A 121 121 ALA HA H 120 3.996 4.069 -0.073 1
1 1409 . 34 1 1 A 121 121 ALA C C 120 180.995 179.551 1.444 1
1 1410 . 34 1 1 A 121 121 ALA CA C 120 54.832 54.695 0.137 1
1 1411 . 34 1 1 A 121 121 ALA CB C 120 17.706 18.308 -0.602 1
1 1412 . 34 1 1 A 121 121 ALA N N 120 123.195 121.103 2.092 1
1 1413 . 34 1 1 A 122 122 PHE H H 121 7.943 7.791 0.152 1
1 1414 . 34 1 1 A 122 122 PHE HA H 121 3.887 3.830 0.057 1
1 1419 . 34 1 1 A 122 122 PHE C C 121 175.410 176.723 -1.313 1
1 1420 . 34 1 1 A 122 122 PHE CA C 121 61.075 60.653 0.422 1
1 1421 . 34 1 1 A 122 122 PHE CB C 121 38.115 38.760 -0.645 1
1 1424 . 34 1 1 A 122 122 PHE N N 121 121.798 120.389 1.409 1
1 1425 . 34 1 1 A 123 123 LYS H H 122 8.468 7.763 0.705 1
1 1426 . 34 1 1 A 123 123 LYS HA H 122 3.077 3.552 -0.475 1
1 1435 . 34 1 1 A 123 123 LYS C C 122 178.453 178.737 -0.284 1
1 1436 . 34 1 1 A 123 123 LYS CA C 122 59.855 59.815 0.040 1
1 1437 . 34 1 1 A 123 123 LYS CB C 122 32.374 32.179 0.195 1
1 1441 . 34 1 1 A 123 123 LYS N N 122 120.614 118.196 2.418 1
1 1442 . 34 1 1 A 124 124 GLU H H 123 8.100 7.676 0.424 1
1 1443 . 34 1 1 A 124 124 GLU HA H 123 3.652 3.970 -0.318 1
1 1448 . 34 1 1 A 124 124 GLU C C 123 177.743 178.446 -0.703 1
1 1449 . 34 1 1 A 124 124 GLU CA C 123 59.406 59.510 -0.104 1
1 1450 . 34 1 1 A 124 124 GLU CB C 123 28.811 29.034 -0.223 1
1 1452 . 34 1 1 A 124 124 GLU N N 123 117.404 118.935 -1.531 1
1 1453 . 34 1 1 A 125 125 MET H H 124 7.537 7.599 -0.062 1
1 1454 . 34 1 1 A 125 125 MET HA H 124 3.860 3.926 -0.066 1
1 1462 . 34 1 1 A 125 125 MET C C 124 179.522 178.282 1.240 1
1 1463 . 34 1 1 A 125 125 MET CA C 124 58.832 58.375 0.457 1
1 1464 . 34 1 1 A 125 125 MET CB C 124 31.765 31.498 0.267 1
1 1467 . 34 1 1 A 125 125 MET N N 124 119.413 118.930 0.483 1
1 1468 . 34 1 1 A 126 126 PHE H H 125 7.148 7.410 -0.262 1
1 1469 . 34 1 1 A 126 126 PHE HA H 125 3.633 4.240 -0.607 1
1 1476 . 34 1 1 A 126 126 PHE C C 125 178.994 178.359 0.635 1
1 1477 . 34 1 1 A 126 126 PHE CA C 125 63.148 61.007 2.141 1
1 1478 . 34 1 1 A 126 126 PHE CB C 125 39.830 38.347 1.483 1
1 1483 . 34 1 1 A 126 126 PHE N N 125 120.013 118.797 1.216 1
1 1484 . 34 1 1 A 127 127 LEU H H 126 8.369 8.594 -0.225 1
1 1485 . 34 1 1 A 127 127 LEU HA H 126 3.972 4.023 -0.051 1
1 1495 . 34 1 1 A 127 127 LEU C C 126 180.621 179.237 1.384 1
1 1496 . 34 1 1 A 127 127 LEU CA C 126 57.944 57.834 0.110 1
1 1497 . 34 1 1 A 127 127 LEU CB C 126 40.543 41.140 -0.597 1
1 1501 . 34 1 1 A 127 127 LEU N N 126 119.692 119.913 -0.221 1
1 1502 . 34 1 1 A 128 128 ASP H H 127 8.578 8.004 0.574 1
1 1503 . 34 1 1 A 128 128 ASP HA H 127 4.308 4.341 -0.033 1
1 1506 . 34 1 1 A 128 128 ASP C C 127 178.254 178.031 0.223 1
1 1507 . 34 1 1 A 128 128 ASP CA C 127 56.964 57.254 -0.290 1
1 1508 . 34 1 1 A 128 128 ASP CB C 127 39.735 41.009 -1.274 1
1 1509 . 34 1 1 A 128 128 ASP N N 127 121.926 119.671 2.255 1
1 1510 . 34 1 1 A 129 129 TYR H H 128 7.710 8.017 -0.307 1
1 1511 . 34 1 1 A 129 129 TYR HA H 128 3.908 4.066 -0.158 1
1 1518 . 34 1 1 A 129 129 TYR C C 128 177.633 177.851 -0.218 1
1 1519 . 34 1 1 A 129 129 TYR CA C 128 61.796 61.503 0.293 1
1 1520 . 34 1 1 A 129 129 TYR CB C 128 39.372 38.777 0.595 1
1 1525 . 34 1 1 A 129 129 TYR N N 128 122.548 120.413 2.135 1
1 1526 . 34 1 1 A 130 130 ARG H H 129 8.622 8.524 0.098 1
1 1527 . 34 1 1 A 130 130 ARG HA H 129 3.722 4.098 -0.376 1
1 1535 . 34 1 1 A 130 130 ARG CA C 129 60.084 59.474 0.610 1
1 1536 . 34 1 1 A 130 130 ARG CB C 129 29.902 29.996 -0.094 1
1 1539 . 34 1 1 A 130 130 ARG N N 129 118.302 119.667 -1.365 1
1 1541 . 34 1 1 A 131 131 ALA H H 130 7.936 8.167 -0.231 1
1 1542 . 34 1 1 A 131 131 ALA HA H 130 3.997 4.042 -0.045 1
1 1546 . 34 1 1 A 131 131 ALA C C 130 180.456 179.431 1.025 1
1 1547 . 34 1 1 A 131 131 ALA CA C 130 55.133 54.859 0.274 1
1 1548 . 34 1 1 A 131 131 ALA CB C 130 17.750 18.162 -0.412 1
1 1549 . 34 1 1 A 131 131 ALA N N 130 119.788 122.067 -2.279 1
1 1550 . 34 1 1 A 132 132 GLU H H 131 7.622 7.523 0.099 1
1 1551 . 34 1 1 A 132 132 GLU HA H 131 3.862 4.036 -0.174 1
1 1556 . 34 1 1 A 132 132 GLU C C 131 179.528 178.016 1.512 1
1 1557 . 34 1 1 A 132 132 GLU CA C 131 58.849 58.374 0.475 1
1 1558 . 34 1 1 A 132 132 GLU CB C 131 28.930 29.063 -0.133 1
1 1560 . 34 1 1 A 132 132 GLU N N 131 118.428 118.084 0.344 1
1 1561 . 34 1 1 A 133 133 LYS H H 132 7.853 7.560 0.293 1
1 1562 . 34 1 1 A 133 133 LYS HA H 132 3.722 4.107 -0.385 1
1 1571 . 34 1 1 A 133 133 LYS C C 132 175.725 177.739 -2.014 1
1 1572 . 34 1 1 A 133 133 LYS CA C 132 57.544 58.514 -0.970 1
1 1573 . 34 1 1 A 133 133 LYS CB C 132 31.770 32.164 -0.394 1
1 1577 . 34 1 1 A 133 133 LYS N N 132 119.473 118.765 0.708 1
1 1578 . 34 1 1 A 134 134 GLU H H 133 8.151 7.811 0.340 1
1 1579 . 34 1 1 A 134 134 GLU HA H 133 4.161 4.144 0.017 1
1 1584 . 34 1 1 A 134 134 GLU C C 133 177.453 179.669 -2.216 1
1 1585 . 34 1 1 A 134 134 GLU CA C 133 57.222 58.272 -1.050 1
1 1586 . 34 1 1 A 134 134 GLU CB C 133 30.091 29.592 0.499 1
1 1588 . 34 1 1 A 134 134 GLU N N 133 116.525 118.738 -2.213 1
1 1589 . 34 1 1 A 135 135 GLY H H 134 7.702 8.008 -0.306 1
1 1590 . 34 1 1 A 135 135 GLY HA2 H 134 3.896 3.701 0.195 1
1 1591 . 34 1 1 A 135 135 GLY HA3 H 134 3.897 3.710 0.187 1
1 1592 . 34 1 1 A 135 135 GLY C C 134 174.538 174.752 -0.214 1
1 1593 . 34 1 1 A 135 135 GLY CA C 134 45.975 47.199 -1.224 1
1 1594 . 34 1 1 A 135 135 GLY N N 134 107.924 109.493 -1.569 1
1 1595 . 34 1 1 A 136 136 ARG H H 135 8.045 8.149 -0.104 1
1 1596 . 34 1 1 A 136 136 ARG HA H 135 4.323 3.961 0.362 1
1 1604 . 34 1 1 A 136 136 ARG C C 135 175.864 175.500 0.364 1
1 1605 . 34 1 1 A 136 136 ARG CA C 135 56.016 56.846 -0.830 1
1 1606 . 34 1 1 A 136 136 ARG CB C 135 30.987 28.899 2.088 1
1 1609 . 34 1 1 A 136 136 ARG N N 135 119.708 119.750 -0.042 1
1 1 . 35 1 1 A 14 14 PHE CA C 13 58.199 56.826 1.373 1
1 2 . 35 1 1 A 14 14 PHE CB C 13 39.717 41.007 -1.290 1
1 3 . 35 1 1 A 15 15 SER H H 14 8.299 7.538 0.761 1
1 4 . 35 1 1 A 15 15 SER HA H 14 4.359 4.649 -0.290 1
1 7 . 35 1 1 A 15 15 SER CA C 14 58.249 58.101 0.148 1
1 8 . 35 1 1 A 15 15 SER CB C 14 63.936 64.175 -0.239 1
1 9 . 35 1 1 A 15 15 SER N N 14 117.379 115.327 2.052 1
1 10 . 35 1 1 A 16 16 SER H H 15 8.255 7.902 0.353 1
1 11 . 35 1 1 A 16 16 SER HA H 15 3.729 4.376 -0.647 1
1 14 . 35 1 1 A 16 16 SER CA C 15 58.224 60.042 -1.818 1
1 15 . 35 1 1 A 16 16 SER CB C 15 63.886 63.342 0.544 1
1 16 . 35 1 1 A 16 16 SER N N 15 117.694 115.831 1.863 1
1 17 . 35 1 1 A 17 17 ALA H H 16 8.333 7.810 0.523 1
1 18 . 35 1 1 A 17 17 ALA HA H 16 4.252 4.248 0.004 1
1 22 . 35 1 1 A 17 17 ALA CA C 16 53.377 54.211 -0.834 1
1 23 . 35 1 1 A 17 17 ALA CB C 16 18.896 18.521 0.375 1
1 24 . 35 1 1 A 17 17 ALA N N 16 125.462 124.696 0.766 1
1 25 . 35 1 1 A 18 18 SER H H 17 8.219 7.943 0.276 1
1 26 . 35 1 1 A 18 18 SER HA H 17 4.332 4.753 -0.421 1
1 29 . 35 1 1 A 18 18 SER CA C 17 59.105 57.126 1.979 1
1 30 . 35 1 1 A 18 18 SER CB C 17 63.592 64.143 -0.551 1
1 31 . 35 1 1 A 18 18 SER N N 17 114.821 108.660 6.161 1
1 32 . 35 1 1 A 19 19 ASP H H 18 8.309 8.568 -0.259 1
1 33 . 35 1 1 A 19 19 ASP HA H 18 4.554 5.017 -0.463 1
1 36 . 35 1 1 A 19 19 ASP C C 18 176.528 177.017 -0.489 1
1 37 . 35 1 1 A 19 19 ASP CA C 18 55.272 55.415 -0.143 1
1 38 . 35 1 1 A 19 19 ASP CB C 18 40.883 41.367 -0.484 1
1 39 . 35 1 1 A 19 19 ASP N N 18 123.367 120.923 2.444 1
1 40 . 35 1 1 A 20 20 ALA H H 19 8.133 8.474 -0.341 1
1 41 . 35 1 1 A 20 20 ALA HA H 19 4.170 4.073 0.097 1
1 45 . 35 1 1 A 20 20 ALA C C 19 179.857 179.057 0.800 1
1 46 . 35 1 1 A 20 20 ALA CA C 19 54.341 55.523 -1.182 1
1 47 . 35 1 1 A 20 20 ALA CB C 19 18.660 18.577 0.083 1
1 48 . 35 1 1 A 20 20 ALA N N 19 123.350 122.648 0.702 1
1 49 . 35 1 1 A 21 21 GLU H H 20 8.140 8.105 0.035 1
1 50 . 35 1 1 A 21 21 GLU HA H 20 4.128 4.078 0.050 1
1 55 . 35 1 1 A 21 21 GLU C C 20 177.675 178.695 -1.020 1
1 56 . 35 1 1 A 21 21 GLU CA C 20 58.520 59.396 -0.876 1
1 57 . 35 1 1 A 21 21 GLU CB C 20 29.765 29.656 0.109 1
1 59 . 35 1 1 A 21 21 GLU N N 20 119.063 119.061 0.002 1
1 60 . 35 1 1 A 22 22 PHE H H 21 8.009 8.075 -0.066 1
1 61 . 35 1 1 A 22 22 PHE HA H 21 4.123 4.466 -0.343 1
1 68 . 35 1 1 A 22 22 PHE C C 21 176.410 177.615 -1.205 1
1 69 . 35 1 1 A 22 22 PHE CA C 21 62.202 61.668 0.534 1
1 70 . 35 1 1 A 22 22 PHE CB C 21 39.223 39.686 -0.463 1
1 75 . 35 1 1 A 22 22 PHE N N 21 121.211 121.002 0.209 1
1 76 . 35 1 1 A 23 23 ASP H H 22 8.261 8.463 -0.202 1
1 77 . 35 1 1 A 23 23 ASP HA H 22 4.041 4.444 -0.403 1
1 80 . 35 1 1 A 23 23 ASP C C 22 179.078 178.236 0.842 1
1 81 . 35 1 1 A 23 23 ASP CA C 22 57.048 57.594 -0.546 1
1 82 . 35 1 1 A 23 23 ASP CB C 22 40.154 41.832 -1.678 1
1 83 . 35 1 1 A 23 23 ASP N N 22 116.876 119.615 -2.739 1
1 84 . 35 1 1 A 24 24 ALA H H 23 7.651 7.778 -0.127 1
1 85 . 35 1 1 A 24 24 ALA HA H 23 3.785 3.857 -0.072 1
1 89 . 35 1 1 A 24 24 ALA C C 23 179.577 179.424 0.153 1
1 90 . 35 1 1 A 24 24 ALA CA C 23 54.341 55.025 -0.684 1
1 91 . 35 1 1 A 24 24 ALA CB C 23 17.762 18.197 -0.435 1
1 92 . 35 1 1 A 24 24 ALA N N 23 121.873 121.213 0.660 1
1 93 . 35 1 1 A 25 25 VAL H H 24 7.718 7.992 -0.274 1
1 94 . 35 1 1 A 25 25 VAL HA H 24 3.216 3.499 -0.283 1
1 102 . 35 1 1 A 25 25 VAL C C 24 177.805 177.685 0.120 1
1 103 . 35 1 1 A 25 25 VAL CA C 24 66.789 66.805 -0.016 1
1 104 . 35 1 1 A 25 25 VAL CB C 24 31.277 31.191 0.086 1
1 107 . 35 1 1 A 25 25 VAL N N 24 117.890 117.769 0.121 1
1 108 . 35 1 1 A 26 26 VAL H H 25 7.867 8.059 -0.192 1
1 109 . 35 1 1 A 26 26 VAL HA H 25 3.274 3.680 -0.406 1
1 117 . 35 1 1 A 26 26 VAL C C 25 177.788 177.888 -0.100 1
1 118 . 35 1 1 A 26 26 VAL CA C 25 67.282 65.847 1.435 1
1 119 . 35 1 1 A 26 26 VAL CB C 25 31.266 30.837 0.429 1
1 122 . 35 1 1 A 26 26 VAL N N 25 118.170 120.254 -2.084 1
1 123 . 35 1 1 A 27 27 GLY H H 26 7.544 7.862 -0.318 1
1 124 . 35 1 1 A 27 27 GLY HA2 H 26 3.592 3.482 0.110 1
1 125 . 35 1 1 A 27 27 GLY HA3 H 26 3.721 3.601 0.120 1
1 126 . 35 1 1 A 27 27 GLY C C 26 176.717 176.514 0.203 1
1 127 . 35 1 1 A 27 27 GLY CA C 26 47.085 47.181 -0.096 1
1 128 . 35 1 1 A 27 27 GLY N N 26 105.795 108.749 -2.954 1
1 129 . 35 1 1 A 28 28 TYR H H 27 7.625 7.343 0.282 1
1 130 . 35 1 1 A 28 28 TYR HA H 27 4.546 4.556 -0.010 1
1 137 . 35 1 1 A 28 28 TYR C C 27 178.991 178.085 0.906 1
1 138 . 35 1 1 A 28 28 TYR CA C 27 58.845 59.667 -0.822 1
1 139 . 35 1 1 A 28 28 TYR CB C 27 37.602 37.424 0.178 1
1 144 . 35 1 1 A 28 28 TYR N N 27 119.933 121.735 -1.802 1
1 145 . 35 1 1 A 29 29 LEU H H 28 8.517 8.198 0.319 1
1 146 . 35 1 1 A 29 29 LEU HA H 28 3.728 3.819 -0.091 1
1 156 . 35 1 1 A 29 29 LEU CA C 28 58.281 58.067 0.214 1
1 157 . 35 1 1 A 29 29 LEU CB C 28 41.948 41.397 0.551 1
1 161 . 35 1 1 A 29 29 LEU N N 28 119.669 120.215 -0.546 1
1 162 . 35 1 1 A 30 30 GLU H H 29 8.072 7.942 0.130 1
1 163 . 35 1 1 A 30 30 GLU HA H 29 3.722 3.851 -0.129 1
1 168 . 35 1 1 A 30 30 GLU C C 29 177.731 178.841 -1.110 1
1 169 . 35 1 1 A 30 30 GLU CA C 29 59.763 59.931 -0.168 1
1 170 . 35 1 1 A 30 30 GLU CB C 29 28.844 29.357 -0.513 1
1 172 . 35 1 1 A 30 30 GLU N N 29 117.666 117.630 0.036 1
1 173 . 35 1 1 A 31 31 ASP H H 30 7.243 8.028 -0.785 1
1 174 . 35 1 1 A 31 31 ASP HA H 30 4.297 4.359 -0.062 1
1 177 . 35 1 1 A 31 31 ASP CA C 30 56.953 57.370 -0.417 1
1 178 . 35 1 1 A 31 31 ASP CB C 30 40.730 42.331 -1.601 1
1 179 . 35 1 1 A 31 31 ASP N N 30 116.720 119.076 -2.356 1
1 180 . 35 1 1 A 32 32 ILE H H 31 7.940 7.537 0.403 1
1 181 . 35 1 1 A 32 32 ILE HA H 31 3.640 3.683 -0.043 1
1 191 . 35 1 1 A 32 32 ILE C C 31 177.980 178.103 -0.123 1
1 192 . 35 1 1 A 32 32 ILE CA C 31 64.692 64.344 0.348 1
1 193 . 35 1 1 A 32 32 ILE CB C 31 38.938 37.396 1.542 1
1 197 . 35 1 1 A 32 32 ILE N N 31 119.728 118.859 0.869 1
1 198 . 35 1 1 A 33 33 ILE H H 32 7.984 7.684 0.300 1
1 199 . 35 1 1 A 33 33 ILE HA H 32 3.598 2.959 0.639 1
1 209 . 35 1 1 A 33 33 ILE C C 32 176.723 177.014 -0.291 1
1 210 . 35 1 1 A 33 33 ILE CA C 32 63.241 64.438 -1.197 1
1 211 . 35 1 1 A 33 33 ILE CB C 32 37.580 37.857 -0.277 1
1 215 . 35 1 1 A 33 33 ILE N N 32 113.919 120.617 -6.698 1
1 216 . 35 1 1 A 34 34 MET H H 33 7.288 7.911 -0.623 1
1 217 . 35 1 1 A 34 34 MET HA H 33 4.496 4.501 -0.005 1
1 225 . 35 1 1 A 34 34 MET C C 33 176.423 175.923 0.500 1
1 226 . 35 1 1 A 34 34 MET CA C 33 54.634 55.077 -0.443 1
1 227 . 35 1 1 A 34 34 MET CB C 33 31.934 32.230 -0.296 1
1 230 . 35 1 1 A 34 34 MET N N 33 115.130 116.483 -1.353 1
1 231 . 35 1 1 A 35 35 ASP H H 34 7.405 7.712 -0.307 1
1 232 . 35 1 1 A 35 35 ASP HA H 34 4.484 4.543 -0.059 1
1 235 . 35 1 1 A 35 35 ASP C C 34 177.139 176.914 0.225 1
1 236 . 35 1 1 A 35 35 ASP CA C 34 54.625 54.641 -0.016 1
1 237 . 35 1 1 A 35 35 ASP CB C 34 43.554 42.792 0.762 1
1 238 . 35 1 1 A 35 35 ASP N N 34 121.814 121.955 -0.141 1
1 239 . 35 1 1 A 36 36 ASP H H 35 8.765 8.793 -0.028 1
1 240 . 35 1 1 A 36 36 ASP HA H 35 4.235 4.299 -0.064 1
1 243 . 35 1 1 A 36 36 ASP C C 35 178.320 178.423 -0.103 1
1 244 . 35 1 1 A 36 36 ASP CA C 35 57.832 57.989 -0.157 1
1 245 . 35 1 1 A 36 36 ASP CB C 35 40.914 40.386 0.528 1
1 246 . 35 1 1 A 36 36 ASP N N 35 125.883 125.059 0.824 1
1 247 . 35 1 1 A 37 37 GLU H H 36 8.905 8.077 0.828 1
1 248 . 35 1 1 A 37 37 GLU HA H 36 3.933 4.050 -0.117 1
1 253 . 35 1 1 A 37 37 GLU C C 36 179.304 179.074 0.230 1
1 254 . 35 1 1 A 37 37 GLU CA C 36 59.828 59.209 0.619 1
1 255 . 35 1 1 A 37 37 GLU CB C 36 29.380 29.386 -0.006 1
1 257 . 35 1 1 A 37 37 GLU N N 36 119.077 120.397 -1.320 1
1 258 . 35 1 1 A 38 38 PHE H H 37 7.460 8.101 -0.641 1
1 259 . 35 1 1 A 38 38 PHE HA H 37 3.642 4.043 -0.401 1
1 267 . 35 1 1 A 38 38 PHE C C 37 176.483 178.121 -1.638 1
1 268 . 35 1 1 A 38 38 PHE CA C 37 61.411 61.190 0.221 1
1 269 . 35 1 1 A 38 38 PHE CB C 37 39.355 39.100 0.255 1
1 275 . 35 1 1 A 38 38 PHE N N 37 119.968 120.575 -0.607 1
1 276 . 35 1 1 A 39 39 GLN H H 38 7.968 8.106 -0.138 1
1 277 . 35 1 1 A 39 39 GLN HA H 38 3.712 3.845 -0.133 1
1 284 . 35 1 1 A 39 39 GLN CA C 38 59.153 58.871 0.282 1
1 285 . 35 1 1 A 39 39 GLN CB C 38 28.213 28.444 -0.231 1
1 287 . 35 1 1 A 39 39 GLN N N 38 116.433 118.646 -2.213 1
1 289 . 35 1 1 A 40 40 LEU H H 39 7.930 7.749 0.181 1
1 290 . 35 1 1 A 40 40 LEU HA H 39 3.916 4.014 -0.098 1
1 300 . 35 1 1 A 40 40 LEU C C 39 177.731 178.154 -0.423 1
1 301 . 35 1 1 A 40 40 LEU CA C 39 57.915 57.961 -0.046 1
1 302 . 35 1 1 A 40 40 LEU CB C 39 41.989 41.598 0.391 1
1 306 . 35 1 1 A 40 40 LEU N N 39 119.505 121.425 -1.920 1
1 307 . 35 1 1 A 41 41 LEU H H 40 7.174 7.816 -0.642 1
1 308 . 35 1 1 A 41 41 LEU HA H 40 3.835 3.995 -0.160 1
1 318 . 35 1 1 A 41 41 LEU C C 40 179.738 178.317 1.421 1
1 319 . 35 1 1 A 41 41 LEU CA C 40 58.266 58.326 -0.060 1
1 320 . 35 1 1 A 41 41 LEU CB C 40 42.050 41.458 0.592 1
1 324 . 35 1 1 A 41 41 LEU N N 40 120.971 119.708 1.263 1
1 325 . 35 1 1 A 42 42 GLN H H 41 8.058 7.877 0.181 1
1 326 . 35 1 1 A 42 42 GLN HA H 41 3.556 3.666 -0.110 1
1 333 . 35 1 1 A 42 42 GLN C C 41 177.642 178.233 -0.591 1
1 334 . 35 1 1 A 42 42 GLN CA C 41 59.826 59.141 0.685 1
1 335 . 35 1 1 A 42 42 GLN CB C 41 28.762 28.135 0.627 1
1 337 . 35 1 1 A 42 42 GLN N N 41 117.899 117.881 0.018 1
1 339 . 35 1 1 A 43 43 ARG H H 42 8.179 7.643 0.536 1
1 340 . 35 1 1 A 43 43 ARG HA H 42 3.655 3.994 -0.339 1
1 347 . 35 1 1 A 43 43 ARG C C 42 178.051 178.760 -0.709 1
1 348 . 35 1 1 A 43 43 ARG CA C 42 59.766 58.933 0.833 1
1 349 . 35 1 1 A 43 43 ARG CB C 42 29.941 29.587 0.354 1
1 352 . 35 1 1 A 43 43 ARG N N 42 119.392 118.290 1.102 1
1 353 . 35 1 1 A 44 44 ASN H H 43 8.525 8.197 0.328 1
1 354 . 35 1 1 A 44 44 ASN HA H 43 4.332 4.377 -0.045 1
1 359 . 35 1 1 A 44 44 ASN C C 43 178.150 177.804 0.346 1
1 360 . 35 1 1 A 44 44 ASN CA C 43 55.841 56.198 -0.357 1
1 361 . 35 1 1 A 44 44 ASN CB C 43 37.632 39.274 -1.642 1
1 362 . 35 1 1 A 44 44 ASN N N 43 116.214 117.596 -1.382 1
1 364 . 35 1 1 A 45 45 PHE H H 44 7.586 7.998 -0.412 1
1 365 . 35 1 1 A 45 45 PHE HA H 44 4.132 4.342 -0.210 1
1 372 . 35 1 1 A 45 45 PHE C C 44 176.691 178.651 -1.960 1
1 373 . 35 1 1 A 45 45 PHE CA C 44 62.333 60.716 1.617 1
1 374 . 35 1 1 A 45 45 PHE CB C 44 39.449 38.877 0.572 1
1 379 . 35 1 1 A 45 45 PHE N N 44 121.501 117.884 3.617 1
1 380 . 35 1 1 A 46 46 MET H H 45 8.190 8.382 -0.192 1
1 381 . 35 1 1 A 46 46 MET HA H 45 4.060 4.473 -0.413 1
1 389 . 35 1 1 A 46 46 MET C C 45 179.754 178.353 1.401 1
1 390 . 35 1 1 A 46 46 MET CA C 45 57.742 58.157 -0.415 1
1 391 . 35 1 1 A 46 46 MET CB C 45 29.912 31.399 -1.487 1
1 394 . 35 1 1 A 46 46 MET N N 45 116.727 117.750 -1.023 1
1 395 . 35 1 1 A 47 47 ASP H H 46 8.579 8.302 0.277 1
1 396 . 35 1 1 A 47 47 ASP HA H 46 4.804 4.768 0.036 1
1 399 . 35 1 1 A 47 47 ASP C C 46 177.854 178.520 -0.666 1
1 400 . 35 1 1 A 47 47 ASP CA C 46 57.277 57.448 -0.171 1
1 401 . 35 1 1 A 47 47 ASP CB C 46 40.776 41.424 -0.648 1
1 402 . 35 1 1 A 47 47 ASP N N 46 117.798 120.745 -2.947 1
1 403 . 35 1 1 A 48 48 LYS H H 47 7.339 8.089 -0.750 1
1 404 . 35 1 1 A 48 48 LYS HA H 47 3.828 4.148 -0.320 1
1 413 . 35 1 1 A 48 48 LYS C C 47 178.812 179.017 -0.205 1
1 414 . 35 1 1 A 48 48 LYS CA C 47 58.953 58.618 0.335 1
1 415 . 35 1 1 A 48 48 LYS CB C 47 32.796 32.464 0.332 1
1 419 . 35 1 1 A 48 48 LYS N N 47 117.852 119.630 -1.778 1
1 420 . 35 1 1 A 49 49 TYR H H 48 6.841 8.694 -1.853 1
1 421 . 35 1 1 A 49 49 TYR HA H 48 4.995 4.730 0.265 1
1 428 . 35 1 1 A 49 49 TYR C C 48 178.138 178.970 -0.832 1
1 429 . 35 1 1 A 49 49 TYR CA C 48 58.620 60.060 -1.440 1
1 430 . 35 1 1 A 49 49 TYR CB C 48 42.939 38.169 4.770 1
1 435 . 35 1 1 A 49 49 TYR N N 48 112.109 119.929 -7.820 1
1 436 . 35 1 1 A 50 50 TYR H H 49 8.491 8.303 0.188 1
1 437 . 35 1 1 A 50 50 TYR HA H 49 4.598 4.510 0.088 1
1 444 . 35 1 1 A 50 50 TYR C C 49 176.015 178.074 -2.059 1
1 445 . 35 1 1 A 50 50 TYR CA C 49 62.442 59.681 2.761 1
1 446 . 35 1 1 A 50 50 TYR CB C 49 36.588 37.048 -0.460 1
1 451 . 35 1 1 A 50 50 TYR N N 49 118.294 119.901 -1.607 1
1 452 . 35 1 1 A 51 51 LEU H H 50 7.512 7.922 -0.410 1
1 453 . 35 1 1 A 51 51 LEU HA H 50 3.878 3.542 0.336 1
1 463 . 35 1 1 A 51 51 LEU C C 50 178.625 179.056 -0.431 1
1 464 . 35 1 1 A 51 51 LEU CA C 50 55.994 57.598 -1.604 1
1 465 . 35 1 1 A 51 51 LEU CB C 50 40.743 41.402 -0.659 1
1 469 . 35 1 1 A 51 51 LEU N N 50 118.478 122.137 -3.659 1
1 470 . 35 1 1 A 52 52 GLU H H 51 8.042 8.280 -0.238 1
1 471 . 35 1 1 A 52 52 GLU HA H 51 4.197 4.000 0.197 1
1 476 . 35 1 1 A 52 52 GLU C C 51 177.629 176.952 0.677 1
1 477 . 35 1 1 A 52 52 GLU CA C 51 56.141 59.106 -2.965 1
1 478 . 35 1 1 A 52 52 GLU CB C 51 29.162 29.033 0.129 1
1 480 . 35 1 1 A 52 52 GLU N N 51 115.067 118.039 -2.972 1
1 481 . 35 1 1 A 53 53 PHE H H 52 7.465 7.927 -0.462 1
1 482 . 35 1 1 A 53 53 PHE HA H 52 4.431 4.673 -0.242 1
1 490 . 35 1 1 A 53 53 PHE C C 52 174.325 174.704 -0.379 1
1 491 . 35 1 1 A 53 53 PHE CA C 52 58.986 57.622 1.364 1
1 492 . 35 1 1 A 53 53 PHE CB C 52 40.183 37.950 2.233 1
1 498 . 35 1 1 A 53 53 PHE N N 52 116.768 119.306 -2.538 1
1 499 . 35 1 1 A 54 54 GLU H H 53 7.484 7.847 -0.363 1
1 500 . 35 1 1 A 54 54 GLU HA H 53 4.583 5.072 -0.489 1
1 505 . 35 1 1 A 54 54 GLU C C 53 175.722 175.076 0.646 1
1 506 . 35 1 1 A 54 54 GLU CA C 53 54.248 55.420 -1.172 1
1 507 . 35 1 1 A 54 54 GLU CB C 53 34.409 31.719 2.690 1
1 509 . 35 1 1 A 54 54 GLU N N 53 118.844 122.186 -3.342 1
1 510 . 35 1 1 A 55 55 ASP H H 54 9.008 8.672 0.336 1
1 511 . 35 1 1 A 55 55 ASP HA H 54 4.735 4.853 -0.118 1
1 514 . 35 1 1 A 55 55 ASP C C 54 175.421 176.198 -0.777 1
1 515 . 35 1 1 A 55 55 ASP CA C 54 52.888 54.171 -1.283 1
1 516 . 35 1 1 A 55 55 ASP CB C 54 38.894 40.975 -2.081 1
1 517 . 35 1 1 A 55 55 ASP N N 54 123.654 123.035 0.619 1
1 518 . 35 1 1 A 56 56 THR H H 55 7.819 8.694 -0.875 1
1 519 . 35 1 1 A 56 56 THR HA H 55 4.574 5.009 -0.435 1
1 524 . 35 1 1 A 56 56 THR C C 55 174.096 174.254 -0.158 1
1 525 . 35 1 1 A 56 56 THR CA C 55 59.172 59.476 -0.304 1
1 526 . 35 1 1 A 56 56 THR CB C 55 71.889 72.073 -0.184 1
1 528 . 35 1 1 A 56 56 THR N N 55 112.015 113.965 -1.950 1
1 529 . 35 1 1 A 57 57 GLU H H 56 8.527 8.715 -0.188 1
1 530 . 35 1 1 A 57 57 GLU HA H 56 4.217 4.491 -0.274 1
1 535 . 35 1 1 A 57 57 GLU C C 56 177.042 175.561 1.481 1
1 536 . 35 1 1 A 57 57 GLU CA C 56 56.869 56.097 0.772 1
1 537 . 35 1 1 A 57 57 GLU CB C 56 29.731 29.779 -0.048 1
1 539 . 35 1 1 A 57 57 GLU N N 56 117.531 118.583 -1.052 1
1 540 . 35 1 1 A 58 58 GLU H H 57 7.587 7.868 -0.281 1
1 541 . 35 1 1 A 58 58 GLU HA H 57 3.941 4.857 -0.916 1
1 546 . 35 1 1 A 58 58 GLU C C 57 176.849 174.737 2.112 1
1 547 . 35 1 1 A 58 58 GLU CA C 57 56.924 54.802 2.122 1
1 548 . 35 1 1 A 58 58 GLU CB C 57 30.251 32.914 -2.663 1
1 550 . 35 1 1 A 58 58 GLU N N 57 119.183 120.180 -0.997 1
1 551 . 35 1 1 A 59 59 ASN H H 58 9.120 8.886 0.234 1
1 552 . 35 1 1 A 59 59 ASN HA H 58 4.922 5.312 -0.390 1
1 557 . 35 1 1 A 59 59 ASN C C 58 174.254 174.171 0.083 1
1 558 . 35 1 1 A 59 59 ASN CA C 58 51.956 52.123 -0.167 1
1 559 . 35 1 1 A 59 59 ASN CB C 58 37.404 39.587 -2.183 1
1 560 . 35 1 1 A 59 59 ASN N N 58 126.767 121.361 5.406 1
1 562 . 35 1 1 A 60 60 LYS H H 59 5.892 8.867 -2.975 1
1 563 . 35 1 1 A 60 60 LYS HA H 59 3.798 4.359 -0.561 1
1 572 . 35 1 1 A 60 60 LYS C C 59 177.908 177.596 0.312 1
1 573 . 35 1 1 A 60 60 LYS CA C 59 56.623 55.732 0.891 1
1 574 . 35 1 1 A 60 60 LYS CB C 59 32.279 33.092 -0.813 1
1 578 . 35 1 1 A 60 60 LYS N N 59 121.527 126.881 -5.354 1
1 579 . 35 1 1 A 61 61 LEU H H 60 8.473 8.635 -0.162 1
1 580 . 35 1 1 A 61 61 LEU HA H 60 3.891 4.129 -0.238 1
1 590 . 35 1 1 A 61 61 LEU C C 60 179.843 178.306 1.537 1
1 591 . 35 1 1 A 61 61 LEU CA C 60 58.301 56.100 2.201 1
1 592 . 35 1 1 A 61 61 LEU CB C 60 41.305 41.475 -0.170 1
1 596 . 35 1 1 A 61 61 LEU N N 60 125.639 122.590 3.049 1
1 597 . 35 1 1 A 62 62 ILE H H 61 7.698 7.608 0.090 1
1 598 . 35 1 1 A 62 62 ILE HA H 61 3.952 3.813 0.139 1
1 608 . 35 1 1 A 62 62 ILE C C 61 175.392 177.090 -1.698 1
1 609 . 35 1 1 A 62 62 ILE CA C 61 61.743 63.275 -1.532 1
1 610 . 35 1 1 A 62 62 ILE CB C 61 39.108 37.647 1.461 1
1 614 . 35 1 1 A 62 62 ILE N N 61 114.111 119.798 -5.687 1
1 615 . 35 1 1 A 63 63 TYR H H 62 7.273 7.395 -0.122 1
1 616 . 35 1 1 A 63 63 TYR HA H 62 4.343 4.182 0.161 1
1 623 . 35 1 1 A 63 63 TYR C C 62 178.264 178.525 -0.261 1
1 624 . 35 1 1 A 63 63 TYR CA C 62 57.231 60.847 -3.616 1
1 625 . 35 1 1 A 63 63 TYR CB C 62 36.332 37.368 -1.036 1
1 630 . 35 1 1 A 63 63 TYR N N 62 117.689 121.387 -3.698 1
1 631 . 35 1 1 A 64 64 THR H H 63 7.747 7.936 -0.189 1
1 632 . 35 1 1 A 64 64 THR HA H 63 4.266 4.178 0.088 1
1 637 . 35 1 1 A 64 64 THR CA C 63 69.362 67.520 1.842 1
1 638 . 35 1 1 A 64 64 THR CB C 63 66.962 67.654 -0.692 1
1 640 . 35 1 1 A 64 64 THR N N 63 113.755 116.241 -2.486 1
1 641 . 35 1 1 A 65 65 PRO HA H 64 4.372 4.350 0.022 1
1 648 . 35 1 1 A 65 65 PRO C C 64 179.913 179.327 0.586 1
1 649 . 35 1 1 A 65 65 PRO CA C 64 66.011 66.261 -0.250 1
1 650 . 35 1 1 A 65 65 PRO CB C 64 30.642 30.723 -0.081 1
1 653 . 35 1 1 A 66 66 ILE H H 65 7.377 7.358 0.019 1
1 654 . 35 1 1 A 66 66 ILE HA H 65 3.530 3.828 -0.298 1
1 664 . 35 1 1 A 66 66 ILE C C 65 177.543 178.283 -0.740 1
1 665 . 35 1 1 A 66 66 ILE CA C 65 66.647 64.435 2.212 1
1 666 . 35 1 1 A 66 66 ILE CB C 65 38.029 37.769 0.260 1
1 670 . 35 1 1 A 66 66 ILE N N 65 118.353 116.646 1.707 1
1 671 . 35 1 1 A 67 67 PHE H H 66 8.480 8.323 0.157 1
1 672 . 35 1 1 A 67 67 PHE HA H 66 4.115 4.077 0.038 1
1 680 . 35 1 1 A 67 67 PHE C C 66 177.293 177.499 -0.206 1
1 681 . 35 1 1 A 67 67 PHE CA C 66 59.570 62.215 -2.645 1
1 682 . 35 1 1 A 67 67 PHE CB C 66 38.865 39.140 -0.275 1
1 688 . 35 1 1 A 67 67 PHE N N 66 122.420 120.396 2.024 1
1 689 . 35 1 1 A 68 68 ASN H H 67 8.595 8.196 0.399 1
1 690 . 35 1 1 A 68 68 ASN HA H 67 4.211 4.360 -0.149 1
1 695 . 35 1 1 A 68 68 ASN C C 67 178.697 177.998 0.699 1
1 696 . 35 1 1 A 68 68 ASN CA C 67 56.056 56.261 -0.205 1
1 697 . 35 1 1 A 68 68 ASN CB C 67 37.704 38.026 -0.322 1
1 698 . 35 1 1 A 68 68 ASN N N 67 115.573 117.228 -1.655 1
1 700 . 35 1 1 A 69 69 GLU H H 68 8.414 7.950 0.464 1
1 701 . 35 1 1 A 69 69 GLU HA H 68 4.102 4.182 -0.080 1
1 706 . 35 1 1 A 69 69 GLU C C 68 177.880 178.824 -0.944 1
1 707 . 35 1 1 A 69 69 GLU CA C 68 59.399 59.388 0.011 1
1 708 . 35 1 1 A 69 69 GLU CB C 68 29.855 29.434 0.421 1
1 710 . 35 1 1 A 69 69 GLU N N 68 123.510 120.037 3.473 1
1 711 . 35 1 1 A 70 70 TYR H H 69 8.659 8.074 0.585 1
1 712 . 35 1 1 A 70 70 TYR HA H 69 3.362 4.132 -0.770 1
1 719 . 35 1 1 A 70 70 TYR C C 69 178.143 177.043 1.100 1
1 720 . 35 1 1 A 70 70 TYR CA C 69 60.686 61.038 -0.352 1
1 721 . 35 1 1 A 70 70 TYR CB C 69 38.560 38.997 -0.437 1
1 726 . 35 1 1 A 70 70 TYR N N 69 122.130 120.826 1.304 1
1 727 . 35 1 1 A 71 71 ILE H H 70 8.031 7.767 0.264 1
1 728 . 35 1 1 A 71 71 ILE HA H 70 3.265 3.795 -0.530 1
1 738 . 35 1 1 A 71 71 ILE C C 70 178.056 177.763 0.293 1
1 739 . 35 1 1 A 71 71 ILE CA C 70 63.756 64.020 -0.264 1
1 740 . 35 1 1 A 71 71 ILE CB C 70 37.321 36.683 0.638 1
1 744 . 35 1 1 A 71 71 ILE N N 70 118.906 120.154 -1.248 1
1 745 . 35 1 1 A 72 72 SER H H 71 7.803 7.946 -0.143 1
1 746 . 35 1 1 A 72 72 SER HA H 71 4.029 4.386 -0.357 1
1 749 . 35 1 1 A 72 72 SER CA C 71 61.380 61.149 0.231 1
1 750 . 35 1 1 A 72 72 SER CB C 71 63.288 63.478 -0.190 1
1 751 . 35 1 1 A 72 72 SER N N 71 113.735 118.686 -4.951 1
1 752 . 35 1 1 A 73 73 LEU H H 72 7.952 7.997 -0.045 1
1 753 . 35 1 1 A 73 73 LEU HA H 72 4.418 4.110 0.308 1
1 763 . 35 1 1 A 73 73 LEU C C 72 177.767 178.319 -0.552 1
1 764 . 35 1 1 A 73 73 LEU CA C 72 56.543 57.428 -0.885 1
1 765 . 35 1 1 A 73 73 LEU CB C 72 44.517 41.677 2.840 1
1 769 . 35 1 1 A 73 73 LEU N N 72 119.411 122.466 -3.055 1
1 770 . 35 1 1 A 74 74 VAL H H 73 8.021 7.674 0.347 1
1 771 . 35 1 1 A 74 74 VAL HA H 73 3.532 3.338 0.194 1
1 779 . 35 1 1 A 74 74 VAL C C 73 177.126 178.017 -0.891 1
1 780 . 35 1 1 A 74 74 VAL CA C 73 66.250 66.338 -0.088 1
1 781 . 35 1 1 A 74 74 VAL CB C 73 31.212 31.142 0.070 1
1 784 . 35 1 1 A 74 74 VAL N N 73 118.747 119.243 -0.496 1
1 785 . 35 1 1 A 75 75 GLU H H 74 7.232 8.057 -0.825 1
1 786 . 35 1 1 A 75 75 GLU HA H 74 3.013 4.264 -1.251 1
1 791 . 35 1 1 A 75 75 GLU C C 74 178.804 179.473 -0.669 1
1 792 . 35 1 1 A 75 75 GLU CA C 74 60.536 59.945 0.591 1
1 793 . 35 1 1 A 75 75 GLU CB C 74 27.009 29.131 -2.122 1
1 795 . 35 1 1 A 75 75 GLU N N 74 118.660 119.814 -1.154 1
1 796 . 35 1 1 A 76 76 LYS H H 75 7.051 8.028 -0.977 1
1 797 . 35 1 1 A 76 76 LYS HA H 75 3.765 4.125 -0.360 1
1 806 . 35 1 1 A 76 76 LYS C C 75 177.765 178.354 -0.589 1
1 807 . 35 1 1 A 76 76 LYS CA C 75 58.357 58.515 -0.158 1
1 808 . 35 1 1 A 76 76 LYS CB C 75 31.939 32.535 -0.596 1
1 812 . 35 1 1 A 76 76 LYS N N 75 116.112 119.451 -3.339 1
1 813 . 35 1 1 A 77 77 TYR H H 76 7.067 7.996 -0.929 1
1 814 . 35 1 1 A 77 77 TYR HA H 76 4.036 4.143 -0.107 1
1 821 . 35 1 1 A 77 77 TYR C C 76 177.752 177.263 0.489 1
1 822 . 35 1 1 A 77 77 TYR CA C 76 61.820 61.470 0.350 1
1 823 . 35 1 1 A 77 77 TYR CB C 76 38.480 38.702 -0.222 1
1 828 . 35 1 1 A 77 77 TYR N N 76 118.434 121.811 -3.377 1
1 829 . 35 1 1 A 78 78 ILE H H 77 7.554 8.315 -0.761 1
1 830 . 35 1 1 A 78 78 ILE HA H 77 3.159 3.607 -0.448 1
1 840 . 35 1 1 A 78 78 ILE C C 77 177.341 177.987 -0.646 1
1 841 . 35 1 1 A 78 78 ILE CA C 77 65.177 65.115 0.062 1
1 842 . 35 1 1 A 78 78 ILE CB C 77 37.339 37.619 -0.280 1
1 846 . 35 1 1 A 78 78 ILE N N 77 117.672 121.418 -3.746 1
1 847 . 35 1 1 A 79 79 GLU H H 78 8.296 7.986 0.310 1
1 848 . 35 1 1 A 79 79 GLU HA H 78 3.557 3.889 -0.332 1
1 853 . 35 1 1 A 79 79 GLU C C 78 177.742 178.938 -1.196 1
1 854 . 35 1 1 A 79 79 GLU CA C 78 60.847 60.161 0.686 1
1 855 . 35 1 1 A 79 79 GLU CB C 78 29.594 29.263 0.331 1
1 857 . 35 1 1 A 79 79 GLU N N 78 118.701 120.740 -2.039 1
1 858 . 35 1 1 A 80 80 GLU H H 79 8.330 8.341 -0.011 1
1 859 . 35 1 1 A 80 80 GLU HA H 79 3.774 4.038 -0.264 1
1 864 . 35 1 1 A 80 80 GLU C C 79 179.926 179.306 0.620 1
1 865 . 35 1 1 A 80 80 GLU CA C 79 59.581 58.947 0.634 1
1 866 . 35 1 1 A 80 80 GLU CB C 79 29.062 28.964 0.098 1
1 868 . 35 1 1 A 80 80 GLU N N 79 116.767 118.038 -1.271 1
1 869 . 35 1 1 A 81 81 GLN H H 80 7.634 7.828 -0.194 1
1 870 . 35 1 1 A 81 81 GLN HA H 80 3.605 3.878 -0.273 1
1 877 . 35 1 1 A 81 81 GLN C C 80 179.681 178.475 1.206 1
1 878 . 35 1 1 A 81 81 GLN CA C 80 57.765 58.420 -0.655 1
1 879 . 35 1 1 A 81 81 GLN CB C 80 28.079 27.998 0.081 1
1 881 . 35 1 1 A 81 81 GLN N N 80 116.325 118.549 -2.224 1
1 883 . 35 1 1 A 82 82 LEU H H 81 8.156 7.606 0.550 1
1 884 . 35 1 1 A 82 82 LEU HA H 81 3.536 3.846 -0.310 1
1 894 . 35 1 1 A 82 82 LEU C C 81 178.945 179.556 -0.611 1
1 895 . 35 1 1 A 82 82 LEU CA C 81 57.761 56.914 0.847 1
1 896 . 35 1 1 A 82 82 LEU CB C 81 40.961 41.112 -0.151 1
1 900 . 35 1 1 A 82 82 LEU N N 81 121.546 120.407 1.139 1
1 901 . 35 1 1 A 83 83 LEU H H 82 8.326 8.110 0.216 1
1 902 . 35 1 1 A 83 83 LEU HA H 82 4.198 4.294 -0.096 1
1 912 . 35 1 1 A 83 83 LEU C C 82 178.631 179.248 -0.617 1
1 913 . 35 1 1 A 83 83 LEU CA C 82 57.016 57.172 -0.156 1
1 914 . 35 1 1 A 83 83 LEU CB C 82 42.182 40.844 1.338 1
1 918 . 35 1 1 A 83 83 LEU N N 82 120.426 119.317 1.109 1
1 919 . 35 1 1 A 84 84 GLN H H 83 6.992 7.723 -0.731 1
1 920 . 35 1 1 A 84 84 GLN HA H 83 3.877 4.001 -0.124 1
1 927 . 35 1 1 A 84 84 GLN C C 83 177.008 176.992 0.016 1
1 928 . 35 1 1 A 84 84 GLN CA C 83 57.543 58.591 -1.048 1
1 929 . 35 1 1 A 84 84 GLN CB C 83 28.688 28.438 0.250 1
1 931 . 35 1 1 A 84 84 GLN N N 83 114.001 117.298 -3.297 1
1 933 . 35 1 1 A 85 85 ARG H H 84 7.072 7.492 -0.420 1
1 934 . 35 1 1 A 85 85 ARG HA H 84 4.047 4.382 -0.335 1
1 942 . 35 1 1 A 85 85 ARG C C 84 175.999 175.674 0.325 1
1 943 . 35 1 1 A 85 85 ARG CA C 84 56.764 56.015 0.749 1
1 944 . 35 1 1 A 85 85 ARG CB C 84 32.044 32.531 -0.487 1
1 947 . 35 1 1 A 85 85 ARG N N 84 115.827 116.469 -0.642 1
1 949 . 35 1 1 A 86 86 ILE H H 85 8.238 7.788 0.450 1
1 950 . 35 1 1 A 86 86 ILE HA H 85 4.389 4.590 -0.201 1
1 960 . 35 1 1 A 86 86 ILE CA C 85 58.007 57.882 0.125 1
1 961 . 35 1 1 A 86 86 ILE CB C 85 39.604 38.785 0.819 1
1 965 . 35 1 1 A 86 86 ILE N N 85 119.285 119.838 -0.553 1
1 966 . 35 1 1 A 87 87 PRO HA H 86 4.392 4.520 -0.128 1
1 973 . 35 1 1 A 87 87 PRO C C 86 177.622 176.509 1.113 1
1 974 . 35 1 1 A 87 87 PRO CA C 86 64.665 64.318 0.347 1
1 975 . 35 1 1 A 87 87 PRO CB C 86 32.020 31.775 0.245 1
1 978 . 35 1 1 A 88 88 GLU H H 87 8.312 8.215 0.097 1
1 979 . 35 1 1 A 88 88 GLU HA H 87 4.208 4.585 -0.377 1
1 984 . 35 1 1 A 88 88 GLU C C 87 175.554 175.800 -0.246 1
1 985 . 35 1 1 A 88 88 GLU CA C 87 56.045 56.195 -0.150 1
1 986 . 35 1 1 A 88 88 GLU CB C 87 28.654 30.514 -1.860 1
1 988 . 35 1 1 A 88 88 GLU N N 87 114.256 116.780 -2.524 1
1 989 . 35 1 1 A 89 89 PHE H H 88 7.946 7.631 0.315 1
1 990 . 35 1 1 A 89 89 PHE HA H 88 3.993 4.384 -0.391 1
1 998 . 35 1 1 A 89 89 PHE C C 88 173.460 174.560 -1.100 1
1 999 . 35 1 1 A 89 89 PHE CA C 88 60.119 59.492 0.627 1
1 1000 . 35 1 1 A 89 89 PHE CB C 88 39.994 39.656 0.338 1
1 1006 . 35 1 1 A 89 89 PHE N N 88 121.550 123.510 -1.960 1
1 1007 . 35 1 1 A 90 90 ASN H H 89 7.266 7.604 -0.338 1
1 1008 . 35 1 1 A 90 90 ASN HA H 89 4.454 5.077 -0.623 1
1 1013 . 35 1 1 A 90 90 ASN C C 89 173.921 174.608 -0.687 1
1 1014 . 35 1 1 A 90 90 ASN CA C 89 51.839 51.335 0.504 1
1 1015 . 35 1 1 A 90 90 ASN CB C 89 40.674 38.899 1.775 1
1 1016 . 35 1 1 A 90 90 ASN N N 89 125.344 122.044 3.300 1
1 1018 . 35 1 1 A 91 91 MET H H 90 8.968 8.256 0.712 1
1 1019 . 35 1 1 A 91 91 MET HA H 90 4.049 3.996 0.053 1
1 1027 . 35 1 1 A 91 91 MET C C 90 177.475 177.956 -0.481 1
1 1028 . 35 1 1 A 91 91 MET CA C 90 57.758 57.631 0.127 1
1 1029 . 35 1 1 A 91 91 MET CB C 90 32.250 32.463 -0.213 1
1 1032 . 35 1 1 A 91 91 MET N N 90 127.052 122.345 4.707 1
1 1033 . 35 1 1 A 92 92 ALA H H 91 8.292 7.977 0.315 1
1 1034 . 35 1 1 A 92 92 ALA HA H 91 4.059 4.132 -0.073 1
1 1038 . 35 1 1 A 92 92 ALA C C 91 180.412 179.640 0.772 1
1 1039 . 35 1 1 A 92 92 ALA CA C 91 55.368 54.868 0.500 1
1 1040 . 35 1 1 A 92 92 ALA CB C 91 17.527 18.367 -0.840 1
1 1041 . 35 1 1 A 92 92 ALA N N 91 123.752 121.258 2.494 1
1 1042 . 35 1 1 A 93 93 ALA H H 92 7.931 7.880 0.051 1
1 1043 . 35 1 1 A 93 93 ALA HA H 92 4.054 4.094 -0.040 1
1 1047 . 35 1 1 A 93 93 ALA C C 92 180.482 179.916 0.566 1
1 1048 . 35 1 1 A 93 93 ALA CA C 92 54.614 54.936 -0.322 1
1 1049 . 35 1 1 A 93 93 ALA CB C 92 18.098 18.306 -0.208 1
1 1050 . 35 1 1 A 93 93 ALA N N 92 121.158 120.790 0.368 1
1 1051 . 35 1 1 A 94 94 PHE H H 93 8.110 7.733 0.377 1
1 1052 . 35 1 1 A 94 94 PHE HA H 93 4.304 4.208 0.096 1
1 1060 . 35 1 1 A 94 94 PHE C C 93 177.350 177.515 -0.165 1
1 1061 . 35 1 1 A 94 94 PHE CA C 93 61.641 61.417 0.224 1
1 1062 . 35 1 1 A 94 94 PHE CB C 93 40.014 39.327 0.687 1
1 1068 . 35 1 1 A 94 94 PHE N N 93 119.807 120.166 -0.359 1
1 1069 . 35 1 1 A 95 95 THR H H 94 8.726 8.128 0.598 1
1 1070 . 35 1 1 A 95 95 THR HA H 94 3.569 4.084 -0.515 1
1 1075 . 35 1 1 A 95 95 THR C C 94 176.932 176.473 0.459 1
1 1076 . 35 1 1 A 95 95 THR CA C 94 66.833 65.475 1.358 1
1 1077 . 35 1 1 A 95 95 THR CB C 94 68.445 68.257 0.188 1
1 1079 . 35 1 1 A 95 95 THR N N 94 113.074 112.792 0.282 1
1 1080 . 35 1 1 A 96 96 THR H H 95 7.657 7.834 -0.177 1
1 1081 . 35 1 1 A 96 96 THR HA H 95 3.945 4.095 -0.150 1
1 1086 . 35 1 1 A 96 96 THR C C 95 176.386 177.444 -1.058 1
1 1087 . 35 1 1 A 96 96 THR CA C 95 66.550 65.673 0.877 1
1 1088 . 35 1 1 A 96 96 THR CB C 95 68.583 67.951 0.632 1
1 1090 . 35 1 1 A 96 96 THR N N 95 117.927 114.128 3.799 1
1 1091 . 35 1 1 A 97 97 THR H H 96 7.699 7.761 -0.062 1
1 1092 . 35 1 1 A 97 97 THR HA H 96 3.905 3.972 -0.067 1
1 1097 . 35 1 1 A 97 97 THR C C 96 176.572 176.508 0.064 1
1 1098 . 35 1 1 A 97 97 THR CA C 96 65.979 66.646 -0.667 1
1 1099 . 35 1 1 A 97 97 THR CB C 96 68.553 67.995 0.558 1
1 1101 . 35 1 1 A 97 97 THR N N 96 118.518 117.633 0.885 1
1 1102 . 35 1 1 A 98 98 LEU H H 97 8.304 8.138 0.166 1
1 1103 . 35 1 1 A 98 98 LEU HA H 97 3.725 3.829 -0.104 1
1 1113 . 35 1 1 A 98 98 LEU C C 97 178.490 178.813 -0.323 1
1 1114 . 35 1 1 A 98 98 LEU CA C 97 58.517 58.038 0.479 1
1 1115 . 35 1 1 A 98 98 LEU CB C 97 41.697 41.031 0.666 1
1 1119 . 35 1 1 A 98 98 LEU N N 97 122.882 121.800 1.082 1
1 1120 . 35 1 1 A 99 99 GLN H H 98 7.639 7.934 -0.295 1
1 1121 . 35 1 1 A 99 99 GLN HA H 98 3.927 3.993 -0.066 1
1 1128 . 35 1 1 A 99 99 GLN C C 98 178.068 178.851 -0.783 1
1 1129 . 35 1 1 A 99 99 GLN CA C 98 58.735 59.343 -0.608 1
1 1130 . 35 1 1 A 99 99 GLN CB C 98 27.986 28.212 -0.226 1
1 1132 . 35 1 1 A 99 99 GLN N N 98 114.302 118.187 -3.885 1
1 1134 . 35 1 1 A 100 100 HIS H H 99 7.575 7.729 -0.154 1
1 1135 . 35 1 1 A 100 100 HIS HA H 99 4.524 4.404 0.120 1
1 1139 . 35 1 1 A 100 100 HIS C C 99 174.789 178.129 -3.340 1
1 1140 . 35 1 1 A 100 100 HIS CA C 99 56.154 60.098 -3.944 1
1 1141 . 35 1 1 A 100 100 HIS CB C 99 28.946 30.682 -1.736 1
1 1143 . 35 1 1 A 100 100 HIS N N 99 114.778 119.305 -4.527 1
1 1144 . 35 1 1 A 101 101 HIS H H 100 7.773 8.234 -0.461 1
1 1145 . 35 1 1 A 101 101 HIS HA H 100 4.704 4.348 0.356 1
1 1149 . 35 1 1 A 101 101 HIS C C 100 174.818 177.406 -2.588 1
1 1150 . 35 1 1 A 101 101 HIS CA C 100 54.830 59.036 -4.206 1
1 1151 . 35 1 1 A 101 101 HIS CB C 100 29.749 28.648 1.101 1
1 1153 . 35 1 1 A 101 101 HIS N N 100 117.397 117.424 -0.027 1
1 1154 . 35 1 1 A 102 102 LYS H H 101 7.324 8.108 -0.784 1
1 1155 . 35 1 1 A 102 102 LYS HA H 101 3.611 4.099 -0.488 1
1 1164 . 35 1 1 A 102 102 LYS C C 101 176.823 178.378 -1.555 1
1 1165 . 35 1 1 A 102 102 LYS CA C 101 59.915 58.906 1.009 1
1 1166 . 35 1 1 A 102 102 LYS CB C 101 32.825 32.125 0.700 1
1 1170 . 35 1 1 A 102 102 LYS N N 101 120.533 122.136 -1.603 1
1 1171 . 35 1 1 A 103 103 ASP H H 102 8.361 8.631 -0.270 1
1 1172 . 35 1 1 A 103 103 ASP HA H 102 4.421 4.365 0.056 1
1 1175 . 35 1 1 A 103 103 ASP C C 102 176.793 178.037 -1.244 1
1 1176 . 35 1 1 A 103 103 ASP CA C 102 55.500 56.234 -0.734 1
1 1177 . 35 1 1 A 103 103 ASP CB C 102 40.178 39.269 0.909 1
1 1178 . 35 1 1 A 103 103 ASP N N 102 114.814 117.407 -2.593 1
1 1179 . 35 1 1 A 104 104 GLU H H 103 7.858 7.951 -0.093 1
1 1180 . 35 1 1 A 104 104 GLU HA H 103 4.339 4.293 0.046 1
1 1183 . 35 1 1 A 104 104 GLU C C 103 175.777 176.833 -1.056 1
1 1184 . 35 1 1 A 104 104 GLU CA C 103 56.356 58.007 -1.651 1
1 1185 . 35 1 1 A 104 104 GLU CB C 103 31.293 30.539 0.754 1
1 1186 . 35 1 1 A 104 104 GLU N N 103 116.826 118.816 -1.990 1
1 1187 . 35 1 1 A 105 105 VAL H H 104 7.201 7.778 -0.577 1
1 1188 . 35 1 1 A 105 105 VAL HA H 104 4.296 4.128 0.168 1
1 1196 . 35 1 1 A 105 105 VAL C C 104 174.482 175.571 -1.089 1
1 1197 . 35 1 1 A 105 105 VAL CA C 104 60.370 62.638 -2.268 1
1 1198 . 35 1 1 A 105 105 VAL CB C 104 34.341 33.166 1.175 1
1 1201 . 35 1 1 A 105 105 VAL N N 104 116.422 119.618 -3.196 1
1 1202 . 35 1 1 A 106 106 ALA H H 105 8.487 8.457 0.030 1
1 1203 . 35 1 1 A 106 106 ALA HA H 105 4.172 4.411 -0.239 1
1 1207 . 35 1 1 A 106 106 ALA C C 105 179.030 178.850 0.180 1
1 1208 . 35 1 1 A 106 106 ALA CA C 105 52.966 52.478 0.488 1
1 1209 . 35 1 1 A 106 106 ALA CB C 105 19.371 19.309 0.062 1
1 1210 . 35 1 1 A 106 106 ALA N N 105 128.313 128.658 -0.345 1
1 1211 . 35 1 1 A 107 107 GLY H H 106 8.738 8.793 -0.055 1
1 1212 . 35 1 1 A 107 107 GLY HA2 H 106 3.773 3.878 -0.105 1
1 1213 . 35 1 1 A 107 107 GLY HA3 H 106 3.998 3.947 0.051 1
1 1214 . 35 1 1 A 107 107 GLY C C 106 174.958 175.378 -0.420 1
1 1215 . 35 1 1 A 107 107 GLY CA C 106 47.449 47.190 0.259 1
1 1216 . 35 1 1 A 107 107 GLY N N 106 110.612 110.791 -0.179 1
1 1217 . 35 1 1 A 108 108 ASP H H 107 8.535 7.875 0.660 1
1 1218 . 35 1 1 A 108 108 ASP HA H 107 4.333 4.644 -0.311 1
1 1221 . 35 1 1 A 108 108 ASP C C 107 179.133 178.839 0.294 1
1 1222 . 35 1 1 A 108 108 ASP CA C 107 56.721 56.163 0.558 1
1 1223 . 35 1 1 A 108 108 ASP CB C 107 39.336 40.882 -1.546 1
1 1224 . 35 1 1 A 108 108 ASP N N 107 117.474 121.994 -4.520 1
1 1225 . 35 1 1 A 109 109 ILE H H 108 7.459 7.521 -0.062 1
1 1226 . 35 1 1 A 109 109 ILE HA H 108 3.688 3.809 -0.121 1
1 1236 . 35 1 1 A 109 109 ILE C C 108 176.735 178.536 -1.801 1
1 1237 . 35 1 1 A 109 109 ILE CA C 108 63.474 65.422 -1.948 1
1 1238 . 35 1 1 A 109 109 ILE CB C 108 37.340 37.615 -0.275 1
1 1242 . 35 1 1 A 109 109 ILE N N 108 119.609 119.437 0.172 1
1 1243 . 35 1 1 A 110 110 PHE H H 109 7.920 8.282 -0.362 1
1 1244 . 35 1 1 A 110 110 PHE HA H 109 3.759 4.096 -0.337 1
1 1252 . 35 1 1 A 110 110 PHE C C 109 177.132 177.339 -0.207 1
1 1253 . 35 1 1 A 110 110 PHE CA C 109 62.766 61.202 1.564 1
1 1254 . 35 1 1 A 110 110 PHE CB C 109 39.752 39.284 0.468 1
1 1260 . 35 1 1 A 110 110 PHE N N 109 120.906 120.236 0.670 1
1 1261 . 35 1 1 A 111 111 ASP H H 110 8.639 8.257 0.382 1
1 1262 . 35 1 1 A 111 111 ASP HA H 110 4.216 4.087 0.129 1
1 1265 . 35 1 1 A 111 111 ASP C C 110 178.900 178.492 0.408 1
1 1266 . 35 1 1 A 111 111 ASP CA C 110 57.105 57.246 -0.141 1
1 1267 . 35 1 1 A 111 111 ASP CB C 110 39.697 40.459 -0.762 1
1 1268 . 35 1 1 A 111 111 ASP N N 110 117.124 118.469 -1.345 1
1 1269 . 35 1 1 A 112 112 MET H H 111 7.331 7.629 -0.298 1
1 1270 . 35 1 1 A 112 112 MET HA H 111 4.081 4.105 -0.024 1
1 1278 . 35 1 1 A 112 112 MET C C 111 179.052 178.157 0.895 1
1 1279 . 35 1 1 A 112 112 MET CA C 111 58.202 58.068 0.134 1
1 1280 . 35 1 1 A 112 112 MET CB C 111 31.827 32.274 -0.447 1
1 1283 . 35 1 1 A 112 112 MET N N 111 118.061 119.454 -1.393 1
1 1284 . 35 1 1 A 113 113 LEU H H 112 8.001 7.996 0.005 1
1 1285 . 35 1 1 A 113 113 LEU HA H 112 3.723 3.675 0.048 1
1 1295 . 35 1 1 A 113 113 LEU C C 112 179.747 178.882 0.865 1
1 1296 . 35 1 1 A 113 113 LEU CA C 112 57.371 57.524 -0.153 1
1 1297 . 35 1 1 A 113 113 LEU CB C 112 40.671 41.148 -0.477 1
1 1301 . 35 1 1 A 113 113 LEU N N 112 120.426 119.824 0.602 1
1 1302 . 35 1 1 A 114 114 LEU H H 113 7.744 7.462 0.282 1
1 1303 . 35 1 1 A 114 114 LEU HA H 113 4.007 3.707 0.300 1
1 1313 . 35 1 1 A 114 114 LEU C C 113 179.358 178.694 0.664 1
1 1314 . 35 1 1 A 114 114 LEU CA C 113 57.202 57.489 -0.287 1
1 1315 . 35 1 1 A 114 114 LEU CB C 113 41.727 41.176 0.551 1
1 1319 . 35 1 1 A 114 114 LEU N N 113 119.584 118.255 1.329 1
1 1320 . 35 1 1 A 115 115 THR H H 114 7.353 7.745 -0.392 1
1 1321 . 35 1 1 A 115 115 THR HA H 114 4.071 4.185 -0.114 1
1 1327 . 35 1 1 A 115 115 THR C C 114 173.591 176.429 -2.838 1
1 1328 . 35 1 1 A 115 115 THR CA C 114 65.332 64.709 0.623 1
1 1329 . 35 1 1 A 115 115 THR CB C 114 70.319 68.607 1.712 1
1 1331 . 35 1 1 A 115 115 THR N N 114 107.535 110.687 -3.152 1
1 1332 . 35 1 1 A 116 116 PHE H H 115 6.979 7.945 -0.966 1
1 1333 . 35 1 1 A 116 116 PHE HA H 115 5.022 4.480 0.542 1
1 1341 . 35 1 1 A 116 116 PHE C C 115 176.488 176.168 0.320 1
1 1342 . 35 1 1 A 116 116 PHE CA C 115 55.911 61.151 -5.240 1
1 1343 . 35 1 1 A 116 116 PHE CB C 115 38.521 39.089 -0.568 1
1 1349 . 35 1 1 A 116 116 PHE N N 115 112.366 120.056 -7.690 1
1 1350 . 35 1 1 A 117 117 THR H H 116 7.564 8.066 -0.502 1
1 1351 . 35 1 1 A 117 117 THR HA H 116 4.626 4.952 -0.326 1
1 1356 . 35 1 1 A 117 117 THR C C 116 174.085 173.788 0.297 1
1 1357 . 35 1 1 A 117 117 THR CA C 116 61.636 62.339 -0.703 1
1 1358 . 35 1 1 A 117 117 THR CB C 116 70.915 72.390 -1.475 1
1 1360 . 35 1 1 A 117 117 THR N N 116 105.498 112.906 -7.408 1
1 1361 . 35 1 1 A 118 118 ASP H H 117 8.270 7.899 0.371 1
1 1362 . 35 1 1 A 118 118 ASP HA H 117 4.955 5.013 -0.058 1
1 1365 . 35 1 1 A 118 118 ASP C C 117 176.328 176.180 0.148 1
1 1366 . 35 1 1 A 118 118 ASP CA C 117 53.417 53.292 0.125 1
1 1367 . 35 1 1 A 118 118 ASP CB C 117 43.388 38.825 4.563 1
1 1368 . 35 1 1 A 118 118 ASP N N 117 124.409 121.626 2.783 1
1 1369 . 35 1 1 A 119 119 PHE H H 118 8.973 8.843 0.130 1
1 1370 . 35 1 1 A 119 119 PHE HA H 118 3.506 4.141 -0.635 1
1 1378 . 35 1 1 A 119 119 PHE CA C 118 61.490 61.495 -0.005 1
1 1379 . 35 1 1 A 119 119 PHE CB C 118 39.246 39.570 -0.324 1
1 1385 . 35 1 1 A 119 119 PHE N N 118 126.688 125.069 1.619 1
1 1386 . 35 1 1 A 120 120 LEU H H 119 8.099 8.311 -0.212 1
1 1387 . 35 1 1 A 120 120 LEU HA H 119 3.842 4.075 -0.233 1
1 1397 . 35 1 1 A 120 120 LEU C C 119 179.601 178.419 1.182 1
1 1398 . 35 1 1 A 120 120 LEU CA C 119 58.174 58.073 0.101 1
1 1399 . 35 1 1 A 120 120 LEU CB C 119 40.315 41.381 -1.066 1
1 1403 . 35 1 1 A 120 120 LEU N N 119 117.930 120.531 -2.601 1
1 1404 . 35 1 1 A 121 121 ALA H H 120 7.729 7.685 0.044 1
1 1405 . 35 1 1 A 121 121 ALA HA H 120 3.996 4.127 -0.131 1
1 1409 . 35 1 1 A 121 121 ALA C C 120 180.995 179.718 1.277 1
1 1410 . 35 1 1 A 121 121 ALA CA C 120 54.832 54.586 0.246 1
1 1411 . 35 1 1 A 121 121 ALA CB C 120 17.706 18.291 -0.585 1
1 1412 . 35 1 1 A 121 121 ALA N N 120 123.195 120.922 2.273 1
1 1413 . 35 1 1 A 122 122 PHE H H 121 7.943 7.986 -0.043 1
1 1414 . 35 1 1 A 122 122 PHE HA H 121 3.887 4.002 -0.115 1
1 1419 . 35 1 1 A 122 122 PHE C C 121 175.410 177.090 -1.680 1
1 1420 . 35 1 1 A 122 122 PHE CA C 121 61.075 60.872 0.203 1
1 1421 . 35 1 1 A 122 122 PHE CB C 121 38.115 39.004 -0.889 1
1 1424 . 35 1 1 A 122 122 PHE N N 121 121.798 119.940 1.858 1
1 1425 . 35 1 1 A 123 123 LYS H H 122 8.468 7.906 0.562 1
1 1426 . 35 1 1 A 123 123 LYS HA H 122 3.077 3.655 -0.578 1
1 1435 . 35 1 1 A 123 123 LYS C C 122 178.453 178.232 0.221 1
1 1436 . 35 1 1 A 123 123 LYS CA C 122 59.855 59.764 0.091 1
1 1437 . 35 1 1 A 123 123 LYS CB C 122 32.374 31.784 0.590 1
1 1441 . 35 1 1 A 123 123 LYS N N 122 120.614 118.882 1.732 1
1 1442 . 35 1 1 A 124 124 GLU H H 123 8.100 7.686 0.414 1
1 1443 . 35 1 1 A 124 124 GLU HA H 123 3.652 4.061 -0.409 1
1 1448 . 35 1 1 A 124 124 GLU C C 123 177.743 178.720 -0.977 1
1 1449 . 35 1 1 A 124 124 GLU CA C 123 59.406 59.154 0.252 1
1 1450 . 35 1 1 A 124 124 GLU CB C 123 28.811 29.116 -0.305 1
1 1452 . 35 1 1 A 124 124 GLU N N 123 117.404 118.715 -1.311 1
1 1453 . 35 1 1 A 125 125 MET H H 124 7.537 7.524 0.013 1
1 1454 . 35 1 1 A 125 125 MET HA H 124 3.860 3.985 -0.125 1
1 1462 . 35 1 1 A 125 125 MET C C 124 179.522 178.341 1.181 1
1 1463 . 35 1 1 A 125 125 MET CA C 124 58.832 58.258 0.574 1
1 1464 . 35 1 1 A 125 125 MET CB C 124 31.765 31.702 0.063 1
1 1467 . 35 1 1 A 125 125 MET N N 124 119.413 119.187 0.226 1
1 1468 . 35 1 1 A 126 126 PHE H H 125 7.148 7.708 -0.560 1
1 1469 . 35 1 1 A 126 126 PHE HA H 125 3.633 4.171 -0.538 1
1 1476 . 35 1 1 A 126 126 PHE C C 125 178.994 178.221 0.773 1
1 1477 . 35 1 1 A 126 126 PHE CA C 125 63.148 61.202 1.946 1
1 1478 . 35 1 1 A 126 126 PHE CB C 125 39.830 38.549 1.281 1
1 1483 . 35 1 1 A 126 126 PHE N N 125 120.013 118.320 1.693 1
1 1484 . 35 1 1 A 127 127 LEU H H 126 8.369 8.257 0.112 1
1 1485 . 35 1 1 A 127 127 LEU HA H 126 3.972 4.048 -0.076 1
1 1495 . 35 1 1 A 127 127 LEU C C 126 180.621 178.644 1.977 1
1 1496 . 35 1 1 A 127 127 LEU CA C 126 57.944 57.977 -0.033 1
1 1497 . 35 1 1 A 127 127 LEU CB C 126 40.543 41.385 -0.842 1
1 1501 . 35 1 1 A 127 127 LEU N N 126 119.692 119.767 -0.075 1
1 1502 . 35 1 1 A 128 128 ASP H H 127 8.578 8.105 0.473 1
1 1503 . 35 1 1 A 128 128 ASP HA H 127 4.308 4.317 -0.009 1
1 1506 . 35 1 1 A 128 128 ASP C C 127 178.254 178.018 0.236 1
1 1507 . 35 1 1 A 128 128 ASP CA C 127 56.964 57.230 -0.266 1
1 1508 . 35 1 1 A 128 128 ASP CB C 127 39.735 40.918 -1.183 1
1 1509 . 35 1 1 A 128 128 ASP N N 127 121.926 119.506 2.420 1
1 1510 . 35 1 1 A 129 129 TYR H H 128 7.710 8.120 -0.410 1
1 1511 . 35 1 1 A 129 129 TYR HA H 128 3.908 4.071 -0.163 1
1 1518 . 35 1 1 A 129 129 TYR C C 128 177.633 177.751 -0.118 1
1 1519 . 35 1 1 A 129 129 TYR CA C 128 61.796 61.507 0.289 1
1 1520 . 35 1 1 A 129 129 TYR CB C 128 39.372 38.654 0.718 1
1 1525 . 35 1 1 A 129 129 TYR N N 128 122.548 120.470 2.078 1
1 1526 . 35 1 1 A 130 130 ARG H H 129 8.622 8.251 0.371 1
1 1527 . 35 1 1 A 130 130 ARG HA H 129 3.722 3.913 -0.191 1
1 1535 . 35 1 1 A 130 130 ARG CA C 129 60.084 59.441 0.643 1
1 1536 . 35 1 1 A 130 130 ARG CB C 129 29.902 29.946 -0.044 1
1 1539 . 35 1 1 A 130 130 ARG N N 129 118.302 119.504 -1.202 1
1 1541 . 35 1 1 A 131 131 ALA H H 130 7.936 7.983 -0.047 1
1 1542 . 35 1 1 A 131 131 ALA HA H 130 3.997 3.997 0.000 1
1 1546 . 35 1 1 A 131 131 ALA C C 130 180.456 180.182 0.274 1
1 1547 . 35 1 1 A 131 131 ALA CA C 130 55.133 54.968 0.165 1
1 1548 . 35 1 1 A 131 131 ALA CB C 130 17.750 18.172 -0.422 1
1 1549 . 35 1 1 A 131 131 ALA N N 130 119.788 121.754 -1.966 1
1 1550 . 35 1 1 A 132 132 GLU H H 131 7.622 7.799 -0.177 1
1 1551 . 35 1 1 A 132 132 GLU HA H 131 3.862 3.980 -0.118 1
1 1556 . 35 1 1 A 132 132 GLU C C 131 179.528 179.552 -0.024 1
1 1557 . 35 1 1 A 132 132 GLU CA C 131 58.849 59.310 -0.461 1
1 1558 . 35 1 1 A 132 132 GLU CB C 131 28.930 28.999 -0.069 1
1 1560 . 35 1 1 A 132 132 GLU N N 131 118.428 117.824 0.604 1
1 1561 . 35 1 1 A 133 133 LYS H H 132 7.853 7.408 0.445 1
1 1562 . 35 1 1 A 133 133 LYS HA H 132 3.722 4.004 -0.282 1
1 1571 . 35 1 1 A 133 133 LYS C C 132 175.725 178.087 -2.362 1
1 1572 . 35 1 1 A 133 133 LYS CA C 132 57.544 59.377 -1.833 1
1 1573 . 35 1 1 A 133 133 LYS CB C 132 31.770 32.066 -0.296 1
1 1577 . 35 1 1 A 133 133 LYS N N 132 119.473 120.075 -0.602 1
1 1578 . 35 1 1 A 134 134 GLU H H 133 8.151 7.729 0.422 1
1 1579 . 35 1 1 A 134 134 GLU HA H 133 4.161 4.477 -0.316 1
1 1584 . 35 1 1 A 134 134 GLU C C 133 177.453 177.964 -0.511 1
1 1585 . 35 1 1 A 134 134 GLU CA C 133 57.222 56.643 0.579 1
1 1586 . 35 1 1 A 134 134 GLU CB C 133 30.091 30.203 -0.112 1
1 1588 . 35 1 1 A 134 134 GLU N N 133 116.525 116.042 0.483 1
1 1589 . 35 1 1 A 135 135 GLY H H 134 7.702 8.044 -0.342 1
1 1590 . 35 1 1 A 135 135 GLY HA2 H 134 3.896 3.880 0.016 1
1 1591 . 35 1 1 A 135 135 GLY HA3 H 134 3.897 3.892 0.005 1
1 1592 . 35 1 1 A 135 135 GLY C C 134 174.538 174.322 0.216 1
1 1593 . 35 1 1 A 135 135 GLY CA C 134 45.975 46.100 -0.125 1
1 1594 . 35 1 1 A 135 135 GLY N N 134 107.924 108.812 -0.888 1
1 1595 . 35 1 1 A 136 136 ARG H H 135 8.045 7.605 0.440 1
1 1596 . 35 1 1 A 136 136 ARG HA H 135 4.323 4.532 -0.209 1
1 1604 . 35 1 1 A 136 136 ARG C C 135 175.864 175.271 0.593 1
1 1605 . 35 1 1 A 136 136 ARG CA C 135 56.016 55.457 0.559 1
1 1606 . 35 1 1 A 136 136 ARG CB C 135 30.987 30.979 0.008 1
1 1609 . 35 1 1 A 136 136 ARG N N 135 119.708 120.914 -1.206 1
1 1 . 36 1 1 A 14 14 PHE CA C 13 58.199 58.157 0.042 1
1 2 . 36 1 1 A 14 14 PHE CB C 13 39.717 37.223 2.494 1
1 3 . 36 1 1 A 15 15 SER H H 14 8.299 8.176 0.123 1
1 4 . 36 1 1 A 15 15 SER HA H 14 4.359 4.800 -0.441 1
1 7 . 36 1 1 A 15 15 SER CA C 14 58.249 59.555 -1.306 1
1 8 . 36 1 1 A 15 15 SER CB C 14 63.936 65.836 -1.900 1
1 9 . 36 1 1 A 15 15 SER N N 14 117.379 120.361 -2.982 1
1 10 . 36 1 1 A 16 16 SER H H 15 8.255 8.554 -0.299 1
1 11 . 36 1 1 A 16 16 SER HA H 15 3.729 4.296 -0.567 1
1 14 . 36 1 1 A 16 16 SER CA C 15 58.224 61.215 -2.991 1
1 15 . 36 1 1 A 16 16 SER CB C 15 63.886 62.645 1.241 1
1 16 . 36 1 1 A 16 16 SER N N 15 117.694 116.000 1.694 1
1 17 . 36 1 1 A 17 17 ALA H H 16 8.333 8.117 0.216 1
1 18 . 36 1 1 A 17 17 ALA HA H 16 4.252 4.296 -0.044 1
1 22 . 36 1 1 A 17 17 ALA CA C 16 53.377 54.095 -0.718 1
1 23 . 36 1 1 A 17 17 ALA CB C 16 18.896 18.530 0.366 1
1 24 . 36 1 1 A 17 17 ALA N N 16 125.462 123.516 1.946 1
1 25 . 36 1 1 A 18 18 SER H H 17 8.219 8.482 -0.263 1
1 26 . 36 1 1 A 18 18 SER HA H 17 4.332 4.802 -0.470 1
1 29 . 36 1 1 A 18 18 SER CA C 17 59.105 57.282 1.823 1
1 30 . 36 1 1 A 18 18 SER CB C 17 63.592 64.187 -0.595 1
1 31 . 36 1 1 A 18 18 SER N N 17 114.821 113.289 1.532 1
1 32 . 36 1 1 A 19 19 ASP H H 18 8.309 8.254 0.055 1
1 33 . 36 1 1 A 19 19 ASP HA H 18 4.554 5.005 -0.451 1
1 36 . 36 1 1 A 19 19 ASP C C 18 176.528 176.653 -0.125 1
1 37 . 36 1 1 A 19 19 ASP CA C 18 55.272 55.639 -0.367 1
1 38 . 36 1 1 A 19 19 ASP CB C 18 40.883 41.061 -0.178 1
1 39 . 36 1 1 A 19 19 ASP N N 18 123.367 120.653 2.714 1
1 40 . 36 1 1 A 20 20 ALA H H 19 8.133 8.666 -0.533 1
1 41 . 36 1 1 A 20 20 ALA HA H 19 4.170 4.090 0.080 1
1 45 . 36 1 1 A 20 20 ALA C C 19 179.857 179.066 0.791 1
1 46 . 36 1 1 A 20 20 ALA CA C 19 54.341 55.523 -1.182 1
1 47 . 36 1 1 A 20 20 ALA CB C 19 18.660 18.452 0.208 1
1 48 . 36 1 1 A 20 20 ALA N N 19 123.350 123.393 -0.043 1
1 49 . 36 1 1 A 21 21 GLU H H 20 8.140 8.009 0.131 1
1 50 . 36 1 1 A 21 21 GLU HA H 20 4.128 4.102 0.026 1
1 55 . 36 1 1 A 21 21 GLU C C 20 177.675 178.736 -1.061 1
1 56 . 36 1 1 A 21 21 GLU CA C 20 58.520 59.412 -0.892 1
1 57 . 36 1 1 A 21 21 GLU CB C 20 29.765 29.644 0.121 1
1 59 . 36 1 1 A 21 21 GLU N N 20 119.063 119.325 -0.262 1
1 60 . 36 1 1 A 22 22 PHE H H 21 8.009 8.228 -0.219 1
1 61 . 36 1 1 A 22 22 PHE HA H 21 4.123 4.374 -0.251 1
1 68 . 36 1 1 A 22 22 PHE C C 21 176.410 177.355 -0.945 1
1 69 . 36 1 1 A 22 22 PHE CA C 21 62.202 61.456 0.746 1
1 70 . 36 1 1 A 22 22 PHE CB C 21 39.223 39.337 -0.114 1
1 75 . 36 1 1 A 22 22 PHE N N 21 121.211 120.984 0.227 1
1 76 . 36 1 1 A 23 23 ASP H H 22 8.261 8.436 -0.175 1
1 77 . 36 1 1 A 23 23 ASP HA H 22 4.041 4.292 -0.251 1
1 80 . 36 1 1 A 23 23 ASP C C 22 179.078 178.124 0.954 1
1 81 . 36 1 1 A 23 23 ASP CA C 22 57.048 57.876 -0.828 1
1 82 . 36 1 1 A 23 23 ASP CB C 22 40.154 42.212 -2.058 1
1 83 . 36 1 1 A 23 23 ASP N N 22 116.876 119.455 -2.579 1
1 84 . 36 1 1 A 24 24 ALA H H 23 7.651 7.650 0.001 1
1 85 . 36 1 1 A 24 24 ALA HA H 23 3.785 3.888 -0.103 1
1 89 . 36 1 1 A 24 24 ALA C C 23 179.577 179.524 0.053 1
1 90 . 36 1 1 A 24 24 ALA CA C 23 54.341 55.065 -0.724 1
1 91 . 36 1 1 A 24 24 ALA CB C 23 17.762 18.267 -0.505 1
1 92 . 36 1 1 A 24 24 ALA N N 23 121.873 121.438 0.435 1
1 93 . 36 1 1 A 25 25 VAL H H 24 7.718 7.952 -0.234 1
1 94 . 36 1 1 A 25 25 VAL HA H 24 3.216 3.590 -0.374 1
1 102 . 36 1 1 A 25 25 VAL C C 24 177.805 178.191 -0.386 1
1 103 . 36 1 1 A 25 25 VAL CA C 24 66.789 66.738 0.051 1
1 104 . 36 1 1 A 25 25 VAL CB C 24 31.277 31.225 0.052 1
1 107 . 36 1 1 A 25 25 VAL N N 24 117.890 118.205 -0.315 1
1 108 . 36 1 1 A 26 26 VAL H H 25 7.867 7.713 0.154 1
1 109 . 36 1 1 A 26 26 VAL HA H 25 3.274 3.484 -0.210 1
1 117 . 36 1 1 A 26 26 VAL C C 25 177.788 177.569 0.219 1
1 118 . 36 1 1 A 26 26 VAL CA C 25 67.282 66.312 0.970 1
1 119 . 36 1 1 A 26 26 VAL CB C 25 31.266 31.418 -0.152 1
1 122 . 36 1 1 A 26 26 VAL N N 25 118.170 119.869 -1.699 1
1 123 . 36 1 1 A 27 27 GLY H H 26 7.544 7.547 -0.003 1
1 124 . 36 1 1 A 27 27 GLY HA2 H 26 3.592 3.476 0.116 1
1 125 . 36 1 1 A 27 27 GLY HA3 H 26 3.721 3.604 0.117 1
1 126 . 36 1 1 A 27 27 GLY C C 26 176.717 176.428 0.289 1
1 127 . 36 1 1 A 27 27 GLY CA C 26 47.085 47.144 -0.059 1
1 128 . 36 1 1 A 27 27 GLY N N 26 105.795 107.354 -1.559 1
1 129 . 36 1 1 A 28 28 TYR H H 27 7.625 7.284 0.341 1
1 130 . 36 1 1 A 28 28 TYR HA H 27 4.546 4.552 -0.006 1
1 137 . 36 1 1 A 28 28 TYR C C 27 178.991 178.174 0.817 1
1 138 . 36 1 1 A 28 28 TYR CA C 27 58.845 59.617 -0.772 1
1 139 . 36 1 1 A 28 28 TYR CB C 27 37.602 37.609 -0.007 1
1 144 . 36 1 1 A 28 28 TYR N N 27 119.933 121.621 -1.688 1
1 145 . 36 1 1 A 29 29 LEU H H 28 8.517 8.469 0.048 1
1 146 . 36 1 1 A 29 29 LEU HA H 28 3.728 3.831 -0.103 1
1 156 . 36 1 1 A 29 29 LEU CA C 28 58.281 57.927 0.354 1
1 157 . 36 1 1 A 29 29 LEU CB C 28 41.948 41.185 0.763 1
1 161 . 36 1 1 A 29 29 LEU N N 28 119.669 120.001 -0.332 1
1 162 . 36 1 1 A 30 30 GLU H H 29 8.072 7.942 0.130 1
1 163 . 36 1 1 A 30 30 GLU HA H 29 3.722 3.871 -0.149 1
1 168 . 36 1 1 A 30 30 GLU C C 29 177.731 179.158 -1.427 1
1 169 . 36 1 1 A 30 30 GLU CA C 29 59.763 59.955 -0.192 1
1 170 . 36 1 1 A 30 30 GLU CB C 29 28.844 29.320 -0.476 1
1 172 . 36 1 1 A 30 30 GLU N N 29 117.666 118.195 -0.529 1
1 173 . 36 1 1 A 31 31 ASP H H 30 7.243 7.800 -0.557 1
1 174 . 36 1 1 A 31 31 ASP HA H 30 4.297 4.356 -0.059 1
1 177 . 36 1 1 A 31 31 ASP CA C 30 56.953 57.442 -0.489 1
1 178 . 36 1 1 A 31 31 ASP CB C 30 40.730 41.106 -0.376 1
1 179 . 36 1 1 A 31 31 ASP N N 30 116.720 119.584 -2.864 1
1 180 . 36 1 1 A 32 32 ILE H H 31 7.940 7.408 0.532 1
1 181 . 36 1 1 A 32 32 ILE HA H 31 3.640 3.739 -0.099 1
1 191 . 36 1 1 A 32 32 ILE C C 31 177.980 178.137 -0.157 1
1 192 . 36 1 1 A 32 32 ILE CA C 31 64.692 64.134 0.558 1
1 193 . 36 1 1 A 32 32 ILE CB C 31 38.938 37.256 1.682 1
1 197 . 36 1 1 A 32 32 ILE N N 31 119.728 120.216 -0.488 1
1 198 . 36 1 1 A 33 33 ILE H H 32 7.984 7.791 0.193 1
1 199 . 36 1 1 A 33 33 ILE HA H 32 3.598 3.051 0.547 1
1 209 . 36 1 1 A 33 33 ILE C C 32 176.723 176.770 -0.047 1
1 210 . 36 1 1 A 33 33 ILE CA C 32 63.241 64.280 -1.039 1
1 211 . 36 1 1 A 33 33 ILE CB C 32 37.580 37.840 -0.260 1
1 215 . 36 1 1 A 33 33 ILE N N 32 113.919 120.595 -6.676 1
1 216 . 36 1 1 A 34 34 MET H H 33 7.288 7.381 -0.093 1
1 217 . 36 1 1 A 34 34 MET HA H 33 4.496 4.676 -0.180 1
1 225 . 36 1 1 A 34 34 MET C C 33 176.423 175.592 0.831 1
1 226 . 36 1 1 A 34 34 MET CA C 33 54.634 54.103 0.531 1
1 227 . 36 1 1 A 34 34 MET CB C 33 31.934 32.935 -1.001 1
1 230 . 36 1 1 A 34 34 MET N N 33 115.130 116.930 -1.800 1
1 231 . 36 1 1 A 35 35 ASP H H 34 7.405 7.627 -0.222 1
1 232 . 36 1 1 A 35 35 ASP HA H 34 4.484 4.565 -0.081 1
1 235 . 36 1 1 A 35 35 ASP C C 34 177.139 176.583 0.556 1
1 236 . 36 1 1 A 35 35 ASP CA C 34 54.625 54.658 -0.033 1
1 237 . 36 1 1 A 35 35 ASP CB C 34 43.554 42.880 0.674 1
1 238 . 36 1 1 A 35 35 ASP N N 34 121.814 122.462 -0.648 1
1 239 . 36 1 1 A 36 36 ASP H H 35 8.765 9.227 -0.462 1
1 240 . 36 1 1 A 36 36 ASP HA H 35 4.235 4.231 0.004 1
1 243 . 36 1 1 A 36 36 ASP C C 35 178.320 177.941 0.379 1
1 244 . 36 1 1 A 36 36 ASP CA C 35 57.832 58.462 -0.630 1
1 245 . 36 1 1 A 36 36 ASP CB C 35 40.914 41.090 -0.176 1
1 246 . 36 1 1 A 36 36 ASP N N 35 125.883 127.607 -1.724 1
1 247 . 36 1 1 A 37 37 GLU H H 36 8.905 8.347 0.558 1
1 248 . 36 1 1 A 37 37 GLU HA H 36 3.933 4.112 -0.179 1
1 253 . 36 1 1 A 37 37 GLU C C 36 179.304 179.097 0.207 1
1 254 . 36 1 1 A 37 37 GLU CA C 36 59.828 59.023 0.805 1
1 255 . 36 1 1 A 37 37 GLU CB C 36 29.380 29.587 -0.207 1
1 257 . 36 1 1 A 37 37 GLU N N 36 119.077 118.205 0.872 1
1 258 . 36 1 1 A 38 38 PHE H H 37 7.460 8.522 -1.062 1
1 259 . 36 1 1 A 38 38 PHE HA H 37 3.642 3.925 -0.283 1
1 267 . 36 1 1 A 38 38 PHE C C 37 176.483 177.872 -1.389 1
1 268 . 36 1 1 A 38 38 PHE CA C 37 61.411 60.946 0.465 1
1 269 . 36 1 1 A 38 38 PHE CB C 37 39.355 39.073 0.282 1
1 275 . 36 1 1 A 38 38 PHE N N 37 119.968 122.929 -2.961 1
1 276 . 36 1 1 A 39 39 GLN H H 38 7.968 8.120 -0.152 1
1 277 . 36 1 1 A 39 39 GLN HA H 38 3.712 3.857 -0.145 1
1 284 . 36 1 1 A 39 39 GLN CA C 38 59.153 58.630 0.523 1
1 285 . 36 1 1 A 39 39 GLN CB C 38 28.213 28.204 0.009 1
1 287 . 36 1 1 A 39 39 GLN N N 38 116.433 118.235 -1.802 1
1 289 . 36 1 1 A 40 40 LEU H H 39 7.930 7.596 0.334 1
1 290 . 36 1 1 A 40 40 LEU HA H 39 3.916 4.030 -0.114 1
1 300 . 36 1 1 A 40 40 LEU C C 39 177.731 178.284 -0.553 1
1 301 . 36 1 1 A 40 40 LEU CA C 39 57.915 58.033 -0.118 1
1 302 . 36 1 1 A 40 40 LEU CB C 39 41.989 41.778 0.211 1
1 306 . 36 1 1 A 40 40 LEU N N 39 119.505 121.727 -2.222 1
1 307 . 36 1 1 A 41 41 LEU H H 40 7.174 7.999 -0.825 1
1 308 . 36 1 1 A 41 41 LEU HA H 40 3.835 4.167 -0.332 1
1 318 . 36 1 1 A 41 41 LEU C C 40 179.738 178.393 1.345 1
1 319 . 36 1 1 A 41 41 LEU CA C 40 58.266 57.916 0.350 1
1 320 . 36 1 1 A 41 41 LEU CB C 40 42.050 40.851 1.199 1
1 324 . 36 1 1 A 41 41 LEU N N 40 120.971 119.544 1.427 1
1 325 . 36 1 1 A 42 42 GLN H H 41 8.058 8.072 -0.014 1
1 326 . 36 1 1 A 42 42 GLN HA H 41 3.556 3.636 -0.080 1
1 333 . 36 1 1 A 42 42 GLN C C 41 177.642 178.805 -1.163 1
1 334 . 36 1 1 A 42 42 GLN CA C 41 59.826 59.021 0.805 1
1 335 . 36 1 1 A 42 42 GLN CB C 41 28.762 27.978 0.784 1
1 337 . 36 1 1 A 42 42 GLN N N 41 117.899 118.295 -0.396 1
1 339 . 36 1 1 A 43 43 ARG H H 42 8.179 7.986 0.193 1
1 340 . 36 1 1 A 43 43 ARG HA H 42 3.655 4.100 -0.445 1
1 347 . 36 1 1 A 43 43 ARG C C 42 178.051 178.800 -0.749 1
1 348 . 36 1 1 A 43 43 ARG CA C 42 59.766 59.118 0.648 1
1 349 . 36 1 1 A 43 43 ARG CB C 42 29.941 29.683 0.258 1
1 352 . 36 1 1 A 43 43 ARG N N 42 119.392 119.218 0.174 1
1 353 . 36 1 1 A 44 44 ASN H H 43 8.525 7.868 0.657 1
1 354 . 36 1 1 A 44 44 ASN HA H 43 4.332 4.477 -0.145 1
1 359 . 36 1 1 A 44 44 ASN C C 43 178.150 177.964 0.186 1
1 360 . 36 1 1 A 44 44 ASN CA C 43 55.841 56.204 -0.363 1
1 361 . 36 1 1 A 44 44 ASN CB C 43 37.632 39.019 -1.387 1
1 362 . 36 1 1 A 44 44 ASN N N 43 116.214 117.528 -1.314 1
1 364 . 36 1 1 A 45 45 PHE H H 44 7.586 7.925 -0.339 1
1 365 . 36 1 1 A 45 45 PHE HA H 44 4.132 4.348 -0.216 1
1 372 . 36 1 1 A 45 45 PHE C C 44 176.691 178.725 -2.034 1
1 373 . 36 1 1 A 45 45 PHE CA C 44 62.333 60.755 1.578 1
1 374 . 36 1 1 A 45 45 PHE CB C 44 39.449 38.884 0.565 1
1 379 . 36 1 1 A 45 45 PHE N N 44 121.501 117.810 3.691 1
1 380 . 36 1 1 A 46 46 MET H H 45 8.190 8.426 -0.236 1
1 381 . 36 1 1 A 46 46 MET HA H 45 4.060 4.205 -0.145 1
1 389 . 36 1 1 A 46 46 MET C C 45 179.754 178.165 1.589 1
1 390 . 36 1 1 A 46 46 MET CA C 45 57.742 57.949 -0.207 1
1 391 . 36 1 1 A 46 46 MET CB C 45 29.912 31.383 -1.471 1
1 394 . 36 1 1 A 46 46 MET N N 45 116.727 117.909 -1.182 1
1 395 . 36 1 1 A 47 47 ASP H H 46 8.579 8.206 0.373 1
1 396 . 36 1 1 A 47 47 ASP HA H 46 4.804 4.750 0.054 1
1 399 . 36 1 1 A 47 47 ASP C C 46 177.854 177.603 0.251 1
1 400 . 36 1 1 A 47 47 ASP CA C 46 57.277 57.291 -0.014 1
1 401 . 36 1 1 A 47 47 ASP CB C 46 40.776 41.961 -1.185 1
1 402 . 36 1 1 A 47 47 ASP N N 46 117.798 120.855 -3.057 1
1 403 . 36 1 1 A 48 48 LYS H H 47 7.339 7.825 -0.486 1
1 404 . 36 1 1 A 48 48 LYS HA H 47 3.828 4.271 -0.443 1
1 413 . 36 1 1 A 48 48 LYS C C 47 178.812 178.495 0.317 1
1 414 . 36 1 1 A 48 48 LYS CA C 47 58.953 57.494 1.459 1
1 415 . 36 1 1 A 48 48 LYS CB C 47 32.796 33.382 -0.586 1
1 419 . 36 1 1 A 48 48 LYS N N 47 117.852 117.903 -0.051 1
1 420 . 36 1 1 A 49 49 TYR H H 48 6.841 8.422 -1.581 1
1 421 . 36 1 1 A 49 49 TYR HA H 48 4.995 4.225 0.770 1
1 428 . 36 1 1 A 49 49 TYR C C 48 178.138 178.490 -0.352 1
1 429 . 36 1 1 A 49 49 TYR CA C 48 58.620 59.822 -1.202 1
1 430 . 36 1 1 A 49 49 TYR CB C 48 42.939 38.120 4.819 1
1 435 . 36 1 1 A 49 49 TYR N N 48 112.109 118.999 -6.890 1
1 436 . 36 1 1 A 50 50 TYR H H 49 8.491 8.222 0.269 1
1 437 . 36 1 1 A 50 50 TYR HA H 49 4.598 4.305 0.293 1
1 444 . 36 1 1 A 50 50 TYR C C 49 176.015 177.777 -1.762 1
1 445 . 36 1 1 A 50 50 TYR CA C 49 62.442 59.428 3.014 1
1 446 . 36 1 1 A 50 50 TYR CB C 49 36.588 37.060 -0.472 1
1 451 . 36 1 1 A 50 50 TYR N N 49 118.294 118.922 -0.628 1
1 452 . 36 1 1 A 51 51 LEU H H 50 7.512 7.481 0.031 1
1 453 . 36 1 1 A 51 51 LEU HA H 50 3.878 3.580 0.298 1
1 463 . 36 1 1 A 51 51 LEU C C 50 178.625 178.805 -0.180 1
1 464 . 36 1 1 A 51 51 LEU CA C 50 55.994 57.139 -1.145 1
1 465 . 36 1 1 A 51 51 LEU CB C 50 40.743 41.511 -0.768 1
1 469 . 36 1 1 A 51 51 LEU N N 50 118.478 121.609 -3.131 1
1 470 . 36 1 1 A 52 52 GLU H H 51 8.042 8.091 -0.049 1
1 471 . 36 1 1 A 52 52 GLU HA H 51 4.197 3.965 0.232 1
1 476 . 36 1 1 A 52 52 GLU C C 51 177.629 177.468 0.161 1
1 477 . 36 1 1 A 52 52 GLU CA C 51 56.141 59.011 -2.870 1
1 478 . 36 1 1 A 52 52 GLU CB C 51 29.162 29.595 -0.433 1
1 480 . 36 1 1 A 52 52 GLU N N 51 115.067 118.012 -2.945 1
1 481 . 36 1 1 A 53 53 PHE H H 52 7.465 7.966 -0.501 1
1 482 . 36 1 1 A 53 53 PHE HA H 52 4.431 4.443 -0.012 1
1 490 . 36 1 1 A 53 53 PHE C C 52 174.325 174.630 -0.305 1
1 491 . 36 1 1 A 53 53 PHE CA C 52 58.986 56.753 2.233 1
1 492 . 36 1 1 A 53 53 PHE CB C 52 40.183 36.955 3.228 1
1 498 . 36 1 1 A 53 53 PHE N N 52 116.768 117.491 -0.723 1
1 499 . 36 1 1 A 54 54 GLU H H 53 7.484 8.368 -0.884 1
1 500 . 36 1 1 A 54 54 GLU HA H 53 4.583 4.808 -0.225 1
1 505 . 36 1 1 A 54 54 GLU C C 53 175.722 175.776 -0.054 1
1 506 . 36 1 1 A 54 54 GLU CA C 53 54.248 55.839 -1.591 1
1 507 . 36 1 1 A 54 54 GLU CB C 53 34.409 31.164 3.245 1
1 509 . 36 1 1 A 54 54 GLU N N 53 118.844 124.300 -5.456 1
1 510 . 36 1 1 A 55 55 ASP H H 54 9.008 8.601 0.407 1
1 511 . 36 1 1 A 55 55 ASP HA H 54 4.735 4.786 -0.051 1
1 514 . 36 1 1 A 55 55 ASP C C 54 175.421 176.011 -0.590 1
1 515 . 36 1 1 A 55 55 ASP CA C 54 52.888 53.881 -0.993 1
1 516 . 36 1 1 A 55 55 ASP CB C 54 38.894 40.106 -1.212 1
1 517 . 36 1 1 A 55 55 ASP N N 54 123.654 123.615 0.039 1
1 518 . 36 1 1 A 56 56 THR H H 55 7.819 8.102 -0.283 1
1 519 . 36 1 1 A 56 56 THR HA H 55 4.574 4.989 -0.415 1
1 524 . 36 1 1 A 56 56 THR C C 55 174.096 174.447 -0.351 1
1 525 . 36 1 1 A 56 56 THR CA C 55 59.172 59.364 -0.192 1
1 526 . 36 1 1 A 56 56 THR CB C 55 71.889 72.281 -0.392 1
1 528 . 36 1 1 A 56 56 THR N N 55 112.015 114.882 -2.867 1
1 529 . 36 1 1 A 57 57 GLU H H 56 8.527 8.927 -0.400 1
1 530 . 36 1 1 A 57 57 GLU HA H 56 4.217 4.387 -0.170 1
1 535 . 36 1 1 A 57 57 GLU C C 56 177.042 176.282 0.760 1
1 536 . 36 1 1 A 57 57 GLU CA C 56 56.869 57.038 -0.169 1
1 537 . 36 1 1 A 57 57 GLU CB C 56 29.731 30.404 -0.673 1
1 539 . 36 1 1 A 57 57 GLU N N 56 117.531 118.990 -1.459 1
1 540 . 36 1 1 A 58 58 GLU H H 57 7.587 7.676 -0.089 1
1 541 . 36 1 1 A 58 58 GLU HA H 57 3.941 4.773 -0.832 1
1 546 . 36 1 1 A 58 58 GLU C C 57 176.849 175.530 1.319 1
1 547 . 36 1 1 A 58 58 GLU CA C 57 56.924 55.649 1.275 1
1 548 . 36 1 1 A 58 58 GLU CB C 57 30.251 31.361 -1.110 1
1 550 . 36 1 1 A 58 58 GLU N N 57 119.183 121.078 -1.895 1
1 551 . 36 1 1 A 59 59 ASN H H 58 9.120 8.830 0.290 1
1 552 . 36 1 1 A 59 59 ASN HA H 58 4.922 5.105 -0.183 1
1 557 . 36 1 1 A 59 59 ASN C C 58 174.254 174.918 -0.664 1
1 558 . 36 1 1 A 59 59 ASN CA C 58 51.956 52.059 -0.103 1
1 559 . 36 1 1 A 59 59 ASN CB C 58 37.404 39.699 -2.295 1
1 560 . 36 1 1 A 59 59 ASN N N 58 126.767 123.159 3.608 1
1 562 . 36 1 1 A 60 60 LYS H H 59 5.892 8.849 -2.957 1
1 563 . 36 1 1 A 60 60 LYS HA H 59 3.798 4.568 -0.770 1
1 572 . 36 1 1 A 60 60 LYS C C 59 177.908 178.160 -0.252 1
1 573 . 36 1 1 A 60 60 LYS CA C 59 56.623 54.688 1.935 1
1 574 . 36 1 1 A 60 60 LYS CB C 59 32.279 34.282 -2.003 1
1 578 . 36 1 1 A 60 60 LYS N N 59 121.527 122.511 -0.984 1
1 579 . 36 1 1 A 61 61 LEU H H 60 8.473 8.884 -0.411 1
1 580 . 36 1 1 A 61 61 LEU HA H 60 3.891 4.233 -0.342 1
1 590 . 36 1 1 A 61 61 LEU C C 60 179.843 178.003 1.840 1
1 591 . 36 1 1 A 61 61 LEU CA C 60 58.301 57.323 0.978 1
1 592 . 36 1 1 A 61 61 LEU CB C 60 41.305 41.878 -0.573 1
1 596 . 36 1 1 A 61 61 LEU N N 60 125.639 124.918 0.721 1
1 597 . 36 1 1 A 62 62 ILE H H 61 7.698 7.950 -0.252 1
1 598 . 36 1 1 A 62 62 ILE HA H 61 3.952 3.930 0.022 1
1 608 . 36 1 1 A 62 62 ILE C C 61 175.392 177.205 -1.813 1
1 609 . 36 1 1 A 62 62 ILE CA C 61 61.743 63.440 -1.697 1
1 610 . 36 1 1 A 62 62 ILE CB C 61 39.108 37.790 1.318 1
1 614 . 36 1 1 A 62 62 ILE N N 61 114.111 118.852 -4.741 1
1 615 . 36 1 1 A 63 63 TYR H H 62 7.273 7.930 -0.657 1
1 616 . 36 1 1 A 63 63 TYR HA H 62 4.343 4.075 0.268 1
1 623 . 36 1 1 A 63 63 TYR C C 62 178.264 178.529 -0.265 1
1 624 . 36 1 1 A 63 63 TYR CA C 62 57.231 61.035 -3.804 1
1 625 . 36 1 1 A 63 63 TYR CB C 62 36.332 37.905 -1.573 1
1 630 . 36 1 1 A 63 63 TYR N N 62 117.689 121.314 -3.625 1
1 631 . 36 1 1 A 64 64 THR H H 63 7.747 8.022 -0.275 1
1 632 . 36 1 1 A 64 64 THR HA H 63 4.266 4.223 0.043 1
1 637 . 36 1 1 A 64 64 THR CA C 63 69.362 67.562 1.800 1
1 638 . 36 1 1 A 64 64 THR CB C 63 66.962 67.656 -0.694 1
1 640 . 36 1 1 A 64 64 THR N N 63 113.755 116.278 -2.523 1
1 641 . 36 1 1 A 65 65 PRO HA H 64 4.372 4.363 0.009 1
1 648 . 36 1 1 A 65 65 PRO C C 64 179.913 179.531 0.382 1
1 649 . 36 1 1 A 65 65 PRO CA C 64 66.011 66.353 -0.342 1
1 650 . 36 1 1 A 65 65 PRO CB C 64 30.642 30.779 -0.137 1
1 653 . 36 1 1 A 66 66 ILE H H 65 7.377 7.331 0.046 1
1 654 . 36 1 1 A 66 66 ILE HA H 65 3.530 3.868 -0.338 1
1 664 . 36 1 1 A 66 66 ILE C C 65 177.543 178.214 -0.671 1
1 665 . 36 1 1 A 66 66 ILE CA C 65 66.647 64.176 2.471 1
1 666 . 36 1 1 A 66 66 ILE CB C 65 38.029 37.578 0.451 1
1 670 . 36 1 1 A 66 66 ILE N N 65 118.353 116.608 1.745 1
1 671 . 36 1 1 A 67 67 PHE H H 66 8.480 8.355 0.125 1
1 672 . 36 1 1 A 67 67 PHE HA H 66 4.115 4.350 -0.235 1
1 680 . 36 1 1 A 67 67 PHE C C 66 177.293 177.928 -0.635 1
1 681 . 36 1 1 A 67 67 PHE CA C 66 59.570 62.240 -2.670 1
1 682 . 36 1 1 A 67 67 PHE CB C 66 38.865 39.510 -0.645 1
1 688 . 36 1 1 A 67 67 PHE N N 66 122.420 120.476 1.944 1
1 689 . 36 1 1 A 68 68 ASN H H 67 8.595 8.250 0.345 1
1 690 . 36 1 1 A 68 68 ASN HA H 67 4.211 4.364 -0.153 1
1 695 . 36 1 1 A 68 68 ASN C C 67 178.697 178.132 0.565 1
1 696 . 36 1 1 A 68 68 ASN CA C 67 56.056 56.195 -0.139 1
1 697 . 36 1 1 A 68 68 ASN CB C 67 37.704 38.036 -0.332 1
1 698 . 36 1 1 A 68 68 ASN N N 67 115.573 117.437 -1.864 1
1 700 . 36 1 1 A 69 69 GLU H H 68 8.414 7.994 0.420 1
1 701 . 36 1 1 A 69 69 GLU HA H 68 4.102 4.222 -0.120 1
1 706 . 36 1 1 A 69 69 GLU C C 68 177.880 178.864 -0.984 1
1 707 . 36 1 1 A 69 69 GLU CA C 68 59.399 59.377 0.022 1
1 708 . 36 1 1 A 69 69 GLU CB C 68 29.855 29.411 0.444 1
1 710 . 36 1 1 A 69 69 GLU N N 68 123.510 119.966 3.544 1
1 711 . 36 1 1 A 70 70 TYR H H 69 8.659 8.068 0.591 1
1 712 . 36 1 1 A 70 70 TYR HA H 69 3.362 4.184 -0.822 1
1 719 . 36 1 1 A 70 70 TYR C C 69 178.143 176.990 1.153 1
1 720 . 36 1 1 A 70 70 TYR CA C 69 60.686 61.355 -0.669 1
1 721 . 36 1 1 A 70 70 TYR CB C 69 38.560 38.766 -0.206 1
1 726 . 36 1 1 A 70 70 TYR N N 69 122.130 120.856 1.274 1
1 727 . 36 1 1 A 71 71 ILE H H 70 8.031 7.940 0.091 1
1 728 . 36 1 1 A 71 71 ILE HA H 70 3.265 3.739 -0.474 1
1 738 . 36 1 1 A 71 71 ILE C C 70 178.056 178.080 -0.024 1
1 739 . 36 1 1 A 71 71 ILE CA C 70 63.756 63.987 -0.231 1
1 740 . 36 1 1 A 71 71 ILE CB C 70 37.321 36.613 0.708 1
1 744 . 36 1 1 A 71 71 ILE N N 70 118.906 120.443 -1.537 1
1 745 . 36 1 1 A 72 72 SER H H 71 7.803 8.047 -0.244 1
1 746 . 36 1 1 A 72 72 SER HA H 71 4.029 4.355 -0.326 1
1 749 . 36 1 1 A 72 72 SER CA C 71 61.380 61.581 -0.201 1
1 750 . 36 1 1 A 72 72 SER CB C 71 63.288 63.227 0.061 1
1 751 . 36 1 1 A 72 72 SER N N 71 113.735 118.695 -4.960 1
1 752 . 36 1 1 A 73 73 LEU H H 72 7.952 8.071 -0.119 1
1 753 . 36 1 1 A 73 73 LEU HA H 72 4.418 4.171 0.247 1
1 763 . 36 1 1 A 73 73 LEU C C 72 177.767 178.270 -0.503 1
1 764 . 36 1 1 A 73 73 LEU CA C 72 56.543 57.471 -0.928 1
1 765 . 36 1 1 A 73 73 LEU CB C 72 44.517 41.837 2.680 1
1 769 . 36 1 1 A 73 73 LEU N N 72 119.411 122.123 -2.712 1
1 770 . 36 1 1 A 74 74 VAL H H 73 8.021 7.495 0.526 1
1 771 . 36 1 1 A 74 74 VAL HA H 73 3.532 3.307 0.225 1
1 779 . 36 1 1 A 74 74 VAL C C 73 177.126 178.129 -1.003 1
1 780 . 36 1 1 A 74 74 VAL CA C 73 66.250 66.664 -0.414 1
1 781 . 36 1 1 A 74 74 VAL CB C 73 31.212 31.063 0.149 1
1 784 . 36 1 1 A 74 74 VAL N N 73 118.747 119.301 -0.554 1
1 785 . 36 1 1 A 75 75 GLU H H 74 7.232 8.020 -0.788 1
1 786 . 36 1 1 A 75 75 GLU HA H 74 3.013 4.148 -1.135 1
1 791 . 36 1 1 A 75 75 GLU C C 74 178.804 179.512 -0.708 1
1 792 . 36 1 1 A 75 75 GLU CA C 74 60.536 59.917 0.619 1
1 793 . 36 1 1 A 75 75 GLU CB C 74 27.009 28.986 -1.977 1
1 795 . 36 1 1 A 75 75 GLU N N 74 118.660 119.775 -1.115 1
1 796 . 36 1 1 A 76 76 LYS H H 75 7.051 8.150 -1.099 1
1 797 . 36 1 1 A 76 76 LYS HA H 75 3.765 4.166 -0.401 1
1 806 . 36 1 1 A 76 76 LYS C C 75 177.765 178.144 -0.379 1
1 807 . 36 1 1 A 76 76 LYS CA C 75 58.357 58.253 0.104 1
1 808 . 36 1 1 A 76 76 LYS CB C 75 31.939 32.108 -0.169 1
1 812 . 36 1 1 A 76 76 LYS N N 75 116.112 119.315 -3.203 1
1 813 . 36 1 1 A 77 77 TYR H H 76 7.067 8.030 -0.963 1
1 814 . 36 1 1 A 77 77 TYR HA H 76 4.036 4.162 -0.126 1
1 821 . 36 1 1 A 77 77 TYR C C 76 177.752 176.880 0.872 1
1 822 . 36 1 1 A 77 77 TYR CA C 76 61.820 61.262 0.558 1
1 823 . 36 1 1 A 77 77 TYR CB C 76 38.480 38.789 -0.309 1
1 828 . 36 1 1 A 77 77 TYR N N 76 118.434 122.338 -3.904 1
1 829 . 36 1 1 A 78 78 ILE H H 77 7.554 8.409 -0.855 1
1 830 . 36 1 1 A 78 78 ILE HA H 77 3.159 3.617 -0.458 1
1 840 . 36 1 1 A 78 78 ILE C C 77 177.341 177.848 -0.507 1
1 841 . 36 1 1 A 78 78 ILE CA C 77 65.177 65.412 -0.235 1
1 842 . 36 1 1 A 78 78 ILE CB C 77 37.339 37.217 0.122 1
1 846 . 36 1 1 A 78 78 ILE N N 77 117.672 121.374 -3.702 1
1 847 . 36 1 1 A 79 79 GLU H H 78 8.296 8.082 0.214 1
1 848 . 36 1 1 A 79 79 GLU HA H 78 3.557 3.877 -0.320 1
1 853 . 36 1 1 A 79 79 GLU C C 78 177.742 178.918 -1.176 1
1 854 . 36 1 1 A 79 79 GLU CA C 78 60.847 60.077 0.770 1
1 855 . 36 1 1 A 79 79 GLU CB C 78 29.594 29.126 0.468 1
1 857 . 36 1 1 A 79 79 GLU N N 78 118.701 121.265 -2.564 1
1 858 . 36 1 1 A 80 80 GLU H H 79 8.330 8.170 0.160 1
1 859 . 36 1 1 A 80 80 GLU HA H 79 3.774 4.022 -0.248 1
1 864 . 36 1 1 A 80 80 GLU C C 79 179.926 179.183 0.743 1
1 865 . 36 1 1 A 80 80 GLU CA C 79 59.581 58.996 0.585 1
1 866 . 36 1 1 A 80 80 GLU CB C 79 29.062 29.173 -0.111 1
1 868 . 36 1 1 A 80 80 GLU N N 79 116.767 118.138 -1.371 1
1 869 . 36 1 1 A 81 81 GLN H H 80 7.634 7.624 0.010 1
1 870 . 36 1 1 A 81 81 GLN HA H 80 3.605 3.783 -0.178 1
1 877 . 36 1 1 A 81 81 GLN C C 80 179.681 179.041 0.640 1
1 878 . 36 1 1 A 81 81 GLN CA C 80 57.765 58.530 -0.765 1
1 879 . 36 1 1 A 81 81 GLN CB C 80 28.079 27.736 0.343 1
1 881 . 36 1 1 A 81 81 GLN N N 80 116.325 118.673 -2.348 1
1 883 . 36 1 1 A 82 82 LEU H H 81 8.156 7.662 0.494 1
1 884 . 36 1 1 A 82 82 LEU HA H 81 3.536 3.734 -0.198 1
1 894 . 36 1 1 A 82 82 LEU C C 81 178.945 179.590 -0.645 1
1 895 . 36 1 1 A 82 82 LEU CA C 81 57.761 57.279 0.482 1
1 896 . 36 1 1 A 82 82 LEU CB C 81 40.961 40.632 0.329 1
1 900 . 36 1 1 A 82 82 LEU N N 81 121.546 120.066 1.480 1
1 901 . 36 1 1 A 83 83 LEU H H 82 8.326 7.977 0.349 1
1 902 . 36 1 1 A 83 83 LEU HA H 82 4.198 4.266 -0.068 1
1 912 . 36 1 1 A 83 83 LEU C C 82 178.631 179.256 -0.625 1
1 913 . 36 1 1 A 83 83 LEU CA C 82 57.016 57.288 -0.272 1
1 914 . 36 1 1 A 83 83 LEU CB C 82 42.182 40.840 1.342 1
1 918 . 36 1 1 A 83 83 LEU N N 82 120.426 119.833 0.593 1
1 919 . 36 1 1 A 84 84 GLN H H 83 6.992 7.655 -0.663 1
1 920 . 36 1 1 A 84 84 GLN HA H 83 3.877 3.975 -0.098 1
1 927 . 36 1 1 A 84 84 GLN C C 83 177.008 176.932 0.076 1
1 928 . 36 1 1 A 84 84 GLN CA C 83 57.543 58.895 -1.352 1
1 929 . 36 1 1 A 84 84 GLN CB C 83 28.688 28.471 0.217 1
1 931 . 36 1 1 A 84 84 GLN N N 83 114.001 117.437 -3.436 1
1 933 . 36 1 1 A 85 85 ARG H H 84 7.072 7.349 -0.277 1
1 934 . 36 1 1 A 85 85 ARG HA H 84 4.047 4.358 -0.311 1
1 942 . 36 1 1 A 85 85 ARG C C 84 175.999 175.275 0.724 1
1 943 . 36 1 1 A 85 85 ARG CA C 84 56.764 55.847 0.917 1
1 944 . 36 1 1 A 85 85 ARG CB C 84 32.044 32.131 -0.087 1
1 947 . 36 1 1 A 85 85 ARG N N 84 115.827 116.590 -0.763 1
1 949 . 36 1 1 A 86 86 ILE H H 85 8.238 7.708 0.530 1
1 950 . 36 1 1 A 86 86 ILE HA H 85 4.389 4.552 -0.163 1
1 960 . 36 1 1 A 86 86 ILE CA C 85 58.007 57.948 0.059 1
1 961 . 36 1 1 A 86 86 ILE CB C 85 39.604 39.175 0.429 1
1 965 . 36 1 1 A 86 86 ILE N N 85 119.285 119.762 -0.477 1
1 966 . 36 1 1 A 87 87 PRO HA H 86 4.392 4.528 -0.136 1
1 973 . 36 1 1 A 87 87 PRO C C 86 177.622 176.315 1.307 1
1 974 . 36 1 1 A 87 87 PRO CA C 86 64.665 64.296 0.369 1
1 975 . 36 1 1 A 87 87 PRO CB C 86 32.020 31.650 0.370 1
1 978 . 36 1 1 A 88 88 GLU H H 87 8.312 8.202 0.110 1
1 979 . 36 1 1 A 88 88 GLU HA H 87 4.208 4.581 -0.373 1
1 984 . 36 1 1 A 88 88 GLU C C 87 175.554 175.864 -0.310 1
1 985 . 36 1 1 A 88 88 GLU CA C 87 56.045 56.284 -0.239 1
1 986 . 36 1 1 A 88 88 GLU CB C 87 28.654 30.653 -1.999 1
1 988 . 36 1 1 A 88 88 GLU N N 87 114.256 116.761 -2.505 1
1 989 . 36 1 1 A 89 89 PHE H H 88 7.946 7.721 0.225 1
1 990 . 36 1 1 A 89 89 PHE HA H 88 3.993 4.696 -0.703 1
1 998 . 36 1 1 A 89 89 PHE C C 88 173.460 174.717 -1.257 1
1 999 . 36 1 1 A 89 89 PHE CA C 88 60.119 58.429 1.690 1
1 1000 . 36 1 1 A 89 89 PHE CB C 88 39.994 40.028 -0.034 1
1 1006 . 36 1 1 A 89 89 PHE N N 88 121.550 123.129 -1.579 1
1 1007 . 36 1 1 A 90 90 ASN H H 89 7.266 8.080 -0.814 1
1 1008 . 36 1 1 A 90 90 ASN HA H 89 4.454 4.976 -0.522 1
1 1013 . 36 1 1 A 90 90 ASN C C 89 173.921 175.162 -1.241 1
1 1014 . 36 1 1 A 90 90 ASN CA C 89 51.839 51.315 0.524 1
1 1015 . 36 1 1 A 90 90 ASN CB C 89 40.674 39.724 0.950 1
1 1016 . 36 1 1 A 90 90 ASN N N 89 125.344 125.527 -0.183 1
1 1018 . 36 1 1 A 91 91 MET H H 90 8.968 8.925 0.043 1
1 1019 . 36 1 1 A 91 91 MET HA H 90 4.049 4.199 -0.150 1
1 1027 . 36 1 1 A 91 91 MET C C 90 177.475 177.918 -0.443 1
1 1028 . 36 1 1 A 91 91 MET CA C 90 57.758 58.655 -0.897 1
1 1029 . 36 1 1 A 91 91 MET CB C 90 32.250 32.608 -0.358 1
1 1032 . 36 1 1 A 91 91 MET N N 90 127.052 125.359 1.693 1
1 1033 . 36 1 1 A 92 92 ALA H H 91 8.292 8.161 0.131 1
1 1034 . 36 1 1 A 92 92 ALA HA H 91 4.059 4.017 0.042 1
1 1038 . 36 1 1 A 92 92 ALA C C 91 180.412 180.216 0.196 1
1 1039 . 36 1 1 A 92 92 ALA CA C 91 55.368 55.292 0.076 1
1 1040 . 36 1 1 A 92 92 ALA CB C 91 17.527 18.476 -0.949 1
1 1041 . 36 1 1 A 92 92 ALA N N 91 123.752 121.424 2.328 1
1 1042 . 36 1 1 A 93 93 ALA H H 92 7.931 8.142 -0.211 1
1 1043 . 36 1 1 A 93 93 ALA HA H 92 4.054 4.037 0.017 1
1 1047 . 36 1 1 A 93 93 ALA C C 92 180.482 179.927 0.555 1
1 1048 . 36 1 1 A 93 93 ALA CA C 92 54.614 55.035 -0.421 1
1 1049 . 36 1 1 A 93 93 ALA CB C 92 18.098 18.131 -0.033 1
1 1050 . 36 1 1 A 93 93 ALA N N 92 121.158 119.830 1.328 1
1 1051 . 36 1 1 A 94 94 PHE H H 93 8.110 7.923 0.187 1
1 1052 . 36 1 1 A 94 94 PHE HA H 93 4.304 4.090 0.214 1
1 1060 . 36 1 1 A 94 94 PHE C C 93 177.350 177.328 0.022 1
1 1061 . 36 1 1 A 94 94 PHE CA C 93 61.641 61.448 0.193 1
1 1062 . 36 1 1 A 94 94 PHE CB C 93 40.014 39.026 0.988 1
1 1068 . 36 1 1 A 94 94 PHE N N 93 119.807 120.063 -0.256 1
1 1069 . 36 1 1 A 95 95 THR H H 94 8.726 8.323 0.403 1
1 1070 . 36 1 1 A 95 95 THR HA H 94 3.569 3.899 -0.330 1
1 1075 . 36 1 1 A 95 95 THR C C 94 176.932 176.895 0.037 1
1 1076 . 36 1 1 A 95 95 THR CA C 94 66.833 65.460 1.373 1
1 1077 . 36 1 1 A 95 95 THR CB C 94 68.445 68.204 0.241 1
1 1079 . 36 1 1 A 95 95 THR N N 94 113.074 112.258 0.816 1
1 1080 . 36 1 1 A 96 96 THR H H 95 7.657 7.745 -0.088 1
1 1081 . 36 1 1 A 96 96 THR HA H 95 3.945 4.088 -0.143 1
1 1086 . 36 1 1 A 96 96 THR C C 95 176.386 176.423 -0.037 1
1 1087 . 36 1 1 A 96 96 THR CA C 95 66.550 66.039 0.511 1
1 1088 . 36 1 1 A 96 96 THR CB C 95 68.583 68.830 -0.247 1
1 1090 . 36 1 1 A 96 96 THR N N 95 117.927 116.458 1.469 1
1 1091 . 36 1 1 A 97 97 THR H H 96 7.699 7.728 -0.029 1
1 1092 . 36 1 1 A 97 97 THR HA H 96 3.905 4.007 -0.102 1
1 1097 . 36 1 1 A 97 97 THR C C 96 176.572 176.320 0.252 1
1 1098 . 36 1 1 A 97 97 THR CA C 96 65.979 66.627 -0.648 1
1 1099 . 36 1 1 A 97 97 THR CB C 96 68.553 68.252 0.301 1
1 1101 . 36 1 1 A 97 97 THR N N 96 118.518 116.473 2.045 1
1 1102 . 36 1 1 A 98 98 LEU H H 97 8.304 8.066 0.238 1
1 1103 . 36 1 1 A 98 98 LEU HA H 97 3.725 3.836 -0.111 1
1 1113 . 36 1 1 A 98 98 LEU C C 97 178.490 178.728 -0.238 1
1 1114 . 36 1 1 A 98 98 LEU CA C 97 58.517 58.049 0.468 1
1 1115 . 36 1 1 A 98 98 LEU CB C 97 41.697 41.182 0.515 1
1 1119 . 36 1 1 A 98 98 LEU N N 97 122.882 121.946 0.936 1
1 1120 . 36 1 1 A 99 99 GLN H H 98 7.639 7.962 -0.323 1
1 1121 . 36 1 1 A 99 99 GLN HA H 98 3.927 3.992 -0.065 1
1 1128 . 36 1 1 A 99 99 GLN C C 98 178.068 178.480 -0.412 1
1 1129 . 36 1 1 A 99 99 GLN CA C 98 58.735 59.106 -0.371 1
1 1130 . 36 1 1 A 99 99 GLN CB C 98 27.986 28.163 -0.177 1
1 1132 . 36 1 1 A 99 99 GLN N N 98 114.302 118.095 -3.793 1
1 1134 . 36 1 1 A 100 100 HIS H H 99 7.575 7.476 0.099 1
1 1135 . 36 1 1 A 100 100 HIS HA H 99 4.524 4.432 0.092 1
1 1139 . 36 1 1 A 100 100 HIS C C 99 174.789 177.711 -2.922 1
1 1140 . 36 1 1 A 100 100 HIS CA C 99 56.154 60.018 -3.864 1
1 1141 . 36 1 1 A 100 100 HIS CB C 99 28.946 30.594 -1.648 1
1 1143 . 36 1 1 A 100 100 HIS N N 99 114.778 118.841 -4.063 1
1 1144 . 36 1 1 A 101 101 HIS H H 100 7.773 8.205 -0.432 1
1 1145 . 36 1 1 A 101 101 HIS HA H 100 4.704 4.365 0.339 1
1 1149 . 36 1 1 A 101 101 HIS C C 100 174.818 177.112 -2.294 1
1 1150 . 36 1 1 A 101 101 HIS CA C 100 54.830 58.573 -3.743 1
1 1151 . 36 1 1 A 101 101 HIS CB C 100 29.749 28.512 1.237 1
1 1153 . 36 1 1 A 101 101 HIS N N 100 117.397 117.329 0.068 1
1 1154 . 36 1 1 A 102 102 LYS H H 101 7.324 8.157 -0.833 1
1 1155 . 36 1 1 A 102 102 LYS HA H 101 3.611 4.044 -0.433 1
1 1164 . 36 1 1 A 102 102 LYS C C 101 176.823 178.150 -1.327 1
1 1165 . 36 1 1 A 102 102 LYS CA C 101 59.915 59.039 0.876 1
1 1166 . 36 1 1 A 102 102 LYS CB C 101 32.825 32.008 0.817 1
1 1170 . 36 1 1 A 102 102 LYS N N 101 120.533 121.982 -1.449 1
1 1171 . 36 1 1 A 103 103 ASP H H 102 8.361 7.700 0.661 1
1 1172 . 36 1 1 A 103 103 ASP HA H 102 4.421 4.458 -0.037 1
1 1175 . 36 1 1 A 103 103 ASP C C 102 176.793 176.568 0.225 1
1 1176 . 36 1 1 A 103 103 ASP CA C 102 55.500 56.155 -0.655 1
1 1177 . 36 1 1 A 103 103 ASP CB C 102 40.178 40.660 -0.482 1
1 1178 . 36 1 1 A 103 103 ASP N N 102 114.814 117.745 -2.931 1
1 1179 . 36 1 1 A 104 104 GLU H H 103 7.858 7.861 -0.003 1
1 1180 . 36 1 1 A 104 104 GLU HA H 103 4.339 4.428 -0.089 1
1 1183 . 36 1 1 A 104 104 GLU C C 103 175.777 176.521 -0.744 1
1 1184 . 36 1 1 A 104 104 GLU CA C 103 56.356 57.634 -1.278 1
1 1185 . 36 1 1 A 104 104 GLU CB C 103 31.293 31.447 -0.154 1
1 1186 . 36 1 1 A 104 104 GLU N N 103 116.826 117.186 -0.360 1
1 1187 . 36 1 1 A 105 105 VAL H H 104 7.201 7.806 -0.605 1
1 1188 . 36 1 1 A 105 105 VAL HA H 104 4.296 4.162 0.134 1
1 1196 . 36 1 1 A 105 105 VAL C C 104 174.482 175.587 -1.105 1
1 1197 . 36 1 1 A 105 105 VAL CA C 104 60.370 62.782 -2.412 1
1 1198 . 36 1 1 A 105 105 VAL CB C 104 34.341 33.274 1.067 1
1 1201 . 36 1 1 A 105 105 VAL N N 104 116.422 119.935 -3.513 1
1 1202 . 36 1 1 A 106 106 ALA H H 105 8.487 8.453 0.034 1
1 1203 . 36 1 1 A 106 106 ALA HA H 105 4.172 4.423 -0.251 1
1 1207 . 36 1 1 A 106 106 ALA C C 105 179.030 178.784 0.246 1
1 1208 . 36 1 1 A 106 106 ALA CA C 105 52.966 52.555 0.411 1
1 1209 . 36 1 1 A 106 106 ALA CB C 105 19.371 19.483 -0.112 1
1 1210 . 36 1 1 A 106 106 ALA N N 105 128.313 128.715 -0.402 1
1 1211 . 36 1 1 A 107 107 GLY H H 106 8.738 8.820 -0.082 1
1 1212 . 36 1 1 A 107 107 GLY HA2 H 106 3.773 3.892 -0.119 1
1 1213 . 36 1 1 A 107 107 GLY HA3 H 106 3.998 3.961 0.037 1
1 1214 . 36 1 1 A 107 107 GLY C C 106 174.958 175.483 -0.525 1
1 1215 . 36 1 1 A 107 107 GLY CA C 106 47.449 47.182 0.267 1
1 1216 . 36 1 1 A 107 107 GLY N N 106 110.612 110.832 -0.220 1
1 1217 . 36 1 1 A 108 108 ASP H H 107 8.535 7.884 0.651 1
1 1218 . 36 1 1 A 108 108 ASP HA H 107 4.333 4.360 -0.027 1
1 1221 . 36 1 1 A 108 108 ASP C C 107 179.133 179.010 0.123 1
1 1222 . 36 1 1 A 108 108 ASP CA C 107 56.721 56.424 0.297 1
1 1223 . 36 1 1 A 108 108 ASP CB C 107 39.336 40.995 -1.659 1
1 1224 . 36 1 1 A 108 108 ASP N N 107 117.474 122.527 -5.053 1
1 1225 . 36 1 1 A 109 109 ILE H H 108 7.459 7.896 -0.437 1
1 1226 . 36 1 1 A 109 109 ILE HA H 108 3.688 3.660 0.028 1
1 1236 . 36 1 1 A 109 109 ILE C C 108 176.735 178.169 -1.434 1
1 1237 . 36 1 1 A 109 109 ILE CA C 108 63.474 65.594 -2.120 1
1 1238 . 36 1 1 A 109 109 ILE CB C 108 37.340 37.956 -0.616 1
1 1242 . 36 1 1 A 109 109 ILE N N 108 119.609 119.541 0.068 1
1 1243 . 36 1 1 A 110 110 PHE H H 109 7.920 8.355 -0.435 1
1 1244 . 36 1 1 A 110 110 PHE HA H 109 3.759 4.100 -0.341 1
1 1252 . 36 1 1 A 110 110 PHE C C 109 177.132 177.402 -0.270 1
1 1253 . 36 1 1 A 110 110 PHE CA C 109 62.766 61.256 1.510 1
1 1254 . 36 1 1 A 110 110 PHE CB C 109 39.752 39.299 0.453 1
1 1260 . 36 1 1 A 110 110 PHE N N 109 120.906 120.411 0.495 1
1 1261 . 36 1 1 A 111 111 ASP H H 110 8.639 8.340 0.299 1
1 1262 . 36 1 1 A 111 111 ASP HA H 110 4.216 4.223 -0.007 1
1 1265 . 36 1 1 A 111 111 ASP C C 110 178.900 178.397 0.503 1
1 1266 . 36 1 1 A 111 111 ASP CA C 110 57.105 57.277 -0.172 1
1 1267 . 36 1 1 A 111 111 ASP CB C 110 39.697 41.720 -2.023 1
1 1268 . 36 1 1 A 111 111 ASP N N 110 117.124 119.049 -1.925 1
1 1269 . 36 1 1 A 112 112 MET H H 111 7.331 7.537 -0.206 1
1 1270 . 36 1 1 A 112 112 MET HA H 111 4.081 4.142 -0.061 1
1 1278 . 36 1 1 A 112 112 MET C C 111 179.052 178.186 0.866 1
1 1279 . 36 1 1 A 112 112 MET CA C 111 58.202 58.145 0.057 1
1 1280 . 36 1 1 A 112 112 MET CB C 111 31.827 32.359 -0.532 1
1 1283 . 36 1 1 A 112 112 MET N N 111 118.061 119.459 -1.398 1
1 1284 . 36 1 1 A 113 113 LEU H H 112 8.001 8.062 -0.061 1
1 1285 . 36 1 1 A 113 113 LEU HA H 112 3.723 3.643 0.080 1
1 1295 . 36 1 1 A 113 113 LEU C C 112 179.747 178.677 1.070 1
1 1296 . 36 1 1 A 113 113 LEU CA C 112 57.371 57.492 -0.121 1
1 1297 . 36 1 1 A 113 113 LEU CB C 112 40.671 41.328 -0.657 1
1 1301 . 36 1 1 A 113 113 LEU N N 112 120.426 119.717 0.709 1
1 1302 . 36 1 1 A 114 114 LEU H H 113 7.744 7.811 -0.067 1
1 1303 . 36 1 1 A 114 114 LEU HA H 113 4.007 3.522 0.485 1
1 1313 . 36 1 1 A 114 114 LEU C C 113 179.358 178.553 0.805 1
1 1314 . 36 1 1 A 114 114 LEU CA C 113 57.202 57.529 -0.327 1
1 1315 . 36 1 1 A 114 114 LEU CB C 113 41.727 41.592 0.135 1
1 1319 . 36 1 1 A 114 114 LEU N N 113 119.584 119.683 -0.099 1
1 1320 . 36 1 1 A 115 115 THR H H 114 7.353 7.612 -0.259 1
1 1321 . 36 1 1 A 115 115 THR HA H 114 4.071 4.116 -0.045 1
1 1327 . 36 1 1 A 115 115 THR C C 114 173.591 176.312 -2.721 1
1 1328 . 36 1 1 A 115 115 THR CA C 114 65.332 64.684 0.648 1
1 1329 . 36 1 1 A 115 115 THR CB C 114 70.319 68.660 1.659 1
1 1331 . 36 1 1 A 115 115 THR N N 114 107.535 112.377 -4.842 1
1 1332 . 36 1 1 A 116 116 PHE H H 115 6.979 7.905 -0.926 1
1 1333 . 36 1 1 A 116 116 PHE HA H 115 5.022 4.346 0.676 1
1 1341 . 36 1 1 A 116 116 PHE C C 115 176.488 176.565 -0.077 1
1 1342 . 36 1 1 A 116 116 PHE CA C 115 55.911 61.221 -5.310 1
1 1343 . 36 1 1 A 116 116 PHE CB C 115 38.521 39.099 -0.578 1
1 1349 . 36 1 1 A 116 116 PHE N N 115 112.366 119.974 -7.608 1
1 1350 . 36 1 1 A 117 117 THR H H 116 7.564 7.537 0.027 1
1 1351 . 36 1 1 A 117 117 THR HA H 116 4.626 4.774 -0.148 1
1 1356 . 36 1 1 A 117 117 THR C C 116 174.085 174.653 -0.568 1
1 1357 . 36 1 1 A 117 117 THR CA C 116 61.636 62.249 -0.613 1
1 1358 . 36 1 1 A 117 117 THR CB C 116 70.915 70.656 0.259 1
1 1360 . 36 1 1 A 117 117 THR N N 116 105.498 106.569 -1.071 1
1 1361 . 36 1 1 A 118 118 ASP H H 117 8.270 7.506 0.764 1
1 1362 . 36 1 1 A 118 118 ASP HA H 117 4.955 4.912 0.043 1
1 1365 . 36 1 1 A 118 118 ASP C C 117 176.328 176.327 0.001 1
1 1366 . 36 1 1 A 118 118 ASP CA C 117 53.417 53.999 -0.582 1
1 1367 . 36 1 1 A 118 118 ASP CB C 117 43.388 39.334 4.054 1
1 1368 . 36 1 1 A 118 118 ASP N N 117 124.409 122.867 1.542 1
1 1369 . 36 1 1 A 119 119 PHE H H 118 8.973 8.737 0.236 1
1 1370 . 36 1 1 A 119 119 PHE HA H 118 3.506 4.206 -0.700 1
1 1378 . 36 1 1 A 119 119 PHE CA C 118 61.490 61.325 0.165 1
1 1379 . 36 1 1 A 119 119 PHE CB C 118 39.246 39.509 -0.263 1
1 1385 . 36 1 1 A 119 119 PHE N N 118 126.688 126.266 0.422 1
1 1386 . 36 1 1 A 120 120 LEU H H 119 8.099 8.393 -0.294 1
1 1387 . 36 1 1 A 120 120 LEU HA H 119 3.842 3.890 -0.048 1
1 1397 . 36 1 1 A 120 120 LEU C C 119 179.601 179.482 0.119 1
1 1398 . 36 1 1 A 120 120 LEU CA C 119 58.174 57.794 0.380 1
1 1399 . 36 1 1 A 120 120 LEU CB C 119 40.315 41.079 -0.764 1
1 1403 . 36 1 1 A 120 120 LEU N N 119 117.930 119.897 -1.967 1
1 1404 . 36 1 1 A 121 121 ALA H H 120 7.729 7.561 0.168 1
1 1405 . 36 1 1 A 121 121 ALA HA H 120 3.996 4.121 -0.125 1
1 1409 . 36 1 1 A 121 121 ALA C C 120 180.995 179.576 1.419 1
1 1410 . 36 1 1 A 121 121 ALA CA C 120 54.832 54.673 0.159 1
1 1411 . 36 1 1 A 121 121 ALA CB C 120 17.706 18.288 -0.582 1
1 1412 . 36 1 1 A 121 121 ALA N N 120 123.195 121.582 1.613 1
1 1413 . 36 1 1 A 122 122 PHE H H 121 7.943 7.898 0.045 1
1 1414 . 36 1 1 A 122 122 PHE HA H 121 3.887 3.912 -0.025 1
1 1419 . 36 1 1 A 122 122 PHE C C 121 175.410 177.018 -1.608 1
1 1420 . 36 1 1 A 122 122 PHE CA C 121 61.075 60.763 0.312 1
1 1421 . 36 1 1 A 122 122 PHE CB C 121 38.115 38.856 -0.741 1
1 1424 . 36 1 1 A 122 122 PHE N N 121 121.798 120.527 1.271 1
1 1425 . 36 1 1 A 123 123 LYS H H 122 8.468 7.860 0.608 1
1 1426 . 36 1 1 A 123 123 LYS HA H 122 3.077 3.854 -0.777 1
1 1435 . 36 1 1 A 123 123 LYS C C 122 178.453 178.757 -0.304 1
1 1436 . 36 1 1 A 123 123 LYS CA C 122 59.855 59.968 -0.113 1
1 1437 . 36 1 1 A 123 123 LYS CB C 122 32.374 32.403 -0.029 1
1 1441 . 36 1 1 A 123 123 LYS N N 122 120.614 118.466 2.148 1
1 1442 . 36 1 1 A 124 124 GLU H H 123 8.100 7.809 0.291 1
1 1443 . 36 1 1 A 124 124 GLU HA H 123 3.652 4.058 -0.406 1
1 1448 . 36 1 1 A 124 124 GLU C C 123 177.743 178.438 -0.695 1
1 1449 . 36 1 1 A 124 124 GLU CA C 123 59.406 59.476 -0.070 1
1 1450 . 36 1 1 A 124 124 GLU CB C 123 28.811 29.398 -0.587 1
1 1452 . 36 1 1 A 124 124 GLU N N 123 117.404 118.775 -1.371 1
1 1453 . 36 1 1 A 125 125 MET H H 124 7.537 7.576 -0.039 1
1 1454 . 36 1 1 A 125 125 MET HA H 124 3.860 3.963 -0.103 1
1 1462 . 36 1 1 A 125 125 MET C C 124 179.522 178.350 1.172 1
1 1463 . 36 1 1 A 125 125 MET CA C 124 58.832 58.466 0.366 1
1 1464 . 36 1 1 A 125 125 MET CB C 124 31.765 31.521 0.244 1
1 1467 . 36 1 1 A 125 125 MET N N 124 119.413 118.966 0.447 1
1 1468 . 36 1 1 A 126 126 PHE H H 125 7.148 7.540 -0.392 1
1 1469 . 36 1 1 A 126 126 PHE HA H 125 3.633 4.220 -0.587 1
1 1476 . 36 1 1 A 126 126 PHE C C 125 178.994 178.239 0.755 1
1 1477 . 36 1 1 A 126 126 PHE CA C 125 63.148 61.174 1.974 1
1 1478 . 36 1 1 A 126 126 PHE CB C 125 39.830 38.386 1.444 1
1 1483 . 36 1 1 A 126 126 PHE N N 125 120.013 118.870 1.143 1
1 1484 . 36 1 1 A 127 127 LEU H H 126 8.369 8.443 -0.074 1
1 1485 . 36 1 1 A 127 127 LEU HA H 126 3.972 4.029 -0.057 1
1 1495 . 36 1 1 A 127 127 LEU C C 126 180.621 178.968 1.653 1
1 1496 . 36 1 1 A 127 127 LEU CA C 126 57.944 58.030 -0.086 1
1 1497 . 36 1 1 A 127 127 LEU CB C 126 40.543 41.358 -0.815 1
1 1501 . 36 1 1 A 127 127 LEU N N 126 119.692 119.781 -0.089 1
1 1502 . 36 1 1 A 128 128 ASP H H 127 8.578 8.087 0.491 1
1 1503 . 36 1 1 A 128 128 ASP HA H 127 4.308 4.324 -0.016 1
1 1506 . 36 1 1 A 128 128 ASP C C 127 178.254 178.011 0.243 1
1 1507 . 36 1 1 A 128 128 ASP CA C 127 56.964 57.279 -0.315 1
1 1508 . 36 1 1 A 128 128 ASP CB C 127 39.735 40.926 -1.191 1
1 1509 . 36 1 1 A 128 128 ASP N N 127 121.926 119.080 2.846 1
1 1510 . 36 1 1 A 129 129 TYR H H 128 7.710 8.253 -0.543 1
1 1511 . 36 1 1 A 129 129 TYR HA H 128 3.908 4.052 -0.144 1
1 1518 . 36 1 1 A 129 129 TYR C C 128 177.633 177.850 -0.217 1
1 1519 . 36 1 1 A 129 129 TYR CA C 128 61.796 61.460 0.336 1
1 1520 . 36 1 1 A 129 129 TYR CB C 128 39.372 38.716 0.656 1
1 1525 . 36 1 1 A 129 129 TYR N N 128 122.548 120.674 1.874 1
1 1526 . 36 1 1 A 130 130 ARG H H 129 8.622 8.394 0.228 1
1 1527 . 36 1 1 A 130 130 ARG HA H 129 3.722 3.907 -0.185 1
1 1535 . 36 1 1 A 130 130 ARG CA C 129 60.084 59.340 0.744 1
1 1536 . 36 1 1 A 130 130 ARG CB C 129 29.902 29.989 -0.087 1
1 1539 . 36 1 1 A 130 130 ARG N N 129 118.302 119.164 -0.862 1
1 1541 . 36 1 1 A 131 131 ALA H H 130 7.936 7.960 -0.024 1
1 1542 . 36 1 1 A 131 131 ALA HA H 130 3.997 4.025 -0.028 1
1 1546 . 36 1 1 A 131 131 ALA C C 130 180.456 179.509 0.947 1
1 1547 . 36 1 1 A 131 131 ALA CA C 130 55.133 54.898 0.235 1
1 1548 . 36 1 1 A 131 131 ALA CB C 130 17.750 18.219 -0.469 1
1 1549 . 36 1 1 A 131 131 ALA N N 130 119.788 121.811 -2.023 1
1 1550 . 36 1 1 A 132 132 GLU H H 131 7.622 7.466 0.156 1
1 1551 . 36 1 1 A 132 132 GLU HA H 131 3.862 4.044 -0.182 1
1 1556 . 36 1 1 A 132 132 GLU C C 131 179.528 178.555 0.973 1
1 1557 . 36 1 1 A 132 132 GLU CA C 131 58.849 58.347 0.502 1
1 1558 . 36 1 1 A 132 132 GLU CB C 131 28.930 29.133 -0.203 1
1 1560 . 36 1 1 A 132 132 GLU N N 131 118.428 117.786 0.642 1
1 1561 . 36 1 1 A 133 133 LYS H H 132 7.853 7.606 0.247 1
1 1562 . 36 1 1 A 133 133 LYS HA H 132 3.722 3.964 -0.242 1
1 1571 . 36 1 1 A 133 133 LYS C C 132 175.725 178.459 -2.734 1
1 1572 . 36 1 1 A 133 133 LYS CA C 132 57.544 58.845 -1.301 1
1 1573 . 36 1 1 A 133 133 LYS CB C 132 31.770 31.762 0.008 1
1 1577 . 36 1 1 A 133 133 LYS N N 132 119.473 119.400 0.073 1
1 1578 . 36 1 1 A 134 134 GLU H H 133 8.151 7.747 0.404 1
1 1579 . 36 1 1 A 134 134 GLU HA H 133 4.161 4.225 -0.064 1
1 1584 . 36 1 1 A 134 134 GLU C C 133 177.453 178.936 -1.483 1
1 1585 . 36 1 1 A 134 134 GLU CA C 133 57.222 57.982 -0.760 1
1 1586 . 36 1 1 A 134 134 GLU CB C 133 30.091 29.555 0.536 1
1 1588 . 36 1 1 A 134 134 GLU N N 133 116.525 119.093 -2.568 1
1 1589 . 36 1 1 A 135 135 GLY H H 134 7.702 8.047 -0.345 1
1 1590 . 36 1 1 A 135 135 GLY HA2 H 134 3.896 3.719 0.177 1
1 1591 . 36 1 1 A 135 135 GLY HA3 H 134 3.897 3.732 0.165 1
1 1592 . 36 1 1 A 135 135 GLY C C 134 174.538 175.128 -0.590 1
1 1593 . 36 1 1 A 135 135 GLY CA C 134 45.975 46.926 -0.951 1
1 1594 . 36 1 1 A 135 135 GLY N N 134 107.924 108.852 -0.928 1
1 1595 . 36 1 1 A 136 136 ARG H H 135 8.045 7.624 0.421 1
1 1596 . 36 1 1 A 136 136 ARG HA H 135 4.323 4.408 -0.085 1
1 1604 . 36 1 1 A 136 136 ARG C C 135 175.864 176.160 -0.296 1
1 1605 . 36 1 1 A 136 136 ARG CA C 135 56.016 56.308 -0.292 1
1 1606 . 36 1 1 A 136 136 ARG CB C 135 30.987 30.952 0.035 1
1 1609 . 36 1 1 A 136 136 ARG N N 135 119.708 119.257 0.451 1
1 1 . 37 1 1 A 14 14 PHE CA C 13 58.199 56.079 2.120 1
1 2 . 37 1 1 A 14 14 PHE CB C 13 39.717 42.014 -2.297 1
1 3 . 37 1 1 A 15 15 SER H H 14 8.299 8.743 -0.444 1
1 4 . 37 1 1 A 15 15 SER HA H 14 4.359 4.730 -0.371 1
1 7 . 37 1 1 A 15 15 SER CA C 14 58.249 58.450 -0.201 1
1 8 . 37 1 1 A 15 15 SER CB C 14 63.936 64.732 -0.796 1
1 9 . 37 1 1 A 15 15 SER N N 14 117.379 113.857 3.522 1
1 10 . 37 1 1 A 16 16 SER H H 15 8.255 8.237 0.018 1
1 11 . 37 1 1 A 16 16 SER HA H 15 3.729 4.738 -1.009 1
1 14 . 37 1 1 A 16 16 SER CA C 15 58.224 57.977 0.247 1
1 15 . 37 1 1 A 16 16 SER CB C 15 63.886 65.596 -1.710 1
1 16 . 37 1 1 A 16 16 SER N N 15 117.694 112.362 5.332 1
1 17 . 37 1 1 A 17 17 ALA H H 16 8.333 8.135 0.198 1
1 18 . 37 1 1 A 17 17 ALA HA H 16 4.252 3.912 0.340 1
1 22 . 37 1 1 A 17 17 ALA CA C 16 53.377 54.922 -1.545 1
1 23 . 37 1 1 A 17 17 ALA CB C 16 18.896 18.373 0.523 1
1 24 . 37 1 1 A 17 17 ALA N N 16 125.462 124.647 0.815 1
1 25 . 37 1 1 A 18 18 SER H H 17 8.219 7.946 0.273 1
1 26 . 37 1 1 A 18 18 SER HA H 17 4.332 4.404 -0.072 1
1 29 . 37 1 1 A 18 18 SER CA C 17 59.105 59.551 -0.446 1
1 30 . 37 1 1 A 18 18 SER CB C 17 63.592 63.209 0.383 1
1 31 . 37 1 1 A 18 18 SER N N 17 114.821 112.784 2.037 1
1 32 . 37 1 1 A 19 19 ASP H H 18 8.309 7.629 0.680 1
1 33 . 37 1 1 A 19 19 ASP HA H 18 4.554 4.711 -0.157 1
1 36 . 37 1 1 A 19 19 ASP C C 18 176.528 176.716 -0.188 1
1 37 . 37 1 1 A 19 19 ASP CA C 18 55.272 53.471 1.801 1
1 38 . 37 1 1 A 19 19 ASP CB C 18 40.883 42.617 -1.734 1
1 39 . 37 1 1 A 19 19 ASP N N 18 123.367 123.012 0.355 1
1 40 . 37 1 1 A 20 20 ALA H H 19 8.133 8.848 -0.715 1
1 41 . 37 1 1 A 20 20 ALA HA H 19 4.170 4.013 0.157 1
1 45 . 37 1 1 A 20 20 ALA C C 19 179.857 179.539 0.318 1
1 46 . 37 1 1 A 20 20 ALA CA C 19 54.341 55.115 -0.774 1
1 47 . 37 1 1 A 20 20 ALA CB C 19 18.660 18.379 0.281 1
1 48 . 37 1 1 A 20 20 ALA N N 19 123.350 127.083 -3.733 1
1 49 . 37 1 1 A 21 21 GLU H H 20 8.140 8.156 -0.016 1
1 50 . 37 1 1 A 21 21 GLU HA H 20 4.128 4.080 0.048 1
1 55 . 37 1 1 A 21 21 GLU C C 20 177.675 178.458 -0.783 1
1 56 . 37 1 1 A 21 21 GLU CA C 20 58.520 59.577 -1.057 1
1 57 . 37 1 1 A 21 21 GLU CB C 20 29.765 29.286 0.479 1
1 59 . 37 1 1 A 21 21 GLU N N 20 119.063 119.379 -0.316 1
1 60 . 37 1 1 A 22 22 PHE H H 21 8.009 7.920 0.089 1
1 61 . 37 1 1 A 22 22 PHE HA H 21 4.123 4.258 -0.135 1
1 68 . 37 1 1 A 22 22 PHE C C 21 176.410 177.348 -0.938 1
1 69 . 37 1 1 A 22 22 PHE CA C 21 62.202 60.818 1.384 1
1 70 . 37 1 1 A 22 22 PHE CB C 21 39.223 39.127 0.096 1
1 75 . 37 1 1 A 22 22 PHE N N 21 121.211 120.780 0.431 1
1 76 . 37 1 1 A 23 23 ASP H H 22 8.261 7.980 0.281 1
1 77 . 37 1 1 A 23 23 ASP HA H 22 4.041 4.340 -0.299 1
1 80 . 37 1 1 A 23 23 ASP C C 22 179.078 178.923 0.155 1
1 81 . 37 1 1 A 23 23 ASP CA C 22 57.048 57.297 -0.249 1
1 82 . 37 1 1 A 23 23 ASP CB C 22 40.154 40.264 -0.110 1
1 83 . 37 1 1 A 23 23 ASP N N 22 116.876 118.333 -1.457 1
1 84 . 37 1 1 A 24 24 ALA H H 23 7.651 8.020 -0.369 1
1 85 . 37 1 1 A 24 24 ALA HA H 23 3.785 3.924 -0.139 1
1 89 . 37 1 1 A 24 24 ALA C C 23 179.577 179.408 0.169 1
1 90 . 37 1 1 A 24 24 ALA CA C 23 54.341 55.048 -0.707 1
1 91 . 37 1 1 A 24 24 ALA CB C 23 17.762 18.379 -0.617 1
1 92 . 37 1 1 A 24 24 ALA N N 23 121.873 123.337 -1.464 1
1 93 . 37 1 1 A 25 25 VAL H H 24 7.718 7.769 -0.051 1
1 94 . 37 1 1 A 25 25 VAL HA H 24 3.216 3.770 -0.554 1
1 102 . 37 1 1 A 25 25 VAL C C 24 177.805 178.304 -0.499 1
1 103 . 37 1 1 A 25 25 VAL CA C 24 66.789 66.854 -0.065 1
1 104 . 37 1 1 A 25 25 VAL CB C 24 31.277 31.307 -0.030 1
1 107 . 37 1 1 A 25 25 VAL N N 24 117.890 118.014 -0.124 1
1 108 . 37 1 1 A 26 26 VAL H H 25 7.867 7.735 0.132 1
1 109 . 37 1 1 A 26 26 VAL HA H 25 3.274 3.593 -0.319 1
1 117 . 37 1 1 A 26 26 VAL C C 25 177.788 177.734 0.054 1
1 118 . 37 1 1 A 26 26 VAL CA C 25 67.282 66.254 1.028 1
1 119 . 37 1 1 A 26 26 VAL CB C 25 31.266 31.333 -0.067 1
1 122 . 37 1 1 A 26 26 VAL N N 25 118.170 120.322 -2.152 1
1 123 . 37 1 1 A 27 27 GLY H H 26 7.544 7.685 -0.141 1
1 124 . 37 1 1 A 27 27 GLY HA2 H 26 3.592 3.488 0.104 1
1 125 . 37 1 1 A 27 27 GLY HA3 H 26 3.721 3.616 0.105 1
1 126 . 37 1 1 A 27 27 GLY C C 26 176.717 176.500 0.217 1
1 127 . 37 1 1 A 27 27 GLY CA C 26 47.085 47.167 -0.082 1
1 128 . 37 1 1 A 27 27 GLY N N 26 105.795 107.807 -2.012 1
1 129 . 37 1 1 A 28 28 TYR H H 27 7.625 7.410 0.215 1
1 130 . 37 1 1 A 28 28 TYR HA H 27 4.546 4.558 -0.012 1
1 137 . 37 1 1 A 28 28 TYR C C 27 178.991 178.167 0.824 1
1 138 . 37 1 1 A 28 28 TYR CA C 27 58.845 59.639 -0.794 1
1 139 . 37 1 1 A 28 28 TYR CB C 27 37.602 37.629 -0.027 1
1 144 . 37 1 1 A 28 28 TYR N N 27 119.933 121.687 -1.754 1
1 145 . 37 1 1 A 29 29 LEU H H 28 8.517 8.419 0.098 1
1 146 . 37 1 1 A 29 29 LEU HA H 28 3.728 3.856 -0.128 1
1 156 . 37 1 1 A 29 29 LEU CA C 28 58.281 57.965 0.316 1
1 157 . 37 1 1 A 29 29 LEU CB C 28 41.948 41.408 0.540 1
1 161 . 37 1 1 A 29 29 LEU N N 28 119.669 120.109 -0.440 1
1 162 . 37 1 1 A 30 30 GLU H H 29 8.072 7.941 0.131 1
1 163 . 37 1 1 A 30 30 GLU HA H 29 3.722 3.856 -0.134 1
1 168 . 37 1 1 A 30 30 GLU C C 29 177.731 178.921 -1.190 1
1 169 . 37 1 1 A 30 30 GLU CA C 29 59.763 60.007 -0.244 1
1 170 . 37 1 1 A 30 30 GLU CB C 29 28.844 29.336 -0.492 1
1 172 . 37 1 1 A 30 30 GLU N N 29 117.666 117.705 -0.039 1
1 173 . 37 1 1 A 31 31 ASP H H 30 7.243 7.980 -0.737 1
1 174 . 37 1 1 A 31 31 ASP HA H 30 4.297 4.384 -0.087 1
1 177 . 37 1 1 A 31 31 ASP CA C 30 56.953 57.223 -0.270 1
1 178 . 37 1 1 A 31 31 ASP CB C 30 40.730 41.912 -1.182 1
1 179 . 37 1 1 A 31 31 ASP N N 30 116.720 119.055 -2.335 1
1 180 . 37 1 1 A 32 32 ILE H H 31 7.940 7.524 0.416 1
1 181 . 37 1 1 A 32 32 ILE HA H 31 3.640 3.659 -0.019 1
1 191 . 37 1 1 A 32 32 ILE C C 31 177.980 178.174 -0.194 1
1 192 . 37 1 1 A 32 32 ILE CA C 31 64.692 64.256 0.436 1
1 193 . 37 1 1 A 32 32 ILE CB C 31 38.938 37.158 1.780 1
1 197 . 37 1 1 A 32 32 ILE N N 31 119.728 118.886 0.842 1
1 198 . 37 1 1 A 33 33 ILE H H 32 7.984 7.777 0.207 1
1 199 . 37 1 1 A 33 33 ILE HA H 32 3.598 3.120 0.478 1
1 209 . 37 1 1 A 33 33 ILE C C 32 176.723 176.883 -0.160 1
1 210 . 37 1 1 A 33 33 ILE CA C 32 63.241 64.485 -1.244 1
1 211 . 37 1 1 A 33 33 ILE CB C 32 37.580 37.759 -0.179 1
1 215 . 37 1 1 A 33 33 ILE N N 32 113.919 120.622 -6.703 1
1 216 . 37 1 1 A 34 34 MET H H 33 7.288 7.659 -0.371 1
1 217 . 37 1 1 A 34 34 MET HA H 33 4.496 4.655 -0.159 1
1 225 . 37 1 1 A 34 34 MET C C 33 176.423 175.811 0.612 1
1 226 . 37 1 1 A 34 34 MET CA C 33 54.634 54.328 0.306 1
1 227 . 37 1 1 A 34 34 MET CB C 33 31.934 31.198 0.736 1
1 230 . 37 1 1 A 34 34 MET N N 33 115.130 116.728 -1.598 1
1 231 . 37 1 1 A 35 35 ASP H H 34 7.405 7.652 -0.247 1
1 232 . 37 1 1 A 35 35 ASP HA H 34 4.484 4.602 -0.118 1
1 235 . 37 1 1 A 35 35 ASP C C 34 177.139 176.245 0.894 1
1 236 . 37 1 1 A 35 35 ASP CA C 34 54.625 54.548 0.077 1
1 237 . 37 1 1 A 35 35 ASP CB C 34 43.554 42.748 0.806 1
1 238 . 37 1 1 A 35 35 ASP N N 34 121.814 122.521 -0.707 1
1 239 . 37 1 1 A 36 36 ASP H H 35 8.765 9.241 -0.476 1
1 240 . 37 1 1 A 36 36 ASP HA H 35 4.235 4.216 0.019 1
1 243 . 37 1 1 A 36 36 ASP C C 35 178.320 177.707 0.613 1
1 244 . 37 1 1 A 36 36 ASP CA C 35 57.832 58.409 -0.577 1
1 245 . 37 1 1 A 36 36 ASP CB C 35 40.914 41.087 -0.173 1
1 246 . 37 1 1 A 36 36 ASP N N 35 125.883 128.099 -2.216 1
1 247 . 37 1 1 A 37 37 GLU H H 36 8.905 7.982 0.923 1
1 248 . 37 1 1 A 37 37 GLU HA H 36 3.933 4.114 -0.181 1
1 253 . 37 1 1 A 37 37 GLU C C 36 179.304 179.108 0.196 1
1 254 . 37 1 1 A 37 37 GLU CA C 36 59.828 59.133 0.695 1
1 255 . 37 1 1 A 37 37 GLU CB C 36 29.380 29.503 -0.123 1
1 257 . 37 1 1 A 37 37 GLU N N 36 119.077 119.022 0.055 1
1 258 . 37 1 1 A 38 38 PHE H H 37 7.460 8.208 -0.748 1
1 259 . 37 1 1 A 38 38 PHE HA H 37 3.642 4.043 -0.401 1
1 267 . 37 1 1 A 38 38 PHE C C 37 176.483 177.703 -1.220 1
1 268 . 37 1 1 A 38 38 PHE CA C 37 61.411 61.247 0.164 1
1 269 . 37 1 1 A 38 38 PHE CB C 37 39.355 39.085 0.270 1
1 275 . 37 1 1 A 38 38 PHE N N 37 119.968 120.825 -0.857 1
1 276 . 37 1 1 A 39 39 GLN H H 38 7.968 8.089 -0.121 1
1 277 . 37 1 1 A 39 39 GLN HA H 38 3.712 3.862 -0.150 1
1 284 . 37 1 1 A 39 39 GLN CA C 38 59.153 58.727 0.426 1
1 285 . 37 1 1 A 39 39 GLN CB C 38 28.213 28.358 -0.145 1
1 287 . 37 1 1 A 39 39 GLN N N 38 116.433 118.257 -1.824 1
1 289 . 37 1 1 A 40 40 LEU H H 39 7.930 7.659 0.271 1
1 290 . 37 1 1 A 40 40 LEU HA H 39 3.916 3.998 -0.082 1
1 300 . 37 1 1 A 40 40 LEU C C 39 177.731 178.294 -0.563 1
1 301 . 37 1 1 A 40 40 LEU CA C 39 57.915 58.040 -0.125 1
1 302 . 37 1 1 A 40 40 LEU CB C 39 41.989 41.932 0.057 1
1 306 . 37 1 1 A 40 40 LEU N N 39 119.505 121.770 -2.265 1
1 307 . 37 1 1 A 41 41 LEU H H 40 7.174 7.791 -0.617 1
1 308 . 37 1 1 A 41 41 LEU HA H 40 3.835 3.999 -0.164 1
1 318 . 37 1 1 A 41 41 LEU C C 40 179.738 178.204 1.534 1
1 319 . 37 1 1 A 41 41 LEU CA C 40 58.266 58.226 0.040 1
1 320 . 37 1 1 A 41 41 LEU CB C 40 42.050 41.726 0.324 1
1 324 . 37 1 1 A 41 41 LEU N N 40 120.971 119.465 1.506 1
1 325 . 37 1 1 A 42 42 GLN H H 41 8.058 7.976 0.082 1
1 326 . 37 1 1 A 42 42 GLN HA H 41 3.556 3.733 -0.177 1
1 333 . 37 1 1 A 42 42 GLN C C 41 177.642 178.480 -0.838 1
1 334 . 37 1 1 A 42 42 GLN CA C 41 59.826 59.169 0.657 1
1 335 . 37 1 1 A 42 42 GLN CB C 41 28.762 28.023 0.739 1
1 337 . 37 1 1 A 42 42 GLN N N 41 117.899 118.425 -0.526 1
1 339 . 37 1 1 A 43 43 ARG H H 42 8.179 7.781 0.398 1
1 340 . 37 1 1 A 43 43 ARG HA H 42 3.655 3.940 -0.285 1
1 347 . 37 1 1 A 43 43 ARG C C 42 178.051 178.218 -0.167 1
1 348 . 37 1 1 A 43 43 ARG CA C 42 59.766 58.659 1.107 1
1 349 . 37 1 1 A 43 43 ARG CB C 42 29.941 30.103 -0.162 1
1 352 . 37 1 1 A 43 43 ARG N N 42 119.392 119.502 -0.110 1
1 353 . 37 1 1 A 44 44 ASN H H 43 8.525 8.027 0.498 1
1 354 . 37 1 1 A 44 44 ASN HA H 43 4.332 4.385 -0.053 1
1 359 . 37 1 1 A 44 44 ASN C C 43 178.150 177.785 0.365 1
1 360 . 37 1 1 A 44 44 ASN CA C 43 55.841 56.190 -0.349 1
1 361 . 37 1 1 A 44 44 ASN CB C 43 37.632 39.327 -1.695 1
1 362 . 37 1 1 A 44 44 ASN N N 43 116.214 117.608 -1.394 1
1 364 . 37 1 1 A 45 45 PHE H H 44 7.586 7.820 -0.234 1
1 365 . 37 1 1 A 45 45 PHE HA H 44 4.132 4.319 -0.187 1
1 372 . 37 1 1 A 45 45 PHE C C 44 176.691 178.519 -1.828 1
1 373 . 37 1 1 A 45 45 PHE CA C 44 62.333 60.548 1.785 1
1 374 . 37 1 1 A 45 45 PHE CB C 44 39.449 38.794 0.655 1
1 379 . 37 1 1 A 45 45 PHE N N 44 121.501 117.772 3.729 1
1 380 . 37 1 1 A 46 46 MET H H 45 8.190 8.360 -0.170 1
1 381 . 37 1 1 A 46 46 MET HA H 45 4.060 4.265 -0.205 1
1 389 . 37 1 1 A 46 46 MET C C 45 179.754 178.179 1.575 1
1 390 . 37 1 1 A 46 46 MET CA C 45 57.742 57.854 -0.112 1
1 391 . 37 1 1 A 46 46 MET CB C 45 29.912 31.070 -1.158 1
1 394 . 37 1 1 A 46 46 MET N N 45 116.727 117.509 -0.782 1
1 395 . 37 1 1 A 47 47 ASP H H 46 8.579 8.268 0.311 1
1 396 . 37 1 1 A 47 47 ASP HA H 46 4.804 4.644 0.160 1
1 399 . 37 1 1 A 47 47 ASP C C 46 177.854 178.496 -0.642 1
1 400 . 37 1 1 A 47 47 ASP CA C 46 57.277 57.359 -0.082 1
1 401 . 37 1 1 A 47 47 ASP CB C 46 40.776 41.510 -0.734 1
1 402 . 37 1 1 A 47 47 ASP N N 46 117.798 120.694 -2.896 1
1 403 . 37 1 1 A 48 48 LYS H H 47 7.339 7.862 -0.523 1
1 404 . 37 1 1 A 48 48 LYS HA H 47 3.828 4.235 -0.407 1
1 413 . 37 1 1 A 48 48 LYS C C 47 178.812 178.693 0.119 1
1 414 . 37 1 1 A 48 48 LYS CA C 47 58.953 58.455 0.498 1
1 415 . 37 1 1 A 48 48 LYS CB C 47 32.796 32.864 -0.068 1
1 419 . 37 1 1 A 48 48 LYS N N 47 117.852 119.745 -1.893 1
1 420 . 37 1 1 A 49 49 TYR H H 48 6.841 8.788 -1.947 1
1 421 . 37 1 1 A 49 49 TYR HA H 48 4.995 4.317 0.678 1
1 428 . 37 1 1 A 49 49 TYR C C 48 178.138 178.603 -0.465 1
1 429 . 37 1 1 A 49 49 TYR CA C 48 58.620 59.916 -1.296 1
1 430 . 37 1 1 A 49 49 TYR CB C 48 42.939 38.465 4.474 1
1 435 . 37 1 1 A 49 49 TYR N N 48 112.109 119.838 -7.729 1
1 436 . 37 1 1 A 50 50 TYR H H 49 8.491 8.105 0.386 1
1 437 . 37 1 1 A 50 50 TYR HA H 49 4.598 4.027 0.571 1
1 444 . 37 1 1 A 50 50 TYR C C 49 176.015 178.047 -2.032 1
1 445 . 37 1 1 A 50 50 TYR CA C 49 62.442 59.403 3.039 1
1 446 . 37 1 1 A 50 50 TYR CB C 49 36.588 36.928 -0.340 1
1 451 . 37 1 1 A 50 50 TYR N N 49 118.294 119.970 -1.676 1
1 452 . 37 1 1 A 51 51 LEU H H 50 7.512 7.762 -0.250 1
1 453 . 37 1 1 A 51 51 LEU HA H 50 3.878 3.460 0.418 1
1 463 . 37 1 1 A 51 51 LEU C C 50 178.625 178.654 -0.029 1
1 464 . 37 1 1 A 51 51 LEU CA C 50 55.994 57.426 -1.432 1
1 465 . 37 1 1 A 51 51 LEU CB C 50 40.743 41.351 -0.608 1
1 469 . 37 1 1 A 51 51 LEU N N 50 118.478 121.293 -2.815 1
1 470 . 37 1 1 A 52 52 GLU H H 51 8.042 7.720 0.322 1
1 471 . 37 1 1 A 52 52 GLU HA H 51 4.197 3.991 0.206 1
1 476 . 37 1 1 A 52 52 GLU C C 51 177.629 177.651 -0.022 1
1 477 . 37 1 1 A 52 52 GLU CA C 51 56.141 59.609 -3.468 1
1 478 . 37 1 1 A 52 52 GLU CB C 51 29.162 29.101 0.061 1
1 480 . 37 1 1 A 52 52 GLU N N 51 115.067 117.584 -2.517 1
1 481 . 37 1 1 A 53 53 PHE H H 52 7.465 7.776 -0.311 1
1 482 . 37 1 1 A 53 53 PHE HA H 52 4.431 4.607 -0.176 1
1 490 . 37 1 1 A 53 53 PHE C C 52 174.325 174.777 -0.452 1
1 491 . 37 1 1 A 53 53 PHE CA C 52 58.986 56.849 2.137 1
1 492 . 37 1 1 A 53 53 PHE CB C 52 40.183 37.081 3.102 1
1 498 . 37 1 1 A 53 53 PHE N N 52 116.768 118.164 -1.396 1
1 499 . 37 1 1 A 54 54 GLU H H 53 7.484 7.892 -0.408 1
1 500 . 37 1 1 A 54 54 GLU HA H 53 4.583 4.723 -0.140 1
1 505 . 37 1 1 A 54 54 GLU C C 53 175.722 175.339 0.383 1
1 506 . 37 1 1 A 54 54 GLU CA C 53 54.248 55.937 -1.689 1
1 507 . 37 1 1 A 54 54 GLU CB C 53 34.409 30.848 3.561 1
1 509 . 37 1 1 A 54 54 GLU N N 53 118.844 122.668 -3.824 1
1 510 . 37 1 1 A 55 55 ASP H H 54 9.008 8.576 0.432 1
1 511 . 37 1 1 A 55 55 ASP HA H 54 4.735 4.768 -0.033 1
1 514 . 37 1 1 A 55 55 ASP C C 54 175.421 175.921 -0.500 1
1 515 . 37 1 1 A 55 55 ASP CA C 54 52.888 53.877 -0.989 1
1 516 . 37 1 1 A 55 55 ASP CB C 54 38.894 40.037 -1.143 1
1 517 . 37 1 1 A 55 55 ASP N N 54 123.654 123.000 0.654 1
1 518 . 37 1 1 A 56 56 THR H H 55 7.819 8.003 -0.184 1
1 519 . 37 1 1 A 56 56 THR HA H 55 4.574 4.913 -0.339 1
1 524 . 37 1 1 A 56 56 THR C C 55 174.096 174.323 -0.227 1
1 525 . 37 1 1 A 56 56 THR CA C 55 59.172 59.373 -0.201 1
1 526 . 37 1 1 A 56 56 THR CB C 55 71.889 72.539 -0.650 1
1 528 . 37 1 1 A 56 56 THR N N 55 112.015 115.176 -3.161 1
1 529 . 37 1 1 A 57 57 GLU H H 56 8.527 8.751 -0.224 1
1 530 . 37 1 1 A 57 57 GLU HA H 56 4.217 4.444 -0.227 1
1 535 . 37 1 1 A 57 57 GLU C C 56 177.042 175.957 1.085 1
1 536 . 37 1 1 A 57 57 GLU CA C 56 56.869 56.825 0.044 1
1 537 . 37 1 1 A 57 57 GLU CB C 56 29.731 30.580 -0.849 1
1 539 . 37 1 1 A 57 57 GLU N N 56 117.531 119.200 -1.669 1
1 540 . 37 1 1 A 58 58 GLU H H 57 7.587 7.887 -0.300 1
1 541 . 37 1 1 A 58 58 GLU HA H 57 3.941 4.356 -0.415 1
1 546 . 37 1 1 A 58 58 GLU C C 57 176.849 176.457 0.392 1
1 547 . 37 1 1 A 58 58 GLU CA C 57 56.924 56.512 0.412 1
1 548 . 37 1 1 A 58 58 GLU CB C 57 30.251 30.172 0.079 1
1 550 . 37 1 1 A 58 58 GLU N N 57 119.183 121.604 -2.421 1
1 551 . 37 1 1 A 59 59 ASN H H 58 9.120 8.722 0.398 1
1 552 . 37 1 1 A 59 59 ASN HA H 58 4.922 5.154 -0.232 1
1 557 . 37 1 1 A 59 59 ASN C C 58 174.254 175.313 -1.059 1
1 558 . 37 1 1 A 59 59 ASN CA C 58 51.956 53.544 -1.588 1
1 559 . 37 1 1 A 59 59 ASN CB C 58 37.404 39.718 -2.314 1
1 560 . 37 1 1 A 59 59 ASN N N 58 126.767 124.980 1.787 1
1 562 . 37 1 1 A 60 60 LYS H H 59 5.892 8.548 -2.656 1
1 563 . 37 1 1 A 60 60 LYS HA H 59 3.798 4.696 -0.898 1
1 572 . 37 1 1 A 60 60 LYS C C 59 177.908 176.478 1.430 1
1 573 . 37 1 1 A 60 60 LYS CA C 59 56.623 54.511 2.112 1
1 574 . 37 1 1 A 60 60 LYS CB C 59 32.279 34.706 -2.427 1
1 578 . 37 1 1 A 60 60 LYS N N 59 121.527 122.458 -0.931 1
1 579 . 37 1 1 A 61 61 LEU H H 60 8.473 8.719 -0.246 1
1 580 . 37 1 1 A 61 61 LEU HA H 60 3.891 4.139 -0.248 1
1 590 . 37 1 1 A 61 61 LEU C C 60 179.843 178.284 1.559 1
1 591 . 37 1 1 A 61 61 LEU CA C 60 58.301 56.124 2.177 1
1 592 . 37 1 1 A 61 61 LEU CB C 60 41.305 41.419 -0.114 1
1 596 . 37 1 1 A 61 61 LEU N N 60 125.639 123.403 2.236 1
1 597 . 37 1 1 A 62 62 ILE H H 61 7.698 7.541 0.157 1
1 598 . 37 1 1 A 62 62 ILE HA H 61 3.952 3.865 0.087 1
1 608 . 37 1 1 A 62 62 ILE C C 61 175.392 177.095 -1.703 1
1 609 . 37 1 1 A 62 62 ILE CA C 61 61.743 63.269 -1.526 1
1 610 . 37 1 1 A 62 62 ILE CB C 61 39.108 37.675 1.433 1
1 614 . 37 1 1 A 62 62 ILE N N 61 114.111 119.821 -5.710 1
1 615 . 37 1 1 A 63 63 TYR H H 62 7.273 7.447 -0.174 1
1 616 . 37 1 1 A 63 63 TYR HA H 62 4.343 4.238 0.105 1
1 623 . 37 1 1 A 63 63 TYR C C 62 178.264 178.628 -0.364 1
1 624 . 37 1 1 A 63 63 TYR CA C 62 57.231 60.826 -3.595 1
1 625 . 37 1 1 A 63 63 TYR CB C 62 36.332 37.736 -1.404 1
1 630 . 37 1 1 A 63 63 TYR N N 62 117.689 121.604 -3.915 1
1 631 . 37 1 1 A 64 64 THR H H 63 7.747 7.978 -0.231 1
1 632 . 37 1 1 A 64 64 THR HA H 63 4.266 4.269 -0.003 1
1 637 . 37 1 1 A 64 64 THR CA C 63 69.362 67.587 1.775 1
1 638 . 37 1 1 A 64 64 THR CB C 63 66.962 67.796 -0.834 1
1 640 . 37 1 1 A 64 64 THR N N 63 113.755 116.326 -2.571 1
1 641 . 37 1 1 A 65 65 PRO HA H 64 4.372 4.398 -0.026 1
1 648 . 37 1 1 A 65 65 PRO C C 64 179.913 179.430 0.483 1
1 649 . 37 1 1 A 65 65 PRO CA C 64 66.011 66.315 -0.304 1
1 650 . 37 1 1 A 65 65 PRO CB C 64 30.642 30.772 -0.130 1
1 653 . 37 1 1 A 66 66 ILE H H 65 7.377 7.344 0.033 1
1 654 . 37 1 1 A 66 66 ILE HA H 65 3.530 3.926 -0.396 1
1 664 . 37 1 1 A 66 66 ILE C C 65 177.543 178.564 -1.021 1
1 665 . 37 1 1 A 66 66 ILE CA C 65 66.647 64.297 2.350 1
1 666 . 37 1 1 A 66 66 ILE CB C 65 38.029 37.771 0.258 1
1 670 . 37 1 1 A 66 66 ILE N N 65 118.353 116.695 1.658 1
1 671 . 37 1 1 A 67 67 PHE H H 66 8.480 8.393 0.087 1
1 672 . 37 1 1 A 67 67 PHE HA H 66 4.115 4.204 -0.089 1
1 680 . 37 1 1 A 67 67 PHE C C 66 177.293 177.558 -0.265 1
1 681 . 37 1 1 A 67 67 PHE CA C 66 59.570 62.401 -2.831 1
1 682 . 37 1 1 A 67 67 PHE CB C 66 38.865 39.090 -0.225 1
1 688 . 37 1 1 A 67 67 PHE N N 66 122.420 120.595 1.825 1
1 689 . 37 1 1 A 68 68 ASN H H 67 8.595 8.328 0.267 1
1 690 . 37 1 1 A 68 68 ASN HA H 67 4.211 4.295 -0.084 1
1 695 . 37 1 1 A 68 68 ASN C C 67 178.697 177.778 0.919 1
1 696 . 37 1 1 A 68 68 ASN CA C 67 56.056 56.345 -0.289 1
1 697 . 37 1 1 A 68 68 ASN CB C 67 37.704 37.706 -0.002 1
1 698 . 37 1 1 A 68 68 ASN N N 67 115.573 117.406 -1.833 1
1 700 . 37 1 1 A 69 69 GLU H H 68 8.414 8.016 0.398 1
1 701 . 37 1 1 A 69 69 GLU HA H 68 4.102 4.187 -0.085 1
1 706 . 37 1 1 A 69 69 GLU C C 68 177.880 178.829 -0.949 1
1 707 . 37 1 1 A 69 69 GLU CA C 68 59.399 59.437 -0.038 1
1 708 . 37 1 1 A 69 69 GLU CB C 68 29.855 29.498 0.357 1
1 710 . 37 1 1 A 69 69 GLU N N 68 123.510 119.854 3.656 1
1 711 . 37 1 1 A 70 70 TYR H H 69 8.659 8.050 0.609 1
1 712 . 37 1 1 A 70 70 TYR HA H 69 3.362 4.151 -0.789 1
1 719 . 37 1 1 A 70 70 TYR C C 69 178.143 177.090 1.053 1
1 720 . 37 1 1 A 70 70 TYR CA C 69 60.686 60.949 -0.263 1
1 721 . 37 1 1 A 70 70 TYR CB C 69 38.560 38.812 -0.252 1
1 726 . 37 1 1 A 70 70 TYR N N 69 122.130 120.545 1.585 1
1 727 . 37 1 1 A 71 71 ILE H H 70 8.031 7.711 0.320 1
1 728 . 37 1 1 A 71 71 ILE HA H 70 3.265 3.668 -0.403 1
1 738 . 37 1 1 A 71 71 ILE C C 70 178.056 177.280 0.776 1
1 739 . 37 1 1 A 71 71 ILE CA C 70 63.756 63.923 -0.167 1
1 740 . 37 1 1 A 71 71 ILE CB C 70 37.321 36.691 0.630 1
1 744 . 37 1 1 A 71 71 ILE N N 70 118.906 120.231 -1.325 1
1 745 . 37 1 1 A 72 72 SER H H 71 7.803 7.703 0.100 1
1 746 . 37 1 1 A 72 72 SER HA H 71 4.029 4.377 -0.348 1
1 749 . 37 1 1 A 72 72 SER CA C 71 61.380 60.909 0.471 1
1 750 . 37 1 1 A 72 72 SER CB C 71 63.288 63.274 0.014 1
1 751 . 37 1 1 A 72 72 SER N N 71 113.735 116.759 -3.024 1
1 752 . 37 1 1 A 73 73 LEU H H 72 7.952 7.937 0.015 1
1 753 . 37 1 1 A 73 73 LEU HA H 72 4.418 4.115 0.303 1
1 763 . 37 1 1 A 73 73 LEU C C 72 177.767 178.276 -0.509 1
1 764 . 37 1 1 A 73 73 LEU CA C 72 56.543 57.420 -0.877 1
1 765 . 37 1 1 A 73 73 LEU CB C 72 44.517 41.817 2.700 1
1 769 . 37 1 1 A 73 73 LEU N N 72 119.411 122.493 -3.082 1
1 770 . 37 1 1 A 74 74 VAL H H 73 8.021 7.576 0.445 1
1 771 . 37 1 1 A 74 74 VAL HA H 73 3.532 3.309 0.223 1
1 779 . 37 1 1 A 74 74 VAL C C 73 177.126 177.938 -0.812 1
1 780 . 37 1 1 A 74 74 VAL CA C 73 66.250 66.294 -0.044 1
1 781 . 37 1 1 A 74 74 VAL CB C 73 31.212 31.128 0.084 1
1 784 . 37 1 1 A 74 74 VAL N N 73 118.747 119.064 -0.317 1
1 785 . 37 1 1 A 75 75 GLU H H 74 7.232 7.949 -0.717 1
1 786 . 37 1 1 A 75 75 GLU HA H 74 3.013 4.174 -1.161 1
1 791 . 37 1 1 A 75 75 GLU C C 74 178.804 179.107 -0.303 1
1 792 . 37 1 1 A 75 75 GLU CA C 74 60.536 59.758 0.778 1
1 793 . 37 1 1 A 75 75 GLU CB C 74 27.009 29.130 -2.121 1
1 795 . 37 1 1 A 75 75 GLU N N 74 118.660 119.923 -1.263 1
1 796 . 37 1 1 A 76 76 LYS H H 75 7.051 7.845 -0.794 1
1 797 . 37 1 1 A 76 76 LYS HA H 75 3.765 4.004 -0.239 1
1 806 . 37 1 1 A 76 76 LYS C C 75 177.765 178.417 -0.652 1
1 807 . 37 1 1 A 76 76 LYS CA C 75 58.357 58.969 -0.612 1
1 808 . 37 1 1 A 76 76 LYS CB C 75 31.939 31.933 0.006 1
1 812 . 37 1 1 A 76 76 LYS N N 75 116.112 119.584 -3.472 1
1 813 . 37 1 1 A 77 77 TYR H H 76 7.067 7.694 -0.627 1
1 814 . 37 1 1 A 77 77 TYR HA H 76 4.036 4.186 -0.150 1
1 821 . 37 1 1 A 77 77 TYR C C 76 177.752 177.028 0.724 1
1 822 . 37 1 1 A 77 77 TYR CA C 76 61.820 61.285 0.535 1
1 823 . 37 1 1 A 77 77 TYR CB C 76 38.480 38.757 -0.277 1
1 828 . 37 1 1 A 77 77 TYR N N 76 118.434 120.748 -2.314 1
1 829 . 37 1 1 A 78 78 ILE H H 77 7.554 8.354 -0.800 1
1 830 . 37 1 1 A 78 78 ILE HA H 77 3.159 3.611 -0.452 1
1 840 . 37 1 1 A 78 78 ILE C C 77 177.341 177.821 -0.480 1
1 841 . 37 1 1 A 78 78 ILE CA C 77 65.177 65.327 -0.150 1
1 842 . 37 1 1 A 78 78 ILE CB C 77 37.339 37.948 -0.609 1
1 846 . 37 1 1 A 78 78 ILE N N 77 117.672 121.640 -3.968 1
1 847 . 37 1 1 A 79 79 GLU H H 78 8.296 8.074 0.222 1
1 848 . 37 1 1 A 79 79 GLU HA H 78 3.557 3.783 -0.226 1
1 853 . 37 1 1 A 79 79 GLU C C 78 177.742 178.905 -1.163 1
1 854 . 37 1 1 A 79 79 GLU CA C 78 60.847 60.085 0.762 1
1 855 . 37 1 1 A 79 79 GLU CB C 78 29.594 29.242 0.352 1
1 857 . 37 1 1 A 79 79 GLU N N 78 118.701 121.032 -2.331 1
1 858 . 37 1 1 A 80 80 GLU H H 79 8.330 8.078 0.252 1
1 859 . 37 1 1 A 80 80 GLU HA H 79 3.774 4.001 -0.227 1
1 864 . 37 1 1 A 80 80 GLU C C 79 179.926 179.257 0.669 1
1 865 . 37 1 1 A 80 80 GLU CA C 79 59.581 58.930 0.651 1
1 866 . 37 1 1 A 80 80 GLU CB C 79 29.062 29.301 -0.239 1
1 868 . 37 1 1 A 80 80 GLU N N 79 116.767 117.972 -1.205 1
1 869 . 37 1 1 A 81 81 GLN H H 80 7.634 7.748 -0.114 1
1 870 . 37 1 1 A 81 81 GLN HA H 80 3.605 3.846 -0.241 1
1 877 . 37 1 1 A 81 81 GLN C C 80 179.681 178.595 1.086 1
1 878 . 37 1 1 A 81 81 GLN CA C 80 57.765 58.553 -0.788 1
1 879 . 37 1 1 A 81 81 GLN CB C 80 28.079 28.047 0.032 1
1 881 . 37 1 1 A 81 81 GLN N N 80 116.325 118.673 -2.348 1
1 883 . 37 1 1 A 82 82 LEU H H 81 8.156 7.630 0.526 1
1 884 . 37 1 1 A 82 82 LEU HA H 81 3.536 3.768 -0.232 1
1 894 . 37 1 1 A 82 82 LEU C C 81 178.945 179.334 -0.389 1
1 895 . 37 1 1 A 82 82 LEU CA C 81 57.761 56.791 0.970 1
1 896 . 37 1 1 A 82 82 LEU CB C 81 40.961 40.990 -0.029 1
1 900 . 37 1 1 A 82 82 LEU N N 81 121.546 120.104 1.442 1
1 901 . 37 1 1 A 83 83 LEU H H 82 8.326 7.983 0.343 1
1 902 . 37 1 1 A 83 83 LEU HA H 82 4.198 4.212 -0.014 1
1 912 . 37 1 1 A 83 83 LEU C C 82 178.631 179.037 -0.406 1
1 913 . 37 1 1 A 83 83 LEU CA C 82 57.016 57.067 -0.051 1
1 914 . 37 1 1 A 83 83 LEU CB C 82 42.182 40.769 1.413 1
1 918 . 37 1 1 A 83 83 LEU N N 82 120.426 119.025 1.401 1
1 919 . 37 1 1 A 84 84 GLN H H 83 6.992 7.748 -0.756 1
1 920 . 37 1 1 A 84 84 GLN HA H 83 3.877 3.974 -0.097 1
1 927 . 37 1 1 A 84 84 GLN C C 83 177.008 176.608 0.400 1
1 928 . 37 1 1 A 84 84 GLN CA C 83 57.543 58.457 -0.914 1
1 929 . 37 1 1 A 84 84 GLN CB C 83 28.688 28.315 0.373 1
1 931 . 37 1 1 A 84 84 GLN N N 83 114.001 117.254 -3.253 1
1 933 . 37 1 1 A 85 85 ARG H H 84 7.072 7.571 -0.499 1
1 934 . 37 1 1 A 85 85 ARG HA H 84 4.047 4.474 -0.427 1
1 942 . 37 1 1 A 85 85 ARG C C 84 175.999 175.299 0.700 1
1 943 . 37 1 1 A 85 85 ARG CA C 84 56.764 56.702 0.062 1
1 944 . 37 1 1 A 85 85 ARG CB C 84 32.044 32.344 -0.300 1
1 947 . 37 1 1 A 85 85 ARG N N 84 115.827 118.816 -2.989 1
1 949 . 37 1 1 A 86 86 ILE H H 85 8.238 7.360 0.878 1
1 950 . 37 1 1 A 86 86 ILE HA H 85 4.389 4.421 -0.032 1
1 960 . 37 1 1 A 86 86 ILE CA C 85 58.007 57.709 0.298 1
1 961 . 37 1 1 A 86 86 ILE CB C 85 39.604 38.681 0.923 1
1 965 . 37 1 1 A 86 86 ILE N N 85 119.285 118.394 0.891 1
1 966 . 37 1 1 A 87 87 PRO HA H 86 4.392 4.590 -0.198 1
1 973 . 37 1 1 A 87 87 PRO C C 86 177.622 176.396 1.226 1
1 974 . 37 1 1 A 87 87 PRO CA C 86 64.665 64.235 0.430 1
1 975 . 37 1 1 A 87 87 PRO CB C 86 32.020 31.744 0.276 1
1 978 . 37 1 1 A 88 88 GLU H H 87 8.312 8.210 0.102 1
1 979 . 37 1 1 A 88 88 GLU HA H 87 4.208 4.579 -0.371 1
1 984 . 37 1 1 A 88 88 GLU C C 87 175.554 175.779 -0.225 1
1 985 . 37 1 1 A 88 88 GLU CA C 87 56.045 56.183 -0.138 1
1 986 . 37 1 1 A 88 88 GLU CB C 87 28.654 30.516 -1.862 1
1 988 . 37 1 1 A 88 88 GLU N N 87 114.256 116.794 -2.538 1
1 989 . 37 1 1 A 89 89 PHE H H 88 7.946 7.361 0.585 1
1 990 . 37 1 1 A 89 89 PHE HA H 88 3.993 4.319 -0.326 1
1 998 . 37 1 1 A 89 89 PHE C C 88 173.460 174.680 -1.220 1
1 999 . 37 1 1 A 89 89 PHE CA C 88 60.119 59.534 0.585 1
1 1000 . 37 1 1 A 89 89 PHE CB C 88 39.994 39.601 0.393 1
1 1006 . 37 1 1 A 89 89 PHE N N 88 121.550 123.432 -1.882 1
1 1007 . 37 1 1 A 90 90 ASN H H 89 7.266 7.843 -0.577 1
1 1008 . 37 1 1 A 90 90 ASN HA H 89 4.454 5.069 -0.615 1
1 1013 . 37 1 1 A 90 90 ASN C C 89 173.921 175.226 -1.305 1
1 1014 . 37 1 1 A 90 90 ASN CA C 89 51.839 51.453 0.386 1
1 1015 . 37 1 1 A 90 90 ASN CB C 89 40.674 39.439 1.235 1
1 1016 . 37 1 1 A 90 90 ASN N N 89 125.344 125.030 0.314 1
1 1018 . 37 1 1 A 91 91 MET H H 90 8.968 8.666 0.302 1
1 1019 . 37 1 1 A 91 91 MET HA H 90 4.049 4.256 -0.207 1
1 1027 . 37 1 1 A 91 91 MET C C 90 177.475 177.836 -0.361 1
1 1028 . 37 1 1 A 91 91 MET CA C 90 57.758 57.542 0.216 1
1 1029 . 37 1 1 A 91 91 MET CB C 90 32.250 32.588 -0.338 1
1 1032 . 37 1 1 A 91 91 MET N N 90 127.052 124.845 2.207 1
1 1033 . 37 1 1 A 92 92 ALA H H 91 8.292 7.925 0.367 1
1 1034 . 37 1 1 A 92 92 ALA HA H 91 4.059 4.141 -0.082 1
1 1038 . 37 1 1 A 92 92 ALA C C 91 180.412 179.555 0.857 1
1 1039 . 37 1 1 A 92 92 ALA CA C 91 55.368 54.840 0.528 1
1 1040 . 37 1 1 A 92 92 ALA CB C 91 17.527 18.934 -1.407 1
1 1041 . 37 1 1 A 92 92 ALA N N 91 123.752 120.967 2.785 1
1 1042 . 37 1 1 A 93 93 ALA H H 92 7.931 8.006 -0.075 1
1 1043 . 37 1 1 A 93 93 ALA HA H 92 4.054 4.217 -0.163 1
1 1047 . 37 1 1 A 93 93 ALA C C 92 180.482 179.905 0.577 1
1 1048 . 37 1 1 A 93 93 ALA CA C 92 54.614 54.852 -0.238 1
1 1049 . 37 1 1 A 93 93 ALA CB C 92 18.098 18.152 -0.054 1
1 1050 . 37 1 1 A 93 93 ALA N N 92 121.158 120.182 0.976 1
1 1051 . 37 1 1 A 94 94 PHE H H 93 8.110 7.791 0.319 1
1 1052 . 37 1 1 A 94 94 PHE HA H 93 4.304 4.152 0.152 1
1 1060 . 37 1 1 A 94 94 PHE C C 93 177.350 177.090 0.260 1
1 1061 . 37 1 1 A 94 94 PHE CA C 93 61.641 61.506 0.135 1
1 1062 . 37 1 1 A 94 94 PHE CB C 93 40.014 39.104 0.910 1
1 1068 . 37 1 1 A 94 94 PHE N N 93 119.807 119.676 0.131 1
1 1069 . 37 1 1 A 95 95 THR H H 94 8.726 8.072 0.654 1
1 1070 . 37 1 1 A 95 95 THR HA H 94 3.569 3.892 -0.323 1
1 1075 . 37 1 1 A 95 95 THR C C 94 176.932 176.501 0.431 1
1 1076 . 37 1 1 A 95 95 THR CA C 94 66.833 65.447 1.386 1
1 1077 . 37 1 1 A 95 95 THR CB C 94 68.445 68.126 0.319 1
1 1079 . 37 1 1 A 95 95 THR N N 94 113.074 112.116 0.958 1
1 1080 . 37 1 1 A 96 96 THR H H 95 7.657 7.822 -0.165 1
1 1081 . 37 1 1 A 96 96 THR HA H 95 3.945 4.108 -0.163 1
1 1086 . 37 1 1 A 96 96 THR C C 95 176.386 177.278 -0.892 1
1 1087 . 37 1 1 A 96 96 THR CA C 95 66.550 65.691 0.859 1
1 1088 . 37 1 1 A 96 96 THR CB C 95 68.583 67.944 0.639 1
1 1090 . 37 1 1 A 96 96 THR N N 95 117.927 114.341 3.586 1
1 1091 . 37 1 1 A 97 97 THR H H 96 7.699 7.874 -0.175 1
1 1092 . 37 1 1 A 97 97 THR HA H 96 3.905 4.050 -0.145 1
1 1097 . 37 1 1 A 97 97 THR C C 96 176.572 176.574 -0.002 1
1 1098 . 37 1 1 A 97 97 THR CA C 96 65.979 66.934 -0.955 1
1 1099 . 37 1 1 A 97 97 THR CB C 96 68.553 68.094 0.459 1
1 1101 . 37 1 1 A 97 97 THR N N 96 118.518 117.785 0.733 1
1 1102 . 37 1 1 A 98 98 LEU H H 97 8.304 8.235 0.069 1
1 1103 . 37 1 1 A 98 98 LEU HA H 97 3.725 3.920 -0.195 1
1 1113 . 37 1 1 A 98 98 LEU C C 97 178.490 178.577 -0.087 1
1 1114 . 37 1 1 A 98 98 LEU CA C 97 58.517 57.970 0.547 1
1 1115 . 37 1 1 A 98 98 LEU CB C 97 41.697 41.041 0.656 1
1 1119 . 37 1 1 A 98 98 LEU N N 97 122.882 122.060 0.822 1
1 1120 . 37 1 1 A 99 99 GLN H H 98 7.639 8.171 -0.532 1
1 1121 . 37 1 1 A 99 99 GLN HA H 98 3.927 4.025 -0.098 1
1 1128 . 37 1 1 A 99 99 GLN C C 98 178.068 178.881 -0.813 1
1 1129 . 37 1 1 A 99 99 GLN CA C 98 58.735 59.360 -0.625 1
1 1130 . 37 1 1 A 99 99 GLN CB C 98 27.986 28.260 -0.274 1
1 1132 . 37 1 1 A 99 99 GLN N N 98 114.302 118.653 -4.351 1
1 1134 . 37 1 1 A 100 100 HIS H H 99 7.575 7.789 -0.214 1
1 1135 . 37 1 1 A 100 100 HIS HA H 99 4.524 4.353 0.171 1
1 1139 . 37 1 1 A 100 100 HIS C C 99 174.789 177.649 -2.860 1
1 1140 . 37 1 1 A 100 100 HIS CA C 99 56.154 60.057 -3.903 1
1 1141 . 37 1 1 A 100 100 HIS CB C 99 28.946 30.736 -1.790 1
1 1143 . 37 1 1 A 100 100 HIS N N 99 114.778 119.319 -4.541 1
1 1144 . 37 1 1 A 101 101 HIS H H 100 7.773 8.146 -0.373 1
1 1145 . 37 1 1 A 101 101 HIS HA H 100 4.704 4.509 0.195 1
1 1149 . 37 1 1 A 101 101 HIS C C 100 174.818 177.096 -2.278 1
1 1150 . 37 1 1 A 101 101 HIS CA C 100 54.830 58.673 -3.843 1
1 1151 . 37 1 1 A 101 101 HIS CB C 100 29.749 28.619 1.130 1
1 1153 . 37 1 1 A 101 101 HIS N N 100 117.397 117.354 0.043 1
1 1154 . 37 1 1 A 102 102 LYS H H 101 7.324 8.029 -0.705 1
1 1155 . 37 1 1 A 102 102 LYS HA H 101 3.611 4.073 -0.462 1
1 1164 . 37 1 1 A 102 102 LYS C C 101 176.823 177.961 -1.138 1
1 1165 . 37 1 1 A 102 102 LYS CA C 101 59.915 58.916 0.999 1
1 1166 . 37 1 1 A 102 102 LYS CB C 101 32.825 32.060 0.765 1
1 1170 . 37 1 1 A 102 102 LYS N N 101 120.533 122.330 -1.797 1
1 1171 . 37 1 1 A 103 103 ASP H H 102 8.361 7.748 0.613 1
1 1172 . 37 1 1 A 103 103 ASP HA H 102 4.421 4.418 0.003 1
1 1175 . 37 1 1 A 103 103 ASP C C 102 176.793 177.713 -0.920 1
1 1176 . 37 1 1 A 103 103 ASP CA C 102 55.500 56.399 -0.899 1
1 1177 . 37 1 1 A 103 103 ASP CB C 102 40.178 40.682 -0.504 1
1 1178 . 37 1 1 A 103 103 ASP N N 102 114.814 119.390 -4.576 1
1 1179 . 37 1 1 A 104 104 GLU H H 103 7.858 7.600 0.258 1
1 1180 . 37 1 1 A 104 104 GLU HA H 103 4.339 4.363 -0.024 1
1 1183 . 37 1 1 A 104 104 GLU C C 103 175.777 177.049 -1.272 1
1 1184 . 37 1 1 A 104 104 GLU CA C 103 56.356 58.309 -1.953 1
1 1185 . 37 1 1 A 104 104 GLU CB C 103 31.293 30.395 0.898 1
1 1186 . 37 1 1 A 104 104 GLU N N 103 116.826 117.030 -0.204 1
1 1187 . 37 1 1 A 105 105 VAL H H 104 7.201 7.806 -0.605 1
1 1188 . 37 1 1 A 105 105 VAL HA H 104 4.296 4.171 0.125 1
1 1196 . 37 1 1 A 105 105 VAL C C 104 174.482 175.488 -1.006 1
1 1197 . 37 1 1 A 105 105 VAL CA C 104 60.370 62.641 -2.271 1
1 1198 . 37 1 1 A 105 105 VAL CB C 104 34.341 32.823 1.518 1
1 1201 . 37 1 1 A 105 105 VAL N N 104 116.422 119.623 -3.201 1
1 1202 . 37 1 1 A 106 106 ALA H H 105 8.487 8.408 0.079 1
1 1203 . 37 1 1 A 106 106 ALA HA H 105 4.172 4.359 -0.187 1
1 1207 . 37 1 1 A 106 106 ALA C C 105 179.030 178.951 0.079 1
1 1208 . 37 1 1 A 106 106 ALA CA C 105 52.966 52.715 0.251 1
1 1209 . 37 1 1 A 106 106 ALA CB C 105 19.371 19.614 -0.243 1
1 1210 . 37 1 1 A 106 106 ALA N N 105 128.313 128.613 -0.300 1
1 1211 . 37 1 1 A 107 107 GLY H H 106 8.738 8.782 -0.044 1
1 1212 . 37 1 1 A 107 107 GLY HA2 H 106 3.773 3.873 -0.100 1
1 1213 . 37 1 1 A 107 107 GLY HA3 H 106 3.998 3.935 0.063 1
1 1214 . 37 1 1 A 107 107 GLY C C 106 174.958 175.896 -0.938 1
1 1215 . 37 1 1 A 107 107 GLY CA C 106 47.449 47.117 0.332 1
1 1216 . 37 1 1 A 107 107 GLY N N 106 110.612 110.933 -0.321 1
1 1217 . 37 1 1 A 108 108 ASP H H 107 8.535 8.466 0.069 1
1 1218 . 37 1 1 A 108 108 ASP HA H 107 4.333 4.342 -0.009 1
1 1221 . 37 1 1 A 108 108 ASP C C 107 179.133 178.467 0.666 1
1 1222 . 37 1 1 A 108 108 ASP CA C 107 56.721 56.692 0.029 1
1 1223 . 37 1 1 A 108 108 ASP CB C 107 39.336 39.746 -0.410 1
1 1224 . 37 1 1 A 108 108 ASP N N 107 117.474 120.934 -3.460 1
1 1225 . 37 1 1 A 109 109 ILE H H 108 7.459 7.912 -0.453 1
1 1226 . 37 1 1 A 109 109 ILE HA H 108 3.688 3.837 -0.149 1
1 1236 . 37 1 1 A 109 109 ILE C C 108 176.735 178.441 -1.706 1
1 1237 . 37 1 1 A 109 109 ILE CA C 108 63.474 65.371 -1.897 1
1 1238 . 37 1 1 A 109 109 ILE CB C 108 37.340 37.817 -0.477 1
1 1242 . 37 1 1 A 109 109 ILE N N 108 119.609 121.028 -1.419 1
1 1243 . 37 1 1 A 110 110 PHE H H 109 7.920 8.391 -0.471 1
1 1244 . 37 1 1 A 110 110 PHE HA H 109 3.759 4.087 -0.328 1
1 1252 . 37 1 1 A 110 110 PHE C C 109 177.132 177.385 -0.253 1
1 1253 . 37 1 1 A 110 110 PHE CA C 109 62.766 61.244 1.522 1
1 1254 . 37 1 1 A 110 110 PHE CB C 109 39.752 39.303 0.449 1
1 1260 . 37 1 1 A 110 110 PHE N N 109 120.906 120.457 0.449 1
1 1261 . 37 1 1 A 111 111 ASP H H 110 8.639 8.188 0.451 1
1 1262 . 37 1 1 A 111 111 ASP HA H 110 4.216 4.238 -0.022 1
1 1265 . 37 1 1 A 111 111 ASP C C 110 178.900 178.422 0.478 1
1 1266 . 37 1 1 A 111 111 ASP CA C 110 57.105 57.294 -0.189 1
1 1267 . 37 1 1 A 111 111 ASP CB C 110 39.697 41.819 -2.122 1
1 1268 . 37 1 1 A 111 111 ASP N N 110 117.124 118.761 -1.637 1
1 1269 . 37 1 1 A 112 112 MET H H 111 7.331 7.540 -0.209 1
1 1270 . 37 1 1 A 112 112 MET HA H 111 4.081 4.149 -0.068 1
1 1278 . 37 1 1 A 112 112 MET C C 111 179.052 178.139 0.913 1
1 1279 . 37 1 1 A 112 112 MET CA C 111 58.202 58.096 0.106 1
1 1280 . 37 1 1 A 112 112 MET CB C 111 31.827 32.450 -0.623 1
1 1283 . 37 1 1 A 112 112 MET N N 111 118.061 119.429 -1.368 1
1 1284 . 37 1 1 A 113 113 LEU H H 112 8.001 7.999 0.002 1
1 1285 . 37 1 1 A 113 113 LEU HA H 112 3.723 3.538 0.185 1
1 1295 . 37 1 1 A 113 113 LEU C C 112 179.747 178.608 1.139 1
1 1296 . 37 1 1 A 113 113 LEU CA C 112 57.371 57.353 0.018 1
1 1297 . 37 1 1 A 113 113 LEU CB C 112 40.671 41.020 -0.349 1
1 1301 . 37 1 1 A 113 113 LEU N N 112 120.426 119.657 0.769 1
1 1302 . 37 1 1 A 114 114 LEU H H 113 7.744 7.639 0.105 1
1 1303 . 37 1 1 A 114 114 LEU HA H 113 4.007 3.519 0.488 1
1 1313 . 37 1 1 A 114 114 LEU C C 113 179.358 178.550 0.808 1
1 1314 . 37 1 1 A 114 114 LEU CA C 113 57.202 57.531 -0.329 1
1 1315 . 37 1 1 A 114 114 LEU CB C 113 41.727 41.616 0.111 1
1 1319 . 37 1 1 A 114 114 LEU N N 113 119.584 119.618 -0.034 1
1 1320 . 37 1 1 A 115 115 THR H H 114 7.353 7.602 -0.249 1
1 1321 . 37 1 1 A 115 115 THR HA H 114 4.071 4.107 -0.036 1
1 1327 . 37 1 1 A 115 115 THR C C 114 173.591 176.505 -2.914 1
1 1328 . 37 1 1 A 115 115 THR CA C 114 65.332 64.415 0.917 1
1 1329 . 37 1 1 A 115 115 THR CB C 114 70.319 68.710 1.609 1
1 1331 . 37 1 1 A 115 115 THR N N 114 107.535 112.388 -4.853 1
1 1332 . 37 1 1 A 116 116 PHE H H 115 6.979 7.864 -0.885 1
1 1333 . 37 1 1 A 116 116 PHE HA H 115 5.022 4.283 0.739 1
1 1341 . 37 1 1 A 116 116 PHE C C 115 176.488 176.566 -0.078 1
1 1342 . 37 1 1 A 116 116 PHE CA C 115 55.911 60.858 -4.947 1
1 1343 . 37 1 1 A 116 116 PHE CB C 115 38.521 39.154 -0.633 1
1 1349 . 37 1 1 A 116 116 PHE N N 115 112.366 120.217 -7.851 1
1 1350 . 37 1 1 A 117 117 THR H H 116 7.564 7.379 0.185 1
1 1351 . 37 1 1 A 117 117 THR HA H 116 4.626 4.842 -0.216 1
1 1356 . 37 1 1 A 117 117 THR C C 116 174.085 174.343 -0.258 1
1 1357 . 37 1 1 A 117 117 THR CA C 116 61.636 61.923 -0.287 1
1 1358 . 37 1 1 A 117 117 THR CB C 116 70.915 70.897 0.018 1
1 1360 . 37 1 1 A 117 117 THR N N 116 105.498 105.937 -0.439 1
1 1361 . 37 1 1 A 118 118 ASP H H 117 8.270 7.701 0.569 1
1 1362 . 37 1 1 A 118 118 ASP HA H 117 4.955 4.660 0.295 1
1 1365 . 37 1 1 A 118 118 ASP C C 117 176.328 176.323 0.005 1
1 1366 . 37 1 1 A 118 118 ASP CA C 117 53.417 53.416 0.001 1
1 1367 . 37 1 1 A 118 118 ASP CB C 117 43.388 40.459 2.929 1
1 1368 . 37 1 1 A 118 118 ASP N N 117 124.409 122.495 1.914 1
1 1369 . 37 1 1 A 119 119 PHE H H 118 8.973 8.756 0.217 1
1 1370 . 37 1 1 A 119 119 PHE HA H 118 3.506 4.066 -0.560 1
1 1378 . 37 1 1 A 119 119 PHE CA C 118 61.490 61.434 0.056 1
1 1379 . 37 1 1 A 119 119 PHE CB C 118 39.246 39.395 -0.149 1
1 1385 . 37 1 1 A 119 119 PHE N N 118 126.688 126.372 0.316 1
1 1386 . 37 1 1 A 120 120 LEU H H 119 8.099 8.373 -0.274 1
1 1387 . 37 1 1 A 120 120 LEU HA H 119 3.842 3.907 -0.065 1
1 1397 . 37 1 1 A 120 120 LEU C C 119 179.601 179.485 0.116 1
1 1398 . 37 1 1 A 120 120 LEU CA C 119 58.174 57.698 0.476 1
1 1399 . 37 1 1 A 120 120 LEU CB C 119 40.315 40.936 -0.621 1
1 1403 . 37 1 1 A 120 120 LEU N N 119 117.930 119.872 -1.942 1
1 1404 . 37 1 1 A 121 121 ALA H H 120 7.729 7.848 -0.119 1
1 1405 . 37 1 1 A 121 121 ALA HA H 120 3.996 4.092 -0.096 1
1 1409 . 37 1 1 A 121 121 ALA C C 120 180.995 179.364 1.631 1
1 1410 . 37 1 1 A 121 121 ALA CA C 120 54.832 54.589 0.243 1
1 1411 . 37 1 1 A 121 121 ALA CB C 120 17.706 18.332 -0.626 1
1 1412 . 37 1 1 A 121 121 ALA N N 120 123.195 121.720 1.475 1
1 1413 . 37 1 1 A 122 122 PHE H H 121 7.943 7.800 0.143 1
1 1414 . 37 1 1 A 122 122 PHE HA H 121 3.887 3.734 0.153 1
1 1419 . 37 1 1 A 122 122 PHE C C 121 175.410 176.683 -1.273 1
1 1420 . 37 1 1 A 122 122 PHE CA C 121 61.075 60.633 0.442 1
1 1421 . 37 1 1 A 122 122 PHE CB C 121 38.115 38.811 -0.696 1
1 1424 . 37 1 1 A 122 122 PHE N N 121 121.798 120.439 1.359 1
1 1425 . 37 1 1 A 123 123 LYS H H 122 8.468 7.635 0.833 1
1 1426 . 37 1 1 A 123 123 LYS HA H 122 3.077 3.728 -0.651 1
1 1435 . 37 1 1 A 123 123 LYS C C 122 178.453 178.773 -0.320 1
1 1436 . 37 1 1 A 123 123 LYS CA C 122 59.855 59.863 -0.008 1
1 1437 . 37 1 1 A 123 123 LYS CB C 122 32.374 32.077 0.297 1
1 1441 . 37 1 1 A 123 123 LYS N N 122 120.614 118.271 2.343 1
1 1442 . 37 1 1 A 124 124 GLU H H 123 8.100 7.716 0.384 1
1 1443 . 37 1 1 A 124 124 GLU HA H 123 3.652 4.002 -0.350 1
1 1448 . 37 1 1 A 124 124 GLU C C 123 177.743 178.438 -0.695 1
1 1449 . 37 1 1 A 124 124 GLU CA C 123 59.406 59.504 -0.098 1
1 1450 . 37 1 1 A 124 124 GLU CB C 123 28.811 29.003 -0.192 1
1 1452 . 37 1 1 A 124 124 GLU N N 123 117.404 119.095 -1.691 1
1 1453 . 37 1 1 A 125 125 MET H H 124 7.537 7.757 -0.220 1
1 1454 . 37 1 1 A 125 125 MET HA H 124 3.860 3.921 -0.061 1
1 1462 . 37 1 1 A 125 125 MET C C 124 179.522 178.170 1.352 1
1 1463 . 37 1 1 A 125 125 MET CA C 124 58.832 58.477 0.355 1
1 1464 . 37 1 1 A 125 125 MET CB C 124 31.765 31.305 0.460 1
1 1467 . 37 1 1 A 125 125 MET N N 124 119.413 118.853 0.560 1
1 1468 . 37 1 1 A 126 126 PHE H H 125 7.148 7.321 -0.173 1
1 1469 . 37 1 1 A 126 126 PHE HA H 125 3.633 4.185 -0.552 1
1 1476 . 37 1 1 A 126 126 PHE C C 125 178.994 178.319 0.675 1
1 1477 . 37 1 1 A 126 126 PHE CA C 125 63.148 60.736 2.412 1
1 1478 . 37 1 1 A 126 126 PHE CB C 125 39.830 39.004 0.826 1
1 1483 . 37 1 1 A 126 126 PHE N N 125 120.013 119.442 0.571 1
1 1484 . 37 1 1 A 127 127 LEU H H 126 8.369 8.439 -0.070 1
1 1485 . 37 1 1 A 127 127 LEU HA H 126 3.972 4.017 -0.045 1
1 1495 . 37 1 1 A 127 127 LEU C C 126 180.621 179.366 1.255 1
1 1496 . 37 1 1 A 127 127 LEU CA C 126 57.944 57.950 -0.006 1
1 1497 . 37 1 1 A 127 127 LEU CB C 126 40.543 41.192 -0.649 1
1 1501 . 37 1 1 A 127 127 LEU N N 126 119.692 119.795 -0.103 1
1 1502 . 37 1 1 A 128 128 ASP H H 127 8.578 7.986 0.592 1
1 1503 . 37 1 1 A 128 128 ASP HA H 127 4.308 4.351 -0.043 1
1 1506 . 37 1 1 A 128 128 ASP C C 127 178.254 178.167 0.087 1
1 1507 . 37 1 1 A 128 128 ASP CA C 127 56.964 57.250 -0.286 1
1 1508 . 37 1 1 A 128 128 ASP CB C 127 39.735 40.946 -1.211 1
1 1509 . 37 1 1 A 128 128 ASP N N 127 121.926 119.691 2.235 1
1 1510 . 37 1 1 A 129 129 TYR H H 128 7.710 8.360 -0.650 1
1 1511 . 37 1 1 A 129 129 TYR HA H 128 3.908 4.225 -0.317 1
1 1518 . 37 1 1 A 129 129 TYR C C 128 177.633 177.739 -0.106 1
1 1519 . 37 1 1 A 129 129 TYR CA C 128 61.796 61.386 0.410 1
1 1520 . 37 1 1 A 129 129 TYR CB C 128 39.372 38.763 0.609 1
1 1525 . 37 1 1 A 129 129 TYR N N 128 122.548 120.409 2.139 1
1 1526 . 37 1 1 A 130 130 ARG H H 129 8.622 8.388 0.234 1
1 1527 . 37 1 1 A 130 130 ARG HA H 129 3.722 4.000 -0.278 1
1 1535 . 37 1 1 A 130 130 ARG CA C 129 60.084 59.586 0.498 1
1 1536 . 37 1 1 A 130 130 ARG CB C 129 29.902 29.919 -0.017 1
1 1539 . 37 1 1 A 130 130 ARG N N 129 118.302 119.260 -0.958 1
1 1541 . 37 1 1 A 131 131 ALA H H 130 7.936 7.975 -0.039 1
1 1542 . 37 1 1 A 131 131 ALA HA H 130 3.997 3.993 0.004 1
1 1546 . 37 1 1 A 131 131 ALA C C 130 180.456 179.699 0.757 1
1 1547 . 37 1 1 A 131 131 ALA CA C 130 55.133 55.062 0.071 1
1 1548 . 37 1 1 A 131 131 ALA CB C 130 17.750 18.195 -0.445 1
1 1549 . 37 1 1 A 131 131 ALA N N 130 119.788 121.835 -2.047 1
1 1550 . 37 1 1 A 132 132 GLU H H 131 7.622 7.436 0.186 1
1 1551 . 37 1 1 A 132 132 GLU HA H 131 3.862 3.979 -0.117 1
1 1556 . 37 1 1 A 132 132 GLU C C 131 179.528 179.347 0.181 1
1 1557 . 37 1 1 A 132 132 GLU CA C 131 58.849 58.878 -0.029 1
1 1558 . 37 1 1 A 132 132 GLU CB C 131 28.930 29.142 -0.212 1
1 1560 . 37 1 1 A 132 132 GLU N N 131 118.428 118.434 -0.006 1
1 1561 . 37 1 1 A 133 133 LYS H H 132 7.853 7.376 0.477 1
1 1562 . 37 1 1 A 133 133 LYS HA H 132 3.722 3.976 -0.254 1
1 1571 . 37 1 1 A 133 133 LYS C C 132 175.725 178.382 -2.657 1
1 1572 . 37 1 1 A 133 133 LYS CA C 132 57.544 58.847 -1.303 1
1 1573 . 37 1 1 A 133 133 LYS CB C 132 31.770 31.881 -0.111 1
1 1577 . 37 1 1 A 133 133 LYS N N 132 119.473 119.478 -0.005 1
1 1578 . 37 1 1 A 134 134 GLU H H 133 8.151 7.592 0.559 1
1 1579 . 37 1 1 A 134 134 GLU HA H 133 4.161 4.351 -0.190 1
1 1584 . 37 1 1 A 134 134 GLU C C 133 177.453 177.839 -0.386 1
1 1585 . 37 1 1 A 134 134 GLU CA C 133 57.222 57.218 0.004 1
1 1586 . 37 1 1 A 134 134 GLU CB C 133 30.091 30.357 -0.266 1
1 1588 . 37 1 1 A 134 134 GLU N N 133 116.525 118.754 -2.229 1
1 1589 . 37 1 1 A 135 135 GLY H H 134 7.702 8.085 -0.383 1
1 1590 . 37 1 1 A 135 135 GLY HA2 H 134 3.896 3.848 0.048 1
1 1591 . 37 1 1 A 135 135 GLY HA3 H 134 3.897 3.859 0.038 1
1 1592 . 37 1 1 A 135 135 GLY C C 134 174.538 175.016 -0.478 1
1 1593 . 37 1 1 A 135 135 GLY CA C 134 45.975 47.364 -1.389 1
1 1594 . 37 1 1 A 135 135 GLY N N 134 107.924 109.112 -1.188 1
1 1595 . 37 1 1 A 136 136 ARG H H 135 8.045 7.778 0.267 1
1 1596 . 37 1 1 A 136 136 ARG HA H 135 4.323 4.257 0.066 1
1 1604 . 37 1 1 A 136 136 ARG C C 135 175.864 176.958 -1.094 1
1 1605 . 37 1 1 A 136 136 ARG CA C 135 56.016 56.713 -0.697 1
1 1606 . 37 1 1 A 136 136 ARG CB C 135 30.987 31.190 -0.203 1
1 1609 . 37 1 1 A 136 136 ARG N N 135 119.708 119.249 0.459 1
1 1 . 38 1 1 A 14 14 PHE CA C 13 58.199 56.263 1.936 1
1 2 . 38 1 1 A 14 14 PHE CB C 13 39.717 43.979 -4.262 1
1 3 . 38 1 1 A 15 15 SER H H 14 8.299 8.894 -0.595 1
1 4 . 38 1 1 A 15 15 SER HA H 14 4.359 5.409 -1.050 1
1 7 . 38 1 1 A 15 15 SER CA C 14 58.249 57.087 1.162 1
1 8 . 38 1 1 A 15 15 SER CB C 14 63.936 66.363 -2.427 1
1 9 . 38 1 1 A 15 15 SER N N 14 117.379 116.858 0.521 1
1 10 . 38 1 1 A 16 16 SER H H 15 8.255 9.065 -0.810 1
1 11 . 38 1 1 A 16 16 SER HA H 15 3.729 4.791 -1.062 1
1 14 . 38 1 1 A 16 16 SER CA C 15 58.224 59.019 -0.795 1
1 15 . 38 1 1 A 16 16 SER CB C 15 63.886 65.830 -1.944 1
1 16 . 38 1 1 A 16 16 SER N N 15 117.694 117.983 -0.289 1
1 17 . 38 1 1 A 17 17 ALA H H 16 8.333 8.193 0.140 1
1 18 . 38 1 1 A 17 17 ALA HA H 16 4.252 4.310 -0.058 1
1 22 . 38 1 1 A 17 17 ALA CA C 16 53.377 54.467 -1.090 1
1 23 . 38 1 1 A 17 17 ALA CB C 16 18.896 18.312 0.584 1
1 24 . 38 1 1 A 17 17 ALA N N 16 125.462 124.281 1.181 1
1 25 . 38 1 1 A 18 18 SER H H 17 8.219 7.776 0.443 1
1 26 . 38 1 1 A 18 18 SER HA H 17 4.332 4.544 -0.212 1
1 29 . 38 1 1 A 18 18 SER CA C 17 59.105 57.514 1.591 1
1 30 . 38 1 1 A 18 18 SER CB C 17 63.592 64.154 -0.562 1
1 31 . 38 1 1 A 18 18 SER N N 17 114.821 108.024 6.797 1
1 32 . 38 1 1 A 19 19 ASP H H 18 8.309 7.392 0.917 1
1 33 . 38 1 1 A 19 19 ASP HA H 18 4.554 5.006 -0.452 1
1 36 . 38 1 1 A 19 19 ASP C C 18 176.528 176.778 -0.250 1
1 37 . 38 1 1 A 19 19 ASP CA C 18 55.272 52.872 2.400 1
1 38 . 38 1 1 A 19 19 ASP CB C 18 40.883 43.546 -2.663 1
1 39 . 38 1 1 A 19 19 ASP N N 18 123.367 121.249 2.118 1
1 40 . 38 1 1 A 20 20 ALA H H 19 8.133 8.626 -0.493 1
1 41 . 38 1 1 A 20 20 ALA HA H 19 4.170 4.144 0.026 1
1 45 . 38 1 1 A 20 20 ALA C C 19 179.857 179.650 0.207 1
1 46 . 38 1 1 A 20 20 ALA CA C 19 54.341 55.096 -0.755 1
1 47 . 38 1 1 A 20 20 ALA CB C 19 18.660 18.137 0.523 1
1 48 . 38 1 1 A 20 20 ALA N N 19 123.350 121.851 1.499 1
1 49 . 38 1 1 A 21 21 GLU H H 20 8.140 8.254 -0.114 1
1 50 . 38 1 1 A 21 21 GLU HA H 20 4.128 4.119 0.009 1
1 55 . 38 1 1 A 21 21 GLU C C 20 177.675 178.633 -0.958 1
1 56 . 38 1 1 A 21 21 GLU CA C 20 58.520 59.413 -0.893 1
1 57 . 38 1 1 A 21 21 GLU CB C 20 29.765 29.668 0.097 1
1 59 . 38 1 1 A 21 21 GLU N N 20 119.063 119.455 -0.392 1
1 60 . 38 1 1 A 22 22 PHE H H 21 8.009 8.019 -0.010 1
1 61 . 38 1 1 A 22 22 PHE HA H 21 4.123 4.383 -0.260 1
1 68 . 38 1 1 A 22 22 PHE C C 21 176.410 177.044 -0.634 1
1 69 . 38 1 1 A 22 22 PHE CA C 21 62.202 61.329 0.873 1
1 70 . 38 1 1 A 22 22 PHE CB C 21 39.223 39.150 0.073 1
1 75 . 38 1 1 A 22 22 PHE N N 21 121.211 121.011 0.200 1
1 76 . 38 1 1 A 23 23 ASP H H 22 8.261 8.508 -0.247 1
1 77 . 38 1 1 A 23 23 ASP HA H 22 4.041 4.328 -0.287 1
1 80 . 38 1 1 A 23 23 ASP C C 22 179.078 178.532 0.546 1
1 81 . 38 1 1 A 23 23 ASP CA C 22 57.048 57.261 -0.213 1
1 82 . 38 1 1 A 23 23 ASP CB C 22 40.154 40.110 0.044 1
1 83 . 38 1 1 A 23 23 ASP N N 22 116.876 118.541 -1.665 1
1 84 . 38 1 1 A 24 24 ALA H H 23 7.651 7.566 0.085 1
1 85 . 38 1 1 A 24 24 ALA HA H 23 3.785 3.837 -0.052 1
1 89 . 38 1 1 A 24 24 ALA C C 23 179.577 179.905 -0.328 1
1 90 . 38 1 1 A 24 24 ALA CA C 23 54.341 55.221 -0.880 1
1 91 . 38 1 1 A 24 24 ALA CB C 23 17.762 18.073 -0.311 1
1 92 . 38 1 1 A 24 24 ALA N N 23 121.873 122.382 -0.509 1
1 93 . 38 1 1 A 25 25 VAL H H 24 7.718 7.851 -0.133 1
1 94 . 38 1 1 A 25 25 VAL HA H 24 3.216 3.605 -0.389 1
1 102 . 38 1 1 A 25 25 VAL C C 24 177.805 178.293 -0.488 1
1 103 . 38 1 1 A 25 25 VAL CA C 24 66.789 66.824 -0.035 1
1 104 . 38 1 1 A 25 25 VAL CB C 24 31.277 31.266 0.011 1
1 107 . 38 1 1 A 25 25 VAL N N 24 117.890 118.623 -0.733 1
1 108 . 38 1 1 A 26 26 VAL H H 25 7.867 7.604 0.263 1
1 109 . 38 1 1 A 26 26 VAL HA H 25 3.274 3.510 -0.236 1
1 117 . 38 1 1 A 26 26 VAL C C 25 177.788 177.972 -0.184 1
1 118 . 38 1 1 A 26 26 VAL CA C 25 67.282 66.312 0.970 1
1 119 . 38 1 1 A 26 26 VAL CB C 25 31.266 31.412 -0.146 1
1 122 . 38 1 1 A 26 26 VAL N N 25 118.170 119.795 -1.625 1
1 123 . 38 1 1 A 27 27 GLY H H 26 7.544 7.624 -0.080 1
1 124 . 38 1 1 A 27 27 GLY HA2 H 26 3.592 3.488 0.104 1
1 125 . 38 1 1 A 27 27 GLY HA3 H 26 3.721 3.611 0.110 1
1 126 . 38 1 1 A 27 27 GLY C C 26 176.717 176.444 0.273 1
1 127 . 38 1 1 A 27 27 GLY CA C 26 47.085 47.188 -0.103 1
1 128 . 38 1 1 A 27 27 GLY N N 26 105.795 107.639 -1.844 1
1 129 . 38 1 1 A 28 28 TYR H H 27 7.625 7.468 0.157 1
1 130 . 38 1 1 A 28 28 TYR HA H 27 4.546 4.564 -0.018 1
1 137 . 38 1 1 A 28 28 TYR C C 27 178.991 178.314 0.677 1
1 138 . 38 1 1 A 28 28 TYR CA C 27 58.845 59.831 -0.986 1
1 139 . 38 1 1 A 28 28 TYR CB C 27 37.602 37.533 0.069 1
1 144 . 38 1 1 A 28 28 TYR N N 27 119.933 121.973 -2.040 1
1 145 . 38 1 1 A 29 29 LEU H H 28 8.517 8.154 0.363 1
1 146 . 38 1 1 A 29 29 LEU HA H 28 3.728 3.829 -0.101 1
1 156 . 38 1 1 A 29 29 LEU CA C 28 58.281 58.113 0.168 1
1 157 . 38 1 1 A 29 29 LEU CB C 28 41.948 41.378 0.570 1
1 161 . 38 1 1 A 29 29 LEU N N 28 119.669 120.790 -1.121 1
1 162 . 38 1 1 A 30 30 GLU H H 29 8.072 7.929 0.143 1
1 163 . 38 1 1 A 30 30 GLU HA H 29 3.722 3.929 -0.207 1
1 168 . 38 1 1 A 30 30 GLU C C 29 177.731 178.885 -1.154 1
1 169 . 38 1 1 A 30 30 GLU CA C 29 59.763 59.845 -0.082 1
1 170 . 38 1 1 A 30 30 GLU CB C 29 28.844 29.116 -0.272 1
1 172 . 38 1 1 A 30 30 GLU N N 29 117.666 117.549 0.117 1
1 173 . 38 1 1 A 31 31 ASP H H 30 7.243 7.895 -0.652 1
1 174 . 38 1 1 A 31 31 ASP HA H 30 4.297 4.395 -0.098 1
1 177 . 38 1 1 A 31 31 ASP CA C 30 56.953 57.612 -0.659 1
1 178 . 38 1 1 A 31 31 ASP CB C 30 40.730 41.504 -0.774 1
1 179 . 38 1 1 A 31 31 ASP N N 30 116.720 119.077 -2.357 1
1 180 . 38 1 1 A 32 32 ILE H H 31 7.940 7.519 0.421 1
1 181 . 38 1 1 A 32 32 ILE HA H 31 3.640 3.631 0.009 1
1 191 . 38 1 1 A 32 32 ILE C C 31 177.980 178.106 -0.126 1
1 192 . 38 1 1 A 32 32 ILE CA C 31 64.692 65.162 -0.470 1
1 193 . 38 1 1 A 32 32 ILE CB C 31 38.938 37.643 1.295 1
1 197 . 38 1 1 A 32 32 ILE N N 31 119.728 119.005 0.723 1
1 198 . 38 1 1 A 33 33 ILE H H 32 7.984 7.759 0.225 1
1 199 . 38 1 1 A 33 33 ILE HA H 32 3.598 2.855 0.743 1
1 209 . 38 1 1 A 33 33 ILE C C 32 176.723 176.848 -0.125 1
1 210 . 38 1 1 A 33 33 ILE CA C 32 63.241 64.295 -1.054 1
1 211 . 38 1 1 A 33 33 ILE CB C 32 37.580 37.801 -0.221 1
1 215 . 38 1 1 A 33 33 ILE N N 32 113.919 120.196 -6.277 1
1 216 . 38 1 1 A 34 34 MET H H 33 7.288 7.538 -0.250 1
1 217 . 38 1 1 A 34 34 MET HA H 33 4.496 4.677 -0.181 1
1 225 . 38 1 1 A 34 34 MET C C 33 176.423 175.694 0.729 1
1 226 . 38 1 1 A 34 34 MET CA C 33 54.634 54.141 0.493 1
1 227 . 38 1 1 A 34 34 MET CB C 33 31.934 32.116 -0.182 1
1 230 . 38 1 1 A 34 34 MET N N 33 115.130 116.846 -1.716 1
1 231 . 38 1 1 A 35 35 ASP H H 34 7.405 7.713 -0.308 1
1 232 . 38 1 1 A 35 35 ASP HA H 34 4.484 4.674 -0.190 1
1 235 . 38 1 1 A 35 35 ASP C C 34 177.139 176.029 1.110 1
1 236 . 38 1 1 A 35 35 ASP CA C 34 54.625 54.381 0.244 1
1 237 . 38 1 1 A 35 35 ASP CB C 34 43.554 43.042 0.512 1
1 238 . 38 1 1 A 35 35 ASP N N 34 121.814 122.545 -0.731 1
1 239 . 38 1 1 A 36 36 ASP H H 35 8.765 9.192 -0.427 1
1 240 . 38 1 1 A 36 36 ASP HA H 35 4.235 4.218 0.017 1
1 243 . 38 1 1 A 36 36 ASP C C 35 178.320 177.873 0.447 1
1 244 . 38 1 1 A 36 36 ASP CA C 35 57.832 58.539 -0.707 1
1 245 . 38 1 1 A 36 36 ASP CB C 35 40.914 41.147 -0.233 1
1 246 . 38 1 1 A 36 36 ASP N N 35 125.883 127.462 -1.579 1
1 247 . 38 1 1 A 37 37 GLU H H 36 8.905 8.187 0.718 1
1 248 . 38 1 1 A 37 37 GLU HA H 36 3.933 4.060 -0.127 1
1 253 . 38 1 1 A 37 37 GLU C C 36 179.304 179.015 0.289 1
1 254 . 38 1 1 A 37 37 GLU CA C 36 59.828 59.181 0.647 1
1 255 . 38 1 1 A 37 37 GLU CB C 36 29.380 29.448 -0.068 1
1 257 . 38 1 1 A 37 37 GLU N N 36 119.077 119.025 0.052 1
1 258 . 38 1 1 A 38 38 PHE H H 37 7.460 8.472 -1.012 1
1 259 . 38 1 1 A 38 38 PHE HA H 37 3.642 4.049 -0.407 1
1 267 . 38 1 1 A 38 38 PHE C C 37 176.483 177.976 -1.493 1
1 268 . 38 1 1 A 38 38 PHE CA C 37 61.411 60.656 0.755 1
1 269 . 38 1 1 A 38 38 PHE CB C 37 39.355 39.204 0.151 1
1 275 . 38 1 1 A 38 38 PHE N N 37 119.968 120.587 -0.619 1
1 276 . 38 1 1 A 39 39 GLN H H 38 7.968 7.954 0.014 1
1 277 . 38 1 1 A 39 39 GLN HA H 38 3.712 3.869 -0.157 1
1 284 . 38 1 1 A 39 39 GLN CA C 38 59.153 58.935 0.218 1
1 285 . 38 1 1 A 39 39 GLN CB C 38 28.213 28.526 -0.313 1
1 287 . 38 1 1 A 39 39 GLN N N 38 116.433 118.434 -2.001 1
1 289 . 38 1 1 A 40 40 LEU H H 39 7.930 7.662 0.268 1
1 290 . 38 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 38 1 1 A 40 40 LEU C C 39 177.731 178.155 -0.424 1
1 301 . 38 1 1 A 40 40 LEU CA C 39 57.915 57.897 0.018 1
1 302 . 38 1 1 A 40 40 LEU CB C 39 41.989 41.474 0.515 1
1 306 . 38 1 1 A 40 40 LEU N N 39 119.505 121.408 -1.903 1
1 307 . 38 1 1 A 41 41 LEU H H 40 7.174 7.815 -0.641 1
1 308 . 38 1 1 A 41 41 LEU HA H 40 3.835 3.962 -0.127 1
1 318 . 38 1 1 A 41 41 LEU C C 40 179.738 178.099 1.639 1
1 319 . 38 1 1 A 41 41 LEU CA C 40 58.266 58.294 -0.028 1
1 320 . 38 1 1 A 41 41 LEU CB C 40 42.050 41.478 0.572 1
1 324 . 38 1 1 A 41 41 LEU N N 40 120.971 119.795 1.176 1
1 325 . 38 1 1 A 42 42 GLN H H 41 8.058 7.864 0.194 1
1 326 . 38 1 1 A 42 42 GLN HA H 41 3.556 3.736 -0.180 1
1 333 . 38 1 1 A 42 42 GLN C C 41 177.642 178.655 -1.013 1
1 334 . 38 1 1 A 42 42 GLN CA C 41 59.826 59.161 0.665 1
1 335 . 38 1 1 A 42 42 GLN CB C 41 28.762 27.919 0.843 1
1 337 . 38 1 1 A 42 42 GLN N N 41 117.899 117.996 -0.097 1
1 339 . 38 1 1 A 43 43 ARG H H 42 8.179 7.691 0.488 1
1 340 . 38 1 1 A 43 43 ARG HA H 42 3.655 4.029 -0.374 1
1 347 . 38 1 1 A 43 43 ARG C C 42 178.051 178.863 -0.812 1
1 348 . 38 1 1 A 43 43 ARG CA C 42 59.766 58.944 0.822 1
1 349 . 38 1 1 A 43 43 ARG CB C 42 29.941 29.616 0.325 1
1 352 . 38 1 1 A 43 43 ARG N N 42 119.392 118.971 0.421 1
1 353 . 38 1 1 A 44 44 ASN H H 43 8.525 8.104 0.421 1
1 354 . 38 1 1 A 44 44 ASN HA H 43 4.332 4.342 -0.010 1
1 359 . 38 1 1 A 44 44 ASN C C 43 178.150 177.667 0.483 1
1 360 . 38 1 1 A 44 44 ASN CA C 43 55.841 56.117 -0.276 1
1 361 . 38 1 1 A 44 44 ASN CB C 43 37.632 39.209 -1.577 1
1 362 . 38 1 1 A 44 44 ASN N N 43 116.214 117.573 -1.359 1
1 364 . 38 1 1 A 45 45 PHE H H 44 7.586 7.666 -0.080 1
1 365 . 38 1 1 A 45 45 PHE HA H 44 4.132 4.328 -0.196 1
1 372 . 38 1 1 A 45 45 PHE C C 44 176.691 178.438 -1.747 1
1 373 . 38 1 1 A 45 45 PHE CA C 44 62.333 60.683 1.650 1
1 374 . 38 1 1 A 45 45 PHE CB C 44 39.449 38.783 0.666 1
1 379 . 38 1 1 A 45 45 PHE N N 44 121.501 117.543 3.958 1
1 380 . 38 1 1 A 46 46 MET H H 45 8.190 8.296 -0.106 1
1 381 . 38 1 1 A 46 46 MET HA H 45 4.060 4.247 -0.187 1
1 389 . 38 1 1 A 46 46 MET C C 45 179.754 178.246 1.508 1
1 390 . 38 1 1 A 46 46 MET CA C 45 57.742 57.918 -0.176 1
1 391 . 38 1 1 A 46 46 MET CB C 45 29.912 31.155 -1.243 1
1 394 . 38 1 1 A 46 46 MET N N 45 116.727 117.468 -0.741 1
1 395 . 38 1 1 A 47 47 ASP H H 46 8.579 8.113 0.466 1
1 396 . 38 1 1 A 47 47 ASP HA H 46 4.804 4.694 0.110 1
1 399 . 38 1 1 A 47 47 ASP C C 46 177.854 178.577 -0.723 1
1 400 . 38 1 1 A 47 47 ASP CA C 46 57.277 57.368 -0.091 1
1 401 . 38 1 1 A 47 47 ASP CB C 46 40.776 41.127 -0.351 1
1 402 . 38 1 1 A 47 47 ASP N N 46 117.798 120.578 -2.780 1
1 403 . 38 1 1 A 48 48 LYS H H 47 7.339 8.018 -0.679 1
1 404 . 38 1 1 A 48 48 LYS HA H 47 3.828 4.155 -0.327 1
1 413 . 38 1 1 A 48 48 LYS C C 47 178.812 179.014 -0.202 1
1 414 . 38 1 1 A 48 48 LYS CA C 47 58.953 58.579 0.374 1
1 415 . 38 1 1 A 48 48 LYS CB C 47 32.796 32.689 0.107 1
1 419 . 38 1 1 A 48 48 LYS N N 47 117.852 119.048 -1.196 1
1 420 . 38 1 1 A 49 49 TYR H H 48 6.841 8.779 -1.938 1
1 421 . 38 1 1 A 49 49 TYR HA H 48 4.995 4.306 0.689 1
1 428 . 38 1 1 A 49 49 TYR C C 48 178.138 178.847 -0.709 1
1 429 . 38 1 1 A 49 49 TYR CA C 48 58.620 60.062 -1.442 1
1 430 . 38 1 1 A 49 49 TYR CB C 48 42.939 38.302 4.637 1
1 435 . 38 1 1 A 49 49 TYR N N 48 112.109 119.996 -7.887 1
1 436 . 38 1 1 A 50 50 TYR H H 49 8.491 8.131 0.360 1
1 437 . 38 1 1 A 50 50 TYR HA H 49 4.598 4.389 0.209 1
1 444 . 38 1 1 A 50 50 TYR C C 49 176.015 177.983 -1.968 1
1 445 . 38 1 1 A 50 50 TYR CA C 49 62.442 59.742 2.700 1
1 446 . 38 1 1 A 50 50 TYR CB C 49 36.588 37.200 -0.612 1
1 451 . 38 1 1 A 50 50 TYR N N 49 118.294 119.476 -1.182 1
1 452 . 38 1 1 A 51 51 LEU H H 50 7.512 7.450 0.062 1
1 453 . 38 1 1 A 51 51 LEU HA H 50 3.878 3.625 0.253 1
1 463 . 38 1 1 A 51 51 LEU C C 50 178.625 179.421 -0.796 1
1 464 . 38 1 1 A 51 51 LEU CA C 50 55.994 57.258 -1.264 1
1 465 . 38 1 1 A 51 51 LEU CB C 50 40.743 41.742 -0.999 1
1 469 . 38 1 1 A 51 51 LEU N N 50 118.478 121.866 -3.388 1
1 470 . 38 1 1 A 52 52 GLU H H 51 8.042 7.947 0.095 1
1 471 . 38 1 1 A 52 52 GLU HA H 51 4.197 4.075 0.122 1
1 476 . 38 1 1 A 52 52 GLU C C 51 177.629 177.366 0.263 1
1 477 . 38 1 1 A 52 52 GLU CA C 51 56.141 58.803 -2.662 1
1 478 . 38 1 1 A 52 52 GLU CB C 51 29.162 29.585 -0.423 1
1 480 . 38 1 1 A 52 52 GLU N N 51 115.067 117.963 -2.896 1
1 481 . 38 1 1 A 53 53 PHE H H 52 7.465 7.925 -0.460 1
1 482 . 38 1 1 A 53 53 PHE HA H 52 4.431 4.643 -0.212 1
1 490 . 38 1 1 A 53 53 PHE C C 52 174.325 174.938 -0.613 1
1 491 . 38 1 1 A 53 53 PHE CA C 52 58.986 56.699 2.287 1
1 492 . 38 1 1 A 53 53 PHE CB C 52 40.183 36.879 3.304 1
1 498 . 38 1 1 A 53 53 PHE N N 52 116.768 118.222 -1.454 1
1 499 . 38 1 1 A 54 54 GLU H H 53 7.484 8.417 -0.933 1
1 500 . 38 1 1 A 54 54 GLU HA H 53 4.583 4.811 -0.228 1
1 505 . 38 1 1 A 54 54 GLU C C 53 175.722 175.660 0.062 1
1 506 . 38 1 1 A 54 54 GLU CA C 53 54.248 55.305 -1.057 1
1 507 . 38 1 1 A 54 54 GLU CB C 53 34.409 30.935 3.474 1
1 509 . 38 1 1 A 54 54 GLU N N 53 118.844 125.183 -6.339 1
1 510 . 38 1 1 A 55 55 ASP H H 54 9.008 8.690 0.318 1
1 511 . 38 1 1 A 55 55 ASP HA H 54 4.735 4.945 -0.210 1
1 514 . 38 1 1 A 55 55 ASP C C 54 175.421 175.722 -0.301 1
1 515 . 38 1 1 A 55 55 ASP CA C 54 52.888 53.650 -0.762 1
1 516 . 38 1 1 A 55 55 ASP CB C 54 38.894 41.000 -2.106 1
1 517 . 38 1 1 A 55 55 ASP N N 54 123.654 124.960 -1.306 1
1 518 . 38 1 1 A 56 56 THR H H 55 7.819 7.819 0.000 1
1 519 . 38 1 1 A 56 56 THR HA H 55 4.574 4.966 -0.392 1
1 524 . 38 1 1 A 56 56 THR C C 55 174.096 174.685 -0.589 1
1 525 . 38 1 1 A 56 56 THR CA C 55 59.172 59.492 -0.320 1
1 526 . 38 1 1 A 56 56 THR CB C 55 71.889 72.413 -0.524 1
1 528 . 38 1 1 A 56 56 THR N N 55 112.015 115.549 -3.534 1
1 529 . 38 1 1 A 57 57 GLU H H 56 8.527 8.619 -0.092 1
1 530 . 38 1 1 A 57 57 GLU HA H 56 4.217 4.328 -0.111 1
1 535 . 38 1 1 A 57 57 GLU C C 56 177.042 176.216 0.826 1
1 536 . 38 1 1 A 57 57 GLU CA C 56 56.869 57.817 -0.948 1
1 537 . 38 1 1 A 57 57 GLU CB C 56 29.731 29.980 -0.249 1
1 539 . 38 1 1 A 57 57 GLU N N 56 117.531 120.494 -2.963 1
1 540 . 38 1 1 A 58 58 GLU H H 57 7.587 7.710 -0.123 1
1 541 . 38 1 1 A 58 58 GLU HA H 57 3.941 4.784 -0.843 1
1 546 . 38 1 1 A 58 58 GLU C C 57 176.849 175.010 1.839 1
1 547 . 38 1 1 A 58 58 GLU CA C 57 56.924 55.887 1.037 1
1 548 . 38 1 1 A 58 58 GLU CB C 57 30.251 31.296 -1.045 1
1 550 . 38 1 1 A 58 58 GLU N N 57 119.183 121.679 -2.496 1
1 551 . 38 1 1 A 59 59 ASN H H 58 9.120 8.808 0.312 1
1 552 . 38 1 1 A 59 59 ASN HA H 58 4.922 5.538 -0.616 1
1 557 . 38 1 1 A 59 59 ASN C C 58 174.254 174.184 0.070 1
1 558 . 38 1 1 A 59 59 ASN CA C 58 51.956 52.063 -0.107 1
1 559 . 38 1 1 A 59 59 ASN CB C 58 37.404 41.885 -4.481 1
1 560 . 38 1 1 A 59 59 ASN N N 58 126.767 125.959 0.808 1
1 562 . 38 1 1 A 60 60 LYS H H 59 5.892 9.029 -3.137 1
1 563 . 38 1 1 A 60 60 LYS HA H 59 3.798 4.630 -0.832 1
1 572 . 38 1 1 A 60 60 LYS C C 59 177.908 177.502 0.406 1
1 573 . 38 1 1 A 60 60 LYS CA C 59 56.623 54.561 2.062 1
1 574 . 38 1 1 A 60 60 LYS CB C 59 32.279 34.497 -2.218 1
1 578 . 38 1 1 A 60 60 LYS N N 59 121.527 125.352 -3.825 1
1 579 . 38 1 1 A 61 61 LEU H H 60 8.473 8.783 -0.310 1
1 580 . 38 1 1 A 61 61 LEU HA H 60 3.891 4.224 -0.333 1
1 590 . 38 1 1 A 61 61 LEU C C 60 179.843 178.520 1.323 1
1 591 . 38 1 1 A 61 61 LEU CA C 60 58.301 56.251 2.050 1
1 592 . 38 1 1 A 61 61 LEU CB C 60 41.305 41.606 -0.301 1
1 596 . 38 1 1 A 61 61 LEU N N 60 125.639 123.237 2.402 1
1 597 . 38 1 1 A 62 62 ILE H H 61 7.698 7.635 0.063 1
1 598 . 38 1 1 A 62 62 ILE HA H 61 3.952 3.848 0.104 1
1 608 . 38 1 1 A 62 62 ILE C C 61 175.392 176.924 -1.532 1
1 609 . 38 1 1 A 62 62 ILE CA C 61 61.743 63.290 -1.547 1
1 610 . 38 1 1 A 62 62 ILE CB C 61 39.108 37.746 1.362 1
1 614 . 38 1 1 A 62 62 ILE N N 61 114.111 120.035 -5.924 1
1 615 . 38 1 1 A 63 63 TYR H H 62 7.273 7.602 -0.329 1
1 616 . 38 1 1 A 63 63 TYR HA H 62 4.343 4.146 0.197 1
1 623 . 38 1 1 A 63 63 TYR C C 62 178.264 178.479 -0.215 1
1 624 . 38 1 1 A 63 63 TYR CA C 62 57.231 61.060 -3.829 1
1 625 . 38 1 1 A 63 63 TYR CB C 62 36.332 38.036 -1.704 1
1 630 . 38 1 1 A 63 63 TYR N N 62 117.689 121.302 -3.613 1
1 631 . 38 1 1 A 64 64 THR H H 63 7.747 8.143 -0.396 1
1 632 . 38 1 1 A 64 64 THR HA H 63 4.266 4.194 0.072 1
1 637 . 38 1 1 A 64 64 THR CA C 63 69.362 67.544 1.818 1
1 638 . 38 1 1 A 64 64 THR CB C 63 66.962 67.484 -0.522 1
1 640 . 38 1 1 A 64 64 THR N N 63 113.755 116.365 -2.610 1
1 641 . 38 1 1 A 65 65 PRO HA H 64 4.372 4.357 0.015 1
1 648 . 38 1 1 A 65 65 PRO C C 64 179.913 179.443 0.470 1
1 649 . 38 1 1 A 65 65 PRO CA C 64 66.011 66.340 -0.329 1
1 650 . 38 1 1 A 65 65 PRO CB C 64 30.642 30.761 -0.119 1
1 653 . 38 1 1 A 66 66 ILE H H 65 7.377 7.361 0.016 1
1 654 . 38 1 1 A 66 66 ILE HA H 65 3.530 3.867 -0.337 1
1 664 . 38 1 1 A 66 66 ILE C C 65 177.543 178.374 -0.831 1
1 665 . 38 1 1 A 66 66 ILE CA C 65 66.647 64.326 2.321 1
1 666 . 38 1 1 A 66 66 ILE CB C 65 38.029 37.800 0.229 1
1 670 . 38 1 1 A 66 66 ILE N N 65 118.353 116.637 1.716 1
1 671 . 38 1 1 A 67 67 PHE H H 66 8.480 8.457 0.023 1
1 672 . 38 1 1 A 67 67 PHE HA H 66 4.115 4.416 -0.301 1
1 680 . 38 1 1 A 67 67 PHE C C 66 177.293 178.127 -0.834 1
1 681 . 38 1 1 A 67 67 PHE CA C 66 59.570 62.068 -2.498 1
1 682 . 38 1 1 A 67 67 PHE CB C 66 38.865 39.583 -0.718 1
1 688 . 38 1 1 A 67 67 PHE N N 66 122.420 120.321 2.099 1
1 689 . 38 1 1 A 68 68 ASN H H 67 8.595 8.219 0.376 1
1 690 . 38 1 1 A 68 68 ASN HA H 67 4.211 4.380 -0.169 1
1 695 . 38 1 1 A 68 68 ASN C C 67 178.697 178.206 0.491 1
1 696 . 38 1 1 A 68 68 ASN CA C 67 56.056 56.423 -0.367 1
1 697 . 38 1 1 A 68 68 ASN CB C 67 37.704 37.928 -0.224 1
1 698 . 38 1 1 A 68 68 ASN N N 67 115.573 116.725 -1.152 1
1 700 . 38 1 1 A 69 69 GLU H H 68 8.414 8.023 0.391 1
1 701 . 38 1 1 A 69 69 GLU HA H 68 4.102 4.190 -0.088 1
1 706 . 38 1 1 A 69 69 GLU C C 68 177.880 178.807 -0.927 1
1 707 . 38 1 1 A 69 69 GLU CA C 68 59.399 59.477 -0.078 1
1 708 . 38 1 1 A 69 69 GLU CB C 68 29.855 29.448 0.407 1
1 710 . 38 1 1 A 69 69 GLU N N 68 123.510 120.056 3.454 1
1 711 . 38 1 1 A 70 70 TYR H H 69 8.659 8.031 0.628 1
1 712 . 38 1 1 A 70 70 TYR HA H 69 3.362 4.090 -0.728 1
1 719 . 38 1 1 A 70 70 TYR C C 69 178.143 176.928 1.215 1
1 720 . 38 1 1 A 70 70 TYR CA C 69 60.686 61.195 -0.509 1
1 721 . 38 1 1 A 70 70 TYR CB C 69 38.560 38.897 -0.337 1
1 726 . 38 1 1 A 70 70 TYR N N 69 122.130 120.854 1.276 1
1 727 . 38 1 1 A 71 71 ILE H H 70 8.031 7.906 0.125 1
1 728 . 38 1 1 A 71 71 ILE HA H 70 3.265 3.676 -0.411 1
1 738 . 38 1 1 A 71 71 ILE C C 70 178.056 177.323 0.733 1
1 739 . 38 1 1 A 71 71 ILE CA C 70 63.756 63.978 -0.222 1
1 740 . 38 1 1 A 71 71 ILE CB C 70 37.321 36.742 0.579 1
1 744 . 38 1 1 A 71 71 ILE N N 70 118.906 120.411 -1.505 1
1 745 . 38 1 1 A 72 72 SER H H 71 7.803 7.711 0.092 1
1 746 . 38 1 1 A 72 72 SER HA H 71 4.029 4.358 -0.329 1
1 749 . 38 1 1 A 72 72 SER CA C 71 61.380 60.940 0.440 1
1 750 . 38 1 1 A 72 72 SER CB C 71 63.288 63.267 0.021 1
1 751 . 38 1 1 A 72 72 SER N N 71 113.735 116.794 -3.059 1
1 752 . 38 1 1 A 73 73 LEU H H 72 7.952 7.985 -0.033 1
1 753 . 38 1 1 A 73 73 LEU HA H 72 4.418 4.130 0.288 1
1 763 . 38 1 1 A 73 73 LEU C C 72 177.767 178.315 -0.548 1
1 764 . 38 1 1 A 73 73 LEU CA C 72 56.543 57.428 -0.885 1
1 765 . 38 1 1 A 73 73 LEU CB C 72 44.517 41.674 2.843 1
1 769 . 38 1 1 A 73 73 LEU N N 72 119.411 122.431 -3.020 1
1 770 . 38 1 1 A 74 74 VAL H H 73 8.021 7.599 0.422 1
1 771 . 38 1 1 A 74 74 VAL HA H 73 3.532 3.339 0.193 1
1 779 . 38 1 1 A 74 74 VAL C C 73 177.126 177.969 -0.843 1
1 780 . 38 1 1 A 74 74 VAL CA C 73 66.250 66.316 -0.066 1
1 781 . 38 1 1 A 74 74 VAL CB C 73 31.212 31.149 0.063 1
1 784 . 38 1 1 A 74 74 VAL N N 73 118.747 119.228 -0.481 1
1 785 . 38 1 1 A 75 75 GLU H H 74 7.232 7.940 -0.708 1
1 786 . 38 1 1 A 75 75 GLU HA H 74 3.013 4.215 -1.202 1
1 791 . 38 1 1 A 75 75 GLU C C 74 178.804 179.177 -0.373 1
1 792 . 38 1 1 A 75 75 GLU CA C 74 60.536 59.989 0.547 1
1 793 . 38 1 1 A 75 75 GLU CB C 74 27.009 29.115 -2.106 1
1 795 . 38 1 1 A 75 75 GLU N N 74 118.660 119.756 -1.096 1
1 796 . 38 1 1 A 76 76 LYS H H 75 7.051 7.808 -0.757 1
1 797 . 38 1 1 A 76 76 LYS HA H 75 3.765 4.032 -0.267 1
1 806 . 38 1 1 A 76 76 LYS C C 75 177.765 178.465 -0.700 1
1 807 . 38 1 1 A 76 76 LYS CA C 75 58.357 58.974 -0.617 1
1 808 . 38 1 1 A 76 76 LYS CB C 75 31.939 31.896 0.043 1
1 812 . 38 1 1 A 76 76 LYS N N 75 116.112 119.679 -3.567 1
1 813 . 38 1 1 A 77 77 TYR H H 76 7.067 7.699 -0.632 1
1 814 . 38 1 1 A 77 77 TYR HA H 76 4.036 4.212 -0.176 1
1 821 . 38 1 1 A 77 77 TYR C C 76 177.752 177.119 0.633 1
1 822 . 38 1 1 A 77 77 TYR CA C 76 61.820 61.257 0.563 1
1 823 . 38 1 1 A 77 77 TYR CB C 76 38.480 38.666 -0.186 1
1 828 . 38 1 1 A 77 77 TYR N N 76 118.434 120.816 -2.382 1
1 829 . 38 1 1 A 78 78 ILE H H 77 7.554 8.289 -0.735 1
1 830 . 38 1 1 A 78 78 ILE HA H 77 3.159 3.609 -0.450 1
1 840 . 38 1 1 A 78 78 ILE C C 77 177.341 177.851 -0.510 1
1 841 . 38 1 1 A 78 78 ILE CA C 77 65.177 65.353 -0.176 1
1 842 . 38 1 1 A 78 78 ILE CB C 77 37.339 38.116 -0.777 1
1 846 . 38 1 1 A 78 78 ILE N N 77 117.672 121.395 -3.723 1
1 847 . 38 1 1 A 79 79 GLU H H 78 8.296 8.003 0.293 1
1 848 . 38 1 1 A 79 79 GLU HA H 78 3.557 3.850 -0.293 1
1 853 . 38 1 1 A 79 79 GLU C C 78 177.742 178.780 -1.038 1
1 854 . 38 1 1 A 79 79 GLU CA C 78 60.847 59.933 0.914 1
1 855 . 38 1 1 A 79 79 GLU CB C 78 29.594 29.128 0.466 1
1 857 . 38 1 1 A 79 79 GLU N N 78 118.701 120.850 -2.149 1
1 858 . 38 1 1 A 80 80 GLU H H 79 8.330 8.200 0.130 1
1 859 . 38 1 1 A 80 80 GLU HA H 79 3.774 4.056 -0.282 1
1 864 . 38 1 1 A 80 80 GLU C C 79 179.926 179.008 0.918 1
1 865 . 38 1 1 A 80 80 GLU CA C 79 59.581 58.770 0.811 1
1 866 . 38 1 1 A 80 80 GLU CB C 79 29.062 29.474 -0.412 1
1 868 . 38 1 1 A 80 80 GLU N N 79 116.767 118.885 -2.118 1
1 869 . 38 1 1 A 81 81 GLN H H 80 7.634 7.758 -0.124 1
1 870 . 38 1 1 A 81 81 GLN HA H 80 3.605 3.848 -0.243 1
1 877 . 38 1 1 A 81 81 GLN C C 80 179.681 178.533 1.148 1
1 878 . 38 1 1 A 81 81 GLN CA C 80 57.765 58.498 -0.733 1
1 879 . 38 1 1 A 81 81 GLN CB C 80 28.079 28.042 0.037 1
1 881 . 38 1 1 A 81 81 GLN N N 80 116.325 118.713 -2.388 1
1 883 . 38 1 1 A 82 82 LEU H H 81 8.156 7.509 0.647 1
1 884 . 38 1 1 A 82 82 LEU HA H 81 3.536 3.759 -0.223 1
1 894 . 38 1 1 A 82 82 LEU C C 81 178.945 179.416 -0.471 1
1 895 . 38 1 1 A 82 82 LEU CA C 81 57.761 56.804 0.957 1
1 896 . 38 1 1 A 82 82 LEU CB C 81 40.961 40.919 0.042 1
1 900 . 38 1 1 A 82 82 LEU N N 81 121.546 120.191 1.355 1
1 901 . 38 1 1 A 83 83 LEU H H 82 8.326 7.915 0.411 1
1 902 . 38 1 1 A 83 83 LEU HA H 82 4.198 4.161 0.037 1
1 912 . 38 1 1 A 83 83 LEU C C 82 178.631 179.388 -0.757 1
1 913 . 38 1 1 A 83 83 LEU CA C 82 57.016 57.216 -0.200 1
1 914 . 38 1 1 A 83 83 LEU CB C 82 42.182 40.769 1.413 1
1 918 . 38 1 1 A 83 83 LEU N N 82 120.426 119.370 1.056 1
1 919 . 38 1 1 A 84 84 GLN H H 83 6.992 7.541 -0.549 1
1 920 . 38 1 1 A 84 84 GLN HA H 83 3.877 4.014 -0.137 1
1 927 . 38 1 1 A 84 84 GLN C C 83 177.008 176.917 0.091 1
1 928 . 38 1 1 A 84 84 GLN CA C 83 57.543 58.290 -0.747 1
1 929 . 38 1 1 A 84 84 GLN CB C 83 28.688 28.578 0.110 1
1 931 . 38 1 1 A 84 84 GLN N N 83 114.001 117.343 -3.342 1
1 933 . 38 1 1 A 85 85 ARG H H 84 7.072 7.284 -0.212 1
1 934 . 38 1 1 A 85 85 ARG HA H 84 4.047 4.382 -0.335 1
1 942 . 38 1 1 A 85 85 ARG C C 84 175.999 175.760 0.239 1
1 943 . 38 1 1 A 85 85 ARG CA C 84 56.764 56.268 0.496 1
1 944 . 38 1 1 A 85 85 ARG CB C 84 32.044 32.659 -0.615 1
1 947 . 38 1 1 A 85 85 ARG N N 84 115.827 116.736 -0.909 1
1 949 . 38 1 1 A 86 86 ILE H H 85 8.238 7.809 0.429 1
1 950 . 38 1 1 A 86 86 ILE HA H 85 4.389 4.497 -0.108 1
1 960 . 38 1 1 A 86 86 ILE CA C 85 58.007 57.722 0.285 1
1 961 . 38 1 1 A 86 86 ILE CB C 85 39.604 38.697 0.907 1
1 965 . 38 1 1 A 86 86 ILE N N 85 119.285 120.325 -1.040 1
1 966 . 38 1 1 A 87 87 PRO HA H 86 4.392 4.545 -0.153 1
1 973 . 38 1 1 A 87 87 PRO C C 86 177.622 176.621 1.001 1
1 974 . 38 1 1 A 87 87 PRO CA C 86 64.665 64.272 0.393 1
1 975 . 38 1 1 A 87 87 PRO CB C 86 32.020 31.760 0.260 1
1 978 . 38 1 1 A 88 88 GLU H H 87 8.312 8.206 0.106 1
1 979 . 38 1 1 A 88 88 GLU HA H 87 4.208 4.540 -0.332 1
1 984 . 38 1 1 A 88 88 GLU C C 87 175.554 175.788 -0.234 1
1 985 . 38 1 1 A 88 88 GLU CA C 87 56.045 56.257 -0.212 1
1 986 . 38 1 1 A 88 88 GLU CB C 87 28.654 30.355 -1.701 1
1 988 . 38 1 1 A 88 88 GLU N N 87 114.256 116.963 -2.707 1
1 989 . 38 1 1 A 89 89 PHE H H 88 7.946 7.542 0.404 1
1 990 . 38 1 1 A 89 89 PHE HA H 88 3.993 4.431 -0.438 1
1 998 . 38 1 1 A 89 89 PHE C C 88 173.460 174.459 -0.999 1
1 999 . 38 1 1 A 89 89 PHE CA C 88 60.119 59.340 0.779 1
1 1000 . 38 1 1 A 89 89 PHE CB C 88 39.994 39.578 0.416 1
1 1006 . 38 1 1 A 89 89 PHE N N 88 121.550 123.351 -1.801 1
1 1007 . 38 1 1 A 90 90 ASN H H 89 7.266 7.795 -0.529 1
1 1008 . 38 1 1 A 90 90 ASN HA H 89 4.454 5.028 -0.574 1
1 1013 . 38 1 1 A 90 90 ASN C C 89 173.921 175.278 -1.357 1
1 1014 . 38 1 1 A 90 90 ASN CA C 89 51.839 51.431 0.408 1
1 1015 . 38 1 1 A 90 90 ASN CB C 89 40.674 39.315 1.359 1
1 1016 . 38 1 1 A 90 90 ASN N N 89 125.344 124.934 0.410 1
1 1018 . 38 1 1 A 91 91 MET H H 90 8.968 8.733 0.235 1
1 1019 . 38 1 1 A 91 91 MET HA H 90 4.049 4.219 -0.170 1
1 1027 . 38 1 1 A 91 91 MET C C 90 177.475 177.798 -0.323 1
1 1028 . 38 1 1 A 91 91 MET CA C 90 57.758 57.910 -0.152 1
1 1029 . 38 1 1 A 91 91 MET CB C 90 32.250 32.504 -0.254 1
1 1032 . 38 1 1 A 91 91 MET N N 90 127.052 125.216 1.836 1
1 1033 . 38 1 1 A 92 92 ALA H H 91 8.292 7.985 0.307 1
1 1034 . 38 1 1 A 92 92 ALA HA H 91 4.059 4.133 -0.074 1
1 1038 . 38 1 1 A 92 92 ALA C C 91 180.412 179.686 0.726 1
1 1039 . 38 1 1 A 92 92 ALA CA C 91 55.368 54.852 0.516 1
1 1040 . 38 1 1 A 92 92 ALA CB C 91 17.527 18.762 -1.235 1
1 1041 . 38 1 1 A 92 92 ALA N N 91 123.752 121.072 2.680 1
1 1042 . 38 1 1 A 93 93 ALA H H 92 7.931 8.041 -0.110 1
1 1043 . 38 1 1 A 93 93 ALA HA H 92 4.054 4.299 -0.245 1
1 1047 . 38 1 1 A 93 93 ALA C C 92 180.482 179.783 0.699 1
1 1048 . 38 1 1 A 93 93 ALA CA C 92 54.614 54.896 -0.282 1
1 1049 . 38 1 1 A 93 93 ALA CB C 92 18.098 18.158 -0.060 1
1 1050 . 38 1 1 A 93 93 ALA N N 92 121.158 120.165 0.993 1
1 1051 . 38 1 1 A 94 94 PHE H H 93 8.110 7.828 0.282 1
1 1052 . 38 1 1 A 94 94 PHE HA H 93 4.304 4.214 0.090 1
1 1060 . 38 1 1 A 94 94 PHE C C 93 177.350 177.055 0.295 1
1 1061 . 38 1 1 A 94 94 PHE CA C 93 61.641 61.626 0.015 1
1 1062 . 38 1 1 A 94 94 PHE CB C 93 40.014 39.246 0.768 1
1 1068 . 38 1 1 A 94 94 PHE N N 93 119.807 119.777 0.030 1
1 1069 . 38 1 1 A 95 95 THR H H 94 8.726 8.141 0.585 1
1 1070 . 38 1 1 A 95 95 THR HA H 94 3.569 3.938 -0.369 1
1 1075 . 38 1 1 A 95 95 THR C C 94 176.932 176.416 0.516 1
1 1076 . 38 1 1 A 95 95 THR CA C 94 66.833 65.508 1.325 1
1 1077 . 38 1 1 A 95 95 THR CB C 94 68.445 68.268 0.177 1
1 1079 . 38 1 1 A 95 95 THR N N 94 113.074 112.027 1.047 1
1 1080 . 38 1 1 A 96 96 THR H H 95 7.657 7.893 -0.236 1
1 1081 . 38 1 1 A 96 96 THR HA H 95 3.945 4.101 -0.156 1
1 1086 . 38 1 1 A 96 96 THR C C 95 176.386 177.578 -1.192 1
1 1087 . 38 1 1 A 96 96 THR CA C 95 66.550 65.685 0.865 1
1 1088 . 38 1 1 A 96 96 THR CB C 95 68.583 67.982 0.601 1
1 1090 . 38 1 1 A 96 96 THR N N 95 117.927 113.875 4.052 1
1 1091 . 38 1 1 A 97 97 THR H H 96 7.699 7.776 -0.077 1
1 1092 . 38 1 1 A 97 97 THR HA H 96 3.905 4.105 -0.200 1
1 1097 . 38 1 1 A 97 97 THR C C 96 176.572 176.516 0.056 1
1 1098 . 38 1 1 A 97 97 THR CA C 96 65.979 66.485 -0.506 1
1 1099 . 38 1 1 A 97 97 THR CB C 96 68.553 68.316 0.237 1
1 1101 . 38 1 1 A 97 97 THR N N 96 118.518 117.519 0.999 1
1 1102 . 38 1 1 A 98 98 LEU H H 97 8.304 8.265 0.039 1
1 1103 . 38 1 1 A 98 98 LEU HA H 97 3.725 3.862 -0.137 1
1 1113 . 38 1 1 A 98 98 LEU C C 97 178.490 178.627 -0.137 1
1 1114 . 38 1 1 A 98 98 LEU CA C 97 58.517 58.074 0.443 1
1 1115 . 38 1 1 A 98 98 LEU CB C 97 41.697 41.124 0.573 1
1 1119 . 38 1 1 A 98 98 LEU N N 97 122.882 122.021 0.861 1
1 1120 . 38 1 1 A 99 99 GLN H H 98 7.639 7.852 -0.213 1
1 1121 . 38 1 1 A 99 99 GLN HA H 98 3.927 4.030 -0.103 1
1 1128 . 38 1 1 A 99 99 GLN C C 98 178.068 178.113 -0.045 1
1 1129 . 38 1 1 A 99 99 GLN CA C 98 58.735 58.876 -0.141 1
1 1130 . 38 1 1 A 99 99 GLN CB C 98 27.986 28.201 -0.215 1
1 1132 . 38 1 1 A 99 99 GLN N N 98 114.302 118.158 -3.856 1
1 1134 . 38 1 1 A 100 100 HIS H H 99 7.575 7.376 0.199 1
1 1135 . 38 1 1 A 100 100 HIS HA H 99 4.524 4.498 0.026 1
1 1139 . 38 1 1 A 100 100 HIS C C 99 174.789 177.463 -2.674 1
1 1140 . 38 1 1 A 100 100 HIS CA C 99 56.154 59.538 -3.384 1
1 1141 . 38 1 1 A 100 100 HIS CB C 99 28.946 30.747 -1.801 1
1 1143 . 38 1 1 A 100 100 HIS N N 99 114.778 118.654 -3.876 1
1 1144 . 38 1 1 A 101 101 HIS H H 100 7.773 8.132 -0.359 1
1 1145 . 38 1 1 A 101 101 HIS HA H 100 4.704 4.431 0.273 1
1 1149 . 38 1 1 A 101 101 HIS C C 100 174.818 177.148 -2.330 1
1 1150 . 38 1 1 A 101 101 HIS CA C 100 54.830 58.701 -3.871 1
1 1151 . 38 1 1 A 101 101 HIS CB C 100 29.749 28.658 1.091 1
1 1153 . 38 1 1 A 101 101 HIS N N 100 117.397 117.370 0.027 1
1 1154 . 38 1 1 A 102 102 LYS H H 101 7.324 8.171 -0.847 1
1 1155 . 38 1 1 A 102 102 LYS HA H 101 3.611 4.025 -0.414 1
1 1164 . 38 1 1 A 102 102 LYS C C 101 176.823 178.099 -1.276 1
1 1165 . 38 1 1 A 102 102 LYS CA C 101 59.915 59.075 0.840 1
1 1166 . 38 1 1 A 102 102 LYS CB C 101 32.825 32.007 0.818 1
1 1170 . 38 1 1 A 102 102 LYS N N 101 120.533 121.728 -1.195 1
1 1171 . 38 1 1 A 103 103 ASP H H 102 8.361 7.684 0.677 1
1 1172 . 38 1 1 A 103 103 ASP HA H 102 4.421 4.479 -0.058 1
1 1175 . 38 1 1 A 103 103 ASP C C 102 176.793 177.896 -1.103 1
1 1176 . 38 1 1 A 103 103 ASP CA C 102 55.500 56.092 -0.592 1
1 1177 . 38 1 1 A 103 103 ASP CB C 102 40.178 40.753 -0.575 1
1 1178 . 38 1 1 A 103 103 ASP N N 102 114.814 119.480 -4.666 1
1 1179 . 38 1 1 A 104 104 GLU H H 103 7.858 8.156 -0.298 1
1 1180 . 38 1 1 A 104 104 GLU HA H 103 4.339 4.472 -0.133 1
1 1183 . 38 1 1 A 104 104 GLU C C 103 175.777 176.131 -0.354 1
1 1184 . 38 1 1 A 104 104 GLU CA C 103 56.356 57.890 -1.534 1
1 1185 . 38 1 1 A 104 104 GLU CB C 103 31.293 31.320 -0.027 1
1 1186 . 38 1 1 A 104 104 GLU N N 103 116.826 119.570 -2.744 1
1 1187 . 38 1 1 A 105 105 VAL H H 104 7.201 7.624 -0.423 1
1 1188 . 38 1 1 A 105 105 VAL HA H 104 4.296 4.212 0.084 1
1 1196 . 38 1 1 A 105 105 VAL C C 104 174.482 175.634 -1.152 1
1 1197 . 38 1 1 A 105 105 VAL CA C 104 60.370 61.573 -1.203 1
1 1198 . 38 1 1 A 105 105 VAL CB C 104 34.341 33.276 1.065 1
1 1201 . 38 1 1 A 105 105 VAL N N 104 116.422 116.371 0.051 1
1 1202 . 38 1 1 A 106 106 ALA H H 105 8.487 8.568 -0.081 1
1 1203 . 38 1 1 A 106 106 ALA HA H 105 4.172 4.387 -0.215 1
1 1207 . 38 1 1 A 106 106 ALA C C 105 179.030 178.441 0.589 1
1 1208 . 38 1 1 A 106 106 ALA CA C 105 52.966 51.850 1.116 1
1 1209 . 38 1 1 A 106 106 ALA CB C 105 19.371 18.782 0.589 1
1 1210 . 38 1 1 A 106 106 ALA N N 105 128.313 125.785 2.528 1
1 1211 . 38 1 1 A 107 107 GLY H H 106 8.738 8.751 -0.013 1
1 1212 . 38 1 1 A 107 107 GLY HA2 H 106 3.773 3.865 -0.092 1
1 1213 . 38 1 1 A 107 107 GLY HA3 H 106 3.998 3.922 0.076 1
1 1214 . 38 1 1 A 107 107 GLY C C 106 174.958 175.530 -0.572 1
1 1215 . 38 1 1 A 107 107 GLY CA C 106 47.449 47.207 0.242 1
1 1216 . 38 1 1 A 107 107 GLY N N 106 110.612 110.615 -0.003 1
1 1217 . 38 1 1 A 108 108 ASP H H 107 8.535 8.340 0.195 1
1 1218 . 38 1 1 A 108 108 ASP HA H 107 4.333 4.455 -0.122 1
1 1221 . 38 1 1 A 108 108 ASP C C 107 179.133 178.622 0.511 1
1 1222 . 38 1 1 A 108 108 ASP CA C 107 56.721 57.001 -0.280 1
1 1223 . 38 1 1 A 108 108 ASP CB C 107 39.336 41.421 -2.085 1
1 1224 . 38 1 1 A 108 108 ASP N N 107 117.474 121.343 -3.869 1
1 1225 . 38 1 1 A 109 109 ILE H H 108 7.459 7.895 -0.436 1
1 1226 . 38 1 1 A 109 109 ILE HA H 108 3.688 3.823 -0.135 1
1 1236 . 38 1 1 A 109 109 ILE C C 108 176.735 178.415 -1.680 1
1 1237 . 38 1 1 A 109 109 ILE CA C 108 63.474 65.338 -1.864 1
1 1238 . 38 1 1 A 109 109 ILE CB C 108 37.340 37.619 -0.279 1
1 1242 . 38 1 1 A 109 109 ILE N N 108 119.609 119.793 -0.184 1
1 1243 . 38 1 1 A 110 110 PHE H H 109 7.920 8.352 -0.432 1
1 1244 . 38 1 1 A 110 110 PHE HA H 109 3.759 4.082 -0.323 1
1 1252 . 38 1 1 A 110 110 PHE C C 109 177.132 177.389 -0.257 1
1 1253 . 38 1 1 A 110 110 PHE CA C 109 62.766 61.247 1.519 1
1 1254 . 38 1 1 A 110 110 PHE CB C 109 39.752 39.314 0.438 1
1 1260 . 38 1 1 A 110 110 PHE N N 109 120.906 120.476 0.430 1
1 1261 . 38 1 1 A 111 111 ASP H H 110 8.639 8.145 0.494 1
1 1262 . 38 1 1 A 111 111 ASP HA H 110 4.216 4.230 -0.014 1
1 1265 . 38 1 1 A 111 111 ASP C C 110 178.900 178.389 0.511 1
1 1266 . 38 1 1 A 111 111 ASP CA C 110 57.105 57.280 -0.175 1
1 1267 . 38 1 1 A 111 111 ASP CB C 110 39.697 41.718 -2.021 1
1 1268 . 38 1 1 A 111 111 ASP N N 110 117.124 119.046 -1.922 1
1 1269 . 38 1 1 A 112 112 MET H H 111 7.331 7.530 -0.199 1
1 1270 . 38 1 1 A 112 112 MET HA H 111 4.081 4.138 -0.057 1
1 1278 . 38 1 1 A 112 112 MET C C 111 179.052 178.167 0.885 1
1 1279 . 38 1 1 A 112 112 MET CA C 111 58.202 58.131 0.071 1
1 1280 . 38 1 1 A 112 112 MET CB C 111 31.827 32.439 -0.612 1
1 1283 . 38 1 1 A 112 112 MET N N 111 118.061 119.445 -1.384 1
1 1284 . 38 1 1 A 113 113 LEU H H 112 8.001 8.028 -0.027 1
1 1285 . 38 1 1 A 113 113 LEU HA H 112 3.723 3.580 0.143 1
1 1295 . 38 1 1 A 113 113 LEU C C 112 179.747 178.680 1.067 1
1 1296 . 38 1 1 A 113 113 LEU CA C 112 57.371 57.407 -0.036 1
1 1297 . 38 1 1 A 113 113 LEU CB C 112 40.671 41.104 -0.433 1
1 1301 . 38 1 1 A 113 113 LEU N N 112 120.426 119.676 0.750 1
1 1302 . 38 1 1 A 114 114 LEU H H 113 7.744 7.706 0.038 1
1 1303 . 38 1 1 A 114 114 LEU HA H 113 4.007 3.490 0.517 1
1 1313 . 38 1 1 A 114 114 LEU C C 113 179.358 178.488 0.870 1
1 1314 . 38 1 1 A 114 114 LEU CA C 113 57.202 57.521 -0.319 1
1 1315 . 38 1 1 A 114 114 LEU CB C 113 41.727 41.581 0.146 1
1 1319 . 38 1 1 A 114 114 LEU N N 113 119.584 119.569 0.015 1
1 1320 . 38 1 1 A 115 115 THR H H 114 7.353 7.675 -0.322 1
1 1321 . 38 1 1 A 115 115 THR HA H 114 4.071 4.185 -0.114 1
1 1327 . 38 1 1 A 115 115 THR C C 114 173.591 176.452 -2.861 1
1 1328 . 38 1 1 A 115 115 THR CA C 114 65.332 64.399 0.933 1
1 1329 . 38 1 1 A 115 115 THR CB C 114 70.319 68.829 1.490 1
1 1331 . 38 1 1 A 115 115 THR N N 114 107.535 112.387 -4.852 1
1 1332 . 38 1 1 A 116 116 PHE H H 115 6.979 7.850 -0.871 1
1 1333 . 38 1 1 A 116 116 PHE HA H 115 5.022 4.290 0.732 1
1 1341 . 38 1 1 A 116 116 PHE C C 115 176.488 176.572 -0.084 1
1 1342 . 38 1 1 A 116 116 PHE CA C 115 55.911 60.889 -4.978 1
1 1343 . 38 1 1 A 116 116 PHE CB C 115 38.521 39.224 -0.703 1
1 1349 . 38 1 1 A 116 116 PHE N N 115 112.366 120.050 -7.684 1
1 1350 . 38 1 1 A 117 117 THR H H 116 7.564 7.303 0.261 1
1 1351 . 38 1 1 A 117 117 THR HA H 116 4.626 4.762 -0.136 1
1 1356 . 38 1 1 A 117 117 THR C C 116 174.085 174.195 -0.110 1
1 1357 . 38 1 1 A 117 117 THR CA C 116 61.636 61.745 -0.109 1
1 1358 . 38 1 1 A 117 117 THR CB C 116 70.915 70.916 -0.001 1
1 1360 . 38 1 1 A 117 117 THR N N 116 105.498 105.712 -0.214 1
1 1361 . 38 1 1 A 118 118 ASP H H 117 8.270 7.445 0.825 1
1 1362 . 38 1 1 A 118 118 ASP HA H 117 4.955 5.027 -0.072 1
1 1365 . 38 1 1 A 118 118 ASP C C 117 176.328 176.117 0.211 1
1 1366 . 38 1 1 A 118 118 ASP CA C 117 53.417 53.008 0.409 1
1 1367 . 38 1 1 A 118 118 ASP CB C 117 43.388 38.667 4.721 1
1 1368 . 38 1 1 A 118 118 ASP N N 117 124.409 123.814 0.595 1
1 1369 . 38 1 1 A 119 119 PHE H H 118 8.973 8.671 0.302 1
1 1370 . 38 1 1 A 119 119 PHE HA H 118 3.506 4.226 -0.720 1
1 1378 . 38 1 1 A 119 119 PHE CA C 118 61.490 61.133 0.357 1
1 1379 . 38 1 1 A 119 119 PHE CB C 118 39.246 39.549 -0.303 1
1 1385 . 38 1 1 A 119 119 PHE N N 118 126.688 124.965 1.723 1
1 1386 . 38 1 1 A 120 120 LEU H H 119 8.099 8.298 -0.199 1
1 1387 . 38 1 1 A 120 120 LEU HA H 119 3.842 3.924 -0.082 1
1 1397 . 38 1 1 A 120 120 LEU C C 119 179.601 179.346 0.255 1
1 1398 . 38 1 1 A 120 120 LEU CA C 119 58.174 57.888 0.286 1
1 1399 . 38 1 1 A 120 120 LEU CB C 119 40.315 41.505 -1.190 1
1 1403 . 38 1 1 A 120 120 LEU N N 119 117.930 119.812 -1.882 1
1 1404 . 38 1 1 A 121 121 ALA H H 120 7.729 7.645 0.084 1
1 1405 . 38 1 1 A 121 121 ALA HA H 120 3.996 4.134 -0.138 1
1 1409 . 38 1 1 A 121 121 ALA C C 120 180.995 179.610 1.385 1
1 1410 . 38 1 1 A 121 121 ALA CA C 120 54.832 54.640 0.192 1
1 1411 . 38 1 1 A 121 121 ALA CB C 120 17.706 18.292 -0.586 1
1 1412 . 38 1 1 A 121 121 ALA N N 120 123.195 120.872 2.323 1
1 1413 . 38 1 1 A 122 122 PHE H H 121 7.943 7.814 0.129 1
1 1414 . 38 1 1 A 122 122 PHE HA H 121 3.887 3.912 -0.025 1
1 1419 . 38 1 1 A 122 122 PHE C C 121 175.410 177.089 -1.679 1
1 1420 . 38 1 1 A 122 122 PHE CA C 121 61.075 60.762 0.313 1
1 1421 . 38 1 1 A 122 122 PHE CB C 121 38.115 38.837 -0.722 1
1 1424 . 38 1 1 A 122 122 PHE N N 121 121.798 120.185 1.613 1
1 1425 . 38 1 1 A 123 123 LYS H H 122 8.468 7.913 0.555 1
1 1426 . 38 1 1 A 123 123 LYS HA H 122 3.077 3.936 -0.859 1
1 1435 . 38 1 1 A 123 123 LYS C C 122 178.453 178.875 -0.422 1
1 1436 . 38 1 1 A 123 123 LYS CA C 122 59.855 59.999 -0.144 1
1 1437 . 38 1 1 A 123 123 LYS CB C 122 32.374 32.081 0.293 1
1 1441 . 38 1 1 A 123 123 LYS N N 122 120.614 118.445 2.169 1
1 1442 . 38 1 1 A 124 124 GLU H H 123 8.100 7.766 0.334 1
1 1443 . 38 1 1 A 124 124 GLU HA H 123 3.652 4.068 -0.416 1
1 1448 . 38 1 1 A 124 124 GLU C C 123 177.743 178.569 -0.826 1
1 1449 . 38 1 1 A 124 124 GLU CA C 123 59.406 59.449 -0.043 1
1 1450 . 38 1 1 A 124 124 GLU CB C 123 28.811 29.221 -0.410 1
1 1452 . 38 1 1 A 124 124 GLU N N 123 117.404 118.964 -1.560 1
1 1453 . 38 1 1 A 125 125 MET H H 124 7.537 7.521 0.016 1
1 1454 . 38 1 1 A 125 125 MET HA H 124 3.860 3.939 -0.079 1
1 1462 . 38 1 1 A 125 125 MET C C 124 179.522 178.322 1.200 1
1 1463 . 38 1 1 A 125 125 MET CA C 124 58.832 58.450 0.382 1
1 1464 . 38 1 1 A 125 125 MET CB C 124 31.765 31.584 0.181 1
1 1467 . 38 1 1 A 125 125 MET N N 124 119.413 118.962 0.451 1
1 1468 . 38 1 1 A 126 126 PHE H H 125 7.148 7.513 -0.365 1
1 1469 . 38 1 1 A 126 126 PHE HA H 125 3.633 4.231 -0.598 1
1 1476 . 38 1 1 A 126 126 PHE C C 125 178.994 178.191 0.803 1
1 1477 . 38 1 1 A 126 126 PHE CA C 125 63.148 60.894 2.254 1
1 1478 . 38 1 1 A 126 126 PHE CB C 125 39.830 38.400 1.430 1
1 1483 . 38 1 1 A 126 126 PHE N N 125 120.013 118.889 1.124 1
1 1484 . 38 1 1 A 127 127 LEU H H 126 8.369 8.244 0.125 1
1 1485 . 38 1 1 A 127 127 LEU HA H 126 3.972 3.998 -0.026 1
1 1495 . 38 1 1 A 127 127 LEU C C 126 180.621 179.034 1.587 1
1 1496 . 38 1 1 A 127 127 LEU CA C 126 57.944 57.876 0.068 1
1 1497 . 38 1 1 A 127 127 LEU CB C 126 40.543 41.036 -0.493 1
1 1501 . 38 1 1 A 127 127 LEU N N 126 119.692 119.535 0.157 1
1 1502 . 38 1 1 A 128 128 ASP H H 127 8.578 8.097 0.481 1
1 1503 . 38 1 1 A 128 128 ASP HA H 127 4.308 4.343 -0.035 1
1 1506 . 38 1 1 A 128 128 ASP C C 127 178.254 178.068 0.186 1
1 1507 . 38 1 1 A 128 128 ASP CA C 127 56.964 57.139 -0.175 1
1 1508 . 38 1 1 A 128 128 ASP CB C 127 39.735 40.665 -0.930 1
1 1509 . 38 1 1 A 128 128 ASP N N 127 121.926 119.488 2.438 1
1 1510 . 38 1 1 A 129 129 TYR H H 128 7.710 8.167 -0.457 1
1 1511 . 38 1 1 A 129 129 TYR HA H 128 3.908 4.009 -0.101 1
1 1518 . 38 1 1 A 129 129 TYR C C 128 177.633 177.545 0.088 1
1 1519 . 38 1 1 A 129 129 TYR CA C 128 61.796 61.222 0.574 1
1 1520 . 38 1 1 A 129 129 TYR CB C 128 39.372 38.630 0.742 1
1 1525 . 38 1 1 A 129 129 TYR N N 128 122.548 120.376 2.172 1
1 1526 . 38 1 1 A 130 130 ARG H H 129 8.622 8.424 0.198 1
1 1527 . 38 1 1 A 130 130 ARG HA H 129 3.722 3.857 -0.135 1
1 1535 . 38 1 1 A 130 130 ARG CA C 129 60.084 59.422 0.662 1
1 1536 . 38 1 1 A 130 130 ARG CB C 129 29.902 30.093 -0.191 1
1 1539 . 38 1 1 A 130 130 ARG N N 129 118.302 119.438 -1.136 1
1 1541 . 38 1 1 A 131 131 ALA H H 130 7.936 7.986 -0.050 1
1 1542 . 38 1 1 A 131 131 ALA HA H 130 3.997 4.046 -0.049 1
1 1546 . 38 1 1 A 131 131 ALA C C 130 180.456 179.465 0.991 1
1 1547 . 38 1 1 A 131 131 ALA CA C 130 55.133 54.762 0.371 1
1 1548 . 38 1 1 A 131 131 ALA CB C 130 17.750 18.459 -0.709 1
1 1549 . 38 1 1 A 131 131 ALA N N 130 119.788 121.701 -1.913 1
1 1550 . 38 1 1 A 132 132 GLU H H 131 7.622 7.530 0.092 1
1 1551 . 38 1 1 A 132 132 GLU HA H 131 3.862 4.010 -0.148 1
1 1556 . 38 1 1 A 132 132 GLU C C 131 179.528 179.080 0.448 1
1 1557 . 38 1 1 A 132 132 GLU CA C 131 58.849 58.646 0.203 1
1 1558 . 38 1 1 A 132 132 GLU CB C 131 28.930 28.918 0.012 1
1 1560 . 38 1 1 A 132 132 GLU N N 131 118.428 118.789 -0.361 1
1 1561 . 38 1 1 A 133 133 LYS H H 132 7.853 7.440 0.413 1
1 1562 . 38 1 1 A 133 133 LYS HA H 132 3.722 3.968 -0.246 1
1 1571 . 38 1 1 A 133 133 LYS C C 132 175.725 178.710 -2.985 1
1 1572 . 38 1 1 A 133 133 LYS CA C 132 57.544 59.349 -1.805 1
1 1573 . 38 1 1 A 133 133 LYS CB C 132 31.770 31.851 -0.081 1
1 1577 . 38 1 1 A 133 133 LYS N N 132 119.473 118.873 0.600 1
1 1578 . 38 1 1 A 134 134 GLU H H 133 8.151 7.803 0.348 1
1 1579 . 38 1 1 A 134 134 GLU HA H 133 4.161 4.140 0.021 1
1 1584 . 38 1 1 A 134 134 GLU C C 133 177.453 178.499 -1.046 1
1 1585 . 38 1 1 A 134 134 GLU CA C 133 57.222 57.561 -0.339 1
1 1586 . 38 1 1 A 134 134 GLU CB C 133 30.091 29.418 0.673 1
1 1588 . 38 1 1 A 134 134 GLU N N 133 116.525 118.354 -1.829 1
1 1589 . 38 1 1 A 135 135 GLY H H 134 7.702 8.113 -0.411 1
1 1590 . 38 1 1 A 135 135 GLY HA2 H 134 3.896 3.745 0.151 1
1 1591 . 38 1 1 A 135 135 GLY HA3 H 134 3.897 3.755 0.142 1
1 1592 . 38 1 1 A 135 135 GLY C C 134 174.538 174.475 0.063 1
1 1593 . 38 1 1 A 135 135 GLY CA C 134 45.975 47.132 -1.157 1
1 1594 . 38 1 1 A 135 135 GLY N N 134 107.924 109.744 -1.820 1
1 1595 . 38 1 1 A 136 136 ARG H H 135 8.045 8.285 -0.240 1
1 1596 . 38 1 1 A 136 136 ARG HA H 135 4.323 4.182 0.141 1
1 1604 . 38 1 1 A 136 136 ARG C C 135 175.864 175.729 0.135 1
1 1605 . 38 1 1 A 136 136 ARG CA C 135 56.016 57.881 -1.865 1
1 1606 . 38 1 1 A 136 136 ARG CB C 135 30.987 30.336 0.651 1
1 1609 . 38 1 1 A 136 136 ARG N N 135 119.708 119.727 -0.019 1
1 1 . 39 1 1 A 14 14 PHE CA C 13 58.199 57.670 0.529 1
1 2 . 39 1 1 A 14 14 PHE CB C 13 39.717 39.459 0.258 1
1 3 . 39 1 1 A 15 15 SER H H 14 8.299 8.285 0.014 1
1 4 . 39 1 1 A 15 15 SER HA H 14 4.359 4.307 0.052 1
1 7 . 39 1 1 A 15 15 SER CA C 14 58.249 60.179 -1.930 1
1 8 . 39 1 1 A 15 15 SER CB C 14 63.936 61.467 2.469 1
1 9 . 39 1 1 A 15 15 SER N N 14 117.379 112.383 4.996 1
1 10 . 39 1 1 A 16 16 SER H H 15 8.255 8.309 -0.054 1
1 11 . 39 1 1 A 16 16 SER HA H 15 3.729 4.734 -1.005 1
1 14 . 39 1 1 A 16 16 SER CA C 15 58.224 59.076 -0.852 1
1 15 . 39 1 1 A 16 16 SER CB C 15 63.886 65.706 -1.820 1
1 16 . 39 1 1 A 16 16 SER N N 15 117.694 114.174 3.520 1
1 17 . 39 1 1 A 17 17 ALA H H 16 8.333 8.351 -0.018 1
1 18 . 39 1 1 A 17 17 ALA HA H 16 4.252 4.251 0.001 1
1 22 . 39 1 1 A 17 17 ALA CA C 16 53.377 54.932 -1.555 1
1 23 . 39 1 1 A 17 17 ALA CB C 16 18.896 18.776 0.120 1
1 24 . 39 1 1 A 17 17 ALA N N 16 125.462 124.293 1.169 1
1 25 . 39 1 1 A 18 18 SER H H 17 8.219 7.878 0.341 1
1 26 . 39 1 1 A 18 18 SER HA H 17 4.332 4.495 -0.163 1
1 29 . 39 1 1 A 18 18 SER CA C 17 59.105 58.261 0.844 1
1 30 . 39 1 1 A 18 18 SER CB C 17 63.592 63.452 0.140 1
1 31 . 39 1 1 A 18 18 SER N N 17 114.821 108.731 6.090 1
1 32 . 39 1 1 A 19 19 ASP H H 18 8.309 7.710 0.599 1
1 33 . 39 1 1 A 19 19 ASP HA H 18 4.554 5.115 -0.561 1
1 36 . 39 1 1 A 19 19 ASP C C 18 176.528 176.499 0.029 1
1 37 . 39 1 1 A 19 19 ASP CA C 18 55.272 52.481 2.791 1
1 38 . 39 1 1 A 19 19 ASP CB C 18 40.883 43.774 -2.891 1
1 39 . 39 1 1 A 19 19 ASP N N 18 123.367 120.238 3.129 1
1 40 . 39 1 1 A 20 20 ALA H H 19 8.133 8.658 -0.525 1
1 41 . 39 1 1 A 20 20 ALA HA H 19 4.170 4.096 0.074 1
1 45 . 39 1 1 A 20 20 ALA C C 19 179.857 179.473 0.384 1
1 46 . 39 1 1 A 20 20 ALA CA C 19 54.341 55.085 -0.744 1
1 47 . 39 1 1 A 20 20 ALA CB C 19 18.660 18.331 0.329 1
1 48 . 39 1 1 A 20 20 ALA N N 19 123.350 120.937 2.413 1
1 49 . 39 1 1 A 21 21 GLU H H 20 8.140 8.201 -0.061 1
1 50 . 39 1 1 A 21 21 GLU HA H 20 4.128 4.083 0.045 1
1 55 . 39 1 1 A 21 21 GLU C C 20 177.675 178.558 -0.883 1
1 56 . 39 1 1 A 21 21 GLU CA C 20 58.520 59.447 -0.927 1
1 57 . 39 1 1 A 21 21 GLU CB C 20 29.765 29.542 0.223 1
1 59 . 39 1 1 A 21 21 GLU N N 20 119.063 119.437 -0.374 1
1 60 . 39 1 1 A 22 22 PHE H H 21 8.009 7.847 0.162 1
1 61 . 39 1 1 A 22 22 PHE HA H 21 4.123 4.337 -0.214 1
1 68 . 39 1 1 A 22 22 PHE C C 21 176.410 177.198 -0.788 1
1 69 . 39 1 1 A 22 22 PHE CA C 21 62.202 61.070 1.132 1
1 70 . 39 1 1 A 22 22 PHE CB C 21 39.223 38.968 0.255 1
1 75 . 39 1 1 A 22 22 PHE N N 21 121.211 120.983 0.228 1
1 76 . 39 1 1 A 23 23 ASP H H 22 8.261 8.563 -0.302 1
1 77 . 39 1 1 A 23 23 ASP HA H 22 4.041 4.421 -0.380 1
1 80 . 39 1 1 A 23 23 ASP C C 22 179.078 178.646 0.432 1
1 81 . 39 1 1 A 23 23 ASP CA C 22 57.048 57.398 -0.350 1
1 82 . 39 1 1 A 23 23 ASP CB C 22 40.154 40.041 0.113 1
1 83 . 39 1 1 A 23 23 ASP N N 22 116.876 118.287 -1.411 1
1 84 . 39 1 1 A 24 24 ALA H H 23 7.651 7.749 -0.098 1
1 85 . 39 1 1 A 24 24 ALA HA H 23 3.785 3.999 -0.214 1
1 89 . 39 1 1 A 24 24 ALA C C 23 179.577 179.544 0.033 1
1 90 . 39 1 1 A 24 24 ALA CA C 23 54.341 55.076 -0.735 1
1 91 . 39 1 1 A 24 24 ALA CB C 23 17.762 18.516 -0.754 1
1 92 . 39 1 1 A 24 24 ALA N N 23 121.873 122.504 -0.631 1
1 93 . 39 1 1 A 25 25 VAL H H 24 7.718 7.815 -0.097 1
1 94 . 39 1 1 A 25 25 VAL HA H 24 3.216 3.591 -0.375 1
1 102 . 39 1 1 A 25 25 VAL C C 24 177.805 178.211 -0.406 1
1 103 . 39 1 1 A 25 25 VAL CA C 24 66.789 66.811 -0.022 1
1 104 . 39 1 1 A 25 25 VAL CB C 24 31.277 31.024 0.253 1
1 107 . 39 1 1 A 25 25 VAL N N 24 117.890 117.907 -0.017 1
1 108 . 39 1 1 A 26 26 VAL H H 25 7.867 7.834 0.033 1
1 109 . 39 1 1 A 26 26 VAL HA H 25 3.274 3.521 -0.247 1
1 117 . 39 1 1 A 26 26 VAL C C 25 177.788 177.873 -0.085 1
1 118 . 39 1 1 A 26 26 VAL CA C 25 67.282 66.395 0.887 1
1 119 . 39 1 1 A 26 26 VAL CB C 25 31.266 31.486 -0.220 1
1 122 . 39 1 1 A 26 26 VAL N N 25 118.170 119.919 -1.749 1
1 123 . 39 1 1 A 27 27 GLY H H 26 7.544 7.637 -0.093 1
1 124 . 39 1 1 A 27 27 GLY HA2 H 26 3.592 3.489 0.103 1
1 125 . 39 1 1 A 27 27 GLY HA3 H 26 3.721 3.621 0.100 1
1 126 . 39 1 1 A 27 27 GLY C C 26 176.717 176.397 0.320 1
1 127 . 39 1 1 A 27 27 GLY CA C 26 47.085 47.186 -0.101 1
1 128 . 39 1 1 A 27 27 GLY N N 26 105.795 107.636 -1.841 1
1 129 . 39 1 1 A 28 28 TYR H H 27 7.625 7.394 0.231 1
1 130 . 39 1 1 A 28 28 TYR HA H 27 4.546 4.566 -0.020 1
1 137 . 39 1 1 A 28 28 TYR C C 27 178.991 178.408 0.583 1
1 138 . 39 1 1 A 28 28 TYR CA C 27 58.845 59.896 -1.051 1
1 139 . 39 1 1 A 28 28 TYR CB C 27 37.602 37.367 0.235 1
1 144 . 39 1 1 A 28 28 TYR N N 27 119.933 121.705 -1.772 1
1 145 . 39 1 1 A 29 29 LEU H H 28 8.517 8.101 0.416 1
1 146 . 39 1 1 A 29 29 LEU HA H 28 3.728 3.828 -0.100 1
1 156 . 39 1 1 A 29 29 LEU CA C 28 58.281 58.047 0.234 1
1 157 . 39 1 1 A 29 29 LEU CB C 28 41.948 41.484 0.464 1
1 161 . 39 1 1 A 29 29 LEU N N 28 119.669 120.867 -1.198 1
1 162 . 39 1 1 A 30 30 GLU H H 29 8.072 8.045 0.027 1
1 163 . 39 1 1 A 30 30 GLU HA H 29 3.722 3.858 -0.136 1
1 168 . 39 1 1 A 30 30 GLU C C 29 177.731 179.040 -1.309 1
1 169 . 39 1 1 A 30 30 GLU CA C 29 59.763 59.964 -0.201 1
1 170 . 39 1 1 A 30 30 GLU CB C 29 28.844 29.287 -0.443 1
1 172 . 39 1 1 A 30 30 GLU N N 29 117.666 117.657 0.009 1
1 173 . 39 1 1 A 31 31 ASP H H 30 7.243 8.063 -0.820 1
1 174 . 39 1 1 A 31 31 ASP HA H 30 4.297 4.378 -0.081 1
1 177 . 39 1 1 A 31 31 ASP CA C 30 56.953 57.315 -0.362 1
1 178 . 39 1 1 A 31 31 ASP CB C 30 40.730 42.268 -1.538 1
1 179 . 39 1 1 A 31 31 ASP N N 30 116.720 119.016 -2.296 1
1 180 . 39 1 1 A 32 32 ILE H H 31 7.940 7.275 0.665 1
1 181 . 39 1 1 A 32 32 ILE HA H 31 3.640 3.749 -0.109 1
1 191 . 39 1 1 A 32 32 ILE C C 31 177.980 178.004 -0.024 1
1 192 . 39 1 1 A 32 32 ILE CA C 31 64.692 63.998 0.694 1
1 193 . 39 1 1 A 32 32 ILE CB C 31 38.938 37.663 1.275 1
1 197 . 39 1 1 A 32 32 ILE N N 31 119.728 117.600 2.128 1
1 198 . 39 1 1 A 33 33 ILE H H 32 7.984 7.858 0.126 1
1 199 . 39 1 1 A 33 33 ILE HA H 32 3.598 3.409 0.189 1
1 209 . 39 1 1 A 33 33 ILE C C 32 176.723 176.912 -0.189 1
1 210 . 39 1 1 A 33 33 ILE CA C 32 63.241 64.695 -1.454 1
1 211 . 39 1 1 A 33 33 ILE CB C 32 37.580 37.790 -0.210 1
1 215 . 39 1 1 A 33 33 ILE N N 32 113.919 120.408 -6.489 1
1 216 . 39 1 1 A 34 34 MET H H 33 7.288 7.632 -0.344 1
1 217 . 39 1 1 A 34 34 MET HA H 33 4.496 4.674 -0.178 1
1 225 . 39 1 1 A 34 34 MET C C 33 176.423 175.736 0.687 1
1 226 . 39 1 1 A 34 34 MET CA C 33 54.634 54.111 0.523 1
1 227 . 39 1 1 A 34 34 MET CB C 33 31.934 32.402 -0.468 1
1 230 . 39 1 1 A 34 34 MET N N 33 115.130 116.979 -1.849 1
1 231 . 39 1 1 A 35 35 ASP H H 34 7.405 7.855 -0.450 1
1 232 . 39 1 1 A 35 35 ASP HA H 34 4.484 4.574 -0.090 1
1 235 . 39 1 1 A 35 35 ASP C C 34 177.139 176.940 0.199 1
1 236 . 39 1 1 A 35 35 ASP CA C 34 54.625 54.441 0.184 1
1 237 . 39 1 1 A 35 35 ASP CB C 34 43.554 42.550 1.004 1
1 238 . 39 1 1 A 35 35 ASP N N 34 121.814 122.399 -0.585 1
1 239 . 39 1 1 A 36 36 ASP H H 35 8.765 8.795 -0.030 1
1 240 . 39 1 1 A 36 36 ASP HA H 35 4.235 4.326 -0.091 1
1 243 . 39 1 1 A 36 36 ASP C C 35 178.320 178.432 -0.112 1
1 244 . 39 1 1 A 36 36 ASP CA C 35 57.832 57.913 -0.081 1
1 245 . 39 1 1 A 36 36 ASP CB C 35 40.914 40.447 0.467 1
1 246 . 39 1 1 A 36 36 ASP N N 35 125.883 125.350 0.533 1
1 247 . 39 1 1 A 37 37 GLU H H 36 8.905 8.027 0.878 1
1 248 . 39 1 1 A 37 37 GLU HA H 36 3.933 4.129 -0.196 1
1 253 . 39 1 1 A 37 37 GLU C C 36 179.304 179.063 0.241 1
1 254 . 39 1 1 A 37 37 GLU CA C 36 59.828 59.226 0.602 1
1 255 . 39 1 1 A 37 37 GLU CB C 36 29.380 29.247 0.133 1
1 257 . 39 1 1 A 37 37 GLU N N 36 119.077 119.833 -0.756 1
1 258 . 39 1 1 A 38 38 PHE H H 37 7.460 8.163 -0.703 1
1 259 . 39 1 1 A 38 38 PHE HA H 37 3.642 4.073 -0.431 1
1 267 . 39 1 1 A 38 38 PHE C C 37 176.483 177.865 -1.382 1
1 268 . 39 1 1 A 38 38 PHE CA C 37 61.411 61.256 0.155 1
1 269 . 39 1 1 A 38 38 PHE CB C 37 39.355 39.043 0.312 1
1 275 . 39 1 1 A 38 38 PHE N N 37 119.968 120.772 -0.804 1
1 276 . 39 1 1 A 39 39 GLN H H 38 7.968 8.144 -0.176 1
1 277 . 39 1 1 A 39 39 GLN HA H 38 3.712 3.896 -0.184 1
1 284 . 39 1 1 A 39 39 GLN CA C 38 59.153 58.670 0.483 1
1 285 . 39 1 1 A 39 39 GLN CB C 38 28.213 28.436 -0.223 1
1 287 . 39 1 1 A 39 39 GLN N N 38 116.433 118.519 -2.086 1
1 289 . 39 1 1 A 40 40 LEU H H 39 7.930 7.663 0.267 1
1 290 . 39 1 1 A 40 40 LEU HA H 39 3.916 4.015 -0.099 1
1 300 . 39 1 1 A 40 40 LEU C C 39 177.731 178.056 -0.325 1
1 301 . 39 1 1 A 40 40 LEU CA C 39 57.915 57.999 -0.084 1
1 302 . 39 1 1 A 40 40 LEU CB C 39 41.989 41.725 0.264 1
1 306 . 39 1 1 A 40 40 LEU N N 39 119.505 121.430 -1.925 1
1 307 . 39 1 1 A 41 41 LEU H H 40 7.174 7.911 -0.737 1
1 308 . 39 1 1 A 41 41 LEU HA H 40 3.835 4.047 -0.212 1
1 318 . 39 1 1 A 41 41 LEU C C 40 179.738 178.309 1.429 1
1 319 . 39 1 1 A 41 41 LEU CA C 40 58.266 58.183 0.083 1
1 320 . 39 1 1 A 41 41 LEU CB C 40 42.050 41.550 0.500 1
1 324 . 39 1 1 A 41 41 LEU N N 40 120.971 119.699 1.272 1
1 325 . 39 1 1 A 42 42 GLN H H 41 8.058 7.897 0.161 1
1 326 . 39 1 1 A 42 42 GLN HA H 41 3.556 3.683 -0.127 1
1 333 . 39 1 1 A 42 42 GLN C C 41 177.642 178.185 -0.543 1
1 334 . 39 1 1 A 42 42 GLN CA C 41 59.826 59.159 0.667 1
1 335 . 39 1 1 A 42 42 GLN CB C 41 28.762 28.292 0.470 1
1 337 . 39 1 1 A 42 42 GLN N N 41 117.899 117.900 -0.001 1
1 339 . 39 1 1 A 43 43 ARG H H 42 8.179 7.799 0.380 1
1 340 . 39 1 1 A 43 43 ARG HA H 42 3.655 3.993 -0.338 1
1 347 . 39 1 1 A 43 43 ARG C C 42 178.051 178.688 -0.637 1
1 348 . 39 1 1 A 43 43 ARG CA C 42 59.766 59.234 0.532 1
1 349 . 39 1 1 A 43 43 ARG CB C 42 29.941 29.824 0.117 1
1 352 . 39 1 1 A 43 43 ARG N N 42 119.392 118.476 0.916 1
1 353 . 39 1 1 A 44 44 ASN H H 43 8.525 8.173 0.352 1
1 354 . 39 1 1 A 44 44 ASN HA H 43 4.332 4.465 -0.133 1
1 359 . 39 1 1 A 44 44 ASN C C 43 178.150 177.759 0.391 1
1 360 . 39 1 1 A 44 44 ASN CA C 43 55.841 56.160 -0.319 1
1 361 . 39 1 1 A 44 44 ASN CB C 43 37.632 39.423 -1.791 1
1 362 . 39 1 1 A 44 44 ASN N N 43 116.214 117.849 -1.635 1
1 364 . 39 1 1 A 45 45 PHE H H 44 7.586 8.003 -0.417 1
1 365 . 39 1 1 A 45 45 PHE HA H 44 4.132 4.284 -0.152 1
1 372 . 39 1 1 A 45 45 PHE C C 44 176.691 178.539 -1.848 1
1 373 . 39 1 1 A 45 45 PHE CA C 44 62.333 60.659 1.674 1
1 374 . 39 1 1 A 45 45 PHE CB C 44 39.449 38.567 0.882 1
1 379 . 39 1 1 A 45 45 PHE N N 44 121.501 117.946 3.555 1
1 380 . 39 1 1 A 46 46 MET H H 45 8.190 8.254 -0.064 1
1 381 . 39 1 1 A 46 46 MET HA H 45 4.060 4.230 -0.170 1
1 389 . 39 1 1 A 46 46 MET C C 45 179.754 178.586 1.168 1
1 390 . 39 1 1 A 46 46 MET CA C 45 57.742 57.977 -0.235 1
1 391 . 39 1 1 A 46 46 MET CB C 45 29.912 31.218 -1.306 1
1 394 . 39 1 1 A 46 46 MET N N 45 116.727 117.561 -0.834 1
1 395 . 39 1 1 A 47 47 ASP H H 46 8.579 8.109 0.470 1
1 396 . 39 1 1 A 47 47 ASP HA H 46 4.804 4.534 0.270 1
1 399 . 39 1 1 A 47 47 ASP C C 46 177.854 178.204 -0.350 1
1 400 . 39 1 1 A 47 47 ASP CA C 46 57.277 57.379 -0.102 1
1 401 . 39 1 1 A 47 47 ASP CB C 46 40.776 40.498 0.278 1
1 402 . 39 1 1 A 47 47 ASP N N 46 117.798 119.547 -1.749 1
1 403 . 39 1 1 A 48 48 LYS H H 47 7.339 7.959 -0.620 1
1 404 . 39 1 1 A 48 48 LYS HA H 47 3.828 4.271 -0.443 1
1 413 . 39 1 1 A 48 48 LYS C C 47 178.812 178.875 -0.063 1
1 414 . 39 1 1 A 48 48 LYS CA C 47 58.953 58.344 0.609 1
1 415 . 39 1 1 A 48 48 LYS CB C 47 32.796 32.950 -0.154 1
1 419 . 39 1 1 A 48 48 LYS N N 47 117.852 120.017 -2.165 1
1 420 . 39 1 1 A 49 49 TYR H H 48 6.841 8.425 -1.584 1
1 421 . 39 1 1 A 49 49 TYR HA H 48 4.995 4.195 0.800 1
1 428 . 39 1 1 A 49 49 TYR C C 48 178.138 178.635 -0.497 1
1 429 . 39 1 1 A 49 49 TYR CA C 48 58.620 60.107 -1.487 1
1 430 . 39 1 1 A 49 49 TYR CB C 48 42.939 38.217 4.722 1
1 435 . 39 1 1 A 49 49 TYR N N 48 112.109 119.959 -7.850 1
1 436 . 39 1 1 A 50 50 TYR H H 49 8.491 8.218 0.273 1
1 437 . 39 1 1 A 50 50 TYR HA H 49 4.598 4.119 0.479 1
1 444 . 39 1 1 A 50 50 TYR C C 49 176.015 177.757 -1.742 1
1 445 . 39 1 1 A 50 50 TYR CA C 49 62.442 59.522 2.920 1
1 446 . 39 1 1 A 50 50 TYR CB C 49 36.588 36.831 -0.243 1
1 451 . 39 1 1 A 50 50 TYR N N 49 118.294 119.158 -0.864 1
1 452 . 39 1 1 A 51 51 LEU H H 50 7.512 7.393 0.119 1
1 453 . 39 1 1 A 51 51 LEU HA H 50 3.878 3.556 0.322 1
1 463 . 39 1 1 A 51 51 LEU C C 50 178.625 178.655 -0.030 1
1 464 . 39 1 1 A 51 51 LEU CA C 50 55.994 57.238 -1.244 1
1 465 . 39 1 1 A 51 51 LEU CB C 50 40.743 41.518 -0.775 1
1 469 . 39 1 1 A 51 51 LEU N N 50 118.478 121.883 -3.405 1
1 470 . 39 1 1 A 52 52 GLU H H 51 8.042 7.772 0.270 1
1 471 . 39 1 1 A 52 52 GLU HA H 51 4.197 3.959 0.238 1
1 476 . 39 1 1 A 52 52 GLU C C 51 177.629 177.764 -0.135 1
1 477 . 39 1 1 A 52 52 GLU CA C 51 56.141 59.479 -3.338 1
1 478 . 39 1 1 A 52 52 GLU CB C 51 29.162 29.125 0.037 1
1 480 . 39 1 1 A 52 52 GLU N N 51 115.067 117.717 -2.650 1
1 481 . 39 1 1 A 53 53 PHE H H 52 7.465 7.897 -0.432 1
1 482 . 39 1 1 A 53 53 PHE HA H 52 4.431 4.649 -0.218 1
1 490 . 39 1 1 A 53 53 PHE C C 52 174.325 175.089 -0.764 1
1 491 . 39 1 1 A 53 53 PHE CA C 52 58.986 57.051 1.935 1
1 492 . 39 1 1 A 53 53 PHE CB C 52 40.183 37.530 2.653 1
1 498 . 39 1 1 A 53 53 PHE N N 52 116.768 118.656 -1.888 1
1 499 . 39 1 1 A 54 54 GLU H H 53 7.484 8.560 -1.076 1
1 500 . 39 1 1 A 54 54 GLU HA H 53 4.583 4.692 -0.109 1
1 505 . 39 1 1 A 54 54 GLU C C 53 175.722 175.777 -0.055 1
1 506 . 39 1 1 A 54 54 GLU CA C 53 54.248 55.845 -1.597 1
1 507 . 39 1 1 A 54 54 GLU CB C 53 34.409 30.953 3.456 1
1 509 . 39 1 1 A 54 54 GLU N N 53 118.844 125.460 -6.616 1
1 510 . 39 1 1 A 55 55 ASP H H 54 9.008 8.572 0.436 1
1 511 . 39 1 1 A 55 55 ASP HA H 54 4.735 4.809 -0.074 1
1 514 . 39 1 1 A 55 55 ASP C C 54 175.421 176.043 -0.622 1
1 515 . 39 1 1 A 55 55 ASP CA C 54 52.888 53.828 -0.940 1
1 516 . 39 1 1 A 55 55 ASP CB C 54 38.894 40.262 -1.368 1
1 517 . 39 1 1 A 55 55 ASP N N 54 123.654 125.516 -1.862 1
1 518 . 39 1 1 A 56 56 THR H H 55 7.819 8.032 -0.213 1
1 519 . 39 1 1 A 56 56 THR HA H 55 4.574 4.896 -0.322 1
1 524 . 39 1 1 A 56 56 THR C C 55 174.096 174.158 -0.062 1
1 525 . 39 1 1 A 56 56 THR CA C 55 59.172 60.228 -1.056 1
1 526 . 39 1 1 A 56 56 THR CB C 55 71.889 71.870 0.019 1
1 528 . 39 1 1 A 56 56 THR N N 55 112.015 115.359 -3.344 1
1 529 . 39 1 1 A 57 57 GLU H H 56 8.527 8.705 -0.178 1
1 530 . 39 1 1 A 57 57 GLU HA H 56 4.217 4.657 -0.440 1
1 535 . 39 1 1 A 57 57 GLU C C 56 177.042 176.403 0.639 1
1 536 . 39 1 1 A 57 57 GLU CA C 56 56.869 56.590 0.279 1
1 537 . 39 1 1 A 57 57 GLU CB C 56 29.731 31.398 -1.667 1
1 539 . 39 1 1 A 57 57 GLU N N 56 117.531 118.158 -0.627 1
1 540 . 39 1 1 A 58 58 GLU H H 57 7.587 7.753 -0.166 1
1 541 . 39 1 1 A 58 58 GLU HA H 57 3.941 4.632 -0.691 1
1 546 . 39 1 1 A 58 58 GLU C C 57 176.849 176.326 0.523 1
1 547 . 39 1 1 A 58 58 GLU CA C 57 56.924 56.023 0.901 1
1 548 . 39 1 1 A 58 58 GLU CB C 57 30.251 30.772 -0.521 1
1 550 . 39 1 1 A 58 58 GLU N N 57 119.183 120.963 -1.780 1
1 551 . 39 1 1 A 59 59 ASN H H 58 9.120 8.726 0.394 1
1 552 . 39 1 1 A 59 59 ASN HA H 58 4.922 5.261 -0.339 1
1 557 . 39 1 1 A 59 59 ASN C C 58 174.254 174.860 -0.606 1
1 558 . 39 1 1 A 59 59 ASN CA C 58 51.956 53.168 -1.212 1
1 559 . 39 1 1 A 59 59 ASN CB C 58 37.404 40.218 -2.814 1
1 560 . 39 1 1 A 59 59 ASN N N 58 126.767 123.709 3.058 1
1 562 . 39 1 1 A 60 60 LYS H H 59 5.892 8.890 -2.998 1
1 563 . 39 1 1 A 60 60 LYS HA H 59 3.798 4.962 -1.164 1
1 572 . 39 1 1 A 60 60 LYS C C 59 177.908 176.940 0.968 1
1 573 . 39 1 1 A 60 60 LYS CA C 59 56.623 54.676 1.947 1
1 574 . 39 1 1 A 60 60 LYS CB C 59 32.279 35.712 -3.433 1
1 578 . 39 1 1 A 60 60 LYS N N 59 121.527 120.106 1.421 1
1 579 . 39 1 1 A 61 61 LEU H H 60 8.473 8.878 -0.405 1
1 580 . 39 1 1 A 61 61 LEU HA H 60 3.891 4.182 -0.291 1
1 590 . 39 1 1 A 61 61 LEU C C 60 179.843 178.755 1.088 1
1 591 . 39 1 1 A 61 61 LEU CA C 60 58.301 56.765 1.536 1
1 592 . 39 1 1 A 61 61 LEU CB C 60 41.305 41.799 -0.494 1
1 596 . 39 1 1 A 61 61 LEU N N 60 125.639 123.236 2.403 1
1 597 . 39 1 1 A 62 62 ILE H H 61 7.698 7.864 -0.166 1
1 598 . 39 1 1 A 62 62 ILE HA H 61 3.952 3.850 0.102 1
1 608 . 39 1 1 A 62 62 ILE C C 61 175.392 177.162 -1.770 1
1 609 . 39 1 1 A 62 62 ILE CA C 61 61.743 63.462 -1.719 1
1 610 . 39 1 1 A 62 62 ILE CB C 61 39.108 37.695 1.413 1
1 614 . 39 1 1 A 62 62 ILE N N 61 114.111 119.337 -5.226 1
1 615 . 39 1 1 A 63 63 TYR H H 62 7.273 7.762 -0.489 1
1 616 . 39 1 1 A 63 63 TYR HA H 62 4.343 4.324 0.019 1
1 623 . 39 1 1 A 63 63 TYR C C 62 178.264 178.652 -0.388 1
1 624 . 39 1 1 A 63 63 TYR CA C 62 57.231 61.170 -3.939 1
1 625 . 39 1 1 A 63 63 TYR CB C 62 36.332 37.439 -1.107 1
1 630 . 39 1 1 A 63 63 TYR N N 62 117.689 121.312 -3.623 1
1 631 . 39 1 1 A 64 64 THR H H 63 7.747 8.143 -0.396 1
1 632 . 39 1 1 A 64 64 THR HA H 63 4.266 4.231 0.035 1
1 637 . 39 1 1 A 64 64 THR CA C 63 69.362 67.566 1.796 1
1 638 . 39 1 1 A 64 64 THR CB C 63 66.962 67.743 -0.781 1
1 640 . 39 1 1 A 64 64 THR N N 63 113.755 116.299 -2.544 1
1 641 . 39 1 1 A 65 65 PRO HA H 64 4.372 4.394 -0.022 1
1 648 . 39 1 1 A 65 65 PRO C C 64 179.913 179.341 0.572 1
1 649 . 39 1 1 A 65 65 PRO CA C 64 66.011 66.004 0.007 1
1 650 . 39 1 1 A 65 65 PRO CB C 64 30.642 30.607 0.035 1
1 653 . 39 1 1 A 66 66 ILE H H 65 7.377 7.329 0.048 1
1 654 . 39 1 1 A 66 66 ILE HA H 65 3.530 3.902 -0.372 1
1 664 . 39 1 1 A 66 66 ILE C C 65 177.543 178.336 -0.793 1
1 665 . 39 1 1 A 66 66 ILE CA C 65 66.647 64.256 2.391 1
1 666 . 39 1 1 A 66 66 ILE CB C 65 38.029 37.736 0.293 1
1 670 . 39 1 1 A 66 66 ILE N N 65 118.353 116.741 1.612 1
1 671 . 39 1 1 A 67 67 PHE H H 66 8.480 8.449 0.031 1
1 672 . 39 1 1 A 67 67 PHE HA H 66 4.115 4.369 -0.254 1
1 680 . 39 1 1 A 67 67 PHE C C 66 177.293 177.884 -0.591 1
1 681 . 39 1 1 A 67 67 PHE CA C 66 59.570 62.225 -2.655 1
1 682 . 39 1 1 A 67 67 PHE CB C 66 38.865 39.580 -0.715 1
1 688 . 39 1 1 A 67 67 PHE N N 66 122.420 120.572 1.848 1
1 689 . 39 1 1 A 68 68 ASN H H 67 8.595 8.364 0.231 1
1 690 . 39 1 1 A 68 68 ASN HA H 67 4.211 4.375 -0.164 1
1 695 . 39 1 1 A 68 68 ASN C C 67 178.697 177.830 0.867 1
1 696 . 39 1 1 A 68 68 ASN CA C 67 56.056 56.302 -0.246 1
1 697 . 39 1 1 A 68 68 ASN CB C 67 37.704 38.140 -0.436 1
1 698 . 39 1 1 A 68 68 ASN N N 67 115.573 117.570 -1.997 1
1 700 . 39 1 1 A 69 69 GLU H H 68 8.414 8.039 0.375 1
1 701 . 39 1 1 A 69 69 GLU HA H 68 4.102 4.174 -0.072 1
1 706 . 39 1 1 A 69 69 GLU C C 68 177.880 178.877 -0.997 1
1 707 . 39 1 1 A 69 69 GLU CA C 68 59.399 59.312 0.087 1
1 708 . 39 1 1 A 69 69 GLU CB C 68 29.855 29.207 0.648 1
1 710 . 39 1 1 A 69 69 GLU N N 68 123.510 120.004 3.506 1
1 711 . 39 1 1 A 70 70 TYR H H 69 8.659 8.159 0.500 1
1 712 . 39 1 1 A 70 70 TYR HA H 69 3.362 4.102 -0.740 1
1 719 . 39 1 1 A 70 70 TYR C C 69 178.143 176.956 1.187 1
1 720 . 39 1 1 A 70 70 TYR CA C 69 60.686 60.791 -0.105 1
1 721 . 39 1 1 A 70 70 TYR CB C 69 38.560 39.004 -0.444 1
1 726 . 39 1 1 A 70 70 TYR N N 69 122.130 121.005 1.125 1
1 727 . 39 1 1 A 71 71 ILE H H 70 8.031 7.577 0.454 1
1 728 . 39 1 1 A 71 71 ILE HA H 70 3.265 3.710 -0.445 1
1 738 . 39 1 1 A 71 71 ILE C C 70 178.056 177.848 0.208 1
1 739 . 39 1 1 A 71 71 ILE CA C 70 63.756 64.148 -0.392 1
1 740 . 39 1 1 A 71 71 ILE CB C 70 37.321 37.549 -0.228 1
1 744 . 39 1 1 A 71 71 ILE N N 70 118.906 120.699 -1.793 1
1 745 . 39 1 1 A 72 72 SER H H 71 7.803 7.903 -0.100 1
1 746 . 39 1 1 A 72 72 SER HA H 71 4.029 4.204 -0.175 1
1 749 . 39 1 1 A 72 72 SER CA C 71 61.380 62.364 -0.984 1
1 750 . 39 1 1 A 72 72 SER CB C 71 63.288 63.014 0.274 1
1 751 . 39 1 1 A 72 72 SER N N 71 113.735 116.234 -2.499 1
1 752 . 39 1 1 A 73 73 LEU H H 72 7.952 7.704 0.248 1
1 753 . 39 1 1 A 73 73 LEU HA H 72 4.418 4.094 0.324 1
1 763 . 39 1 1 A 73 73 LEU C C 72 177.767 178.325 -0.558 1
1 764 . 39 1 1 A 73 73 LEU CA C 72 56.543 57.405 -0.862 1
1 765 . 39 1 1 A 73 73 LEU CB C 72 44.517 41.659 2.858 1
1 769 . 39 1 1 A 73 73 LEU N N 72 119.411 121.887 -2.476 1
1 770 . 39 1 1 A 74 74 VAL H H 73 8.021 7.745 0.276 1
1 771 . 39 1 1 A 74 74 VAL HA H 73 3.532 3.326 0.206 1
1 779 . 39 1 1 A 74 74 VAL C C 73 177.126 177.968 -0.842 1
1 780 . 39 1 1 A 74 74 VAL CA C 73 66.250 66.319 -0.069 1
1 781 . 39 1 1 A 74 74 VAL CB C 73 31.212 31.157 0.055 1
1 784 . 39 1 1 A 74 74 VAL N N 73 118.747 119.070 -0.323 1
1 785 . 39 1 1 A 75 75 GLU H H 74 7.232 7.997 -0.765 1
1 786 . 39 1 1 A 75 75 GLU HA H 74 3.013 4.133 -1.120 1
1 791 . 39 1 1 A 75 75 GLU C C 74 178.804 179.439 -0.635 1
1 792 . 39 1 1 A 75 75 GLU CA C 74 60.536 59.922 0.614 1
1 793 . 39 1 1 A 75 75 GLU CB C 74 27.009 29.018 -2.009 1
1 795 . 39 1 1 A 75 75 GLU N N 74 118.660 119.781 -1.121 1
1 796 . 39 1 1 A 76 76 LYS H H 75 7.051 7.979 -0.928 1
1 797 . 39 1 1 A 76 76 LYS HA H 75 3.765 4.019 -0.254 1
1 806 . 39 1 1 A 76 76 LYS C C 75 177.765 179.080 -1.315 1
1 807 . 39 1 1 A 76 76 LYS CA C 75 58.357 58.698 -0.341 1
1 808 . 39 1 1 A 76 76 LYS CB C 75 31.939 32.236 -0.297 1
1 812 . 39 1 1 A 76 76 LYS N N 75 116.112 119.475 -3.363 1
1 813 . 39 1 1 A 77 77 TYR H H 76 7.067 7.883 -0.816 1
1 814 . 39 1 1 A 77 77 TYR HA H 76 4.036 4.359 -0.323 1
1 821 . 39 1 1 A 77 77 TYR C C 76 177.752 177.105 0.647 1
1 822 . 39 1 1 A 77 77 TYR CA C 76 61.820 60.975 0.845 1
1 823 . 39 1 1 A 77 77 TYR CB C 76 38.480 38.788 -0.308 1
1 828 . 39 1 1 A 77 77 TYR N N 76 118.434 121.860 -3.426 1
1 829 . 39 1 1 A 78 78 ILE H H 77 7.554 7.876 -0.322 1
1 830 . 39 1 1 A 78 78 ILE HA H 77 3.159 3.549 -0.390 1
1 840 . 39 1 1 A 78 78 ILE C C 77 177.341 177.918 -0.577 1
1 841 . 39 1 1 A 78 78 ILE CA C 77 65.177 64.658 0.519 1
1 842 . 39 1 1 A 78 78 ILE CB C 77 37.339 37.406 -0.067 1
1 846 . 39 1 1 A 78 78 ILE N N 77 117.672 120.549 -2.877 1
1 847 . 39 1 1 A 79 79 GLU H H 78 8.296 7.853 0.443 1
1 848 . 39 1 1 A 79 79 GLU HA H 78 3.557 3.914 -0.357 1
1 853 . 39 1 1 A 79 79 GLU C C 78 177.742 178.470 -0.728 1
1 854 . 39 1 1 A 79 79 GLU CA C 78 60.847 59.082 1.765 1
1 855 . 39 1 1 A 79 79 GLU CB C 78 29.594 29.231 0.363 1
1 857 . 39 1 1 A 79 79 GLU N N 78 118.701 120.688 -1.987 1
1 858 . 39 1 1 A 80 80 GLU H H 79 8.330 8.347 -0.017 1
1 859 . 39 1 1 A 80 80 GLU HA H 79 3.774 3.970 -0.196 1
1 864 . 39 1 1 A 80 80 GLU C C 79 179.926 178.842 1.084 1
1 865 . 39 1 1 A 80 80 GLU CA C 79 59.581 59.373 0.208 1
1 866 . 39 1 1 A 80 80 GLU CB C 79 29.062 29.100 -0.038 1
1 868 . 39 1 1 A 80 80 GLU N N 79 116.767 117.811 -1.044 1
1 869 . 39 1 1 A 81 81 GLN H H 80 7.634 7.600 0.034 1
1 870 . 39 1 1 A 81 81 GLN HA H 80 3.605 3.829 -0.224 1
1 877 . 39 1 1 A 81 81 GLN C C 80 179.681 178.538 1.143 1
1 878 . 39 1 1 A 81 81 GLN CA C 80 57.765 58.311 -0.546 1
1 879 . 39 1 1 A 81 81 GLN CB C 80 28.079 27.829 0.250 1
1 881 . 39 1 1 A 81 81 GLN N N 80 116.325 118.985 -2.660 1
1 883 . 39 1 1 A 82 82 LEU H H 81 8.156 7.477 0.679 1
1 884 . 39 1 1 A 82 82 LEU HA H 81 3.536 3.757 -0.221 1
1 894 . 39 1 1 A 82 82 LEU C C 81 178.945 179.140 -0.195 1
1 895 . 39 1 1 A 82 82 LEU CA C 81 57.761 56.838 0.923 1
1 896 . 39 1 1 A 82 82 LEU CB C 81 40.961 40.977 -0.016 1
1 900 . 39 1 1 A 82 82 LEU N N 81 121.546 120.370 1.176 1
1 901 . 39 1 1 A 83 83 LEU H H 82 8.326 7.826 0.500 1
1 902 . 39 1 1 A 83 83 LEU HA H 82 4.198 4.205 -0.007 1
1 912 . 39 1 1 A 83 83 LEU C C 82 178.631 179.164 -0.533 1
1 913 . 39 1 1 A 83 83 LEU CA C 82 57.016 56.930 0.086 1
1 914 . 39 1 1 A 83 83 LEU CB C 82 42.182 40.865 1.317 1
1 918 . 39 1 1 A 83 83 LEU N N 82 120.426 118.849 1.577 1
1 919 . 39 1 1 A 84 84 GLN H H 83 6.992 7.658 -0.666 1
1 920 . 39 1 1 A 84 84 GLN HA H 83 3.877 4.017 -0.140 1
1 927 . 39 1 1 A 84 84 GLN C C 83 177.008 176.648 0.360 1
1 928 . 39 1 1 A 84 84 GLN CA C 83 57.543 58.275 -0.732 1
1 929 . 39 1 1 A 84 84 GLN CB C 83 28.688 28.325 0.363 1
1 931 . 39 1 1 A 84 84 GLN N N 83 114.001 117.270 -3.269 1
1 933 . 39 1 1 A 85 85 ARG H H 84 7.072 7.627 -0.555 1
1 934 . 39 1 1 A 85 85 ARG HA H 84 4.047 4.446 -0.399 1
1 942 . 39 1 1 A 85 85 ARG C C 84 175.999 175.397 0.602 1
1 943 . 39 1 1 A 85 85 ARG CA C 84 56.764 56.650 0.114 1
1 944 . 39 1 1 A 85 85 ARG CB C 84 32.044 32.270 -0.226 1
1 947 . 39 1 1 A 85 85 ARG N N 84 115.827 118.838 -3.011 1
1 949 . 39 1 1 A 86 86 ILE H H 85 8.238 7.346 0.892 1
1 950 . 39 1 1 A 86 86 ILE HA H 85 4.389 4.500 -0.111 1
1 960 . 39 1 1 A 86 86 ILE CA C 85 58.007 57.788 0.219 1
1 961 . 39 1 1 A 86 86 ILE CB C 85 39.604 39.133 0.471 1
1 965 . 39 1 1 A 86 86 ILE N N 85 119.285 118.230 1.055 1
1 966 . 39 1 1 A 87 87 PRO HA H 86 4.392 4.565 -0.173 1
1 973 . 39 1 1 A 87 87 PRO C C 86 177.622 176.618 1.004 1
1 974 . 39 1 1 A 87 87 PRO CA C 86 64.665 64.184 0.481 1
1 975 . 39 1 1 A 87 87 PRO CB C 86 32.020 31.744 0.276 1
1 978 . 39 1 1 A 88 88 GLU H H 87 8.312 8.207 0.105 1
1 979 . 39 1 1 A 88 88 GLU HA H 87 4.208 4.529 -0.321 1
1 984 . 39 1 1 A 88 88 GLU C C 87 175.554 175.703 -0.149 1
1 985 . 39 1 1 A 88 88 GLU CA C 87 56.045 56.197 -0.152 1
1 986 . 39 1 1 A 88 88 GLU CB C 87 28.654 30.374 -1.720 1
1 988 . 39 1 1 A 88 88 GLU N N 87 114.256 117.011 -2.755 1
1 989 . 39 1 1 A 89 89 PHE H H 88 7.946 7.372 0.574 1
1 990 . 39 1 1 A 89 89 PHE HA H 88 3.993 4.325 -0.332 1
1 998 . 39 1 1 A 89 89 PHE C C 88 173.460 174.620 -1.160 1
1 999 . 39 1 1 A 89 89 PHE CA C 88 60.119 59.577 0.542 1
1 1000 . 39 1 1 A 89 89 PHE CB C 88 39.994 39.636 0.358 1
1 1006 . 39 1 1 A 89 89 PHE N N 88 121.550 123.524 -1.974 1
1 1007 . 39 1 1 A 90 90 ASN H H 89 7.266 7.858 -0.592 1
1 1008 . 39 1 1 A 90 90 ASN HA H 89 4.454 5.088 -0.634 1
1 1013 . 39 1 1 A 90 90 ASN C C 89 173.921 175.043 -1.122 1
1 1014 . 39 1 1 A 90 90 ASN CA C 89 51.839 51.727 0.112 1
1 1015 . 39 1 1 A 90 90 ASN CB C 89 40.674 39.535 1.139 1
1 1016 . 39 1 1 A 90 90 ASN N N 89 125.344 124.804 0.540 1
1 1018 . 39 1 1 A 91 91 MET H H 90 8.968 8.461 0.507 1
1 1019 . 39 1 1 A 91 91 MET HA H 90 4.049 4.216 -0.167 1
1 1027 . 39 1 1 A 91 91 MET C C 90 177.475 178.075 -0.600 1
1 1028 . 39 1 1 A 91 91 MET CA C 90 57.758 57.588 0.170 1
1 1029 . 39 1 1 A 91 91 MET CB C 90 32.250 32.530 -0.280 1
1 1032 . 39 1 1 A 91 91 MET N N 90 127.052 124.240 2.812 1
1 1033 . 39 1 1 A 92 92 ALA H H 91 8.292 8.142 0.150 1
1 1034 . 39 1 1 A 92 92 ALA HA H 91 4.059 4.131 -0.072 1
1 1038 . 39 1 1 A 92 92 ALA C C 91 180.412 179.721 0.691 1
1 1039 . 39 1 1 A 92 92 ALA CA C 91 55.368 54.985 0.383 1
1 1040 . 39 1 1 A 92 92 ALA CB C 91 17.527 18.358 -0.831 1
1 1041 . 39 1 1 A 92 92 ALA N N 91 123.752 121.091 2.661 1
1 1042 . 39 1 1 A 93 93 ALA H H 92 7.931 8.040 -0.109 1
1 1043 . 39 1 1 A 93 93 ALA HA H 92 4.054 4.118 -0.064 1
1 1047 . 39 1 1 A 93 93 ALA C C 92 180.482 179.819 0.663 1
1 1048 . 39 1 1 A 93 93 ALA CA C 92 54.614 54.843 -0.229 1
1 1049 . 39 1 1 A 93 93 ALA CB C 92 18.098 18.210 -0.112 1
1 1050 . 39 1 1 A 93 93 ALA N N 92 121.158 120.210 0.948 1
1 1051 . 39 1 1 A 94 94 PHE H H 93 8.110 7.658 0.452 1
1 1052 . 39 1 1 A 94 94 PHE HA H 93 4.304 4.089 0.215 1
1 1060 . 39 1 1 A 94 94 PHE C C 93 177.350 177.422 -0.072 1
1 1061 . 39 1 1 A 94 94 PHE CA C 93 61.641 61.418 0.223 1
1 1062 . 39 1 1 A 94 94 PHE CB C 93 40.014 39.268 0.746 1
1 1068 . 39 1 1 A 94 94 PHE N N 93 119.807 119.728 0.079 1
1 1069 . 39 1 1 A 95 95 THR H H 94 8.726 8.380 0.346 1
1 1070 . 39 1 1 A 95 95 THR HA H 94 3.569 4.006 -0.437 1
1 1075 . 39 1 1 A 95 95 THR C C 94 176.932 176.845 0.087 1
1 1076 . 39 1 1 A 95 95 THR CA C 94 66.833 65.612 1.221 1
1 1077 . 39 1 1 A 95 95 THR CB C 94 68.445 68.259 0.186 1
1 1079 . 39 1 1 A 95 95 THR N N 94 113.074 112.456 0.618 1
1 1080 . 39 1 1 A 96 96 THR H H 95 7.657 7.787 -0.130 1
1 1081 . 39 1 1 A 96 96 THR HA H 95 3.945 4.024 -0.079 1
1 1086 . 39 1 1 A 96 96 THR C C 95 176.386 176.306 0.080 1
1 1087 . 39 1 1 A 96 96 THR CA C 95 66.550 66.000 0.550 1
1 1088 . 39 1 1 A 96 96 THR CB C 95 68.583 68.701 -0.118 1
1 1090 . 39 1 1 A 96 96 THR N N 95 117.927 116.910 1.017 1
1 1091 . 39 1 1 A 97 97 THR H H 96 7.699 7.521 0.178 1
1 1092 . 39 1 1 A 97 97 THR HA H 96 3.905 4.059 -0.154 1
1 1097 . 39 1 1 A 97 97 THR C C 96 176.572 176.087 0.485 1
1 1098 . 39 1 1 A 97 97 THR CA C 96 65.979 66.091 -0.112 1
1 1099 . 39 1 1 A 97 97 THR CB C 96 68.553 68.076 0.477 1
1 1101 . 39 1 1 A 97 97 THR N N 96 118.518 116.702 1.816 1
1 1102 . 39 1 1 A 98 98 LEU H H 97 8.304 7.948 0.356 1
1 1103 . 39 1 1 A 98 98 LEU HA H 97 3.725 3.630 0.095 1
1 1113 . 39 1 1 A 98 98 LEU C C 97 178.490 178.413 0.077 1
1 1114 . 39 1 1 A 98 98 LEU CA C 97 58.517 57.804 0.713 1
1 1115 . 39 1 1 A 98 98 LEU CB C 97 41.697 40.884 0.813 1
1 1119 . 39 1 1 A 98 98 LEU N N 97 122.882 121.842 1.040 1
1 1120 . 39 1 1 A 99 99 GLN H H 98 7.639 7.751 -0.112 1
1 1121 . 39 1 1 A 99 99 GLN HA H 98 3.927 4.185 -0.258 1
1 1128 . 39 1 1 A 99 99 GLN C C 98 178.068 177.984 0.084 1
1 1129 . 39 1 1 A 99 99 GLN CA C 98 58.735 59.179 -0.444 1
1 1130 . 39 1 1 A 99 99 GLN CB C 98 27.986 28.379 -0.393 1
1 1132 . 39 1 1 A 99 99 GLN N N 98 114.302 118.246 -3.944 1
1 1134 . 39 1 1 A 100 100 HIS H H 99 7.575 7.953 -0.378 1
1 1135 . 39 1 1 A 100 100 HIS HA H 99 4.524 4.588 -0.064 1
1 1139 . 39 1 1 A 100 100 HIS C C 99 174.789 177.327 -2.538 1
1 1140 . 39 1 1 A 100 100 HIS CA C 99 56.154 57.212 -1.058 1
1 1141 . 39 1 1 A 100 100 HIS CB C 99 28.946 30.483 -1.537 1
1 1143 . 39 1 1 A 100 100 HIS N N 99 114.778 116.873 -2.095 1
1 1144 . 39 1 1 A 101 101 HIS H H 100 7.773 7.610 0.163 1
1 1145 . 39 1 1 A 101 101 HIS HA H 100 4.704 3.922 0.782 1
1 1149 . 39 1 1 A 101 101 HIS C C 100 174.818 176.753 -1.935 1
1 1150 . 39 1 1 A 101 101 HIS CA C 100 54.830 57.960 -3.130 1
1 1151 . 39 1 1 A 101 101 HIS CB C 100 29.749 29.892 -0.143 1
1 1153 . 39 1 1 A 101 101 HIS N N 100 117.397 120.000 -2.603 1
1 1154 . 39 1 1 A 102 102 LYS H H 101 7.324 8.352 -1.028 1
1 1155 . 39 1 1 A 102 102 LYS HA H 101 3.611 4.045 -0.434 1
1 1164 . 39 1 1 A 102 102 LYS C C 101 176.823 178.328 -1.505 1
1 1165 . 39 1 1 A 102 102 LYS CA C 101 59.915 58.473 1.442 1
1 1166 . 39 1 1 A 102 102 LYS CB C 101 32.825 31.322 1.503 1
1 1170 . 39 1 1 A 102 102 LYS N N 101 120.533 117.023 3.510 1
1 1171 . 39 1 1 A 103 103 ASP H H 102 8.361 7.536 0.825 1
1 1172 . 39 1 1 A 103 103 ASP HA H 102 4.421 4.472 -0.051 1
1 1175 . 39 1 1 A 103 103 ASP C C 102 176.793 177.083 -0.290 1
1 1176 . 39 1 1 A 103 103 ASP CA C 102 55.500 55.987 -0.487 1
1 1177 . 39 1 1 A 103 103 ASP CB C 102 40.178 40.595 -0.417 1
1 1178 . 39 1 1 A 103 103 ASP N N 102 114.814 119.758 -4.944 1
1 1179 . 39 1 1 A 104 104 GLU H H 103 7.858 7.605 0.253 1
1 1180 . 39 1 1 A 104 104 GLU HA H 103 4.339 4.324 0.015 1
1 1183 . 39 1 1 A 104 104 GLU C C 103 175.777 176.338 -0.561 1
1 1184 . 39 1 1 A 104 104 GLU CA C 103 56.356 57.476 -1.120 1
1 1185 . 39 1 1 A 104 104 GLU CB C 103 31.293 31.216 0.077 1
1 1186 . 39 1 1 A 104 104 GLU N N 103 116.826 117.634 -0.808 1
1 1187 . 39 1 1 A 105 105 VAL H H 104 7.201 7.394 -0.193 1
1 1188 . 39 1 1 A 105 105 VAL HA H 104 4.296 4.144 0.152 1
1 1196 . 39 1 1 A 105 105 VAL C C 104 174.482 175.648 -1.166 1
1 1197 . 39 1 1 A 105 105 VAL CA C 104 60.370 62.608 -2.238 1
1 1198 . 39 1 1 A 105 105 VAL CB C 104 34.341 32.879 1.462 1
1 1201 . 39 1 1 A 105 105 VAL N N 104 116.422 119.029 -2.607 1
1 1202 . 39 1 1 A 106 106 ALA H H 105 8.487 8.375 0.112 1
1 1203 . 39 1 1 A 106 106 ALA HA H 105 4.172 4.341 -0.169 1
1 1207 . 39 1 1 A 106 106 ALA C C 105 179.030 178.940 0.090 1
1 1208 . 39 1 1 A 106 106 ALA CA C 105 52.966 52.709 0.257 1
1 1209 . 39 1 1 A 106 106 ALA CB C 105 19.371 19.616 -0.245 1
1 1210 . 39 1 1 A 106 106 ALA N N 105 128.313 128.602 -0.289 1
1 1211 . 39 1 1 A 107 107 GLY H H 106 8.738 8.790 -0.052 1
1 1212 . 39 1 1 A 107 107 GLY HA2 H 106 3.773 3.862 -0.089 1
1 1213 . 39 1 1 A 107 107 GLY HA3 H 106 3.998 3.926 0.072 1
1 1214 . 39 1 1 A 107 107 GLY C C 106 174.958 175.215 -0.257 1
1 1215 . 39 1 1 A 107 107 GLY CA C 106 47.449 47.084 0.365 1
1 1216 . 39 1 1 A 107 107 GLY N N 106 110.612 110.926 -0.314 1
1 1217 . 39 1 1 A 108 108 ASP H H 107 8.535 7.835 0.700 1
1 1218 . 39 1 1 A 108 108 ASP HA H 107 4.333 4.369 -0.036 1
1 1221 . 39 1 1 A 108 108 ASP C C 107 179.133 179.009 0.124 1
1 1222 . 39 1 1 A 108 108 ASP CA C 107 56.721 56.424 0.297 1
1 1223 . 39 1 1 A 108 108 ASP CB C 107 39.336 40.488 -1.152 1
1 1224 . 39 1 1 A 108 108 ASP N N 107 117.474 122.157 -4.683 1
1 1225 . 39 1 1 A 109 109 ILE H H 108 7.459 7.869 -0.410 1
1 1226 . 39 1 1 A 109 109 ILE HA H 108 3.688 3.815 -0.127 1
1 1236 . 39 1 1 A 109 109 ILE C C 108 176.735 178.386 -1.651 1
1 1237 . 39 1 1 A 109 109 ILE CA C 108 63.474 65.433 -1.959 1
1 1238 . 39 1 1 A 109 109 ILE CB C 108 37.340 37.590 -0.250 1
1 1242 . 39 1 1 A 109 109 ILE N N 108 119.609 119.679 -0.070 1
1 1243 . 39 1 1 A 110 110 PHE H H 109 7.920 8.325 -0.405 1
1 1244 . 39 1 1 A 110 110 PHE HA H 109 3.759 4.074 -0.315 1
1 1252 . 39 1 1 A 110 110 PHE C C 109 177.132 177.288 -0.156 1
1 1253 . 39 1 1 A 110 110 PHE CA C 109 62.766 61.229 1.537 1
1 1254 . 39 1 1 A 110 110 PHE CB C 109 39.752 39.297 0.455 1
1 1260 . 39 1 1 A 110 110 PHE N N 109 120.906 120.408 0.498 1
1 1261 . 39 1 1 A 111 111 ASP H H 110 8.639 8.292 0.347 1
1 1262 . 39 1 1 A 111 111 ASP HA H 110 4.216 4.218 -0.002 1
1 1265 . 39 1 1 A 111 111 ASP C C 110 178.900 178.325 0.575 1
1 1266 . 39 1 1 A 111 111 ASP CA C 110 57.105 57.316 -0.211 1
1 1267 . 39 1 1 A 111 111 ASP CB C 110 39.697 42.031 -2.334 1
1 1268 . 39 1 1 A 111 111 ASP N N 110 117.124 118.765 -1.641 1
1 1269 . 39 1 1 A 112 112 MET H H 111 7.331 7.582 -0.251 1
1 1270 . 39 1 1 A 112 112 MET HA H 111 4.081 4.141 -0.060 1
1 1278 . 39 1 1 A 112 112 MET C C 111 179.052 178.117 0.935 1
1 1279 . 39 1 1 A 112 112 MET CA C 111 58.202 57.972 0.230 1
1 1280 . 39 1 1 A 112 112 MET CB C 111 31.827 32.388 -0.561 1
1 1283 . 39 1 1 A 112 112 MET N N 111 118.061 119.380 -1.319 1
1 1284 . 39 1 1 A 113 113 LEU H H 112 8.001 7.963 0.038 1
1 1285 . 39 1 1 A 113 113 LEU HA H 112 3.723 3.558 0.165 1
1 1295 . 39 1 1 A 113 113 LEU C C 112 179.747 178.684 1.063 1
1 1296 . 39 1 1 A 113 113 LEU CA C 112 57.371 57.375 -0.004 1
1 1297 . 39 1 1 A 113 113 LEU CB C 112 40.671 40.911 -0.240 1
1 1301 . 39 1 1 A 113 113 LEU N N 112 120.426 119.789 0.637 1
1 1302 . 39 1 1 A 114 114 LEU H H 113 7.744 7.367 0.377 1
1 1303 . 39 1 1 A 114 114 LEU HA H 113 4.007 3.589 0.418 1
1 1313 . 39 1 1 A 114 114 LEU C C 113 179.358 178.855 0.503 1
1 1314 . 39 1 1 A 114 114 LEU CA C 113 57.202 57.405 -0.203 1
1 1315 . 39 1 1 A 114 114 LEU CB C 113 41.727 41.068 0.659 1
1 1319 . 39 1 1 A 114 114 LEU N N 113 119.584 118.475 1.109 1
1 1320 . 39 1 1 A 115 115 THR H H 114 7.353 7.659 -0.306 1
1 1321 . 39 1 1 A 115 115 THR HA H 114 4.071 4.043 0.028 1
1 1327 . 39 1 1 A 115 115 THR C C 114 173.591 176.695 -3.104 1
1 1328 . 39 1 1 A 115 115 THR CA C 114 65.332 64.746 0.586 1
1 1329 . 39 1 1 A 115 115 THR CB C 114 70.319 68.561 1.758 1
1 1331 . 39 1 1 A 115 115 THR N N 114 107.535 110.770 -3.235 1
1 1332 . 39 1 1 A 116 116 PHE H H 115 6.979 7.848 -0.869 1
1 1333 . 39 1 1 A 116 116 PHE HA H 115 5.022 4.258 0.764 1
1 1341 . 39 1 1 A 116 116 PHE C C 115 176.488 176.652 -0.164 1
1 1342 . 39 1 1 A 116 116 PHE CA C 115 55.911 60.825 -4.914 1
1 1343 . 39 1 1 A 116 116 PHE CB C 115 38.521 39.192 -0.671 1
1 1349 . 39 1 1 A 116 116 PHE N N 115 112.366 119.823 -7.457 1
1 1350 . 39 1 1 A 117 117 THR H H 116 7.564 7.612 -0.048 1
1 1351 . 39 1 1 A 117 117 THR HA H 116 4.626 4.846 -0.220 1
1 1356 . 39 1 1 A 117 117 THR C C 116 174.085 174.367 -0.282 1
1 1357 . 39 1 1 A 117 117 THR CA C 116 61.636 61.996 -0.360 1
1 1358 . 39 1 1 A 117 117 THR CB C 116 70.915 70.990 -0.075 1
1 1360 . 39 1 1 A 117 117 THR N N 116 105.498 105.654 -0.156 1
1 1361 . 39 1 1 A 118 118 ASP H H 117 8.270 7.776 0.494 1
1 1362 . 39 1 1 A 118 118 ASP HA H 117 4.955 4.881 0.074 1
1 1365 . 39 1 1 A 118 118 ASP C C 117 176.328 176.222 0.106 1
1 1366 . 39 1 1 A 118 118 ASP CA C 117 53.417 53.848 -0.431 1
1 1367 . 39 1 1 A 118 118 ASP CB C 117 43.388 39.066 4.322 1
1 1368 . 39 1 1 A 118 118 ASP N N 117 124.409 124.034 0.375 1
1 1369 . 39 1 1 A 119 119 PHE H H 118 8.973 8.903 0.070 1
1 1370 . 39 1 1 A 119 119 PHE HA H 118 3.506 4.251 -0.745 1
1 1378 . 39 1 1 A 119 119 PHE CA C 118 61.490 61.293 0.197 1
1 1379 . 39 1 1 A 119 119 PHE CB C 118 39.246 39.560 -0.314 1
1 1385 . 39 1 1 A 119 119 PHE N N 118 126.688 125.488 1.200 1
1 1386 . 39 1 1 A 120 120 LEU H H 119 8.099 8.302 -0.203 1
1 1387 . 39 1 1 A 120 120 LEU HA H 119 3.842 3.955 -0.113 1
1 1397 . 39 1 1 A 120 120 LEU C C 119 179.601 179.451 0.150 1
1 1398 . 39 1 1 A 120 120 LEU CA C 119 58.174 57.822 0.352 1
1 1399 . 39 1 1 A 120 120 LEU CB C 119 40.315 41.116 -0.801 1
1 1403 . 39 1 1 A 120 120 LEU N N 119 117.930 119.888 -1.958 1
1 1404 . 39 1 1 A 121 121 ALA H H 120 7.729 7.593 0.136 1
1 1405 . 39 1 1 A 121 121 ALA HA H 120 3.996 4.117 -0.121 1
1 1409 . 39 1 1 A 121 121 ALA C C 120 180.995 179.702 1.293 1
1 1410 . 39 1 1 A 121 121 ALA CA C 120 54.832 54.614 0.218 1
1 1411 . 39 1 1 A 121 121 ALA CB C 120 17.706 18.262 -0.556 1
1 1412 . 39 1 1 A 121 121 ALA N N 120 123.195 121.072 2.123 1
1 1413 . 39 1 1 A 122 122 PHE H H 121 7.943 8.024 -0.081 1
1 1414 . 39 1 1 A 122 122 PHE HA H 121 3.887 3.800 0.087 1
1 1419 . 39 1 1 A 122 122 PHE C C 121 175.410 176.771 -1.361 1
1 1420 . 39 1 1 A 122 122 PHE CA C 121 61.075 60.721 0.354 1
1 1421 . 39 1 1 A 122 122 PHE CB C 121 38.115 38.996 -0.881 1
1 1424 . 39 1 1 A 122 122 PHE N N 121 121.798 119.938 1.860 1
1 1425 . 39 1 1 A 123 123 LYS H H 122 8.468 7.890 0.578 1
1 1426 . 39 1 1 A 123 123 LYS HA H 122 3.077 3.755 -0.678 1
1 1435 . 39 1 1 A 123 123 LYS C C 122 178.453 178.877 -0.424 1
1 1436 . 39 1 1 A 123 123 LYS CA C 122 59.855 59.938 -0.083 1
1 1437 . 39 1 1 A 123 123 LYS CB C 122 32.374 32.295 0.079 1
1 1441 . 39 1 1 A 123 123 LYS N N 122 120.614 118.513 2.101 1
1 1442 . 39 1 1 A 124 124 GLU H H 123 8.100 7.805 0.295 1
1 1443 . 39 1 1 A 124 124 GLU HA H 123 3.652 4.007 -0.355 1
1 1448 . 39 1 1 A 124 124 GLU C C 123 177.743 178.520 -0.777 1
1 1449 . 39 1 1 A 124 124 GLU CA C 123 59.406 59.513 -0.107 1
1 1450 . 39 1 1 A 124 124 GLU CB C 123 28.811 29.320 -0.509 1
1 1452 . 39 1 1 A 124 124 GLU N N 123 117.404 118.779 -1.375 1
1 1453 . 39 1 1 A 125 125 MET H H 124 7.537 7.466 0.071 1
1 1454 . 39 1 1 A 125 125 MET HA H 124 3.860 3.978 -0.118 1
1 1462 . 39 1 1 A 125 125 MET C C 124 179.522 178.278 1.244 1
1 1463 . 39 1 1 A 125 125 MET CA C 124 58.832 58.329 0.503 1
1 1464 . 39 1 1 A 125 125 MET CB C 124 31.765 31.453 0.312 1
1 1467 . 39 1 1 A 125 125 MET N N 124 119.413 119.097 0.316 1
1 1468 . 39 1 1 A 126 126 PHE H H 125 7.148 7.365 -0.217 1
1 1469 . 39 1 1 A 126 126 PHE HA H 125 3.633 4.204 -0.571 1
1 1476 . 39 1 1 A 126 126 PHE C C 125 178.994 178.347 0.647 1
1 1477 . 39 1 1 A 126 126 PHE CA C 125 63.148 61.011 2.137 1
1 1478 . 39 1 1 A 126 126 PHE CB C 125 39.830 38.563 1.267 1
1 1483 . 39 1 1 A 126 126 PHE N N 125 120.013 118.792 1.221 1
1 1484 . 39 1 1 A 127 127 LEU H H 126 8.369 8.666 -0.297 1
1 1485 . 39 1 1 A 127 127 LEU HA H 126 3.972 4.046 -0.074 1
1 1495 . 39 1 1 A 127 127 LEU C C 126 180.621 179.400 1.221 1
1 1496 . 39 1 1 A 127 127 LEU CA C 126 57.944 57.974 -0.030 1
1 1497 . 39 1 1 A 127 127 LEU CB C 126 40.543 41.291 -0.748 1
1 1501 . 39 1 1 A 127 127 LEU N N 126 119.692 119.892 -0.200 1
1 1502 . 39 1 1 A 128 128 ASP H H 127 8.578 8.067 0.511 1
1 1503 . 39 1 1 A 128 128 ASP HA H 127 4.308 4.350 -0.042 1
1 1506 . 39 1 1 A 128 128 ASP C C 127 178.254 178.081 0.173 1
1 1507 . 39 1 1 A 128 128 ASP CA C 127 56.964 57.167 -0.203 1
1 1508 . 39 1 1 A 128 128 ASP CB C 127 39.735 40.588 -0.853 1
1 1509 . 39 1 1 A 128 128 ASP N N 127 121.926 119.718 2.208 1
1 1510 . 39 1 1 A 129 129 TYR H H 128 7.710 8.089 -0.379 1
1 1511 . 39 1 1 A 129 129 TYR HA H 128 3.908 4.021 -0.113 1
1 1518 . 39 1 1 A 129 129 TYR C C 128 177.633 177.819 -0.186 1
1 1519 . 39 1 1 A 129 129 TYR CA C 128 61.796 61.631 0.165 1
1 1520 . 39 1 1 A 129 129 TYR CB C 128 39.372 39.032 0.340 1
1 1525 . 39 1 1 A 129 129 TYR N N 128 122.548 120.609 1.939 1
1 1526 . 39 1 1 A 130 130 ARG H H 129 8.622 8.351 0.271 1
1 1527 . 39 1 1 A 130 130 ARG HA H 129 3.722 4.108 -0.386 1
1 1535 . 39 1 1 A 130 130 ARG CA C 129 60.084 59.563 0.521 1
1 1536 . 39 1 1 A 130 130 ARG CB C 129 29.902 30.012 -0.110 1
1 1539 . 39 1 1 A 130 130 ARG N N 129 118.302 119.795 -1.493 1
1 1541 . 39 1 1 A 131 131 ALA H H 130 7.936 8.047 -0.111 1
1 1542 . 39 1 1 A 131 131 ALA HA H 130 3.997 4.014 -0.017 1
1 1546 . 39 1 1 A 131 131 ALA C C 130 180.456 180.243 0.213 1
1 1547 . 39 1 1 A 131 131 ALA CA C 130 55.133 54.974 0.159 1
1 1548 . 39 1 1 A 131 131 ALA CB C 130 17.750 18.217 -0.467 1
1 1549 . 39 1 1 A 131 131 ALA N N 130 119.788 121.927 -2.139 1
1 1550 . 39 1 1 A 132 132 GLU H H 131 7.622 7.789 -0.167 1
1 1551 . 39 1 1 A 132 132 GLU HA H 131 3.862 3.995 -0.133 1
1 1556 . 39 1 1 A 132 132 GLU C C 131 179.528 179.089 0.439 1
1 1557 . 39 1 1 A 132 132 GLU CA C 131 58.849 59.323 -0.474 1
1 1558 . 39 1 1 A 132 132 GLU CB C 131 28.930 28.972 -0.042 1
1 1560 . 39 1 1 A 132 132 GLU N N 131 118.428 117.931 0.497 1
1 1561 . 39 1 1 A 133 133 LYS H H 132 7.853 7.627 0.226 1
1 1562 . 39 1 1 A 133 133 LYS HA H 132 3.722 4.030 -0.308 1
1 1571 . 39 1 1 A 133 133 LYS C C 132 175.725 178.031 -2.306 1
1 1572 . 39 1 1 A 133 133 LYS CA C 132 57.544 58.899 -1.355 1
1 1573 . 39 1 1 A 133 133 LYS CB C 132 31.770 32.131 -0.361 1
1 1577 . 39 1 1 A 133 133 LYS N N 132 119.473 118.575 0.898 1
1 1578 . 39 1 1 A 134 134 GLU H H 133 8.151 7.966 0.185 1
1 1579 . 39 1 1 A 134 134 GLU HA H 133 4.161 4.419 -0.258 1
1 1584 . 39 1 1 A 134 134 GLU C C 133 177.453 177.535 -0.082 1
1 1585 . 39 1 1 A 134 134 GLU CA C 133 57.222 56.562 0.660 1
1 1586 . 39 1 1 A 134 134 GLU CB C 133 30.091 30.182 -0.091 1
1 1588 . 39 1 1 A 134 134 GLU N N 133 116.525 117.261 -0.736 1
1 1589 . 39 1 1 A 135 135 GLY H H 134 7.702 7.695 0.007 1
1 1590 . 39 1 1 A 135 135 GLY HA2 H 134 3.896 4.040 -0.144 1
1 1591 . 39 1 1 A 135 135 GLY HA3 H 134 3.897 4.045 -0.148 1
1 1592 . 39 1 1 A 135 135 GLY C C 134 174.538 173.346 1.192 1
1 1593 . 39 1 1 A 135 135 GLY CA C 134 45.975 45.508 0.467 1
1 1594 . 39 1 1 A 135 135 GLY N N 134 107.924 107.313 0.611 1
1 1595 . 39 1 1 A 136 136 ARG H H 135 8.045 7.700 0.345 1
1 1596 . 39 1 1 A 136 136 ARG HA H 135 4.323 4.582 -0.259 1
1 1604 . 39 1 1 A 136 136 ARG C C 135 175.864 175.746 0.118 1
1 1605 . 39 1 1 A 136 136 ARG CA C 135 56.016 55.283 0.733 1
1 1606 . 39 1 1 A 136 136 ARG CB C 135 30.987 32.612 -1.625 1
1 1609 . 39 1 1 A 136 136 ARG N N 135 119.708 120.439 -0.731 1
1 1 . 40 1 1 A 14 14 PHE CA C 13 58.199 56.972 1.227 1
1 2 . 40 1 1 A 14 14 PHE CB C 13 39.717 39.942 -0.225 1
1 3 . 40 1 1 A 15 15 SER H H 14 8.299 8.924 -0.625 1
1 4 . 40 1 1 A 15 15 SER HA H 14 4.359 4.750 -0.391 1
1 7 . 40 1 1 A 15 15 SER CA C 14 58.249 57.218 1.031 1
1 8 . 40 1 1 A 15 15 SER CB C 14 63.936 64.529 -0.593 1
1 9 . 40 1 1 A 15 15 SER N N 14 117.379 118.407 -1.028 1
1 10 . 40 1 1 A 16 16 SER H H 15 8.255 8.321 -0.066 1
1 11 . 40 1 1 A 16 16 SER HA H 15 3.729 4.302 -0.573 1
1 14 . 40 1 1 A 16 16 SER CA C 15 58.224 59.773 -1.549 1
1 15 . 40 1 1 A 16 16 SER CB C 15 63.886 61.279 2.607 1
1 16 . 40 1 1 A 16 16 SER N N 15 117.694 116.429 1.265 1
1 17 . 40 1 1 A 17 17 ALA H H 16 8.333 8.016 0.317 1
1 18 . 40 1 1 A 17 17 ALA HA H 16 4.252 4.068 0.184 1
1 22 . 40 1 1 A 17 17 ALA CA C 16 53.377 54.513 -1.136 1
1 23 . 40 1 1 A 17 17 ALA CB C 16 18.896 18.569 0.327 1
1 24 . 40 1 1 A 17 17 ALA N N 16 125.462 124.075 1.387 1
1 25 . 40 1 1 A 18 18 SER H H 17 8.219 7.869 0.350 1
1 26 . 40 1 1 A 18 18 SER HA H 17 4.332 4.523 -0.191 1
1 29 . 40 1 1 A 18 18 SER CA C 17 59.105 57.916 1.189 1
1 30 . 40 1 1 A 18 18 SER CB C 17 63.592 63.808 -0.216 1
1 31 . 40 1 1 A 18 18 SER N N 17 114.821 112.011 2.810 1
1 32 . 40 1 1 A 19 19 ASP H H 18 8.309 7.830 0.479 1
1 33 . 40 1 1 A 19 19 ASP HA H 18 4.554 4.672 -0.118 1
1 36 . 40 1 1 A 19 19 ASP C C 18 176.528 176.833 -0.305 1
1 37 . 40 1 1 A 19 19 ASP CA C 18 55.272 53.418 1.854 1
1 38 . 40 1 1 A 19 19 ASP CB C 18 40.883 42.274 -1.391 1
1 39 . 40 1 1 A 19 19 ASP N N 18 123.367 121.631 1.736 1
1 40 . 40 1 1 A 20 20 ALA H H 19 8.133 8.862 -0.729 1
1 41 . 40 1 1 A 20 20 ALA HA H 19 4.170 4.014 0.156 1
1 45 . 40 1 1 A 20 20 ALA C C 19 179.857 179.618 0.239 1
1 46 . 40 1 1 A 20 20 ALA CA C 19 54.341 55.145 -0.804 1
1 47 . 40 1 1 A 20 20 ALA CB C 19 18.660 18.395 0.265 1
1 48 . 40 1 1 A 20 20 ALA N N 19 123.350 126.631 -3.281 1
1 49 . 40 1 1 A 21 21 GLU H H 20 8.140 7.990 0.150 1
1 50 . 40 1 1 A 21 21 GLU HA H 20 4.128 4.054 0.074 1
1 55 . 40 1 1 A 21 21 GLU C C 20 177.675 178.402 -0.727 1
1 56 . 40 1 1 A 21 21 GLU CA C 20 58.520 59.575 -1.055 1
1 57 . 40 1 1 A 21 21 GLU CB C 20 29.765 29.481 0.284 1
1 59 . 40 1 1 A 21 21 GLU N N 20 119.063 119.393 -0.330 1
1 60 . 40 1 1 A 22 22 PHE H H 21 8.009 7.870 0.139 1
1 61 . 40 1 1 A 22 22 PHE HA H 21 4.123 4.287 -0.164 1
1 68 . 40 1 1 A 22 22 PHE C C 21 176.410 177.092 -0.682 1
1 69 . 40 1 1 A 22 22 PHE CA C 21 62.202 61.175 1.027 1
1 70 . 40 1 1 A 22 22 PHE CB C 21 39.223 39.177 0.046 1
1 75 . 40 1 1 A 22 22 PHE N N 21 121.211 120.760 0.451 1
1 76 . 40 1 1 A 23 23 ASP H H 22 8.261 8.069 0.192 1
1 77 . 40 1 1 A 23 23 ASP HA H 22 4.041 4.312 -0.271 1
1 80 . 40 1 1 A 23 23 ASP C C 22 179.078 178.701 0.377 1
1 81 . 40 1 1 A 23 23 ASP CA C 22 57.048 57.392 -0.344 1
1 82 . 40 1 1 A 23 23 ASP CB C 22 40.154 40.169 -0.015 1
1 83 . 40 1 1 A 23 23 ASP N N 22 116.876 118.446 -1.570 1
1 84 . 40 1 1 A 24 24 ALA H H 23 7.651 7.889 -0.238 1
1 85 . 40 1 1 A 24 24 ALA HA H 23 3.785 3.898 -0.113 1
1 89 . 40 1 1 A 24 24 ALA C C 23 179.577 179.475 0.102 1
1 90 . 40 1 1 A 24 24 ALA CA C 23 54.341 54.990 -0.649 1
1 91 . 40 1 1 A 24 24 ALA CB C 23 17.762 18.331 -0.569 1
1 92 . 40 1 1 A 24 24 ALA N N 23 121.873 123.261 -1.388 1
1 93 . 40 1 1 A 25 25 VAL H H 24 7.718 7.784 -0.066 1
1 94 . 40 1 1 A 25 25 VAL HA H 24 3.216 3.531 -0.315 1
1 102 . 40 1 1 A 25 25 VAL C C 24 177.805 178.365 -0.560 1
1 103 . 40 1 1 A 25 25 VAL CA C 24 66.789 66.697 0.092 1
1 104 . 40 1 1 A 25 25 VAL CB C 24 31.277 31.294 -0.017 1
1 107 . 40 1 1 A 25 25 VAL N N 24 117.890 118.052 -0.162 1
1 108 . 40 1 1 A 26 26 VAL H H 25 7.867 7.715 0.152 1
1 109 . 40 1 1 A 26 26 VAL HA H 25 3.274 3.510 -0.236 1
1 117 . 40 1 1 A 26 26 VAL C C 25 177.788 177.673 0.115 1
1 118 . 40 1 1 A 26 26 VAL CA C 25 67.282 66.411 0.871 1
1 119 . 40 1 1 A 26 26 VAL CB C 25 31.266 31.389 -0.123 1
1 122 . 40 1 1 A 26 26 VAL N N 25 118.170 120.152 -1.982 1
1 123 . 40 1 1 A 27 27 GLY H H 26 7.544 7.599 -0.055 1
1 124 . 40 1 1 A 27 27 GLY HA2 H 26 3.592 3.506 0.086 1
1 125 . 40 1 1 A 27 27 GLY HA3 H 26 3.721 3.623 0.098 1
1 126 . 40 1 1 A 27 27 GLY C C 26 176.717 176.400 0.317 1
1 127 . 40 1 1 A 27 27 GLY CA C 26 47.085 47.186 -0.101 1
1 128 . 40 1 1 A 27 27 GLY N N 26 105.795 107.516 -1.721 1
1 129 . 40 1 1 A 28 28 TYR H H 27 7.625 7.365 0.260 1
1 130 . 40 1 1 A 28 28 TYR HA H 27 4.546 4.579 -0.033 1
1 137 . 40 1 1 A 28 28 TYR C C 27 178.991 178.126 0.865 1
1 138 . 40 1 1 A 28 28 TYR CA C 27 58.845 59.710 -0.865 1
1 139 . 40 1 1 A 28 28 TYR CB C 27 37.602 37.557 0.045 1
1 144 . 40 1 1 A 28 28 TYR N N 27 119.933 121.703 -1.770 1
1 145 . 40 1 1 A 29 29 LEU H H 28 8.517 8.518 -0.001 1
1 146 . 40 1 1 A 29 29 LEU HA H 28 3.728 3.852 -0.124 1
1 156 . 40 1 1 A 29 29 LEU CA C 28 58.281 57.958 0.323 1
1 157 . 40 1 1 A 29 29 LEU CB C 28 41.948 41.415 0.533 1
1 161 . 40 1 1 A 29 29 LEU N N 28 119.669 120.140 -0.471 1
1 162 . 40 1 1 A 30 30 GLU H H 29 8.072 8.063 0.009 1
1 163 . 40 1 1 A 30 30 GLU HA H 29 3.722 3.842 -0.120 1
1 168 . 40 1 1 A 30 30 GLU C C 29 177.731 178.849 -1.118 1
1 169 . 40 1 1 A 30 30 GLU CA C 29 59.763 59.940 -0.177 1
1 170 . 40 1 1 A 30 30 GLU CB C 29 28.844 29.339 -0.495 1
1 172 . 40 1 1 A 30 30 GLU N N 29 117.666 117.659 0.007 1
1 173 . 40 1 1 A 31 31 ASP H H 30 7.243 7.974 -0.731 1
1 174 . 40 1 1 A 31 31 ASP HA H 30 4.297 4.372 -0.075 1
1 177 . 40 1 1 A 31 31 ASP CA C 30 56.953 57.428 -0.475 1
1 178 . 40 1 1 A 31 31 ASP CB C 30 40.730 41.967 -1.237 1
1 179 . 40 1 1 A 31 31 ASP N N 30 116.720 119.024 -2.304 1
1 180 . 40 1 1 A 32 32 ILE H H 31 7.940 7.488 0.452 1
1 181 . 40 1 1 A 32 32 ILE HA H 31 3.640 3.681 -0.041 1
1 191 . 40 1 1 A 32 32 ILE C C 31 177.980 178.025 -0.045 1
1 192 . 40 1 1 A 32 32 ILE CA C 31 64.692 64.292 0.400 1
1 193 . 40 1 1 A 32 32 ILE CB C 31 38.938 37.183 1.755 1
1 197 . 40 1 1 A 32 32 ILE N N 31 119.728 118.918 0.810 1
1 198 . 40 1 1 A 33 33 ILE H H 32 7.984 7.868 0.116 1
1 199 . 40 1 1 A 33 33 ILE HA H 32 3.598 2.438 1.160 1
1 209 . 40 1 1 A 33 33 ILE C C 32 176.723 176.811 -0.088 1
1 210 . 40 1 1 A 33 33 ILE CA C 32 63.241 64.259 -1.018 1
1 211 . 40 1 1 A 33 33 ILE CB C 32 37.580 37.387 0.193 1
1 215 . 40 1 1 A 33 33 ILE N N 32 113.919 120.482 -6.563 1
1 216 . 40 1 1 A 34 34 MET H H 33 7.288 7.760 -0.472 1
1 217 . 40 1 1 A 34 34 MET HA H 33 4.496 4.616 -0.120 1
1 225 . 40 1 1 A 34 34 MET C C 33 176.423 175.732 0.691 1
1 226 . 40 1 1 A 34 34 MET CA C 33 54.634 54.318 0.316 1
1 227 . 40 1 1 A 34 34 MET CB C 33 31.934 31.346 0.588 1
1 230 . 40 1 1 A 34 34 MET N N 33 115.130 116.937 -1.807 1
1 231 . 40 1 1 A 35 35 ASP H H 34 7.405 7.472 -0.067 1
1 232 . 40 1 1 A 35 35 ASP HA H 34 4.484 4.545 -0.061 1
1 235 . 40 1 1 A 35 35 ASP C C 34 177.139 176.923 0.216 1
1 236 . 40 1 1 A 35 35 ASP CA C 34 54.625 54.715 -0.090 1
1 237 . 40 1 1 A 35 35 ASP CB C 34 43.554 42.909 0.645 1
1 238 . 40 1 1 A 35 35 ASP N N 34 121.814 121.868 -0.054 1
1 239 . 40 1 1 A 36 36 ASP H H 35 8.765 8.826 -0.061 1
1 240 . 40 1 1 A 36 36 ASP HA H 35 4.235 4.343 -0.108 1
1 243 . 40 1 1 A 36 36 ASP C C 35 178.320 178.068 0.252 1
1 244 . 40 1 1 A 36 36 ASP CA C 35 57.832 57.960 -0.128 1
1 245 . 40 1 1 A 36 36 ASP CB C 35 40.914 40.431 0.483 1
1 246 . 40 1 1 A 36 36 ASP N N 35 125.883 125.200 0.683 1
1 247 . 40 1 1 A 37 37 GLU H H 36 8.905 8.397 0.508 1
1 248 . 40 1 1 A 37 37 GLU HA H 36 3.933 4.102 -0.169 1
1 253 . 40 1 1 A 37 37 GLU C C 36 179.304 179.063 0.241 1
1 254 . 40 1 1 A 37 37 GLU CA C 36 59.828 58.989 0.839 1
1 255 . 40 1 1 A 37 37 GLU CB C 36 29.380 29.685 -0.305 1
1 257 . 40 1 1 A 37 37 GLU N N 36 119.077 119.892 -0.815 1
1 258 . 40 1 1 A 38 38 PHE H H 37 7.460 8.527 -1.067 1
1 259 . 40 1 1 A 38 38 PHE HA H 37 3.642 4.082 -0.440 1
1 267 . 40 1 1 A 38 38 PHE C C 37 176.483 177.808 -1.325 1
1 268 . 40 1 1 A 38 38 PHE CA C 37 61.411 61.023 0.388 1
1 269 . 40 1 1 A 38 38 PHE CB C 37 39.355 39.195 0.160 1
1 275 . 40 1 1 A 38 38 PHE N N 37 119.968 123.159 -3.191 1
1 276 . 40 1 1 A 39 39 GLN H H 38 7.968 8.133 -0.165 1
1 277 . 40 1 1 A 39 39 GLN HA H 38 3.712 3.813 -0.101 1
1 284 . 40 1 1 A 39 39 GLN CA C 38 59.153 58.864 0.289 1
1 285 . 40 1 1 A 39 39 GLN CB C 38 28.213 28.124 0.089 1
1 287 . 40 1 1 A 39 39 GLN N N 38 116.433 118.679 -2.246 1
1 289 . 40 1 1 A 40 40 LEU H H 39 7.930 7.881 0.049 1
1 290 . 40 1 1 A 40 40 LEU HA H 39 3.916 4.016 -0.100 1
1 300 . 40 1 1 A 40 40 LEU C C 39 177.731 178.395 -0.664 1
1 301 . 40 1 1 A 40 40 LEU CA C 39 57.915 58.230 -0.315 1
1 302 . 40 1 1 A 40 40 LEU CB C 39 41.989 41.758 0.231 1
1 306 . 40 1 1 A 40 40 LEU N N 39 119.505 121.997 -2.492 1
1 307 . 40 1 1 A 41 41 LEU H H 40 7.174 8.011 -0.837 1
1 308 . 40 1 1 A 41 41 LEU HA H 40 3.835 4.069 -0.234 1
1 318 . 40 1 1 A 41 41 LEU C C 40 179.738 178.671 1.067 1
1 319 . 40 1 1 A 41 41 LEU CA C 40 58.266 57.973 0.293 1
1 320 . 40 1 1 A 41 41 LEU CB C 40 42.050 40.889 1.161 1
1 324 . 40 1 1 A 41 41 LEU N N 40 120.971 119.661 1.310 1
1 325 . 40 1 1 A 42 42 GLN H H 41 8.058 8.013 0.045 1
1 326 . 40 1 1 A 42 42 GLN HA H 41 3.556 3.747 -0.191 1
1 333 . 40 1 1 A 42 42 GLN C C 41 177.642 178.230 -0.588 1
1 334 . 40 1 1 A 42 42 GLN CA C 41 59.826 58.764 1.062 1
1 335 . 40 1 1 A 42 42 GLN CB C 41 28.762 28.153 0.609 1
1 337 . 40 1 1 A 42 42 GLN N N 41 117.899 118.584 -0.685 1
1 339 . 40 1 1 A 43 43 ARG H H 42 8.179 8.016 0.163 1
1 340 . 40 1 1 A 43 43 ARG HA H 42 3.655 3.962 -0.307 1
1 347 . 40 1 1 A 43 43 ARG C C 42 178.051 178.414 -0.363 1
1 348 . 40 1 1 A 43 43 ARG CA C 42 59.766 58.713 1.053 1
1 349 . 40 1 1 A 43 43 ARG CB C 42 29.941 29.695 0.246 1
1 352 . 40 1 1 A 43 43 ARG N N 42 119.392 119.695 -0.303 1
1 353 . 40 1 1 A 44 44 ASN H H 43 8.525 8.228 0.297 1
1 354 . 40 1 1 A 44 44 ASN HA H 43 4.332 4.389 -0.057 1
1 359 . 40 1 1 A 44 44 ASN C C 43 178.150 177.844 0.306 1
1 360 . 40 1 1 A 44 44 ASN CA C 43 55.841 56.205 -0.364 1
1 361 . 40 1 1 A 44 44 ASN CB C 43 37.632 39.352 -1.720 1
1 362 . 40 1 1 A 44 44 ASN N N 43 116.214 117.891 -1.677 1
1 364 . 40 1 1 A 45 45 PHE H H 44 7.586 7.891 -0.305 1
1 365 . 40 1 1 A 45 45 PHE HA H 44 4.132 4.320 -0.188 1
1 372 . 40 1 1 A 45 45 PHE C C 44 176.691 178.750 -2.059 1
1 373 . 40 1 1 A 45 45 PHE CA C 44 62.333 60.887 1.446 1
1 374 . 40 1 1 A 45 45 PHE CB C 44 39.449 38.780 0.669 1
1 379 . 40 1 1 A 45 45 PHE N N 44 121.501 117.656 3.845 1
1 380 . 40 1 1 A 46 46 MET H H 45 8.190 8.177 0.013 1
1 381 . 40 1 1 A 46 46 MET HA H 45 4.060 4.275 -0.215 1
1 389 . 40 1 1 A 46 46 MET C C 45 179.754 178.177 1.577 1
1 390 . 40 1 1 A 46 46 MET CA C 45 57.742 57.914 -0.172 1
1 391 . 40 1 1 A 46 46 MET CB C 45 29.912 31.246 -1.334 1
1 394 . 40 1 1 A 46 46 MET N N 45 116.727 117.950 -1.223 1
1 395 . 40 1 1 A 47 47 ASP H H 46 8.579 8.380 0.199 1
1 396 . 40 1 1 A 47 47 ASP HA H 46 4.804 4.677 0.127 1
1 399 . 40 1 1 A 47 47 ASP C C 46 177.854 178.504 -0.650 1
1 400 . 40 1 1 A 47 47 ASP CA C 46 57.277 57.305 -0.028 1
1 401 . 40 1 1 A 47 47 ASP CB C 46 40.776 41.631 -0.855 1
1 402 . 40 1 1 A 47 47 ASP N N 46 117.798 120.711 -2.913 1
1 403 . 40 1 1 A 48 48 LYS H H 47 7.339 7.855 -0.516 1
1 404 . 40 1 1 A 48 48 LYS HA H 47 3.828 4.211 -0.383 1
1 413 . 40 1 1 A 48 48 LYS C C 47 178.812 178.664 0.148 1
1 414 . 40 1 1 A 48 48 LYS CA C 47 58.953 58.434 0.519 1
1 415 . 40 1 1 A 48 48 LYS CB C 47 32.796 32.829 -0.033 1
1 419 . 40 1 1 A 48 48 LYS N N 47 117.852 119.720 -1.868 1
1 420 . 40 1 1 A 49 49 TYR H H 48 6.841 8.631 -1.790 1
1 421 . 40 1 1 A 49 49 TYR HA H 48 4.995 4.243 0.752 1
1 428 . 40 1 1 A 49 49 TYR C C 48 178.138 178.509 -0.371 1
1 429 . 40 1 1 A 49 49 TYR CA C 48 58.620 59.810 -1.190 1
1 430 . 40 1 1 A 49 49 TYR CB C 48 42.939 38.324 4.615 1
1 435 . 40 1 1 A 49 49 TYR N N 48 112.109 119.767 -7.658 1
1 436 . 40 1 1 A 50 50 TYR H H 49 8.491 8.074 0.417 1
1 437 . 40 1 1 A 50 50 TYR HA H 49 4.598 4.145 0.453 1
1 444 . 40 1 1 A 50 50 TYR C C 49 176.015 177.951 -1.936 1
1 445 . 40 1 1 A 50 50 TYR CA C 49 62.442 59.719 2.723 1
1 446 . 40 1 1 A 50 50 TYR CB C 49 36.588 37.249 -0.661 1
1 451 . 40 1 1 A 50 50 TYR N N 49 118.294 119.856 -1.562 1
1 452 . 40 1 1 A 51 51 LEU H H 50 7.512 7.731 -0.219 1
1 453 . 40 1 1 A 51 51 LEU HA H 50 3.878 3.363 0.515 1
1 463 . 40 1 1 A 51 51 LEU C C 50 178.625 178.735 -0.110 1
1 464 . 40 1 1 A 51 51 LEU CA C 50 55.994 57.431 -1.437 1
1 465 . 40 1 1 A 51 51 LEU CB C 50 40.743 41.280 -0.537 1
1 469 . 40 1 1 A 51 51 LEU N N 50 118.478 121.607 -3.129 1
1 470 . 40 1 1 A 52 52 GLU H H 51 8.042 7.801 0.241 1
1 471 . 40 1 1 A 52 52 GLU HA H 51 4.197 3.930 0.267 1
1 476 . 40 1 1 A 52 52 GLU C C 51 177.629 177.729 -0.100 1
1 477 . 40 1 1 A 52 52 GLU CA C 51 56.141 59.533 -3.392 1
1 478 . 40 1 1 A 52 52 GLU CB C 51 29.162 29.064 0.098 1
1 480 . 40 1 1 A 52 52 GLU N N 51 115.067 117.852 -2.785 1
1 481 . 40 1 1 A 53 53 PHE H H 52 7.465 7.909 -0.444 1
1 482 . 40 1 1 A 53 53 PHE HA H 52 4.431 4.598 -0.167 1
1 490 . 40 1 1 A 53 53 PHE C C 52 174.325 174.811 -0.486 1
1 491 . 40 1 1 A 53 53 PHE CA C 52 58.986 57.148 1.838 1
1 492 . 40 1 1 A 53 53 PHE CB C 52 40.183 37.737 2.446 1
1 498 . 40 1 1 A 53 53 PHE N N 52 116.768 119.323 -2.555 1
1 499 . 40 1 1 A 54 54 GLU H H 53 7.484 8.625 -1.141 1
1 500 . 40 1 1 A 54 54 GLU HA H 53 4.583 4.794 -0.211 1
1 505 . 40 1 1 A 54 54 GLU C C 53 175.722 175.746 -0.024 1
1 506 . 40 1 1 A 54 54 GLU CA C 53 54.248 55.355 -1.107 1
1 507 . 40 1 1 A 54 54 GLU CB C 53 34.409 31.799 2.610 1
1 509 . 40 1 1 A 54 54 GLU N N 53 118.844 124.409 -5.565 1
1 510 . 40 1 1 A 55 55 ASP H H 54 9.008 8.610 0.398 1
1 511 . 40 1 1 A 55 55 ASP HA H 54 4.735 4.758 -0.023 1
1 514 . 40 1 1 A 55 55 ASP C C 54 175.421 176.051 -0.630 1
1 515 . 40 1 1 A 55 55 ASP CA C 54 52.888 53.970 -1.082 1
1 516 . 40 1 1 A 55 55 ASP CB C 54 38.894 39.969 -1.075 1
1 517 . 40 1 1 A 55 55 ASP N N 54 123.654 123.826 -0.172 1
1 518 . 40 1 1 A 56 56 THR H H 55 7.819 8.300 -0.481 1
1 519 . 40 1 1 A 56 56 THR HA H 55 4.574 4.988 -0.414 1
1 524 . 40 1 1 A 56 56 THR C C 55 174.096 174.132 -0.036 1
1 525 . 40 1 1 A 56 56 THR CA C 55 59.172 60.367 -1.195 1
1 526 . 40 1 1 A 56 56 THR CB C 55 71.889 71.937 -0.048 1
1 528 . 40 1 1 A 56 56 THR N N 55 112.015 114.616 -2.601 1
1 529 . 40 1 1 A 57 57 GLU H H 56 8.527 8.564 -0.037 1
1 530 . 40 1 1 A 57 57 GLU HA H 56 4.217 4.644 -0.427 1
1 535 . 40 1 1 A 57 57 GLU C C 56 177.042 176.525 0.517 1
1 536 . 40 1 1 A 57 57 GLU CA C 56 56.869 55.886 0.983 1
1 537 . 40 1 1 A 57 57 GLU CB C 56 29.731 31.496 -1.765 1
1 539 . 40 1 1 A 57 57 GLU N N 56 117.531 119.114 -1.583 1
1 540 . 40 1 1 A 58 58 GLU H H 57 7.587 7.744 -0.157 1
1 541 . 40 1 1 A 58 58 GLU HA H 57 3.941 4.550 -0.609 1
1 546 . 40 1 1 A 58 58 GLU C C 57 176.849 176.079 0.770 1
1 547 . 40 1 1 A 58 58 GLU CA C 57 56.924 55.567 1.357 1
1 548 . 40 1 1 A 58 58 GLU CB C 57 30.251 30.789 -0.538 1
1 550 . 40 1 1 A 58 58 GLU N N 57 119.183 120.914 -1.731 1
1 551 . 40 1 1 A 59 59 ASN H H 58 9.120 8.704 0.416 1
1 552 . 40 1 1 A 59 59 ASN HA H 58 4.922 5.360 -0.438 1
1 557 . 40 1 1 A 59 59 ASN C C 58 174.254 174.502 -0.248 1
1 558 . 40 1 1 A 59 59 ASN CA C 58 51.956 52.908 -0.952 1
1 559 . 40 1 1 A 59 59 ASN CB C 58 37.404 40.410 -3.006 1
1 560 . 40 1 1 A 59 59 ASN N N 58 126.767 120.280 6.487 1
1 562 . 40 1 1 A 60 60 LYS H H 59 5.892 8.964 -3.072 1
1 563 . 40 1 1 A 60 60 LYS HA H 59 3.798 4.839 -1.041 1
1 572 . 40 1 1 A 60 60 LYS C C 59 177.908 177.098 0.810 1
1 573 . 40 1 1 A 60 60 LYS CA C 59 56.623 54.765 1.858 1
1 574 . 40 1 1 A 60 60 LYS CB C 59 32.279 34.739 -2.460 1
1 578 . 40 1 1 A 60 60 LYS N N 59 121.527 122.672 -1.145 1
1 579 . 40 1 1 A 61 61 LEU H H 60 8.473 8.820 -0.347 1
1 580 . 40 1 1 A 61 61 LEU HA H 60 3.891 4.210 -0.319 1
1 590 . 40 1 1 A 61 61 LEU C C 60 179.843 178.681 1.162 1
1 591 . 40 1 1 A 61 61 LEU CA C 60 58.301 56.398 1.903 1
1 592 . 40 1 1 A 61 61 LEU CB C 60 41.305 41.415 -0.110 1
1 596 . 40 1 1 A 61 61 LEU N N 60 125.639 123.581 2.058 1
1 597 . 40 1 1 A 62 62 ILE H H 61 7.698 7.716 -0.018 1
1 598 . 40 1 1 A 62 62 ILE HA H 61 3.952 3.843 0.109 1
1 608 . 40 1 1 A 62 62 ILE C C 61 175.392 177.157 -1.765 1
1 609 . 40 1 1 A 62 62 ILE CA C 61 61.743 63.124 -1.381 1
1 610 . 40 1 1 A 62 62 ILE CB C 61 39.108 37.661 1.447 1
1 614 . 40 1 1 A 62 62 ILE N N 61 114.111 119.692 -5.581 1
1 615 . 40 1 1 A 63 63 TYR H H 62 7.273 7.154 0.119 1
1 616 . 40 1 1 A 63 63 TYR HA H 62 4.343 4.228 0.115 1
1 623 . 40 1 1 A 63 63 TYR C C 62 178.264 178.604 -0.340 1
1 624 . 40 1 1 A 63 63 TYR CA C 62 57.231 60.970 -3.739 1
1 625 . 40 1 1 A 63 63 TYR CB C 62 36.332 37.558 -1.226 1
1 630 . 40 1 1 A 63 63 TYR N N 62 117.689 121.430 -3.741 1
1 631 . 40 1 1 A 64 64 THR H H 63 7.747 7.917 -0.170 1
1 632 . 40 1 1 A 64 64 THR HA H 63 4.266 4.237 0.029 1
1 637 . 40 1 1 A 64 64 THR CA C 63 69.362 67.561 1.801 1
1 638 . 40 1 1 A 64 64 THR CB C 63 66.962 67.909 -0.947 1
1 640 . 40 1 1 A 64 64 THR N N 63 113.755 116.061 -2.306 1
1 641 . 40 1 1 A 65 65 PRO HA H 64 4.372 4.391 -0.019 1
1 648 . 40 1 1 A 65 65 PRO C C 64 179.913 179.406 0.507 1
1 649 . 40 1 1 A 65 65 PRO CA C 64 66.011 66.299 -0.288 1
1 650 . 40 1 1 A 65 65 PRO CB C 64 30.642 30.755 -0.113 1
1 653 . 40 1 1 A 66 66 ILE H H 65 7.377 7.358 0.019 1
1 654 . 40 1 1 A 66 66 ILE HA H 65 3.530 3.897 -0.367 1
1 664 . 40 1 1 A 66 66 ILE C C 65 177.543 178.511 -0.968 1
1 665 . 40 1 1 A 66 66 ILE CA C 65 66.647 64.366 2.281 1
1 666 . 40 1 1 A 66 66 ILE CB C 65 38.029 37.817 0.212 1
1 670 . 40 1 1 A 66 66 ILE N N 65 118.353 116.657 1.696 1
1 671 . 40 1 1 A 67 67 PHE H H 66 8.480 8.330 0.150 1
1 672 . 40 1 1 A 67 67 PHE HA H 66 4.115 4.222 -0.107 1
1 680 . 40 1 1 A 67 67 PHE C C 66 177.293 177.492 -0.199 1
1 681 . 40 1 1 A 67 67 PHE CA C 66 59.570 62.254 -2.684 1
1 682 . 40 1 1 A 67 67 PHE CB C 66 38.865 39.292 -0.427 1
1 688 . 40 1 1 A 67 67 PHE N N 66 122.420 120.573 1.847 1
1 689 . 40 1 1 A 68 68 ASN H H 67 8.595 8.546 0.049 1
1 690 . 40 1 1 A 68 68 ASN HA H 67 4.211 4.440 -0.229 1
1 695 . 40 1 1 A 68 68 ASN C C 67 178.697 178.107 0.590 1
1 696 . 40 1 1 A 68 68 ASN CA C 67 56.056 56.211 -0.155 1
1 697 . 40 1 1 A 68 68 ASN CB C 67 37.704 38.130 -0.426 1
1 698 . 40 1 1 A 68 68 ASN N N 67 115.573 117.527 -1.954 1
1 700 . 40 1 1 A 69 69 GLU H H 68 8.414 8.027 0.387 1
1 701 . 40 1 1 A 69 69 GLU HA H 68 4.102 4.166 -0.064 1
1 706 . 40 1 1 A 69 69 GLU C C 68 177.880 178.776 -0.896 1
1 707 . 40 1 1 A 69 69 GLU CA C 68 59.399 59.478 -0.079 1
1 708 . 40 1 1 A 69 69 GLU CB C 68 29.855 29.506 0.349 1
1 710 . 40 1 1 A 69 69 GLU N N 68 123.510 119.987 3.523 1
1 711 . 40 1 1 A 70 70 TYR H H 69 8.659 8.275 0.384 1
1 712 . 40 1 1 A 70 70 TYR HA H 69 3.362 4.072 -0.710 1
1 719 . 40 1 1 A 70 70 TYR C C 69 178.143 177.322 0.821 1
1 720 . 40 1 1 A 70 70 TYR CA C 69 60.686 60.970 -0.284 1
1 721 . 40 1 1 A 70 70 TYR CB C 69 38.560 38.831 -0.271 1
1 726 . 40 1 1 A 70 70 TYR N N 69 122.130 120.475 1.655 1
1 727 . 40 1 1 A 71 71 ILE H H 70 8.031 7.587 0.444 1
1 728 . 40 1 1 A 71 71 ILE HA H 70 3.265 3.653 -0.388 1
1 738 . 40 1 1 A 71 71 ILE C C 70 178.056 177.938 0.118 1
1 739 . 40 1 1 A 71 71 ILE CA C 70 63.756 64.114 -0.358 1
1 740 . 40 1 1 A 71 71 ILE CB C 70 37.321 37.797 -0.476 1
1 744 . 40 1 1 A 71 71 ILE N N 70 118.906 120.672 -1.766 1
1 745 . 40 1 1 A 72 72 SER H H 71 7.803 7.937 -0.134 1
1 746 . 40 1 1 A 72 72 SER HA H 71 4.029 4.239 -0.210 1
1 749 . 40 1 1 A 72 72 SER CA C 71 61.380 62.182 -0.802 1
1 750 . 40 1 1 A 72 72 SER CB C 71 63.288 62.873 0.415 1
1 751 . 40 1 1 A 72 72 SER N N 71 113.735 116.247 -2.512 1
1 752 . 40 1 1 A 73 73 LEU H H 72 7.952 7.843 0.109 1
1 753 . 40 1 1 A 73 73 LEU HA H 72 4.418 4.135 0.283 1
1 763 . 40 1 1 A 73 73 LEU C C 72 177.767 178.344 -0.577 1
1 764 . 40 1 1 A 73 73 LEU CA C 72 56.543 57.448 -0.905 1
1 765 . 40 1 1 A 73 73 LEU CB C 72 44.517 41.752 2.765 1
1 769 . 40 1 1 A 73 73 LEU N N 72 119.411 122.175 -2.764 1
1 770 . 40 1 1 A 74 74 VAL H H 73 8.021 7.731 0.290 1
1 771 . 40 1 1 A 74 74 VAL HA H 73 3.532 3.314 0.218 1
1 779 . 40 1 1 A 74 74 VAL C C 73 177.126 177.956 -0.830 1
1 780 . 40 1 1 A 74 74 VAL CA C 73 66.250 66.295 -0.045 1
1 781 . 40 1 1 A 74 74 VAL CB C 73 31.212 31.138 0.074 1
1 784 . 40 1 1 A 74 74 VAL N N 73 118.747 119.094 -0.347 1
1 785 . 40 1 1 A 75 75 GLU H H 74 7.232 7.962 -0.730 1
1 786 . 40 1 1 A 75 75 GLU HA H 74 3.013 4.195 -1.182 1
1 791 . 40 1 1 A 75 75 GLU C C 74 178.804 178.987 -0.183 1
1 792 . 40 1 1 A 75 75 GLU CA C 74 60.536 59.801 0.735 1
1 793 . 40 1 1 A 75 75 GLU CB C 74 27.009 29.144 -2.135 1
1 795 . 40 1 1 A 75 75 GLU N N 74 118.660 119.864 -1.204 1
1 796 . 40 1 1 A 76 76 LYS H H 75 7.051 7.851 -0.800 1
1 797 . 40 1 1 A 76 76 LYS HA H 75 3.765 4.043 -0.278 1
1 806 . 40 1 1 A 76 76 LYS C C 75 177.765 178.816 -1.051 1
1 807 . 40 1 1 A 76 76 LYS CA C 75 58.357 58.920 -0.563 1
1 808 . 40 1 1 A 76 76 LYS CB C 75 31.939 31.880 0.059 1
1 812 . 40 1 1 A 76 76 LYS N N 75 116.112 119.505 -3.393 1
1 813 . 40 1 1 A 77 77 TYR H H 76 7.067 7.780 -0.713 1
1 814 . 40 1 1 A 77 77 TYR HA H 76 4.036 4.079 -0.043 1
1 821 . 40 1 1 A 77 77 TYR C C 76 177.752 177.298 0.454 1
1 822 . 40 1 1 A 77 77 TYR CA C 76 61.820 61.296 0.524 1
1 823 . 40 1 1 A 77 77 TYR CB C 76 38.480 38.639 -0.159 1
1 828 . 40 1 1 A 77 77 TYR N N 76 118.434 120.727 -2.293 1
1 829 . 40 1 1 A 78 78 ILE H H 77 7.554 8.150 -0.596 1
1 830 . 40 1 1 A 78 78 ILE HA H 77 3.159 3.527 -0.368 1
1 840 . 40 1 1 A 78 78 ILE C C 77 177.341 177.897 -0.556 1
1 841 . 40 1 1 A 78 78 ILE CA C 77 65.177 64.871 0.306 1
1 842 . 40 1 1 A 78 78 ILE CB C 77 37.339 37.434 -0.095 1
1 846 . 40 1 1 A 78 78 ILE N N 77 117.672 120.632 -2.960 1
1 847 . 40 1 1 A 79 79 GLU H H 78 8.296 7.983 0.313 1
1 848 . 40 1 1 A 79 79 GLU HA H 78 3.557 3.756 -0.199 1
1 853 . 40 1 1 A 79 79 GLU C C 78 177.742 178.580 -0.838 1
1 854 . 40 1 1 A 79 79 GLU CA C 78 60.847 60.035 0.812 1
1 855 . 40 1 1 A 79 79 GLU CB C 78 29.594 29.121 0.473 1
1 857 . 40 1 1 A 79 79 GLU N N 78 118.701 120.750 -2.049 1
1 858 . 40 1 1 A 80 80 GLU H H 79 8.330 8.411 -0.081 1
1 859 . 40 1 1 A 80 80 GLU HA H 79 3.774 3.926 -0.152 1
1 864 . 40 1 1 A 80 80 GLU C C 79 179.926 179.397 0.529 1
1 865 . 40 1 1 A 80 80 GLU CA C 79 59.581 58.985 0.596 1
1 866 . 40 1 1 A 80 80 GLU CB C 79 29.062 29.101 -0.039 1
1 868 . 40 1 1 A 80 80 GLU N N 79 116.767 117.945 -1.178 1
1 869 . 40 1 1 A 81 81 GLN H H 80 7.634 7.609 0.025 1
1 870 . 40 1 1 A 81 81 GLN HA H 80 3.605 3.862 -0.257 1
1 877 . 40 1 1 A 81 81 GLN C C 80 179.681 178.381 1.300 1
1 878 . 40 1 1 A 81 81 GLN CA C 80 57.765 58.428 -0.663 1
1 879 . 40 1 1 A 81 81 GLN CB C 80 28.079 28.096 -0.017 1
1 881 . 40 1 1 A 81 81 GLN N N 80 116.325 118.641 -2.316 1
1 883 . 40 1 1 A 82 82 LEU H H 81 8.156 7.471 0.685 1
1 884 . 40 1 1 A 82 82 LEU HA H 81 3.536 3.807 -0.271 1
1 894 . 40 1 1 A 82 82 LEU C C 81 178.945 179.417 -0.472 1
1 895 . 40 1 1 A 82 82 LEU CA C 81 57.761 56.800 0.961 1
1 896 . 40 1 1 A 82 82 LEU CB C 81 40.961 41.001 -0.040 1
1 900 . 40 1 1 A 82 82 LEU N N 81 121.546 120.459 1.087 1
1 901 . 40 1 1 A 83 83 LEU H H 82 8.326 8.169 0.157 1
1 902 . 40 1 1 A 83 83 LEU HA H 82 4.198 4.186 0.012 1
1 912 . 40 1 1 A 83 83 LEU C C 82 178.631 179.249 -0.618 1
1 913 . 40 1 1 A 83 83 LEU CA C 82 57.016 56.953 0.063 1
1 914 . 40 1 1 A 83 83 LEU CB C 82 42.182 40.881 1.301 1
1 918 . 40 1 1 A 83 83 LEU N N 82 120.426 118.905 1.521 1
1 919 . 40 1 1 A 84 84 GLN H H 83 6.992 7.533 -0.541 1
1 920 . 40 1 1 A 84 84 GLN HA H 83 3.877 4.021 -0.144 1
1 927 . 40 1 1 A 84 84 GLN C C 83 177.008 176.830 0.178 1
1 928 . 40 1 1 A 84 84 GLN CA C 83 57.543 58.290 -0.747 1
1 929 . 40 1 1 A 84 84 GLN CB C 83 28.688 28.574 0.114 1
1 931 . 40 1 1 A 84 84 GLN N N 83 114.001 117.269 -3.268 1
1 933 . 40 1 1 A 85 85 ARG H H 84 7.072 7.375 -0.303 1
1 934 . 40 1 1 A 85 85 ARG HA H 84 4.047 4.400 -0.353 1
1 942 . 40 1 1 A 85 85 ARG C C 84 175.999 174.941 1.058 1
1 943 . 40 1 1 A 85 85 ARG CA C 84 56.764 55.607 1.157 1
1 944 . 40 1 1 A 85 85 ARG CB C 84 32.044 32.068 -0.024 1
1 947 . 40 1 1 A 85 85 ARG N N 84 115.827 116.765 -0.938 1
1 949 . 40 1 1 A 86 86 ILE H H 85 8.238 7.421 0.817 1
1 950 . 40 1 1 A 86 86 ILE HA H 85 4.389 4.572 -0.183 1
1 960 . 40 1 1 A 86 86 ILE CA C 85 58.007 57.967 0.040 1
1 961 . 40 1 1 A 86 86 ILE CB C 85 39.604 39.005 0.599 1
1 965 . 40 1 1 A 86 86 ILE N N 85 119.285 119.168 0.117 1
1 966 . 40 1 1 A 87 87 PRO HA H 86 4.392 4.531 -0.139 1
1 973 . 40 1 1 A 87 87 PRO C C 86 177.622 177.553 0.069 1
1 974 . 40 1 1 A 87 87 PRO CA C 86 64.665 64.307 0.358 1
1 975 . 40 1 1 A 87 87 PRO CB C 86 32.020 31.776 0.244 1
1 978 . 40 1 1 A 88 88 GLU H H 87 8.312 8.619 -0.307 1
1 979 . 40 1 1 A 88 88 GLU HA H 87 4.208 4.393 -0.185 1
1 984 . 40 1 1 A 88 88 GLU C C 87 175.554 176.584 -1.030 1
1 985 . 40 1 1 A 88 88 GLU CA C 87 56.045 55.838 0.207 1
1 986 . 40 1 1 A 88 88 GLU CB C 87 28.654 29.199 -0.545 1
1 988 . 40 1 1 A 88 88 GLU N N 87 114.256 115.639 -1.383 1
1 989 . 40 1 1 A 89 89 PHE H H 88 7.946 7.398 0.548 1
1 990 . 40 1 1 A 89 89 PHE HA H 88 3.993 4.313 -0.320 1
1 998 . 40 1 1 A 89 89 PHE C C 88 173.460 174.689 -1.229 1
1 999 . 40 1 1 A 89 89 PHE CA C 88 60.119 59.582 0.537 1
1 1000 . 40 1 1 A 89 89 PHE CB C 88 39.994 39.678 0.316 1
1 1006 . 40 1 1 A 89 89 PHE N N 88 121.550 122.488 -0.938 1
1 1007 . 40 1 1 A 90 90 ASN H H 89 7.266 7.881 -0.615 1
1 1008 . 40 1 1 A 90 90 ASN HA H 89 4.454 5.272 -0.818 1
1 1013 . 40 1 1 A 90 90 ASN C C 89 173.921 174.875 -0.954 1
1 1014 . 40 1 1 A 90 90 ASN CA C 89 51.839 51.484 0.355 1
1 1015 . 40 1 1 A 90 90 ASN CB C 89 40.674 38.848 1.826 1
1 1016 . 40 1 1 A 90 90 ASN N N 89 125.344 123.484 1.860 1
1 1018 . 40 1 1 A 91 91 MET H H 90 8.968 8.556 0.412 1
1 1019 . 40 1 1 A 91 91 MET HA H 90 4.049 4.189 -0.140 1
1 1027 . 40 1 1 A 91 91 MET C C 90 177.475 177.961 -0.486 1
1 1028 . 40 1 1 A 91 91 MET CA C 90 57.758 57.525 0.233 1
1 1029 . 40 1 1 A 91 91 MET CB C 90 32.250 32.611 -0.361 1
1 1032 . 40 1 1 A 91 91 MET N N 90 127.052 122.768 4.284 1
1 1033 . 40 1 1 A 92 92 ALA H H 91 8.292 7.901 0.391 1
1 1034 . 40 1 1 A 92 92 ALA HA H 91 4.059 4.145 -0.086 1
1 1038 . 40 1 1 A 92 92 ALA C C 91 180.412 179.572 0.840 1
1 1039 . 40 1 1 A 92 92 ALA CA C 91 55.368 54.854 0.514 1
1 1040 . 40 1 1 A 92 92 ALA CB C 91 17.527 18.895 -1.368 1
1 1041 . 40 1 1 A 92 92 ALA N N 91 123.752 120.976 2.776 1
1 1042 . 40 1 1 A 93 93 ALA H H 92 7.931 8.022 -0.091 1
1 1043 . 40 1 1 A 93 93 ALA HA H 92 4.054 4.207 -0.153 1
1 1047 . 40 1 1 A 93 93 ALA C C 92 180.482 179.893 0.589 1
1 1048 . 40 1 1 A 93 93 ALA CA C 92 54.614 54.862 -0.248 1
1 1049 . 40 1 1 A 93 93 ALA CB C 92 18.098 18.130 -0.032 1
1 1050 . 40 1 1 A 93 93 ALA N N 92 121.158 119.978 1.180 1
1 1051 . 40 1 1 A 94 94 PHE H H 93 8.110 7.789 0.321 1
1 1052 . 40 1 1 A 94 94 PHE HA H 93 4.304 4.188 0.116 1
1 1060 . 40 1 1 A 94 94 PHE C C 93 177.350 177.126 0.224 1
1 1061 . 40 1 1 A 94 94 PHE CA C 93 61.641 61.512 0.129 1
1 1062 . 40 1 1 A 94 94 PHE CB C 93 40.014 39.163 0.851 1
1 1068 . 40 1 1 A 94 94 PHE N N 93 119.807 119.661 0.146 1
1 1069 . 40 1 1 A 95 95 THR H H 94 8.726 8.124 0.602 1
1 1070 . 40 1 1 A 95 95 THR HA H 94 3.569 4.024 -0.455 1
1 1075 . 40 1 1 A 95 95 THR C C 94 176.932 176.677 0.255 1
1 1076 . 40 1 1 A 95 95 THR CA C 94 66.833 65.387 1.446 1
1 1077 . 40 1 1 A 95 95 THR CB C 94 68.445 68.043 0.402 1
1 1079 . 40 1 1 A 95 95 THR N N 94 113.074 112.238 0.836 1
1 1080 . 40 1 1 A 96 96 THR H H 95 7.657 7.856 -0.199 1
1 1081 . 40 1 1 A 96 96 THR HA H 95 3.945 4.119 -0.174 1
1 1086 . 40 1 1 A 96 96 THR C C 95 176.386 177.364 -0.978 1
1 1087 . 40 1 1 A 96 96 THR CA C 95 66.550 65.762 0.788 1
1 1088 . 40 1 1 A 96 96 THR CB C 95 68.583 67.959 0.624 1
1 1090 . 40 1 1 A 96 96 THR N N 95 117.927 114.107 3.820 1
1 1091 . 40 1 1 A 97 97 THR H H 96 7.699 7.920 -0.221 1
1 1092 . 40 1 1 A 97 97 THR HA H 96 3.905 4.110 -0.205 1
1 1097 . 40 1 1 A 97 97 THR C C 96 176.572 176.623 -0.051 1
1 1098 . 40 1 1 A 97 97 THR CA C 96 65.979 66.700 -0.721 1
1 1099 . 40 1 1 A 97 97 THR CB C 96 68.553 68.065 0.488 1
1 1101 . 40 1 1 A 97 97 THR N N 96 118.518 118.007 0.511 1
1 1102 . 40 1 1 A 98 98 LEU H H 97 8.304 8.239 0.065 1
1 1103 . 40 1 1 A 98 98 LEU HA H 97 3.725 3.888 -0.163 1
1 1113 . 40 1 1 A 98 98 LEU C C 97 178.490 178.829 -0.339 1
1 1114 . 40 1 1 A 98 98 LEU CA C 97 58.517 57.953 0.564 1
1 1115 . 40 1 1 A 98 98 LEU CB C 97 41.697 41.087 0.610 1
1 1119 . 40 1 1 A 98 98 LEU N N 97 122.882 122.067 0.815 1
1 1120 . 40 1 1 A 99 99 GLN H H 98 7.639 7.917 -0.278 1
1 1121 . 40 1 1 A 99 99 GLN HA H 98 3.927 4.135 -0.208 1
1 1128 . 40 1 1 A 99 99 GLN C C 98 178.068 178.205 -0.137 1
1 1129 . 40 1 1 A 99 99 GLN CA C 98 58.735 58.934 -0.199 1
1 1130 . 40 1 1 A 99 99 GLN CB C 98 27.986 28.243 -0.257 1
1 1132 . 40 1 1 A 99 99 GLN N N 98 114.302 118.169 -3.867 1
1 1134 . 40 1 1 A 100 100 HIS H H 99 7.575 7.682 -0.107 1
1 1135 . 40 1 1 A 100 100 HIS HA H 99 4.524 4.431 0.093 1
1 1139 . 40 1 1 A 100 100 HIS C C 99 174.789 177.688 -2.899 1
1 1140 . 40 1 1 A 100 100 HIS CA C 99 56.154 59.370 -3.216 1
1 1141 . 40 1 1 A 100 100 HIS CB C 99 28.946 30.685 -1.739 1
1 1143 . 40 1 1 A 100 100 HIS N N 99 114.778 118.658 -3.880 1
1 1144 . 40 1 1 A 101 101 HIS H H 100 7.773 8.074 -0.301 1
1 1145 . 40 1 1 A 101 101 HIS HA H 100 4.704 4.378 0.326 1
1 1149 . 40 1 1 A 101 101 HIS C C 100 174.818 177.313 -2.495 1
1 1150 . 40 1 1 A 101 101 HIS CA C 100 54.830 58.653 -3.823 1
1 1151 . 40 1 1 A 101 101 HIS CB C 100 29.749 28.650 1.099 1
1 1153 . 40 1 1 A 101 101 HIS N N 100 117.397 117.273 0.124 1
1 1154 . 40 1 1 A 102 102 LYS H H 101 7.324 8.133 -0.809 1
1 1155 . 40 1 1 A 102 102 LYS HA H 101 3.611 4.088 -0.477 1
1 1164 . 40 1 1 A 102 102 LYS C C 101 176.823 178.130 -1.307 1
1 1165 . 40 1 1 A 102 102 LYS CA C 101 59.915 58.868 1.047 1
1 1166 . 40 1 1 A 102 102 LYS CB C 101 32.825 32.151 0.674 1
1 1170 . 40 1 1 A 102 102 LYS N N 101 120.533 122.414 -1.881 1
1 1171 . 40 1 1 A 103 103 ASP H H 102 8.361 7.864 0.497 1
1 1172 . 40 1 1 A 103 103 ASP HA H 102 4.421 4.383 0.038 1
1 1175 . 40 1 1 A 103 103 ASP C C 102 176.793 177.968 -1.175 1
1 1176 . 40 1 1 A 103 103 ASP CA C 102 55.500 56.699 -1.199 1
1 1177 . 40 1 1 A 103 103 ASP CB C 102 40.178 40.725 -0.547 1
1 1178 . 40 1 1 A 103 103 ASP N N 102 114.814 119.311 -4.497 1
1 1179 . 40 1 1 A 104 104 GLU H H 103 7.858 7.985 -0.127 1
1 1180 . 40 1 1 A 104 104 GLU HA H 103 4.339 4.263 0.076 1
1 1183 . 40 1 1 A 104 104 GLU C C 103 175.777 177.110 -1.333 1
1 1184 . 40 1 1 A 104 104 GLU CA C 103 56.356 58.202 -1.846 1
1 1185 . 40 1 1 A 104 104 GLU CB C 103 31.293 30.665 0.628 1
1 1186 . 40 1 1 A 104 104 GLU N N 103 116.826 118.507 -1.681 1
1 1187 . 40 1 1 A 105 105 VAL H H 104 7.201 7.857 -0.656 1
1 1188 . 40 1 1 A 105 105 VAL HA H 104 4.296 4.138 0.158 1
1 1196 . 40 1 1 A 105 105 VAL C C 104 174.482 175.465 -0.983 1
1 1197 . 40 1 1 A 105 105 VAL CA C 104 60.370 62.604 -2.234 1
1 1198 . 40 1 1 A 105 105 VAL CB C 104 34.341 32.747 1.594 1
1 1201 . 40 1 1 A 105 105 VAL N N 104 116.422 119.591 -3.169 1
1 1202 . 40 1 1 A 106 106 ALA H H 105 8.487 8.370 0.117 1
1 1203 . 40 1 1 A 106 106 ALA HA H 105 4.172 4.347 -0.175 1
1 1207 . 40 1 1 A 106 106 ALA C C 105 179.030 178.933 0.097 1
1 1208 . 40 1 1 A 106 106 ALA CA C 105 52.966 52.692 0.274 1
1 1209 . 40 1 1 A 106 106 ALA CB C 105 19.371 19.574 -0.203 1
1 1210 . 40 1 1 A 106 106 ALA N N 105 128.313 128.579 -0.266 1
1 1211 . 40 1 1 A 107 107 GLY H H 106 8.738 8.793 -0.055 1
1 1212 . 40 1 1 A 107 107 GLY HA2 H 106 3.773 3.868 -0.095 1
1 1213 . 40 1 1 A 107 107 GLY HA3 H 106 3.998 3.933 0.065 1
1 1214 . 40 1 1 A 107 107 GLY C C 106 174.958 175.338 -0.380 1
1 1215 . 40 1 1 A 107 107 GLY CA C 106 47.449 47.116 0.333 1
1 1216 . 40 1 1 A 107 107 GLY N N 106 110.612 110.940 -0.328 1
1 1217 . 40 1 1 A 108 108 ASP H H 107 8.535 7.833 0.702 1
1 1218 . 40 1 1 A 108 108 ASP HA H 107 4.333 4.351 -0.018 1
1 1221 . 40 1 1 A 108 108 ASP C C 107 179.133 179.001 0.132 1
1 1222 . 40 1 1 A 108 108 ASP CA C 107 56.721 56.334 0.387 1
1 1223 . 40 1 1 A 108 108 ASP CB C 107 39.336 40.679 -1.343 1
1 1224 . 40 1 1 A 108 108 ASP N N 107 117.474 122.288 -4.814 1
1 1225 . 40 1 1 A 109 109 ILE H H 108 7.459 7.907 -0.448 1
1 1226 . 40 1 1 A 109 109 ILE HA H 108 3.688 3.799 -0.111 1
1 1236 . 40 1 1 A 109 109 ILE C C 108 176.735 178.432 -1.697 1
1 1237 . 40 1 1 A 109 109 ILE CA C 108 63.474 65.431 -1.957 1
1 1238 . 40 1 1 A 109 109 ILE CB C 108 37.340 37.685 -0.345 1
1 1242 . 40 1 1 A 109 109 ILE N N 108 119.609 119.721 -0.112 1
1 1243 . 40 1 1 A 110 110 PHE H H 109 7.920 8.369 -0.449 1
1 1244 . 40 1 1 A 110 110 PHE HA H 109 3.759 4.075 -0.316 1
1 1252 . 40 1 1 A 110 110 PHE C C 109 177.132 177.370 -0.238 1
1 1253 . 40 1 1 A 110 110 PHE CA C 109 62.766 61.222 1.544 1
1 1254 . 40 1 1 A 110 110 PHE CB C 109 39.752 39.304 0.448 1
1 1260 . 40 1 1 A 110 110 PHE N N 109 120.906 120.434 0.472 1
1 1261 . 40 1 1 A 111 111 ASP H H 110 8.639 8.240 0.399 1
1 1262 . 40 1 1 A 111 111 ASP HA H 110 4.216 4.206 0.010 1
1 1265 . 40 1 1 A 111 111 ASP C C 110 178.900 178.327 0.573 1
1 1266 . 40 1 1 A 111 111 ASP CA C 110 57.105 57.280 -0.175 1
1 1267 . 40 1 1 A 111 111 ASP CB C 110 39.697 42.002 -2.305 1
1 1268 . 40 1 1 A 111 111 ASP N N 110 117.124 118.737 -1.613 1
1 1269 . 40 1 1 A 112 112 MET H H 111 7.331 7.572 -0.241 1
1 1270 . 40 1 1 A 112 112 MET HA H 111 4.081 4.132 -0.051 1
1 1278 . 40 1 1 A 112 112 MET C C 111 179.052 178.138 0.914 1
1 1279 . 40 1 1 A 112 112 MET CA C 111 58.202 58.083 0.119 1
1 1280 . 40 1 1 A 112 112 MET CB C 111 31.827 32.442 -0.615 1
1 1283 . 40 1 1 A 112 112 MET N N 111 118.061 119.397 -1.336 1
1 1284 . 40 1 1 A 113 113 LEU H H 112 8.001 8.025 -0.024 1
1 1285 . 40 1 1 A 113 113 LEU HA H 112 3.723 3.552 0.171 1
1 1295 . 40 1 1 A 113 113 LEU C C 112 179.747 178.557 1.190 1
1 1296 . 40 1 1 A 113 113 LEU CA C 112 57.371 57.387 -0.016 1
1 1297 . 40 1 1 A 113 113 LEU CB C 112 40.671 41.031 -0.360 1
1 1301 . 40 1 1 A 113 113 LEU N N 112 120.426 119.649 0.777 1
1 1302 . 40 1 1 A 114 114 LEU H H 113 7.744 7.679 0.065 1
1 1303 . 40 1 1 A 114 114 LEU HA H 113 4.007 3.505 0.502 1
1 1313 . 40 1 1 A 114 114 LEU C C 113 179.358 178.528 0.830 1
1 1314 . 40 1 1 A 114 114 LEU CA C 113 57.202 57.485 -0.283 1
1 1315 . 40 1 1 A 114 114 LEU CB C 113 41.727 41.585 0.142 1
1 1319 . 40 1 1 A 114 114 LEU N N 113 119.584 119.594 -0.010 1
1 1320 . 40 1 1 A 115 115 THR H H 114 7.353 7.590 -0.237 1
1 1321 . 40 1 1 A 115 115 THR HA H 114 4.071 4.093 -0.022 1
1 1327 . 40 1 1 A 115 115 THR C C 114 173.591 176.465 -2.874 1
1 1328 . 40 1 1 A 115 115 THR CA C 114 65.332 64.366 0.966 1
1 1329 . 40 1 1 A 115 115 THR CB C 114 70.319 68.662 1.657 1
1 1331 . 40 1 1 A 115 115 THR N N 114 107.535 112.363 -4.828 1
1 1332 . 40 1 1 A 116 116 PHE H H 115 6.979 7.752 -0.773 1
1 1333 . 40 1 1 A 116 116 PHE HA H 115 5.022 4.296 0.726 1
1 1341 . 40 1 1 A 116 116 PHE C C 115 176.488 176.116 0.372 1
1 1342 . 40 1 1 A 116 116 PHE CA C 115 55.911 60.831 -4.920 1
1 1343 . 40 1 1 A 116 116 PHE CB C 115 38.521 39.099 -0.578 1
1 1349 . 40 1 1 A 116 116 PHE N N 115 112.366 120.117 -7.751 1
1 1350 . 40 1 1 A 117 117 THR H H 116 7.564 7.975 -0.411 1
1 1351 . 40 1 1 A 117 117 THR HA H 116 4.626 4.907 -0.281 1
1 1356 . 40 1 1 A 117 117 THR C C 116 174.085 174.233 -0.148 1
1 1357 . 40 1 1 A 117 117 THR CA C 116 61.636 62.521 -0.885 1
1 1358 . 40 1 1 A 117 117 THR CB C 116 70.915 72.363 -1.448 1
1 1360 . 40 1 1 A 117 117 THR N N 116 105.498 112.493 -6.995 1
1 1361 . 40 1 1 A 118 118 ASP H H 117 8.270 7.738 0.532 1
1 1362 . 40 1 1 A 118 118 ASP HA H 117 4.955 4.671 0.284 1
1 1365 . 40 1 1 A 118 118 ASP C C 117 176.328 176.308 0.020 1
1 1366 . 40 1 1 A 118 118 ASP CA C 117 53.417 53.397 0.020 1
1 1367 . 40 1 1 A 118 118 ASP CB C 117 43.388 40.664 2.724 1
1 1368 . 40 1 1 A 118 118 ASP N N 117 124.409 121.945 2.464 1
1 1369 . 40 1 1 A 119 119 PHE H H 118 8.973 8.669 0.304 1
1 1370 . 40 1 1 A 119 119 PHE HA H 118 3.506 4.141 -0.635 1
1 1378 . 40 1 1 A 119 119 PHE CA C 118 61.490 61.571 -0.081 1
1 1379 . 40 1 1 A 119 119 PHE CB C 118 39.246 39.387 -0.141 1
1 1385 . 40 1 1 A 119 119 PHE N N 118 126.688 126.744 -0.056 1
1 1386 . 40 1 1 A 120 120 LEU H H 119 8.099 8.369 -0.270 1
1 1387 . 40 1 1 A 120 120 LEU HA H 119 3.842 4.032 -0.190 1
1 1397 . 40 1 1 A 120 120 LEU C C 119 179.601 178.690 0.911 1
1 1398 . 40 1 1 A 120 120 LEU CA C 119 58.174 57.962 0.212 1
1 1399 . 40 1 1 A 120 120 LEU CB C 119 40.315 41.405 -1.090 1
1 1403 . 40 1 1 A 120 120 LEU N N 119 117.930 120.680 -2.750 1
1 1404 . 40 1 1 A 121 121 ALA H H 120 7.729 7.913 -0.184 1
1 1405 . 40 1 1 A 121 121 ALA HA H 120 3.996 4.081 -0.085 1
1 1409 . 40 1 1 A 121 121 ALA C C 120 180.995 179.526 1.469 1
1 1410 . 40 1 1 A 121 121 ALA CA C 120 54.832 54.598 0.234 1
1 1411 . 40 1 1 A 121 121 ALA CB C 120 17.706 18.314 -0.608 1
1 1412 . 40 1 1 A 121 121 ALA N N 120 123.195 121.191 2.004 1
1 1413 . 40 1 1 A 122 122 PHE H H 121 7.943 7.783 0.160 1
1 1414 . 40 1 1 A 122 122 PHE HA H 121 3.887 3.752 0.135 1
1 1419 . 40 1 1 A 122 122 PHE C C 121 175.410 176.697 -1.287 1
1 1420 . 40 1 1 A 122 122 PHE CA C 121 61.075 60.611 0.464 1
1 1421 . 40 1 1 A 122 122 PHE CB C 121 38.115 38.698 -0.583 1
1 1424 . 40 1 1 A 122 122 PHE N N 121 121.798 120.426 1.372 1
1 1425 . 40 1 1 A 123 123 LYS H H 122 8.468 7.823 0.645 1
1 1426 . 40 1 1 A 123 123 LYS HA H 122 3.077 3.635 -0.558 1
1 1435 . 40 1 1 A 123 123 LYS C C 122 178.453 178.666 -0.213 1
1 1436 . 40 1 1 A 123 123 LYS CA C 122 59.855 59.732 0.123 1
1 1437 . 40 1 1 A 123 123 LYS CB C 122 32.374 32.116 0.258 1
1 1441 . 40 1 1 A 123 123 LYS N N 122 120.614 118.390 2.224 1
1 1442 . 40 1 1 A 124 124 GLU H H 123 8.100 7.861 0.239 1
1 1443 . 40 1 1 A 124 124 GLU HA H 123 3.652 3.995 -0.343 1
1 1448 . 40 1 1 A 124 124 GLU C C 123 177.743 178.429 -0.686 1
1 1449 . 40 1 1 A 124 124 GLU CA C 123 59.406 59.410 -0.004 1
1 1450 . 40 1 1 A 124 124 GLU CB C 123 28.811 29.169 -0.358 1
1 1452 . 40 1 1 A 124 124 GLU N N 123 117.404 118.775 -1.371 1
1 1453 . 40 1 1 A 125 125 MET H H 124 7.537 7.546 -0.009 1
1 1454 . 40 1 1 A 125 125 MET HA H 124 3.860 3.917 -0.057 1
1 1462 . 40 1 1 A 125 125 MET C C 124 179.522 178.319 1.203 1
1 1463 . 40 1 1 A 125 125 MET CA C 124 58.832 58.474 0.358 1
1 1464 . 40 1 1 A 125 125 MET CB C 124 31.765 31.312 0.453 1
1 1467 . 40 1 1 A 125 125 MET N N 124 119.413 118.740 0.673 1
1 1468 . 40 1 1 A 126 126 PHE H H 125 7.148 7.375 -0.227 1
1 1469 . 40 1 1 A 126 126 PHE HA H 125 3.633 4.237 -0.604 1
1 1476 . 40 1 1 A 126 126 PHE C C 125 178.994 178.300 0.694 1
1 1477 . 40 1 1 A 126 126 PHE CA C 125 63.148 60.833 2.315 1
1 1478 . 40 1 1 A 126 126 PHE CB C 125 39.830 38.534 1.296 1
1 1483 . 40 1 1 A 126 126 PHE N N 125 120.013 119.054 0.959 1
1 1484 . 40 1 1 A 127 127 LEU H H 126 8.369 8.428 -0.059 1
1 1485 . 40 1 1 A 127 127 LEU HA H 126 3.972 4.062 -0.090 1
1 1495 . 40 1 1 A 127 127 LEU C C 126 180.621 179.303 1.318 1
1 1496 . 40 1 1 A 127 127 LEU CA C 126 57.944 57.606 0.338 1
1 1497 . 40 1 1 A 127 127 LEU CB C 126 40.543 40.993 -0.450 1
1 1501 . 40 1 1 A 127 127 LEU N N 126 119.692 119.606 0.086 1
1 1502 . 40 1 1 A 128 128 ASP H H 127 8.578 8.132 0.446 1
1 1503 . 40 1 1 A 128 128 ASP HA H 127 4.308 4.367 -0.059 1
1 1506 . 40 1 1 A 128 128 ASP C C 127 178.254 177.996 0.258 1
1 1507 . 40 1 1 A 128 128 ASP CA C 127 56.964 57.270 -0.306 1
1 1508 . 40 1 1 A 128 128 ASP CB C 127 39.735 41.007 -1.272 1
1 1509 . 40 1 1 A 128 128 ASP N N 127 121.926 119.790 2.136 1
1 1510 . 40 1 1 A 129 129 TYR H H 128 7.710 8.043 -0.333 1
1 1511 . 40 1 1 A 129 129 TYR HA H 128 3.908 4.052 -0.144 1
1 1518 . 40 1 1 A 129 129 TYR C C 128 177.633 177.738 -0.105 1
1 1519 . 40 1 1 A 129 129 TYR CA C 128 61.796 61.465 0.331 1
1 1520 . 40 1 1 A 129 129 TYR CB C 128 39.372 38.695 0.677 1
1 1525 . 40 1 1 A 129 129 TYR N N 128 122.548 120.104 2.444 1
1 1526 . 40 1 1 A 130 130 ARG H H 129 8.622 8.427 0.195 1
1 1527 . 40 1 1 A 130 130 ARG HA H 129 3.722 3.870 -0.148 1
1 1535 . 40 1 1 A 130 130 ARG CA C 129 60.084 59.638 0.446 1
1 1536 . 40 1 1 A 130 130 ARG CB C 129 29.902 29.875 0.027 1
1 1539 . 40 1 1 A 130 130 ARG N N 129 118.302 119.115 -0.813 1
1 1541 . 40 1 1 A 131 131 ALA H H 130 7.936 7.814 0.122 1
1 1542 . 40 1 1 A 131 131 ALA HA H 130 3.997 4.037 -0.040 1
1 1546 . 40 1 1 A 131 131 ALA C C 130 180.456 179.084 1.372 1
1 1547 . 40 1 1 A 131 131 ALA CA C 130 55.133 54.658 0.475 1
1 1548 . 40 1 1 A 131 131 ALA CB C 130 17.750 18.165 -0.415 1
1 1549 . 40 1 1 A 131 131 ALA N N 130 119.788 121.284 -1.496 1
1 1550 . 40 1 1 A 132 132 GLU H H 131 7.622 7.406 0.216 1
1 1551 . 40 1 1 A 132 132 GLU HA H 131 3.862 4.077 -0.215 1
1 1556 . 40 1 1 A 132 132 GLU C C 131 179.528 178.993 0.535 1
1 1557 . 40 1 1 A 132 132 GLU CA C 131 58.849 58.130 0.719 1
1 1558 . 40 1 1 A 132 132 GLU CB C 131 28.930 29.218 -0.288 1
1 1560 . 40 1 1 A 132 132 GLU N N 131 118.428 117.835 0.593 1
1 1561 . 40 1 1 A 133 133 LYS H H 132 7.853 7.491 0.362 1
1 1562 . 40 1 1 A 133 133 LYS HA H 132 3.722 3.948 -0.226 1
1 1571 . 40 1 1 A 133 133 LYS C C 132 175.725 178.321 -2.596 1
1 1572 . 40 1 1 A 133 133 LYS CA C 132 57.544 58.961 -1.417 1
1 1573 . 40 1 1 A 133 133 LYS CB C 132 31.770 31.919 -0.149 1
1 1577 . 40 1 1 A 133 133 LYS N N 132 119.473 119.849 -0.376 1
1 1578 . 40 1 1 A 134 134 GLU H H 133 8.151 8.156 -0.005 1
1 1579 . 40 1 1 A 134 134 GLU HA H 133 4.161 4.336 -0.175 1
1 1584 . 40 1 1 A 134 134 GLU C C 133 177.453 178.056 -0.603 1
1 1585 . 40 1 1 A 134 134 GLU CA C 133 57.222 56.846 0.376 1
1 1586 . 40 1 1 A 134 134 GLU CB C 133 30.091 29.878 0.213 1
1 1588 . 40 1 1 A 134 134 GLU N N 133 116.525 116.244 0.281 1
1 1589 . 40 1 1 A 135 135 GLY H H 134 7.702 7.710 -0.008 1
1 1590 . 40 1 1 A 135 135 GLY HA2 H 134 3.896 3.986 -0.090 1
1 1591 . 40 1 1 A 135 135 GLY HA3 H 134 3.897 3.993 -0.096 1
1 1592 . 40 1 1 A 135 135 GLY C C 134 174.538 173.406 1.132 1
1 1593 . 40 1 1 A 135 135 GLY CA C 134 45.975 45.288 0.687 1
1 1594 . 40 1 1 A 135 135 GLY N N 134 107.924 107.635 0.289 1
1 1595 . 40 1 1 A 136 136 ARG H H 135 8.045 7.544 0.501 1
1 1596 . 40 1 1 A 136 136 ARG HA H 135 4.323 4.843 -0.520 1
1 1604 . 40 1 1 A 136 136 ARG C C 135 175.864 174.801 1.063 1
1 1605 . 40 1 1 A 136 136 ARG CA C 135 56.016 55.616 0.400 1
1 1606 . 40 1 1 A 136 136 ARG CB C 135 30.987 33.892 -2.905 1
1 1609 . 40 1 1 A 136 136 ARG N N 135 119.708 119.985 -0.277 1
1 1 . 41 1 1 A 14 14 PHE CA C 13 58.199 60.848 -2.649 1
1 2 . 41 1 1 A 14 14 PHE CB C 13 39.717 39.197 0.520 1
1 3 . 41 1 1 A 15 15 SER H H 14 8.299 8.170 0.129 1
1 4 . 41 1 1 A 15 15 SER HA H 14 4.359 4.691 -0.332 1
1 7 . 41 1 1 A 15 15 SER CA C 14 58.249 58.691 -0.442 1
1 8 . 41 1 1 A 15 15 SER CB C 14 63.936 64.323 -0.387 1
1 9 . 41 1 1 A 15 15 SER N N 14 117.379 110.020 7.359 1
1 10 . 41 1 1 A 16 16 SER H H 15 8.255 8.060 0.195 1
1 11 . 41 1 1 A 16 16 SER HA H 15 3.729 4.818 -1.089 1
1 14 . 41 1 1 A 16 16 SER CA C 15 58.224 59.234 -1.010 1
1 15 . 41 1 1 A 16 16 SER CB C 15 63.886 66.175 -2.289 1
1 16 . 41 1 1 A 16 16 SER N N 15 117.694 115.464 2.230 1
1 17 . 41 1 1 A 17 17 ALA H H 16 8.333 8.407 -0.074 1
1 18 . 41 1 1 A 17 17 ALA HA H 16 4.252 4.171 0.081 1
1 22 . 41 1 1 A 17 17 ALA CA C 16 53.377 54.254 -0.877 1
1 23 . 41 1 1 A 17 17 ALA CB C 16 18.896 18.635 0.261 1
1 24 . 41 1 1 A 17 17 ALA N N 16 125.462 124.189 1.273 1
1 25 . 41 1 1 A 18 18 SER H H 17 8.219 7.947 0.272 1
1 26 . 41 1 1 A 18 18 SER HA H 17 4.332 4.571 -0.239 1
1 29 . 41 1 1 A 18 18 SER CA C 17 59.105 57.569 1.536 1
1 30 . 41 1 1 A 18 18 SER CB C 17 63.592 64.287 -0.695 1
1 31 . 41 1 1 A 18 18 SER N N 17 114.821 111.891 2.930 1
1 32 . 41 1 1 A 19 19 ASP H H 18 8.309 8.427 -0.118 1
1 33 . 41 1 1 A 19 19 ASP HA H 18 4.554 5.062 -0.508 1
1 36 . 41 1 1 A 19 19 ASP C C 18 176.528 176.985 -0.457 1
1 37 . 41 1 1 A 19 19 ASP CA C 18 55.272 55.359 -0.087 1
1 38 . 41 1 1 A 19 19 ASP CB C 18 40.883 41.435 -0.552 1
1 39 . 41 1 1 A 19 19 ASP N N 18 123.367 121.772 1.595 1
1 40 . 41 1 1 A 20 20 ALA H H 19 8.133 8.494 -0.361 1
1 41 . 41 1 1 A 20 20 ALA HA H 19 4.170 4.095 0.075 1
1 45 . 41 1 1 A 20 20 ALA C C 19 179.857 178.898 0.959 1
1 46 . 41 1 1 A 20 20 ALA CA C 19 54.341 55.537 -1.196 1
1 47 . 41 1 1 A 20 20 ALA CB C 19 18.660 18.577 0.083 1
1 48 . 41 1 1 A 20 20 ALA N N 19 123.350 122.651 0.699 1
1 49 . 41 1 1 A 21 21 GLU H H 20 8.140 7.984 0.156 1
1 50 . 41 1 1 A 21 21 GLU HA H 20 4.128 4.104 0.024 1
1 55 . 41 1 1 A 21 21 GLU C C 20 177.675 178.679 -1.004 1
1 56 . 41 1 1 A 21 21 GLU CA C 20 58.520 59.357 -0.837 1
1 57 . 41 1 1 A 21 21 GLU CB C 20 29.765 29.465 0.300 1
1 59 . 41 1 1 A 21 21 GLU N N 20 119.063 118.991 0.072 1
1 60 . 41 1 1 A 22 22 PHE H H 21 8.009 8.023 -0.014 1
1 61 . 41 1 1 A 22 22 PHE HA H 21 4.123 4.305 -0.182 1
1 68 . 41 1 1 A 22 22 PHE C C 21 176.410 177.089 -0.679 1
1 69 . 41 1 1 A 22 22 PHE CA C 21 62.202 61.081 1.121 1
1 70 . 41 1 1 A 22 22 PHE CB C 21 39.223 39.139 0.084 1
1 75 . 41 1 1 A 22 22 PHE N N 21 121.211 120.628 0.583 1
1 76 . 41 1 1 A 23 23 ASP H H 22 8.261 8.425 -0.164 1
1 77 . 41 1 1 A 23 23 ASP HA H 22 4.041 4.333 -0.292 1
1 80 . 41 1 1 A 23 23 ASP C C 22 179.078 178.694 0.384 1
1 81 . 41 1 1 A 23 23 ASP CA C 22 57.048 57.359 -0.311 1
1 82 . 41 1 1 A 23 23 ASP CB C 22 40.154 40.167 -0.013 1
1 83 . 41 1 1 A 23 23 ASP N N 22 116.876 118.530 -1.654 1
1 84 . 41 1 1 A 24 24 ALA H H 23 7.651 7.614 0.037 1
1 85 . 41 1 1 A 24 24 ALA HA H 23 3.785 3.903 -0.118 1
1 89 . 41 1 1 A 24 24 ALA C C 23 179.577 179.521 0.056 1
1 90 . 41 1 1 A 24 24 ALA CA C 23 54.341 55.036 -0.695 1
1 91 . 41 1 1 A 24 24 ALA CB C 23 17.762 18.372 -0.610 1
1 92 . 41 1 1 A 24 24 ALA N N 23 121.873 122.972 -1.099 1
1 93 . 41 1 1 A 25 25 VAL H H 24 7.718 7.757 -0.039 1
1 94 . 41 1 1 A 25 25 VAL HA H 24 3.216 3.604 -0.388 1
1 102 . 41 1 1 A 25 25 VAL C C 24 177.805 178.271 -0.466 1
1 103 . 41 1 1 A 25 25 VAL CA C 24 66.789 66.525 0.264 1
1 104 . 41 1 1 A 25 25 VAL CB C 24 31.277 31.408 -0.131 1
1 107 . 41 1 1 A 25 25 VAL N N 24 117.890 118.110 -0.220 1
1 108 . 41 1 1 A 26 26 VAL H H 25 7.867 7.749 0.118 1
1 109 . 41 1 1 A 26 26 VAL HA H 25 3.274 3.550 -0.276 1
1 117 . 41 1 1 A 26 26 VAL C C 25 177.788 177.719 0.069 1
1 118 . 41 1 1 A 26 26 VAL CA C 25 67.282 66.397 0.885 1
1 119 . 41 1 1 A 26 26 VAL CB C 25 31.266 31.386 -0.120 1
1 122 . 41 1 1 A 26 26 VAL N N 25 118.170 120.428 -2.258 1
1 123 . 41 1 1 A 27 27 GLY H H 26 7.544 7.590 -0.046 1
1 124 . 41 1 1 A 27 27 GLY HA2 H 26 3.592 3.477 0.115 1
1 125 . 41 1 1 A 27 27 GLY HA3 H 26 3.721 3.616 0.105 1
1 126 . 41 1 1 A 27 27 GLY C C 26 176.717 176.356 0.361 1
1 127 . 41 1 1 A 27 27 GLY CA C 26 47.085 47.160 -0.075 1
1 128 . 41 1 1 A 27 27 GLY N N 26 105.795 107.601 -1.806 1
1 129 . 41 1 1 A 28 28 TYR H H 27 7.625 7.309 0.316 1
1 130 . 41 1 1 A 28 28 TYR HA H 27 4.546 4.572 -0.026 1
1 137 . 41 1 1 A 28 28 TYR C C 27 178.991 178.525 0.466 1
1 138 . 41 1 1 A 28 28 TYR CA C 27 58.845 59.884 -1.039 1
1 139 . 41 1 1 A 28 28 TYR CB C 27 37.602 37.528 0.074 1
1 144 . 41 1 1 A 28 28 TYR N N 27 119.933 121.749 -1.816 1
1 145 . 41 1 1 A 29 29 LEU H H 28 8.517 8.075 0.442 1
1 146 . 41 1 1 A 29 29 LEU HA H 28 3.728 3.852 -0.124 1
1 156 . 41 1 1 A 29 29 LEU CA C 28 58.281 57.998 0.283 1
1 157 . 41 1 1 A 29 29 LEU CB C 28 41.948 41.417 0.531 1
1 161 . 41 1 1 A 29 29 LEU N N 28 119.669 120.885 -1.216 1
1 162 . 41 1 1 A 30 30 GLU H H 29 8.072 8.111 -0.039 1
1 163 . 41 1 1 A 30 30 GLU HA H 29 3.722 3.874 -0.152 1
1 168 . 41 1 1 A 30 30 GLU C C 29 177.731 178.896 -1.165 1
1 169 . 41 1 1 A 30 30 GLU CA C 29 59.763 59.950 -0.187 1
1 170 . 41 1 1 A 30 30 GLU CB C 29 28.844 29.283 -0.439 1
1 172 . 41 1 1 A 30 30 GLU N N 29 117.666 117.697 -0.031 1
1 173 . 41 1 1 A 31 31 ASP H H 30 7.243 8.088 -0.845 1
1 174 . 41 1 1 A 31 31 ASP HA H 30 4.297 4.380 -0.083 1
1 177 . 41 1 1 A 31 31 ASP CA C 30 56.953 57.217 -0.264 1
1 178 . 41 1 1 A 31 31 ASP CB C 30 40.730 42.234 -1.504 1
1 179 . 41 1 1 A 31 31 ASP N N 30 116.720 119.197 -2.477 1
1 180 . 41 1 1 A 32 32 ILE H H 31 7.940 7.500 0.440 1
1 181 . 41 1 1 A 32 32 ILE HA H 31 3.640 3.793 -0.153 1
1 191 . 41 1 1 A 32 32 ILE C C 31 177.980 178.103 -0.123 1
1 192 . 41 1 1 A 32 32 ILE CA C 31 64.692 64.009 0.683 1
1 193 . 41 1 1 A 32 32 ILE CB C 31 38.938 36.818 2.120 1
1 197 . 41 1 1 A 32 32 ILE N N 31 119.728 117.895 1.833 1
1 198 . 41 1 1 A 33 33 ILE H H 32 7.984 7.914 0.070 1
1 199 . 41 1 1 A 33 33 ILE HA H 32 3.598 3.516 0.082 1
1 209 . 41 1 1 A 33 33 ILE C C 32 176.723 177.012 -0.289 1
1 210 . 41 1 1 A 33 33 ILE CA C 32 63.241 64.701 -1.460 1
1 211 . 41 1 1 A 33 33 ILE CB C 32 37.580 38.005 -0.425 1
1 215 . 41 1 1 A 33 33 ILE N N 32 113.919 120.956 -7.037 1
1 216 . 41 1 1 A 34 34 MET H H 33 7.288 7.501 -0.213 1
1 217 . 41 1 1 A 34 34 MET HA H 33 4.496 4.711 -0.215 1
1 225 . 41 1 1 A 34 34 MET C C 33 176.423 175.708 0.715 1
1 226 . 41 1 1 A 34 34 MET CA C 33 54.634 54.205 0.429 1
1 227 . 41 1 1 A 34 34 MET CB C 33 31.934 32.697 -0.763 1
1 230 . 41 1 1 A 34 34 MET N N 33 115.130 116.865 -1.735 1
1 231 . 41 1 1 A 35 35 ASP H H 34 7.405 7.747 -0.342 1
1 232 . 41 1 1 A 35 35 ASP HA H 34 4.484 4.570 -0.086 1
1 235 . 41 1 1 A 35 35 ASP C C 34 177.139 176.487 0.652 1
1 236 . 41 1 1 A 35 35 ASP CA C 34 54.625 54.521 0.104 1
1 237 . 41 1 1 A 35 35 ASP CB C 34 43.554 42.463 1.091 1
1 238 . 41 1 1 A 35 35 ASP N N 34 121.814 122.615 -0.801 1
1 239 . 41 1 1 A 36 36 ASP H H 35 8.765 9.187 -0.422 1
1 240 . 41 1 1 A 36 36 ASP HA H 35 4.235 4.220 0.015 1
1 243 . 41 1 1 A 36 36 ASP C C 35 178.320 177.884 0.436 1
1 244 . 41 1 1 A 36 36 ASP CA C 35 57.832 58.357 -0.525 1
1 245 . 41 1 1 A 36 36 ASP CB C 35 40.914 41.165 -0.251 1
1 246 . 41 1 1 A 36 36 ASP N N 35 125.883 128.247 -2.364 1
1 247 . 41 1 1 A 37 37 GLU H H 36 8.905 8.324 0.581 1
1 248 . 41 1 1 A 37 37 GLU HA H 36 3.933 4.067 -0.134 1
1 253 . 41 1 1 A 37 37 GLU C C 36 179.304 178.997 0.307 1
1 254 . 41 1 1 A 37 37 GLU CA C 36 59.828 59.229 0.599 1
1 255 . 41 1 1 A 37 37 GLU CB C 36 29.380 29.432 -0.052 1
1 257 . 41 1 1 A 37 37 GLU N N 36 119.077 119.035 0.042 1
1 258 . 41 1 1 A 38 38 PHE H H 37 7.460 8.221 -0.761 1
1 259 . 41 1 1 A 38 38 PHE HA H 37 3.642 4.046 -0.404 1
1 267 . 41 1 1 A 38 38 PHE C C 37 176.483 177.940 -1.457 1
1 268 . 41 1 1 A 38 38 PHE CA C 37 61.411 61.246 0.165 1
1 269 . 41 1 1 A 38 38 PHE CB C 37 39.355 38.998 0.357 1
1 275 . 41 1 1 A 38 38 PHE N N 37 119.968 120.714 -0.746 1
1 276 . 41 1 1 A 39 39 GLN H H 38 7.968 8.185 -0.217 1
1 277 . 41 1 1 A 39 39 GLN HA H 38 3.712 3.789 -0.077 1
1 284 . 41 1 1 A 39 39 GLN CA C 38 59.153 58.838 0.315 1
1 285 . 41 1 1 A 39 39 GLN CB C 38 28.213 28.475 -0.262 1
1 287 . 41 1 1 A 39 39 GLN N N 38 116.433 118.193 -1.760 1
1 289 . 41 1 1 A 40 40 LEU H H 39 7.930 7.748 0.182 1
1 290 . 41 1 1 A 40 40 LEU HA H 39 3.916 4.010 -0.094 1
1 300 . 41 1 1 A 40 40 LEU C C 39 177.731 178.057 -0.326 1
1 301 . 41 1 1 A 40 40 LEU CA C 39 57.915 57.910 0.005 1
1 302 . 41 1 1 A 40 40 LEU CB C 39 41.989 41.496 0.493 1
1 306 . 41 1 1 A 40 40 LEU N N 39 119.505 121.421 -1.916 1
1 307 . 41 1 1 A 41 41 LEU H H 40 7.174 7.939 -0.765 1
1 308 . 41 1 1 A 41 41 LEU HA H 40 3.835 4.024 -0.189 1
1 318 . 41 1 1 A 41 41 LEU C C 40 179.738 178.162 1.576 1
1 319 . 41 1 1 A 41 41 LEU CA C 40 58.266 58.305 -0.039 1
1 320 . 41 1 1 A 41 41 LEU CB C 40 42.050 41.494 0.556 1
1 324 . 41 1 1 A 41 41 LEU N N 40 120.971 119.817 1.154 1
1 325 . 41 1 1 A 42 42 GLN H H 41 8.058 7.957 0.101 1
1 326 . 41 1 1 A 42 42 GLN HA H 41 3.556 3.668 -0.112 1
1 333 . 41 1 1 A 42 42 GLN C C 41 177.642 178.102 -0.460 1
1 334 . 41 1 1 A 42 42 GLN CA C 41 59.826 59.126 0.700 1
1 335 . 41 1 1 A 42 42 GLN CB C 41 28.762 27.874 0.888 1
1 337 . 41 1 1 A 42 42 GLN N N 41 117.899 117.880 0.019 1
1 339 . 41 1 1 A 43 43 ARG H H 42 8.179 7.922 0.257 1
1 340 . 41 1 1 A 43 43 ARG HA H 42 3.655 3.952 -0.297 1
1 347 . 41 1 1 A 43 43 ARG C C 42 178.051 178.366 -0.315 1
1 348 . 41 1 1 A 43 43 ARG CA C 42 59.766 58.775 0.991 1
1 349 . 41 1 1 A 43 43 ARG CB C 42 29.941 29.777 0.164 1
1 352 . 41 1 1 A 43 43 ARG N N 42 119.392 120.133 -0.741 1
1 353 . 41 1 1 A 44 44 ASN H H 43 8.525 8.068 0.457 1
1 354 . 41 1 1 A 44 44 ASN HA H 43 4.332 4.391 -0.059 1
1 359 . 41 1 1 A 44 44 ASN C C 43 178.150 177.838 0.312 1
1 360 . 41 1 1 A 44 44 ASN CA C 43 55.841 56.235 -0.394 1
1 361 . 41 1 1 A 44 44 ASN CB C 43 37.632 39.200 -1.568 1
1 362 . 41 1 1 A 44 44 ASN N N 43 116.214 117.702 -1.488 1
1 364 . 41 1 1 A 45 45 PHE H H 44 7.586 7.930 -0.344 1
1 365 . 41 1 1 A 45 45 PHE HA H 44 4.132 4.195 -0.063 1
1 372 . 41 1 1 A 45 45 PHE C C 44 176.691 178.556 -1.865 1
1 373 . 41 1 1 A 45 45 PHE CA C 44 62.333 60.588 1.745 1
1 374 . 41 1 1 A 45 45 PHE CB C 44 39.449 38.111 1.338 1
1 379 . 41 1 1 A 45 45 PHE N N 44 121.501 117.665 3.836 1
1 380 . 41 1 1 A 46 46 MET H H 45 8.190 8.296 -0.106 1
1 381 . 41 1 1 A 46 46 MET HA H 45 4.060 4.154 -0.094 1
1 389 . 41 1 1 A 46 46 MET C C 45 179.754 178.055 1.699 1
1 390 . 41 1 1 A 46 46 MET CA C 45 57.742 57.641 0.101 1
1 391 . 41 1 1 A 46 46 MET CB C 45 29.912 31.073 -1.161 1
1 394 . 41 1 1 A 46 46 MET N N 45 116.727 117.832 -1.105 1
1 395 . 41 1 1 A 47 47 ASP H H 46 8.579 8.201 0.378 1
1 396 . 41 1 1 A 47 47 ASP HA H 46 4.804 4.579 0.225 1
1 399 . 41 1 1 A 47 47 ASP C C 46 177.854 177.620 0.234 1
1 400 . 41 1 1 A 47 47 ASP CA C 46 57.277 57.198 0.079 1
1 401 . 41 1 1 A 47 47 ASP CB C 46 40.776 41.457 -0.681 1
1 402 . 41 1 1 A 47 47 ASP N N 46 117.798 120.622 -2.824 1
1 403 . 41 1 1 A 48 48 LYS H H 47 7.339 7.779 -0.440 1
1 404 . 41 1 1 A 48 48 LYS HA H 47 3.828 4.337 -0.509 1
1 413 . 41 1 1 A 48 48 LYS C C 47 178.812 178.434 0.378 1
1 414 . 41 1 1 A 48 48 LYS CA C 47 58.953 57.326 1.627 1
1 415 . 41 1 1 A 48 48 LYS CB C 47 32.796 33.464 -0.668 1
1 419 . 41 1 1 A 48 48 LYS N N 47 117.852 117.793 0.059 1
1 420 . 41 1 1 A 49 49 TYR H H 48 6.841 8.637 -1.796 1
1 421 . 41 1 1 A 49 49 TYR HA H 48 4.995 4.147 0.848 1
1 428 . 41 1 1 A 49 49 TYR C C 48 178.138 178.543 -0.405 1
1 429 . 41 1 1 A 49 49 TYR CA C 48 58.620 59.776 -1.156 1
1 430 . 41 1 1 A 49 49 TYR CB C 48 42.939 37.943 4.996 1
1 435 . 41 1 1 A 49 49 TYR N N 48 112.109 119.052 -6.943 1
1 436 . 41 1 1 A 50 50 TYR H H 49 8.491 8.125 0.366 1
1 437 . 41 1 1 A 50 50 TYR HA H 49 4.598 4.185 0.413 1
1 444 . 41 1 1 A 50 50 TYR C C 49 176.015 178.202 -2.187 1
1 445 . 41 1 1 A 50 50 TYR CA C 49 62.442 59.342 3.100 1
1 446 . 41 1 1 A 50 50 TYR CB C 49 36.588 36.848 -0.260 1
1 451 . 41 1 1 A 50 50 TYR N N 49 118.294 119.569 -1.275 1
1 452 . 41 1 1 A 51 51 LEU H H 50 7.512 7.589 -0.077 1
1 453 . 41 1 1 A 51 51 LEU HA H 50 3.878 3.465 0.413 1
1 463 . 41 1 1 A 51 51 LEU C C 50 178.625 178.879 -0.254 1
1 464 . 41 1 1 A 51 51 LEU CA C 50 55.994 57.405 -1.411 1
1 465 . 41 1 1 A 51 51 LEU CB C 50 40.743 41.292 -0.549 1
1 469 . 41 1 1 A 51 51 LEU N N 50 118.478 121.311 -2.833 1
1 470 . 41 1 1 A 52 52 GLU H H 51 8.042 7.917 0.125 1
1 471 . 41 1 1 A 52 52 GLU HA H 51 4.197 4.000 0.197 1
1 476 . 41 1 1 A 52 52 GLU C C 51 177.629 177.598 0.031 1
1 477 . 41 1 1 A 52 52 GLU CA C 51 56.141 59.356 -3.215 1
1 478 . 41 1 1 A 52 52 GLU CB C 51 29.162 29.215 -0.053 1
1 480 . 41 1 1 A 52 52 GLU N N 51 115.067 117.893 -2.826 1
1 481 . 41 1 1 A 53 53 PHE H H 52 7.465 7.802 -0.337 1
1 482 . 41 1 1 A 53 53 PHE HA H 52 4.431 4.550 -0.119 1
1 490 . 41 1 1 A 53 53 PHE C C 52 174.325 175.175 -0.850 1
1 491 . 41 1 1 A 53 53 PHE CA C 52 58.986 56.904 2.082 1
1 492 . 41 1 1 A 53 53 PHE CB C 52 40.183 37.277 2.906 1
1 498 . 41 1 1 A 53 53 PHE N N 52 116.768 118.698 -1.930 1
1 499 . 41 1 1 A 54 54 GLU H H 53 7.484 8.666 -1.182 1
1 500 . 41 1 1 A 54 54 GLU HA H 53 4.583 4.895 -0.312 1
1 505 . 41 1 1 A 54 54 GLU C C 53 175.722 175.483 0.239 1
1 506 . 41 1 1 A 54 54 GLU CA C 53 54.248 54.687 -0.439 1
1 507 . 41 1 1 A 54 54 GLU CB C 53 34.409 32.224 2.185 1
1 509 . 41 1 1 A 54 54 GLU N N 53 118.844 123.404 -4.560 1
1 510 . 41 1 1 A 55 55 ASP H H 54 9.008 8.725 0.283 1
1 511 . 41 1 1 A 55 55 ASP HA H 54 4.735 4.799 -0.064 1
1 514 . 41 1 1 A 55 55 ASP C C 54 175.421 175.945 -0.524 1
1 515 . 41 1 1 A 55 55 ASP CA C 54 52.888 53.988 -1.100 1
1 516 . 41 1 1 A 55 55 ASP CB C 54 38.894 40.665 -1.771 1
1 517 . 41 1 1 A 55 55 ASP N N 54 123.654 124.435 -0.781 1
1 518 . 41 1 1 A 56 56 THR H H 55 7.819 8.109 -0.290 1
1 519 . 41 1 1 A 56 56 THR HA H 55 4.574 4.903 -0.329 1
1 524 . 41 1 1 A 56 56 THR C C 55 174.096 174.054 0.042 1
1 525 . 41 1 1 A 56 56 THR CA C 55 59.172 60.169 -0.997 1
1 526 . 41 1 1 A 56 56 THR CB C 55 71.889 72.081 -0.192 1
1 528 . 41 1 1 A 56 56 THR N N 55 112.015 117.718 -5.703 1
1 529 . 41 1 1 A 57 57 GLU H H 56 8.527 8.738 -0.211 1
1 530 . 41 1 1 A 57 57 GLU HA H 56 4.217 4.585 -0.368 1
1 535 . 41 1 1 A 57 57 GLU C C 56 177.042 176.328 0.714 1
1 536 . 41 1 1 A 57 57 GLU CA C 56 56.869 56.930 -0.061 1
1 537 . 41 1 1 A 57 57 GLU CB C 56 29.731 31.503 -1.772 1
1 539 . 41 1 1 A 57 57 GLU N N 56 117.531 118.257 -0.726 1
1 540 . 41 1 1 A 58 58 GLU H H 57 7.587 7.665 -0.078 1
1 541 . 41 1 1 A 58 58 GLU HA H 57 3.941 4.522 -0.581 1
1 546 . 41 1 1 A 58 58 GLU C C 57 176.849 175.866 0.983 1
1 547 . 41 1 1 A 58 58 GLU CA C 57 56.924 56.102 0.822 1
1 548 . 41 1 1 A 58 58 GLU CB C 57 30.251 30.520 -0.269 1
1 550 . 41 1 1 A 58 58 GLU N N 57 119.183 120.647 -1.464 1
1 551 . 41 1 1 A 59 59 ASN H H 58 9.120 8.685 0.435 1
1 552 . 41 1 1 A 59 59 ASN HA H 58 4.922 5.158 -0.236 1
1 557 . 41 1 1 A 59 59 ASN C C 58 174.254 174.326 -0.072 1
1 558 . 41 1 1 A 59 59 ASN CA C 58 51.956 52.310 -0.354 1
1 559 . 41 1 1 A 59 59 ASN CB C 58 37.404 40.255 -2.851 1
1 560 . 41 1 1 A 59 59 ASN N N 58 126.767 125.787 0.980 1
1 562 . 41 1 1 A 60 60 LYS H H 59 5.892 8.691 -2.799 1
1 563 . 41 1 1 A 60 60 LYS HA H 59 3.798 4.641 -0.843 1
1 572 . 41 1 1 A 60 60 LYS C C 59 177.908 177.462 0.446 1
1 573 . 41 1 1 A 60 60 LYS CA C 59 56.623 54.610 2.013 1
1 574 . 41 1 1 A 60 60 LYS CB C 59 32.279 34.819 -2.540 1
1 578 . 41 1 1 A 60 60 LYS N N 59 121.527 123.524 -1.997 1
1 579 . 41 1 1 A 61 61 LEU H H 60 8.473 8.849 -0.376 1
1 580 . 41 1 1 A 61 61 LEU HA H 60 3.891 4.237 -0.346 1
1 590 . 41 1 1 A 61 61 LEU C C 60 179.843 178.628 1.215 1
1 591 . 41 1 1 A 61 61 LEU CA C 60 58.301 56.523 1.778 1
1 592 . 41 1 1 A 61 61 LEU CB C 60 41.305 41.588 -0.283 1
1 596 . 41 1 1 A 61 61 LEU N N 60 125.639 123.122 2.517 1
1 597 . 41 1 1 A 62 62 ILE H H 61 7.698 7.898 -0.200 1
1 598 . 41 1 1 A 62 62 ILE HA H 61 3.952 3.954 -0.002 1
1 608 . 41 1 1 A 62 62 ILE C C 61 175.392 177.064 -1.672 1
1 609 . 41 1 1 A 62 62 ILE CA C 61 61.743 63.228 -1.485 1
1 610 . 41 1 1 A 62 62 ILE CB C 61 39.108 37.854 1.254 1
1 614 . 41 1 1 A 62 62 ILE N N 61 114.111 119.712 -5.601 1
1 615 . 41 1 1 A 63 63 TYR H H 62 7.273 7.914 -0.641 1
1 616 . 41 1 1 A 63 63 TYR HA H 62 4.343 4.306 0.037 1
1 623 . 41 1 1 A 63 63 TYR C C 62 178.264 178.633 -0.369 1
1 624 . 41 1 1 A 63 63 TYR CA C 62 57.231 61.166 -3.935 1
1 625 . 41 1 1 A 63 63 TYR CB C 62 36.332 37.662 -1.330 1
1 630 . 41 1 1 A 63 63 TYR N N 62 117.689 121.319 -3.630 1
1 631 . 41 1 1 A 64 64 THR H H 63 7.747 8.046 -0.299 1
1 632 . 41 1 1 A 64 64 THR HA H 63 4.266 4.241 0.025 1
1 637 . 41 1 1 A 64 64 THR CA C 63 69.362 67.559 1.803 1
1 638 . 41 1 1 A 64 64 THR CB C 63 66.962 67.921 -0.959 1
1 640 . 41 1 1 A 64 64 THR N N 63 113.755 116.080 -2.325 1
1 641 . 41 1 1 A 65 65 PRO HA H 64 4.372 4.449 -0.077 1
1 648 . 41 1 1 A 65 65 PRO C C 64 179.913 179.461 0.452 1
1 649 . 41 1 1 A 65 65 PRO CA C 64 66.011 66.296 -0.285 1
1 650 . 41 1 1 A 65 65 PRO CB C 64 30.642 30.767 -0.125 1
1 653 . 41 1 1 A 66 66 ILE H H 65 7.377 7.337 0.040 1
1 654 . 41 1 1 A 66 66 ILE HA H 65 3.530 3.875 -0.345 1
1 664 . 41 1 1 A 66 66 ILE C C 65 177.543 178.140 -0.597 1
1 665 . 41 1 1 A 66 66 ILE CA C 65 66.647 64.175 2.472 1
1 666 . 41 1 1 A 66 66 ILE CB C 65 38.029 37.609 0.420 1
1 670 . 41 1 1 A 66 66 ILE N N 65 118.353 116.566 1.787 1
1 671 . 41 1 1 A 67 67 PHE H H 66 8.480 8.410 0.070 1
1 672 . 41 1 1 A 67 67 PHE HA H 66 4.115 4.303 -0.188 1
1 680 . 41 1 1 A 67 67 PHE C C 66 177.293 178.425 -1.132 1
1 681 . 41 1 1 A 67 67 PHE CA C 66 59.570 61.566 -1.996 1
1 682 . 41 1 1 A 67 67 PHE CB C 66 38.865 39.281 -0.416 1
1 688 . 41 1 1 A 67 67 PHE N N 66 122.420 120.360 2.060 1
1 689 . 41 1 1 A 68 68 ASN H H 67 8.595 8.212 0.383 1
1 690 . 41 1 1 A 68 68 ASN HA H 67 4.211 4.391 -0.180 1
1 695 . 41 1 1 A 68 68 ASN C C 67 178.697 178.203 0.494 1
1 696 . 41 1 1 A 68 68 ASN CA C 67 56.056 56.278 -0.222 1
1 697 . 41 1 1 A 68 68 ASN CB C 67 37.704 37.953 -0.249 1
1 698 . 41 1 1 A 68 68 ASN N N 67 115.573 117.346 -1.773 1
1 700 . 41 1 1 A 69 69 GLU H H 68 8.414 7.982 0.432 1
1 701 . 41 1 1 A 69 69 GLU HA H 68 4.102 4.181 -0.079 1
1 706 . 41 1 1 A 69 69 GLU C C 68 177.880 178.841 -0.961 1
1 707 . 41 1 1 A 69 69 GLU CA C 68 59.399 59.336 0.063 1
1 708 . 41 1 1 A 69 69 GLU CB C 68 29.855 29.385 0.470 1
1 710 . 41 1 1 A 69 69 GLU N N 68 123.510 120.063 3.447 1
1 711 . 41 1 1 A 70 70 TYR H H 69 8.659 8.030 0.629 1
1 712 . 41 1 1 A 70 70 TYR HA H 69 3.362 4.167 -0.805 1
1 719 . 41 1 1 A 70 70 TYR C C 69 178.143 176.893 1.250 1
1 720 . 41 1 1 A 70 70 TYR CA C 69 60.686 61.521 -0.835 1
1 721 . 41 1 1 A 70 70 TYR CB C 69 38.560 38.819 -0.259 1
1 726 . 41 1 1 A 70 70 TYR N N 69 122.130 121.114 1.016 1
1 727 . 41 1 1 A 71 71 ILE H H 70 8.031 7.934 0.097 1
1 728 . 41 1 1 A 71 71 ILE HA H 70 3.265 3.664 -0.399 1
1 738 . 41 1 1 A 71 71 ILE C C 70 178.056 178.291 -0.235 1
1 739 . 41 1 1 A 71 71 ILE CA C 70 63.756 64.320 -0.564 1
1 740 . 41 1 1 A 71 71 ILE CB C 70 37.321 36.679 0.642 1
1 744 . 41 1 1 A 71 71 ILE N N 70 118.906 120.731 -1.825 1
1 745 . 41 1 1 A 72 72 SER H H 71 7.803 7.675 0.128 1
1 746 . 41 1 1 A 72 72 SER HA H 71 4.029 4.284 -0.255 1
1 749 . 41 1 1 A 72 72 SER CA C 71 61.380 61.100 0.280 1
1 750 . 41 1 1 A 72 72 SER CB C 71 63.288 62.899 0.389 1
1 751 . 41 1 1 A 72 72 SER N N 71 113.735 117.045 -3.310 1
1 752 . 41 1 1 A 73 73 LEU H H 72 7.952 7.933 0.019 1
1 753 . 41 1 1 A 73 73 LEU HA H 72 4.418 4.155 0.263 1
1 763 . 41 1 1 A 73 73 LEU C C 72 177.767 178.316 -0.549 1
1 764 . 41 1 1 A 73 73 LEU CA C 72 56.543 57.453 -0.910 1
1 765 . 41 1 1 A 73 73 LEU CB C 72 44.517 41.775 2.742 1
1 769 . 41 1 1 A 73 73 LEU N N 72 119.411 122.404 -2.993 1
1 770 . 41 1 1 A 74 74 VAL H H 73 8.021 7.481 0.540 1
1 771 . 41 1 1 A 74 74 VAL HA H 73 3.532 3.303 0.229 1
1 779 . 41 1 1 A 74 74 VAL C C 73 177.126 178.048 -0.922 1
1 780 . 41 1 1 A 74 74 VAL CA C 73 66.250 66.514 -0.264 1
1 781 . 41 1 1 A 74 74 VAL CB C 73 31.212 30.957 0.255 1
1 784 . 41 1 1 A 74 74 VAL N N 73 118.747 119.343 -0.596 1
1 785 . 41 1 1 A 75 75 GLU H H 74 7.232 7.910 -0.678 1
1 786 . 41 1 1 A 75 75 GLU HA H 74 3.013 4.219 -1.206 1
1 791 . 41 1 1 A 75 75 GLU C C 74 178.804 179.688 -0.884 1
1 792 . 41 1 1 A 75 75 GLU CA C 74 60.536 59.991 0.545 1
1 793 . 41 1 1 A 75 75 GLU CB C 74 27.009 29.112 -2.103 1
1 795 . 41 1 1 A 75 75 GLU N N 74 118.660 119.748 -1.088 1
1 796 . 41 1 1 A 76 76 LYS H H 75 7.051 8.024 -0.973 1
1 797 . 41 1 1 A 76 76 LYS HA H 75 3.765 4.119 -0.354 1
1 806 . 41 1 1 A 76 76 LYS C C 75 177.765 178.067 -0.302 1
1 807 . 41 1 1 A 76 76 LYS CA C 75 58.357 58.427 -0.070 1
1 808 . 41 1 1 A 76 76 LYS CB C 75 31.939 32.197 -0.258 1
1 812 . 41 1 1 A 76 76 LYS N N 75 116.112 119.415 -3.303 1
1 813 . 41 1 1 A 77 77 TYR H H 76 7.067 8.017 -0.950 1
1 814 . 41 1 1 A 77 77 TYR HA H 76 4.036 4.198 -0.162 1
1 821 . 41 1 1 A 77 77 TYR C C 76 177.752 177.256 0.496 1
1 822 . 41 1 1 A 77 77 TYR CA C 76 61.820 61.337 0.483 1
1 823 . 41 1 1 A 77 77 TYR CB C 76 38.480 38.706 -0.226 1
1 828 . 41 1 1 A 77 77 TYR N N 76 118.434 122.352 -3.918 1
1 829 . 41 1 1 A 78 78 ILE H H 77 7.554 8.314 -0.760 1
1 830 . 41 1 1 A 78 78 ILE HA H 77 3.159 3.568 -0.409 1
1 840 . 41 1 1 A 78 78 ILE C C 77 177.341 177.776 -0.435 1
1 841 . 41 1 1 A 78 78 ILE CA C 77 65.177 65.321 -0.144 1
1 842 . 41 1 1 A 78 78 ILE CB C 77 37.339 38.011 -0.672 1
1 846 . 41 1 1 A 78 78 ILE N N 77 117.672 121.487 -3.815 1
1 847 . 41 1 1 A 79 79 GLU H H 78 8.296 7.953 0.343 1
1 848 . 41 1 1 A 79 79 GLU HA H 78 3.557 3.749 -0.192 1
1 853 . 41 1 1 A 79 79 GLU C C 78 177.742 178.816 -1.074 1
1 854 . 41 1 1 A 79 79 GLU CA C 78 60.847 60.017 0.830 1
1 855 . 41 1 1 A 79 79 GLU CB C 78 29.594 29.185 0.409 1
1 857 . 41 1 1 A 79 79 GLU N N 78 118.701 120.868 -2.167 1
1 858 . 41 1 1 A 80 80 GLU H H 79 8.330 8.153 0.177 1
1 859 . 41 1 1 A 80 80 GLU HA H 79 3.774 4.001 -0.227 1
1 864 . 41 1 1 A 80 80 GLU C C 79 179.926 179.086 0.840 1
1 865 . 41 1 1 A 80 80 GLU CA C 79 59.581 58.948 0.633 1
1 866 . 41 1 1 A 80 80 GLU CB C 79 29.062 29.308 -0.246 1
1 868 . 41 1 1 A 80 80 GLU N N 79 116.767 117.981 -1.214 1
1 869 . 41 1 1 A 81 81 GLN H H 80 7.634 7.735 -0.101 1
1 870 . 41 1 1 A 81 81 GLN HA H 80 3.605 3.845 -0.240 1
1 877 . 41 1 1 A 81 81 GLN C C 80 179.681 178.515 1.166 1
1 878 . 41 1 1 A 81 81 GLN CA C 80 57.765 58.425 -0.660 1
1 879 . 41 1 1 A 81 81 GLN CB C 80 28.079 28.004 0.075 1
1 881 . 41 1 1 A 81 81 GLN N N 80 116.325 118.563 -2.238 1
1 883 . 41 1 1 A 82 82 LEU H H 81 8.156 7.474 0.682 1
1 884 . 41 1 1 A 82 82 LEU HA H 81 3.536 3.834 -0.298 1
1 894 . 41 1 1 A 82 82 LEU C C 81 178.945 179.327 -0.382 1
1 895 . 41 1 1 A 82 82 LEU CA C 81 57.761 56.843 0.918 1
1 896 . 41 1 1 A 82 82 LEU CB C 81 40.961 41.006 -0.045 1
1 900 . 41 1 1 A 82 82 LEU N N 81 121.546 120.165 1.381 1
1 901 . 41 1 1 A 83 83 LEU H H 82 8.326 7.914 0.412 1
1 902 . 41 1 1 A 83 83 LEU HA H 82 4.198 4.220 -0.022 1
1 912 . 41 1 1 A 83 83 LEU C C 82 178.631 179.064 -0.433 1
1 913 . 41 1 1 A 83 83 LEU CA C 82 57.016 57.038 -0.022 1
1 914 . 41 1 1 A 83 83 LEU CB C 82 42.182 40.730 1.452 1
1 918 . 41 1 1 A 83 83 LEU N N 82 120.426 118.820 1.606 1
1 919 . 41 1 1 A 84 84 GLN H H 83 6.992 7.726 -0.734 1
1 920 . 41 1 1 A 84 84 GLN HA H 83 3.877 3.977 -0.100 1
1 927 . 41 1 1 A 84 84 GLN C C 83 177.008 176.656 0.352 1
1 928 . 41 1 1 A 84 84 GLN CA C 83 57.543 58.665 -1.122 1
1 929 . 41 1 1 A 84 84 GLN CB C 83 28.688 28.440 0.248 1
1 931 . 41 1 1 A 84 84 GLN N N 83 114.001 117.215 -3.214 1
1 933 . 41 1 1 A 85 85 ARG H H 84 7.072 7.625 -0.553 1
1 934 . 41 1 1 A 85 85 ARG HA H 84 4.047 4.486 -0.439 1
1 942 . 41 1 1 A 85 85 ARG C C 84 175.999 175.410 0.589 1
1 943 . 41 1 1 A 85 85 ARG CA C 84 56.764 56.743 0.021 1
1 944 . 41 1 1 A 85 85 ARG CB C 84 32.044 32.311 -0.267 1
1 947 . 41 1 1 A 85 85 ARG N N 84 115.827 118.952 -3.125 1
1 949 . 41 1 1 A 86 86 ILE H H 85 8.238 7.369 0.869 1
1 950 . 41 1 1 A 86 86 ILE HA H 85 4.389 4.444 -0.055 1
1 960 . 41 1 1 A 86 86 ILE CA C 85 58.007 57.786 0.221 1
1 961 . 41 1 1 A 86 86 ILE CB C 85 39.604 38.546 1.058 1
1 965 . 41 1 1 A 86 86 ILE N N 85 119.285 118.479 0.806 1
1 966 . 41 1 1 A 87 87 PRO HA H 86 4.392 4.599 -0.207 1
1 973 . 41 1 1 A 87 87 PRO C C 86 177.622 176.371 1.251 1
1 974 . 41 1 1 A 87 87 PRO CA C 86 64.665 64.243 0.422 1
1 975 . 41 1 1 A 87 87 PRO CB C 86 32.020 31.706 0.314 1
1 978 . 41 1 1 A 88 88 GLU H H 87 8.312 8.218 0.094 1
1 979 . 41 1 1 A 88 88 GLU HA H 87 4.208 4.575 -0.367 1
1 984 . 41 1 1 A 88 88 GLU C C 87 175.554 175.784 -0.230 1
1 985 . 41 1 1 A 88 88 GLU CA C 87 56.045 56.206 -0.161 1
1 986 . 41 1 1 A 88 88 GLU CB C 87 28.654 30.776 -2.122 1
1 988 . 41 1 1 A 88 88 GLU N N 87 114.256 116.790 -2.534 1
1 989 . 41 1 1 A 89 89 PHE H H 88 7.946 7.356 0.590 1
1 990 . 41 1 1 A 89 89 PHE HA H 88 3.993 4.341 -0.348 1
1 998 . 41 1 1 A 89 89 PHE C C 88 173.460 174.536 -1.076 1
1 999 . 41 1 1 A 89 89 PHE CA C 88 60.119 59.540 0.579 1
1 1000 . 41 1 1 A 89 89 PHE CB C 88 39.994 39.679 0.315 1
1 1006 . 41 1 1 A 89 89 PHE N N 88 121.550 123.485 -1.935 1
1 1007 . 41 1 1 A 90 90 ASN H H 89 7.266 7.831 -0.565 1
1 1008 . 41 1 1 A 90 90 ASN HA H 89 4.454 5.093 -0.639 1
1 1013 . 41 1 1 A 90 90 ASN C C 89 173.921 175.251 -1.330 1
1 1014 . 41 1 1 A 90 90 ASN CA C 89 51.839 51.494 0.345 1
1 1015 . 41 1 1 A 90 90 ASN CB C 89 40.674 39.425 1.249 1
1 1016 . 41 1 1 A 90 90 ASN N N 89 125.344 125.039 0.305 1
1 1018 . 41 1 1 A 91 91 MET H H 90 8.968 8.759 0.209 1
1 1019 . 41 1 1 A 91 91 MET HA H 90 4.049 4.265 -0.216 1
1 1027 . 41 1 1 A 91 91 MET C C 90 177.475 177.872 -0.397 1
1 1028 . 41 1 1 A 91 91 MET CA C 90 57.758 57.986 -0.228 1
1 1029 . 41 1 1 A 91 91 MET CB C 90 32.250 32.432 -0.182 1
1 1032 . 41 1 1 A 91 91 MET N N 90 127.052 124.676 2.376 1
1 1033 . 41 1 1 A 92 92 ALA H H 91 8.292 7.977 0.315 1
1 1034 . 41 1 1 A 92 92 ALA HA H 91 4.059 4.134 -0.075 1
1 1038 . 41 1 1 A 92 92 ALA C C 91 180.412 179.688 0.724 1
1 1039 . 41 1 1 A 92 92 ALA CA C 91 55.368 54.878 0.490 1
1 1040 . 41 1 1 A 92 92 ALA CB C 91 17.527 18.775 -1.248 1
1 1041 . 41 1 1 A 92 92 ALA N N 91 123.752 121.075 2.677 1
1 1042 . 41 1 1 A 93 93 ALA H H 92 7.931 7.973 -0.042 1
1 1043 . 41 1 1 A 93 93 ALA HA H 92 4.054 4.071 -0.017 1
1 1047 . 41 1 1 A 93 93 ALA C C 92 180.482 179.890 0.592 1
1 1048 . 41 1 1 A 93 93 ALA CA C 92 54.614 54.864 -0.250 1
1 1049 . 41 1 1 A 93 93 ALA CB C 92 18.098 18.075 0.023 1
1 1050 . 41 1 1 A 93 93 ALA N N 92 121.158 119.937 1.221 1
1 1051 . 41 1 1 A 94 94 PHE H H 93 8.110 7.824 0.286 1
1 1052 . 41 1 1 A 94 94 PHE HA H 93 4.304 4.181 0.123 1
1 1060 . 41 1 1 A 94 94 PHE C C 93 177.350 177.099 0.251 1
1 1061 . 41 1 1 A 94 94 PHE CA C 93 61.641 61.513 0.128 1
1 1062 . 41 1 1 A 94 94 PHE CB C 93 40.014 39.397 0.617 1
1 1068 . 41 1 1 A 94 94 PHE N N 93 119.807 119.743 0.064 1
1 1069 . 41 1 1 A 95 95 THR H H 94 8.726 8.232 0.494 1
1 1070 . 41 1 1 A 95 95 THR HA H 94 3.569 3.862 -0.293 1
1 1075 . 41 1 1 A 95 95 THR C C 94 176.932 176.982 -0.050 1
1 1076 . 41 1 1 A 95 95 THR CA C 94 66.833 65.495 1.338 1
1 1077 . 41 1 1 A 95 95 THR CB C 94 68.445 68.227 0.218 1
1 1079 . 41 1 1 A 95 95 THR N N 94 113.074 111.984 1.090 1
1 1080 . 41 1 1 A 96 96 THR H H 95 7.657 7.854 -0.197 1
1 1081 . 41 1 1 A 96 96 THR HA H 95 3.945 3.971 -0.026 1
1 1086 . 41 1 1 A 96 96 THR C C 95 176.386 176.475 -0.089 1
1 1087 . 41 1 1 A 96 96 THR CA C 95 66.550 66.221 0.329 1
1 1088 . 41 1 1 A 96 96 THR CB C 95 68.583 68.729 -0.146 1
1 1090 . 41 1 1 A 96 96 THR N N 95 117.927 116.469 1.458 1
1 1091 . 41 1 1 A 97 97 THR H H 96 7.699 7.974 -0.275 1
1 1092 . 41 1 1 A 97 97 THR HA H 96 3.905 3.940 -0.035 1
1 1097 . 41 1 1 A 97 97 THR C C 96 176.572 176.549 0.023 1
1 1098 . 41 1 1 A 97 97 THR CA C 96 65.979 66.660 -0.681 1
1 1099 . 41 1 1 A 97 97 THR CB C 96 68.553 68.011 0.542 1
1 1101 . 41 1 1 A 97 97 THR N N 96 118.518 116.340 2.178 1
1 1102 . 41 1 1 A 98 98 LEU H H 97 8.304 8.142 0.162 1
1 1103 . 41 1 1 A 98 98 LEU HA H 97 3.725 3.924 -0.199 1
1 1113 . 41 1 1 A 98 98 LEU C C 97 178.490 178.794 -0.304 1
1 1114 . 41 1 1 A 98 98 LEU CA C 97 58.517 58.056 0.461 1
1 1115 . 41 1 1 A 98 98 LEU CB C 97 41.697 41.391 0.306 1
1 1119 . 41 1 1 A 98 98 LEU N N 97 122.882 122.180 0.702 1
1 1120 . 41 1 1 A 99 99 GLN H H 98 7.639 8.023 -0.384 1
1 1121 . 41 1 1 A 99 99 GLN HA H 98 3.927 4.039 -0.112 1
1 1128 . 41 1 1 A 99 99 GLN C C 98 178.068 178.352 -0.284 1
1 1129 . 41 1 1 A 99 99 GLN CA C 98 58.735 58.954 -0.219 1
1 1130 . 41 1 1 A 99 99 GLN CB C 98 27.986 28.352 -0.366 1
1 1132 . 41 1 1 A 99 99 GLN N N 98 114.302 117.659 -3.357 1
1 1134 . 41 1 1 A 100 100 HIS H H 99 7.575 8.085 -0.510 1
1 1135 . 41 1 1 A 100 100 HIS HA H 99 4.524 4.262 0.262 1
1 1139 . 41 1 1 A 100 100 HIS C C 99 174.789 177.350 -2.561 1
1 1140 . 41 1 1 A 100 100 HIS CA C 99 56.154 59.237 -3.083 1
1 1141 . 41 1 1 A 100 100 HIS CB C 99 28.946 29.998 -1.052 1
1 1143 . 41 1 1 A 100 100 HIS N N 99 114.778 121.439 -6.661 1
1 1144 . 41 1 1 A 101 101 HIS H H 100 7.773 8.198 -0.425 1
1 1145 . 41 1 1 A 101 101 HIS HA H 100 4.704 3.815 0.889 1
1 1149 . 41 1 1 A 101 101 HIS C C 100 174.818 176.895 -2.077 1
1 1150 . 41 1 1 A 101 101 HIS CA C 100 54.830 58.177 -3.347 1
1 1151 . 41 1 1 A 101 101 HIS CB C 100 29.749 30.101 -0.352 1
1 1153 . 41 1 1 A 101 101 HIS N N 100 117.397 118.676 -1.279 1
1 1154 . 41 1 1 A 102 102 LYS H H 101 7.324 8.044 -0.720 1
1 1155 . 41 1 1 A 102 102 LYS HA H 101 3.611 4.016 -0.405 1
1 1164 . 41 1 1 A 102 102 LYS C C 101 176.823 178.732 -1.909 1
1 1165 . 41 1 1 A 102 102 LYS CA C 101 59.915 59.393 0.522 1
1 1166 . 41 1 1 A 102 102 LYS CB C 101 32.825 32.060 0.765 1
1 1170 . 41 1 1 A 102 102 LYS N N 101 120.533 117.504 3.029 1
1 1171 . 41 1 1 A 103 103 ASP H H 102 8.361 7.380 0.981 1
1 1172 . 41 1 1 A 103 103 ASP HA H 102 4.421 4.457 -0.036 1
1 1175 . 41 1 1 A 103 103 ASP C C 102 176.793 177.423 -0.630 1
1 1176 . 41 1 1 A 103 103 ASP CA C 102 55.500 55.725 -0.225 1
1 1177 . 41 1 1 A 103 103 ASP CB C 102 40.178 40.285 -0.107 1
1 1178 . 41 1 1 A 103 103 ASP N N 102 114.814 119.458 -4.644 1
1 1179 . 41 1 1 A 104 104 GLU H H 103 7.858 8.253 -0.395 1
1 1180 . 41 1 1 A 104 104 GLU HA H 103 4.339 4.573 -0.234 1
1 1183 . 41 1 1 A 104 104 GLU C C 103 175.777 176.326 -0.549 1
1 1184 . 41 1 1 A 104 104 GLU CA C 103 56.356 57.884 -1.528 1
1 1185 . 41 1 1 A 104 104 GLU CB C 103 31.293 31.962 -0.669 1
1 1186 . 41 1 1 A 104 104 GLU N N 103 116.826 118.744 -1.918 1
1 1187 . 41 1 1 A 105 105 VAL H H 104 7.201 7.521 -0.320 1
1 1188 . 41 1 1 A 105 105 VAL HA H 104 4.296 4.148 0.148 1
1 1196 . 41 1 1 A 105 105 VAL C C 104 174.482 175.650 -1.168 1
1 1197 . 41 1 1 A 105 105 VAL CA C 104 60.370 62.639 -2.269 1
1 1198 . 41 1 1 A 105 105 VAL CB C 104 34.341 32.903 1.438 1
1 1201 . 41 1 1 A 105 105 VAL N N 104 116.422 119.784 -3.362 1
1 1202 . 41 1 1 A 106 106 ALA H H 105 8.487 8.578 -0.091 1
1 1203 . 41 1 1 A 106 106 ALA HA H 105 4.172 4.371 -0.199 1
1 1207 . 41 1 1 A 106 106 ALA C C 105 179.030 178.410 0.620 1
1 1208 . 41 1 1 A 106 106 ALA CA C 105 52.966 52.291 0.675 1
1 1209 . 41 1 1 A 106 106 ALA CB C 105 19.371 19.026 0.345 1
1 1210 . 41 1 1 A 106 106 ALA N N 105 128.313 128.731 -0.418 1
1 1211 . 41 1 1 A 107 107 GLY H H 106 8.738 8.765 -0.027 1
1 1212 . 41 1 1 A 107 107 GLY HA2 H 106 3.773 3.867 -0.094 1
1 1213 . 41 1 1 A 107 107 GLY HA3 H 106 3.998 3.928 0.070 1
1 1214 . 41 1 1 A 107 107 GLY C C 106 174.958 175.820 -0.862 1
1 1215 . 41 1 1 A 107 107 GLY CA C 106 47.449 47.210 0.239 1
1 1216 . 41 1 1 A 107 107 GLY N N 106 110.612 110.659 -0.047 1
1 1217 . 41 1 1 A 108 108 ASP H H 107 8.535 8.478 0.057 1
1 1218 . 41 1 1 A 108 108 ASP HA H 107 4.333 4.340 -0.007 1
1 1221 . 41 1 1 A 108 108 ASP C C 107 179.133 178.260 0.873 1
1 1222 . 41 1 1 A 108 108 ASP CA C 107 56.721 56.829 -0.108 1
1 1223 . 41 1 1 A 108 108 ASP CB C 107 39.336 39.632 -0.296 1
1 1224 . 41 1 1 A 108 108 ASP N N 107 117.474 120.884 -3.410 1
1 1225 . 41 1 1 A 109 109 ILE H H 108 7.459 7.617 -0.158 1
1 1226 . 41 1 1 A 109 109 ILE HA H 108 3.688 3.829 -0.141 1
1 1236 . 41 1 1 A 109 109 ILE C C 108 176.735 178.422 -1.687 1
1 1237 . 41 1 1 A 109 109 ILE CA C 108 63.474 65.386 -1.912 1
1 1238 . 41 1 1 A 109 109 ILE CB C 108 37.340 37.595 -0.255 1
1 1242 . 41 1 1 A 109 109 ILE N N 108 119.609 121.224 -1.615 1
1 1243 . 41 1 1 A 110 110 PHE H H 109 7.920 8.292 -0.372 1
1 1244 . 41 1 1 A 110 110 PHE HA H 109 3.759 4.085 -0.326 1
1 1252 . 41 1 1 A 110 110 PHE C C 109 177.132 177.401 -0.269 1
1 1253 . 41 1 1 A 110 110 PHE CA C 109 62.766 61.256 1.510 1
1 1254 . 41 1 1 A 110 110 PHE CB C 109 39.752 39.298 0.454 1
1 1260 . 41 1 1 A 110 110 PHE N N 109 120.906 120.496 0.410 1
1 1261 . 41 1 1 A 111 111 ASP H H 110 8.639 8.240 0.399 1
1 1262 . 41 1 1 A 111 111 ASP HA H 110 4.216 4.224 -0.008 1
1 1265 . 41 1 1 A 111 111 ASP C C 110 178.900 178.435 0.465 1
1 1266 . 41 1 1 A 111 111 ASP CA C 110 57.105 57.243 -0.138 1
1 1267 . 41 1 1 A 111 111 ASP CB C 110 39.697 41.709 -2.012 1
1 1268 . 41 1 1 A 111 111 ASP N N 110 117.124 119.044 -1.920 1
1 1269 . 41 1 1 A 112 112 MET H H 111 7.331 7.547 -0.216 1
1 1270 . 41 1 1 A 112 112 MET HA H 111 4.081 4.147 -0.066 1
1 1278 . 41 1 1 A 112 112 MET C C 111 179.052 178.177 0.875 1
1 1279 . 41 1 1 A 112 112 MET CA C 111 58.202 58.142 0.060 1
1 1280 . 41 1 1 A 112 112 MET CB C 111 31.827 32.364 -0.537 1
1 1283 . 41 1 1 A 112 112 MET N N 111 118.061 119.505 -1.444 1
1 1284 . 41 1 1 A 113 113 LEU H H 112 8.001 8.051 -0.050 1
1 1285 . 41 1 1 A 113 113 LEU HA H 112 3.723 3.602 0.121 1
1 1295 . 41 1 1 A 113 113 LEU C C 112 179.747 178.661 1.086 1
1 1296 . 41 1 1 A 113 113 LEU CA C 112 57.371 57.432 -0.061 1
1 1297 . 41 1 1 A 113 113 LEU CB C 112 40.671 41.116 -0.445 1
1 1301 . 41 1 1 A 113 113 LEU N N 112 120.426 119.693 0.733 1
1 1302 . 41 1 1 A 114 114 LEU H H 113 7.744 7.662 0.082 1
1 1303 . 41 1 1 A 114 114 LEU HA H 113 4.007 3.546 0.461 1
1 1313 . 41 1 1 A 114 114 LEU C C 113 179.358 178.552 0.806 1
1 1314 . 41 1 1 A 114 114 LEU CA C 113 57.202 57.542 -0.340 1
1 1315 . 41 1 1 A 114 114 LEU CB C 113 41.727 41.612 0.115 1
1 1319 . 41 1 1 A 114 114 LEU N N 113 119.584 119.660 -0.076 1
1 1320 . 41 1 1 A 115 115 THR H H 114 7.353 7.611 -0.258 1
1 1321 . 41 1 1 A 115 115 THR HA H 114 4.071 4.101 -0.030 1
1 1327 . 41 1 1 A 115 115 THR C C 114 173.591 176.149 -2.558 1
1 1328 . 41 1 1 A 115 115 THR CA C 114 65.332 64.489 0.843 1
1 1329 . 41 1 1 A 115 115 THR CB C 114 70.319 68.656 1.663 1
1 1331 . 41 1 1 A 115 115 THR N N 114 107.535 112.301 -4.766 1
1 1332 . 41 1 1 A 116 116 PHE H H 115 6.979 7.894 -0.915 1
1 1333 . 41 1 1 A 116 116 PHE HA H 115 5.022 4.495 0.527 1
1 1341 . 41 1 1 A 116 116 PHE C C 115 176.488 175.927 0.561 1
1 1342 . 41 1 1 A 116 116 PHE CA C 115 55.911 61.208 -5.297 1
1 1343 . 41 1 1 A 116 116 PHE CB C 115 38.521 38.598 -0.077 1
1 1349 . 41 1 1 A 116 116 PHE N N 115 112.366 119.994 -7.628 1
1 1350 . 41 1 1 A 117 117 THR H H 116 7.564 8.094 -0.530 1
1 1351 . 41 1 1 A 117 117 THR HA H 116 4.626 4.870 -0.244 1
1 1356 . 41 1 1 A 117 117 THR C C 116 174.085 173.968 0.117 1
1 1357 . 41 1 1 A 117 117 THR CA C 116 61.636 62.696 -1.060 1
1 1358 . 41 1 1 A 117 117 THR CB C 116 70.915 72.459 -1.544 1
1 1360 . 41 1 1 A 117 117 THR N N 116 105.498 113.477 -7.979 1
1 1361 . 41 1 1 A 118 118 ASP H H 117 8.270 7.787 0.483 1
1 1362 . 41 1 1 A 118 118 ASP HA H 117 4.955 4.700 0.255 1
1 1365 . 41 1 1 A 118 118 ASP C C 117 176.328 176.401 -0.073 1
1 1366 . 41 1 1 A 118 118 ASP CA C 117 53.417 53.322 0.095 1
1 1367 . 41 1 1 A 118 118 ASP CB C 117 43.388 40.334 3.054 1
1 1368 . 41 1 1 A 118 118 ASP N N 117 124.409 121.991 2.418 1
1 1369 . 41 1 1 A 119 119 PHE H H 118 8.973 8.792 0.181 1
1 1370 . 41 1 1 A 119 119 PHE HA H 118 3.506 4.189 -0.683 1
1 1378 . 41 1 1 A 119 119 PHE CA C 118 61.490 61.172 0.318 1
1 1379 . 41 1 1 A 119 119 PHE CB C 118 39.246 39.558 -0.312 1
1 1385 . 41 1 1 A 119 119 PHE N N 118 126.688 126.410 0.278 1
1 1386 . 41 1 1 A 120 120 LEU H H 119 8.099 8.312 -0.213 1
1 1387 . 41 1 1 A 120 120 LEU HA H 119 3.842 3.937 -0.095 1
1 1397 . 41 1 1 A 120 120 LEU C C 119 179.601 179.511 0.090 1
1 1398 . 41 1 1 A 120 120 LEU CA C 119 58.174 57.932 0.242 1
1 1399 . 41 1 1 A 120 120 LEU CB C 119 40.315 41.084 -0.769 1
1 1403 . 41 1 1 A 120 120 LEU N N 119 117.930 119.834 -1.904 1
1 1404 . 41 1 1 A 121 121 ALA H H 120 7.729 7.889 -0.160 1
1 1405 . 41 1 1 A 121 121 ALA HA H 120 3.996 4.112 -0.116 1
1 1409 . 41 1 1 A 121 121 ALA C C 120 180.995 179.571 1.424 1
1 1410 . 41 1 1 A 121 121 ALA CA C 120 54.832 54.740 0.092 1
1 1411 . 41 1 1 A 121 121 ALA CB C 120 17.706 18.317 -0.611 1
1 1412 . 41 1 1 A 121 121 ALA N N 120 123.195 121.422 1.773 1
1 1413 . 41 1 1 A 122 122 PHE H H 121 7.943 7.929 0.014 1
1 1414 . 41 1 1 A 122 122 PHE HA H 121 3.887 3.859 0.028 1
1 1419 . 41 1 1 A 122 122 PHE C C 121 175.410 176.886 -1.476 1
1 1420 . 41 1 1 A 122 122 PHE CA C 121 61.075 60.739 0.336 1
1 1421 . 41 1 1 A 122 122 PHE CB C 121 38.115 38.851 -0.736 1
1 1424 . 41 1 1 A 122 122 PHE N N 121 121.798 120.469 1.329 1
1 1425 . 41 1 1 A 123 123 LYS H H 122 8.468 7.857 0.611 1
1 1426 . 41 1 1 A 123 123 LYS HA H 122 3.077 3.984 -0.907 1
1 1435 . 41 1 1 A 123 123 LYS C C 122 178.453 178.905 -0.452 1
1 1436 . 41 1 1 A 123 123 LYS CA C 122 59.855 59.923 -0.068 1
1 1437 . 41 1 1 A 123 123 LYS CB C 122 32.374 32.282 0.092 1
1 1441 . 41 1 1 A 123 123 LYS N N 122 120.614 118.580 2.034 1
1 1442 . 41 1 1 A 124 124 GLU H H 123 8.100 7.919 0.181 1
1 1443 . 41 1 1 A 124 124 GLU HA H 123 3.652 4.072 -0.420 1
1 1448 . 41 1 1 A 124 124 GLU C C 123 177.743 178.603 -0.860 1
1 1449 . 41 1 1 A 124 124 GLU CA C 123 59.406 59.438 -0.032 1
1 1450 . 41 1 1 A 124 124 GLU CB C 123 28.811 29.419 -0.608 1
1 1452 . 41 1 1 A 124 124 GLU N N 123 117.404 118.824 -1.420 1
1 1453 . 41 1 1 A 125 125 MET H H 124 7.537 7.657 -0.120 1
1 1454 . 41 1 1 A 125 125 MET HA H 124 3.860 4.008 -0.148 1
1 1462 . 41 1 1 A 125 125 MET C C 124 179.522 178.279 1.243 1
1 1463 . 41 1 1 A 125 125 MET CA C 124 58.832 58.367 0.465 1
1 1464 . 41 1 1 A 125 125 MET CB C 124 31.765 31.534 0.231 1
1 1467 . 41 1 1 A 125 125 MET N N 124 119.413 119.169 0.244 1
1 1468 . 41 1 1 A 126 126 PHE H H 125 7.148 7.483 -0.335 1
1 1469 . 41 1 1 A 126 126 PHE HA H 125 3.633 4.194 -0.561 1
1 1476 . 41 1 1 A 126 126 PHE C C 125 178.994 178.315 0.679 1
1 1477 . 41 1 1 A 126 126 PHE CA C 125 63.148 60.963 2.185 1
1 1478 . 41 1 1 A 126 126 PHE CB C 125 39.830 38.424 1.406 1
1 1483 . 41 1 1 A 126 126 PHE N N 125 120.013 119.128 0.885 1
1 1484 . 41 1 1 A 127 127 LEU H H 126 8.369 8.516 -0.147 1
1 1485 . 41 1 1 A 127 127 LEU HA H 126 3.972 4.034 -0.062 1
1 1495 . 41 1 1 A 127 127 LEU C C 126 180.621 179.119 1.502 1
1 1496 . 41 1 1 A 127 127 LEU CA C 126 57.944 57.965 -0.021 1
1 1497 . 41 1 1 A 127 127 LEU CB C 126 40.543 41.215 -0.672 1
1 1501 . 41 1 1 A 127 127 LEU N N 126 119.692 119.741 -0.049 1
1 1502 . 41 1 1 A 128 128 ASP H H 127 8.578 8.183 0.395 1
1 1503 . 41 1 1 A 128 128 ASP HA H 127 4.308 4.364 -0.056 1
1 1506 . 41 1 1 A 128 128 ASP C C 127 178.254 178.178 0.076 1
1 1507 . 41 1 1 A 128 128 ASP CA C 127 56.964 57.312 -0.348 1
1 1508 . 41 1 1 A 128 128 ASP CB C 127 39.735 40.915 -1.180 1
1 1509 . 41 1 1 A 128 128 ASP N N 127 121.926 119.528 2.398 1
1 1510 . 41 1 1 A 129 129 TYR H H 128 7.710 8.171 -0.461 1
1 1511 . 41 1 1 A 129 129 TYR HA H 128 3.908 4.032 -0.124 1
1 1518 . 41 1 1 A 129 129 TYR C C 128 177.633 177.484 0.149 1
1 1519 . 41 1 1 A 129 129 TYR CA C 128 61.796 61.581 0.215 1
1 1520 . 41 1 1 A 129 129 TYR CB C 128 39.372 38.718 0.654 1
1 1525 . 41 1 1 A 129 129 TYR N N 128 122.548 120.365 2.183 1
1 1526 . 41 1 1 A 130 130 ARG H H 129 8.622 8.320 0.302 1
1 1527 . 41 1 1 A 130 130 ARG HA H 129 3.722 3.941 -0.219 1
1 1535 . 41 1 1 A 130 130 ARG CA C 129 60.084 59.754 0.330 1
1 1536 . 41 1 1 A 130 130 ARG CB C 129 29.902 29.915 -0.013 1
1 1539 . 41 1 1 A 130 130 ARG N N 129 118.302 119.388 -1.086 1
1 1541 . 41 1 1 A 131 131 ALA H H 130 7.936 7.977 -0.041 1
1 1542 . 41 1 1 A 131 131 ALA HA H 130 3.997 4.010 -0.013 1
1 1546 . 41 1 1 A 131 131 ALA C C 130 180.456 180.133 0.323 1
1 1547 . 41 1 1 A 131 131 ALA CA C 130 55.133 54.989 0.144 1
1 1548 . 41 1 1 A 131 131 ALA CB C 130 17.750 18.154 -0.404 1
1 1549 . 41 1 1 A 131 131 ALA N N 130 119.788 120.467 -0.679 1
1 1550 . 41 1 1 A 132 132 GLU H H 131 7.622 7.409 0.213 1
1 1551 . 41 1 1 A 132 132 GLU HA H 131 3.862 3.997 -0.135 1
1 1556 . 41 1 1 A 132 132 GLU C C 131 179.528 178.099 1.429 1
1 1557 . 41 1 1 A 132 132 GLU CA C 131 58.849 58.461 0.388 1
1 1558 . 41 1 1 A 132 132 GLU CB C 131 28.930 28.963 -0.033 1
1 1560 . 41 1 1 A 132 132 GLU N N 131 118.428 117.588 0.840 1
1 1561 . 41 1 1 A 133 133 LYS H H 132 7.853 7.516 0.337 1
1 1562 . 41 1 1 A 133 133 LYS HA H 132 3.722 4.020 -0.298 1
1 1571 . 41 1 1 A 133 133 LYS C C 132 175.725 177.857 -2.132 1
1 1572 . 41 1 1 A 133 133 LYS CA C 132 57.544 57.925 -0.381 1
1 1573 . 41 1 1 A 133 133 LYS CB C 132 31.770 31.725 0.045 1
1 1577 . 41 1 1 A 133 133 LYS N N 132 119.473 118.193 1.280 1
1 1578 . 41 1 1 A 134 134 GLU H H 133 8.151 7.467 0.684 1
1 1579 . 41 1 1 A 134 134 GLU HA H 133 4.161 4.178 -0.017 1
1 1584 . 41 1 1 A 134 134 GLU C C 133 177.453 176.901 0.552 1
1 1585 . 41 1 1 A 134 134 GLU CA C 133 57.222 55.873 1.349 1
1 1586 . 41 1 1 A 134 134 GLU CB C 133 30.091 29.149 0.942 1
1 1588 . 41 1 1 A 134 134 GLU N N 133 116.525 115.887 0.638 1
1 1589 . 41 1 1 A 135 135 GLY H H 134 7.702 8.133 -0.431 1
1 1590 . 41 1 1 A 135 135 GLY HA2 H 134 3.896 3.985 -0.089 1
1 1591 . 41 1 1 A 135 135 GLY HA3 H 134 3.897 3.995 -0.098 1
1 1592 . 41 1 1 A 135 135 GLY C C 134 174.538 173.219 1.319 1
1 1593 . 41 1 1 A 135 135 GLY CA C 134 45.975 45.633 0.342 1
1 1594 . 41 1 1 A 135 135 GLY N N 134 107.924 110.664 -2.740 1
1 1595 . 41 1 1 A 136 136 ARG H H 135 8.045 7.718 0.327 1
1 1596 . 41 1 1 A 136 136 ARG HA H 135 4.323 4.687 -0.364 1
1 1604 . 41 1 1 A 136 136 ARG C C 135 175.864 174.646 1.218 1
1 1605 . 41 1 1 A 136 136 ARG CA C 135 56.016 54.486 1.530 1
1 1606 . 41 1 1 A 136 136 ARG CB C 135 30.987 33.029 -2.042 1
1 1609 . 41 1 1 A 136 136 ARG N N 135 119.708 116.489 3.219 1
1 1 . 42 1 1 A 14 14 PHE CA C 13 58.199 58.050 0.149 1
1 2 . 42 1 1 A 14 14 PHE CB C 13 39.717 39.805 -0.088 1
1 3 . 42 1 1 A 15 15 SER H H 14 8.299 8.353 -0.054 1
1 4 . 42 1 1 A 15 15 SER HA H 14 4.359 5.296 -0.937 1
1 7 . 42 1 1 A 15 15 SER CA C 14 58.249 55.899 2.350 1
1 8 . 42 1 1 A 15 15 SER CB C 14 63.936 65.773 -1.837 1
1 9 . 42 1 1 A 15 15 SER N N 14 117.379 119.857 -2.478 1
1 10 . 42 1 1 A 16 16 SER H H 15 8.255 8.664 -0.409 1
1 11 . 42 1 1 A 16 16 SER HA H 15 3.729 4.537 -0.808 1
1 14 . 42 1 1 A 16 16 SER CA C 15 58.224 59.687 -1.463 1
1 15 . 42 1 1 A 16 16 SER CB C 15 63.886 64.621 -0.735 1
1 16 . 42 1 1 A 16 16 SER N N 15 117.694 118.334 -0.640 1
1 17 . 42 1 1 A 17 17 ALA H H 16 8.333 7.936 0.397 1
1 18 . 42 1 1 A 17 17 ALA HA H 16 4.252 4.259 -0.007 1
1 22 . 42 1 1 A 17 17 ALA CA C 16 53.377 53.905 -0.528 1
1 23 . 42 1 1 A 17 17 ALA CB C 16 18.896 18.466 0.430 1
1 24 . 42 1 1 A 17 17 ALA N N 16 125.462 123.665 1.797 1
1 25 . 42 1 1 A 18 18 SER H H 17 8.219 7.981 0.238 1
1 26 . 42 1 1 A 18 18 SER HA H 17 4.332 4.828 -0.496 1
1 29 . 42 1 1 A 18 18 SER CA C 17 59.105 57.176 1.929 1
1 30 . 42 1 1 A 18 18 SER CB C 17 63.592 64.061 -0.469 1
1 31 . 42 1 1 A 18 18 SER N N 17 114.821 109.154 5.667 1
1 32 . 42 1 1 A 19 19 ASP H H 18 8.309 8.420 -0.111 1
1 33 . 42 1 1 A 19 19 ASP HA H 18 4.554 4.958 -0.404 1
1 36 . 42 1 1 A 19 19 ASP C C 18 176.528 176.610 -0.082 1
1 37 . 42 1 1 A 19 19 ASP CA C 18 55.272 54.279 0.993 1
1 38 . 42 1 1 A 19 19 ASP CB C 18 40.883 42.362 -1.479 1
1 39 . 42 1 1 A 19 19 ASP N N 18 123.367 119.482 3.885 1
1 40 . 42 1 1 A 20 20 ALA H H 19 8.133 8.560 -0.427 1
1 41 . 42 1 1 A 20 20 ALA HA H 19 4.170 4.091 0.079 1
1 45 . 42 1 1 A 20 20 ALA C C 19 179.857 179.071 0.786 1
1 46 . 42 1 1 A 20 20 ALA CA C 19 54.341 55.546 -1.205 1
1 47 . 42 1 1 A 20 20 ALA CB C 19 18.660 18.672 -0.012 1
1 48 . 42 1 1 A 20 20 ALA N N 19 123.350 123.016 0.334 1
1 49 . 42 1 1 A 21 21 GLU H H 20 8.140 8.051 0.089 1
1 50 . 42 1 1 A 21 21 GLU HA H 20 4.128 4.083 0.045 1
1 55 . 42 1 1 A 21 21 GLU C C 20 177.675 178.645 -0.970 1
1 56 . 42 1 1 A 21 21 GLU CA C 20 58.520 59.368 -0.848 1
1 57 . 42 1 1 A 21 21 GLU CB C 20 29.765 29.550 0.215 1
1 59 . 42 1 1 A 21 21 GLU N N 20 119.063 119.281 -0.218 1
1 60 . 42 1 1 A 22 22 PHE H H 21 8.009 7.987 0.022 1
1 61 . 42 1 1 A 22 22 PHE HA H 21 4.123 4.345 -0.222 1
1 68 . 42 1 1 A 22 22 PHE C C 21 176.410 177.389 -0.979 1
1 69 . 42 1 1 A 22 22 PHE CA C 21 62.202 61.161 1.041 1
1 70 . 42 1 1 A 22 22 PHE CB C 21 39.223 39.065 0.158 1
1 75 . 42 1 1 A 22 22 PHE N N 21 121.211 120.644 0.567 1
1 76 . 42 1 1 A 23 23 ASP H H 22 8.261 8.381 -0.120 1
1 77 . 42 1 1 A 23 23 ASP HA H 22 4.041 4.472 -0.431 1
1 80 . 42 1 1 A 23 23 ASP C C 22 179.078 178.223 0.855 1
1 81 . 42 1 1 A 23 23 ASP CA C 22 57.048 57.952 -0.904 1
1 82 . 42 1 1 A 23 23 ASP CB C 22 40.154 42.281 -2.127 1
1 83 . 42 1 1 A 23 23 ASP N N 22 116.876 119.490 -2.614 1
1 84 . 42 1 1 A 24 24 ALA H H 23 7.651 7.523 0.128 1
1 85 . 42 1 1 A 24 24 ALA HA H 23 3.785 3.869 -0.084 1
1 89 . 42 1 1 A 24 24 ALA C C 23 179.577 179.544 0.033 1
1 90 . 42 1 1 A 24 24 ALA CA C 23 54.341 54.922 -0.581 1
1 91 . 42 1 1 A 24 24 ALA CB C 23 17.762 18.189 -0.427 1
1 92 . 42 1 1 A 24 24 ALA N N 23 121.873 121.253 0.620 1
1 93 . 42 1 1 A 25 25 VAL H H 24 7.718 7.800 -0.082 1
1 94 . 42 1 1 A 25 25 VAL HA H 24 3.216 3.475 -0.259 1
1 102 . 42 1 1 A 25 25 VAL C C 24 177.805 178.394 -0.589 1
1 103 . 42 1 1 A 25 25 VAL CA C 24 66.789 66.677 0.112 1
1 104 . 42 1 1 A 25 25 VAL CB C 24 31.277 31.220 0.057 1
1 107 . 42 1 1 A 25 25 VAL N N 24 117.890 118.414 -0.524 1
1 108 . 42 1 1 A 26 26 VAL H H 25 7.867 7.884 -0.017 1
1 109 . 42 1 1 A 26 26 VAL HA H 25 3.274 3.594 -0.320 1
1 117 . 42 1 1 A 26 26 VAL C C 25 177.788 177.945 -0.157 1
1 118 . 42 1 1 A 26 26 VAL CA C 25 67.282 66.499 0.783 1
1 119 . 42 1 1 A 26 26 VAL CB C 25 31.266 31.549 -0.283 1
1 122 . 42 1 1 A 26 26 VAL N N 25 118.170 120.230 -2.060 1
1 123 . 42 1 1 A 27 27 GLY H H 26 7.544 7.633 -0.089 1
1 124 . 42 1 1 A 27 27 GLY HA2 H 26 3.592 3.553 0.039 1
1 125 . 42 1 1 A 27 27 GLY HA3 H 26 3.721 3.665 0.056 1
1 126 . 42 1 1 A 27 27 GLY C C 26 176.717 176.562 0.155 1
1 127 . 42 1 1 A 27 27 GLY CA C 26 47.085 47.267 -0.182 1
1 128 . 42 1 1 A 27 27 GLY N N 26 105.795 107.487 -1.692 1
1 129 . 42 1 1 A 28 28 TYR H H 27 7.625 7.357 0.268 1
1 130 . 42 1 1 A 28 28 TYR HA H 27 4.546 4.577 -0.031 1
1 137 . 42 1 1 A 28 28 TYR C C 27 178.991 178.125 0.866 1
1 138 . 42 1 1 A 28 28 TYR CA C 27 58.845 59.695 -0.850 1
1 139 . 42 1 1 A 28 28 TYR CB C 27 37.602 37.489 0.113 1
1 144 . 42 1 1 A 28 28 TYR N N 27 119.933 121.877 -1.944 1
1 145 . 42 1 1 A 29 29 LEU H H 28 8.517 8.250 0.267 1
1 146 . 42 1 1 A 29 29 LEU HA H 28 3.728 3.842 -0.114 1
1 156 . 42 1 1 A 29 29 LEU CA C 28 58.281 57.950 0.331 1
1 157 . 42 1 1 A 29 29 LEU CB C 28 41.948 41.407 0.541 1
1 161 . 42 1 1 A 29 29 LEU N N 28 119.669 120.155 -0.486 1
1 162 . 42 1 1 A 30 30 GLU H H 29 8.072 7.988 0.084 1
1 163 . 42 1 1 A 30 30 GLU HA H 29 3.722 3.888 -0.166 1
1 168 . 42 1 1 A 30 30 GLU C C 29 177.731 179.316 -1.585 1
1 169 . 42 1 1 A 30 30 GLU CA C 29 59.763 59.952 -0.189 1
1 170 . 42 1 1 A 30 30 GLU CB C 29 28.844 29.364 -0.520 1
1 172 . 42 1 1 A 30 30 GLU N N 29 117.666 117.882 -0.216 1
1 173 . 42 1 1 A 31 31 ASP H H 30 7.243 7.819 -0.576 1
1 174 . 42 1 1 A 31 31 ASP HA H 30 4.297 4.393 -0.096 1
1 177 . 42 1 1 A 31 31 ASP CA C 30 56.953 57.321 -0.368 1
1 178 . 42 1 1 A 31 31 ASP CB C 30 40.730 40.470 0.260 1
1 179 . 42 1 1 A 31 31 ASP N N 30 116.720 119.488 -2.768 1
1 180 . 42 1 1 A 32 32 ILE H H 31 7.940 7.514 0.426 1
1 181 . 42 1 1 A 32 32 ILE HA H 31 3.640 3.659 -0.019 1
1 191 . 42 1 1 A 32 32 ILE C C 31 177.980 178.062 -0.082 1
1 192 . 42 1 1 A 32 32 ILE CA C 31 64.692 64.547 0.145 1
1 193 . 42 1 1 A 32 32 ILE CB C 31 38.938 37.916 1.022 1
1 197 . 42 1 1 A 32 32 ILE N N 31 119.728 120.121 -0.393 1
1 198 . 42 1 1 A 33 33 ILE H H 32 7.984 7.835 0.149 1
1 199 . 42 1 1 A 33 33 ILE HA H 32 3.598 2.877 0.721 1
1 209 . 42 1 1 A 33 33 ILE C C 32 176.723 176.890 -0.167 1
1 210 . 42 1 1 A 33 33 ILE CA C 32 63.241 64.461 -1.220 1
1 211 . 42 1 1 A 33 33 ILE CB C 32 37.580 37.806 -0.226 1
1 215 . 42 1 1 A 33 33 ILE N N 32 113.919 120.142 -6.223 1
1 216 . 42 1 1 A 34 34 MET H H 33 7.288 7.674 -0.386 1
1 217 . 42 1 1 A 34 34 MET HA H 33 4.496 4.657 -0.161 1
1 225 . 42 1 1 A 34 34 MET C C 33 176.423 175.783 0.640 1
1 226 . 42 1 1 A 34 34 MET CA C 33 54.634 54.242 0.392 1
1 227 . 42 1 1 A 34 34 MET CB C 33 31.934 31.501 0.433 1
1 230 . 42 1 1 A 34 34 MET N N 33 115.130 116.796 -1.666 1
1 231 . 42 1 1 A 35 35 ASP H H 34 7.405 7.698 -0.293 1
1 232 . 42 1 1 A 35 35 ASP HA H 34 4.484 4.587 -0.103 1
1 235 . 42 1 1 A 35 35 ASP C C 34 177.139 176.878 0.261 1
1 236 . 42 1 1 A 35 35 ASP CA C 34 54.625 54.567 0.058 1
1 237 . 42 1 1 A 35 35 ASP CB C 34 43.554 42.629 0.925 1
1 238 . 42 1 1 A 35 35 ASP N N 34 121.814 122.427 -0.613 1
1 239 . 42 1 1 A 36 36 ASP H H 35 8.765 8.822 -0.057 1
1 240 . 42 1 1 A 36 36 ASP HA H 35 4.235 4.328 -0.093 1
1 243 . 42 1 1 A 36 36 ASP C C 35 178.320 178.437 -0.117 1
1 244 . 42 1 1 A 36 36 ASP CA C 35 57.832 57.981 -0.149 1
1 245 . 42 1 1 A 36 36 ASP CB C 35 40.914 40.361 0.553 1
1 246 . 42 1 1 A 36 36 ASP N N 35 125.883 125.290 0.593 1
1 247 . 42 1 1 A 37 37 GLU H H 36 8.905 8.124 0.781 1
1 248 . 42 1 1 A 37 37 GLU HA H 36 3.933 4.046 -0.113 1
1 253 . 42 1 1 A 37 37 GLU C C 36 179.304 179.056 0.248 1
1 254 . 42 1 1 A 37 37 GLU CA C 36 59.828 59.172 0.656 1
1 255 . 42 1 1 A 37 37 GLU CB C 36 29.380 29.435 -0.055 1
1 257 . 42 1 1 A 37 37 GLU N N 36 119.077 120.386 -1.309 1
1 258 . 42 1 1 A 38 38 PHE H H 37 7.460 8.150 -0.690 1
1 259 . 42 1 1 A 38 38 PHE HA H 37 3.642 4.012 -0.370 1
1 267 . 42 1 1 A 38 38 PHE C C 37 176.483 178.063 -1.580 1
1 268 . 42 1 1 A 38 38 PHE CA C 37 61.411 61.304 0.107 1
1 269 . 42 1 1 A 38 38 PHE CB C 37 39.355 39.102 0.253 1
1 275 . 42 1 1 A 38 38 PHE N N 37 119.968 120.692 -0.724 1
1 276 . 42 1 1 A 39 39 GLN H H 38 7.968 8.012 -0.044 1
1 277 . 42 1 1 A 39 39 GLN HA H 38 3.712 3.850 -0.138 1
1 284 . 42 1 1 A 39 39 GLN CA C 38 59.153 58.825 0.328 1
1 285 . 42 1 1 A 39 39 GLN CB C 38 28.213 28.436 -0.223 1
1 287 . 42 1 1 A 39 39 GLN N N 38 116.433 118.218 -1.785 1
1 289 . 42 1 1 A 40 40 LEU H H 39 7.930 7.677 0.253 1
1 290 . 42 1 1 A 40 40 LEU HA H 39 3.916 4.029 -0.113 1
1 300 . 42 1 1 A 40 40 LEU C C 39 177.731 178.312 -0.581 1
1 301 . 42 1 1 A 40 40 LEU CA C 39 57.915 57.849 0.066 1
1 302 . 42 1 1 A 40 40 LEU CB C 39 41.989 41.591 0.398 1
1 306 . 42 1 1 A 40 40 LEU N N 39 119.505 121.034 -1.529 1
1 307 . 42 1 1 A 41 41 LEU H H 40 7.174 7.844 -0.670 1
1 308 . 42 1 1 A 41 41 LEU HA H 40 3.835 3.964 -0.129 1
1 318 . 42 1 1 A 41 41 LEU C C 40 179.738 178.171 1.567 1
1 319 . 42 1 1 A 41 41 LEU CA C 40 58.266 57.973 0.293 1
1 320 . 42 1 1 A 41 41 LEU CB C 40 42.050 41.519 0.531 1
1 324 . 42 1 1 A 41 41 LEU N N 40 120.971 119.920 1.051 1
1 325 . 42 1 1 A 42 42 GLN H H 41 8.058 8.039 0.019 1
1 326 . 42 1 1 A 42 42 GLN HA H 41 3.556 4.059 -0.503 1
1 333 . 42 1 1 A 42 42 GLN C C 41 177.642 178.463 -0.821 1
1 334 . 42 1 1 A 42 42 GLN CA C 41 59.826 59.191 0.635 1
1 335 . 42 1 1 A 42 42 GLN CB C 41 28.762 27.943 0.819 1
1 337 . 42 1 1 A 42 42 GLN N N 41 117.899 118.352 -0.453 1
1 339 . 42 1 1 A 43 43 ARG H H 42 8.179 7.739 0.440 1
1 340 . 42 1 1 A 43 43 ARG HA H 42 3.655 3.793 -0.138 1
1 347 . 42 1 1 A 43 43 ARG C C 42 178.051 178.208 -0.157 1
1 348 . 42 1 1 A 43 43 ARG CA C 42 59.766 58.477 1.289 1
1 349 . 42 1 1 A 43 43 ARG CB C 42 29.941 30.355 -0.414 1
1 352 . 42 1 1 A 43 43 ARG N N 42 119.392 119.516 -0.124 1
1 353 . 42 1 1 A 44 44 ASN H H 43 8.525 7.878 0.647 1
1 354 . 42 1 1 A 44 44 ASN HA H 43 4.332 4.450 -0.118 1
1 359 . 42 1 1 A 44 44 ASN C C 43 178.150 177.410 0.740 1
1 360 . 42 1 1 A 44 44 ASN CA C 43 55.841 56.169 -0.328 1
1 361 . 42 1 1 A 44 44 ASN CB C 43 37.632 38.987 -1.355 1
1 362 . 42 1 1 A 44 44 ASN N N 43 116.214 117.683 -1.469 1
1 364 . 42 1 1 A 45 45 PHE H H 44 7.586 7.513 0.073 1
1 365 . 42 1 1 A 45 45 PHE HA H 44 4.132 4.239 -0.107 1
1 372 . 42 1 1 A 45 45 PHE C C 44 176.691 177.557 -0.866 1
1 373 . 42 1 1 A 45 45 PHE CA C 44 62.333 60.452 1.881 1
1 374 . 42 1 1 A 45 45 PHE CB C 44 39.449 38.640 0.809 1
1 379 . 42 1 1 A 45 45 PHE N N 44 121.501 118.856 2.645 1
1 380 . 42 1 1 A 46 46 MET H H 45 8.190 7.839 0.351 1
1 381 . 42 1 1 A 46 46 MET HA H 45 4.060 3.500 0.560 1
1 389 . 42 1 1 A 46 46 MET C C 45 179.754 177.887 1.867 1
1 390 . 42 1 1 A 46 46 MET CA C 45 57.742 57.406 0.336 1
1 391 . 42 1 1 A 46 46 MET CB C 45 29.912 30.914 -1.002 1
1 394 . 42 1 1 A 46 46 MET N N 45 116.727 118.505 -1.778 1
1 395 . 42 1 1 A 47 47 ASP H H 46 8.579 8.071 0.508 1
1 396 . 42 1 1 A 47 47 ASP HA H 46 4.804 4.582 0.222 1
1 399 . 42 1 1 A 47 47 ASP C C 46 177.854 178.171 -0.317 1
1 400 . 42 1 1 A 47 47 ASP CA C 46 57.277 57.187 0.090 1
1 401 . 42 1 1 A 47 47 ASP CB C 46 40.776 41.749 -0.973 1
1 402 . 42 1 1 A 47 47 ASP N N 46 117.798 120.514 -2.716 1
1 403 . 42 1 1 A 48 48 LYS H H 47 7.339 7.536 -0.197 1
1 404 . 42 1 1 A 48 48 LYS HA H 47 3.828 4.199 -0.371 1
1 413 . 42 1 1 A 48 48 LYS C C 47 178.812 178.638 0.174 1
1 414 . 42 1 1 A 48 48 LYS CA C 47 58.953 58.522 0.431 1
1 415 . 42 1 1 A 48 48 LYS CB C 47 32.796 33.046 -0.250 1
1 419 . 42 1 1 A 48 48 LYS N N 47 117.852 119.657 -1.805 1
1 420 . 42 1 1 A 49 49 TYR H H 48 6.841 8.385 -1.544 1
1 421 . 42 1 1 A 49 49 TYR HA H 48 4.995 4.529 0.466 1
1 428 . 42 1 1 A 49 49 TYR C C 48 178.138 178.540 -0.402 1
1 429 . 42 1 1 A 49 49 TYR CA C 48 58.620 59.747 -1.127 1
1 430 . 42 1 1 A 49 49 TYR CB C 48 42.939 37.668 5.271 1
1 435 . 42 1 1 A 49 49 TYR N N 48 112.109 119.461 -7.352 1
1 436 . 42 1 1 A 50 50 TYR H H 49 8.491 7.959 0.532 1
1 437 . 42 1 1 A 50 50 TYR HA H 49 4.598 4.264 0.334 1
1 444 . 42 1 1 A 50 50 TYR C C 49 176.015 177.765 -1.750 1
1 445 . 42 1 1 A 50 50 TYR CA C 49 62.442 59.722 2.720 1
1 446 . 42 1 1 A 50 50 TYR CB C 49 36.588 37.004 -0.416 1
1 451 . 42 1 1 A 50 50 TYR N N 49 118.294 119.916 -1.622 1
1 452 . 42 1 1 A 51 51 LEU H H 50 7.512 7.693 -0.181 1
1 453 . 42 1 1 A 51 51 LEU HA H 50 3.878 3.541 0.337 1
1 463 . 42 1 1 A 51 51 LEU C C 50 178.625 178.686 -0.061 1
1 464 . 42 1 1 A 51 51 LEU CA C 50 55.994 57.393 -1.399 1
1 465 . 42 1 1 A 51 51 LEU CB C 50 40.743 41.464 -0.721 1
1 469 . 42 1 1 A 51 51 LEU N N 50 118.478 121.326 -2.848 1
1 470 . 42 1 1 A 52 52 GLU H H 51 8.042 8.291 -0.249 1
1 471 . 42 1 1 A 52 52 GLU HA H 51 4.197 3.986 0.211 1
1 476 . 42 1 1 A 52 52 GLU C C 51 177.629 176.885 0.744 1
1 477 . 42 1 1 A 52 52 GLU CA C 51 56.141 58.935 -2.794 1
1 478 . 42 1 1 A 52 52 GLU CB C 51 29.162 28.947 0.215 1
1 480 . 42 1 1 A 52 52 GLU N N 51 115.067 118.169 -3.102 1
1 481 . 42 1 1 A 53 53 PHE H H 52 7.465 7.923 -0.458 1
1 482 . 42 1 1 A 53 53 PHE HA H 52 4.431 4.563 -0.132 1
1 490 . 42 1 1 A 53 53 PHE C C 52 174.325 175.030 -0.705 1
1 491 . 42 1 1 A 53 53 PHE CA C 52 58.986 57.779 1.207 1
1 492 . 42 1 1 A 53 53 PHE CB C 52 40.183 37.809 2.374 1
1 498 . 42 1 1 A 53 53 PHE N N 52 116.768 119.329 -2.561 1
1 499 . 42 1 1 A 54 54 GLU H H 53 7.484 8.772 -1.288 1
1 500 . 42 1 1 A 54 54 GLU HA H 53 4.583 4.836 -0.253 1
1 505 . 42 1 1 A 54 54 GLU C C 53 175.722 175.828 -0.106 1
1 506 . 42 1 1 A 54 54 GLU CA C 53 54.248 55.006 -0.758 1
1 507 . 42 1 1 A 54 54 GLU CB C 53 34.409 31.967 2.442 1
1 509 . 42 1 1 A 54 54 GLU N N 53 118.844 124.328 -5.484 1
1 510 . 42 1 1 A 55 55 ASP H H 54 9.008 8.637 0.371 1
1 511 . 42 1 1 A 55 55 ASP HA H 54 4.735 4.799 -0.064 1
1 514 . 42 1 1 A 55 55 ASP C C 54 175.421 175.900 -0.479 1
1 515 . 42 1 1 A 55 55 ASP CA C 54 52.888 53.842 -0.954 1
1 516 . 42 1 1 A 55 55 ASP CB C 54 38.894 39.838 -0.944 1
1 517 . 42 1 1 A 55 55 ASP N N 54 123.654 122.992 0.662 1
1 518 . 42 1 1 A 56 56 THR H H 55 7.819 8.070 -0.251 1
1 519 . 42 1 1 A 56 56 THR HA H 55 4.574 5.044 -0.470 1
1 524 . 42 1 1 A 56 56 THR C C 55 174.096 174.466 -0.370 1
1 525 . 42 1 1 A 56 56 THR CA C 55 59.172 59.451 -0.279 1
1 526 . 42 1 1 A 56 56 THR CB C 55 71.889 71.873 0.016 1
1 528 . 42 1 1 A 56 56 THR N N 55 112.015 114.795 -2.780 1
1 529 . 42 1 1 A 57 57 GLU H H 56 8.527 8.783 -0.256 1
1 530 . 42 1 1 A 57 57 GLU HA H 56 4.217 4.400 -0.183 1
1 535 . 42 1 1 A 57 57 GLU C C 56 177.042 176.048 0.994 1
1 536 . 42 1 1 A 57 57 GLU CA C 56 56.869 57.003 -0.134 1
1 537 . 42 1 1 A 57 57 GLU CB C 56 29.731 30.695 -0.964 1
1 539 . 42 1 1 A 57 57 GLU N N 56 117.531 119.531 -2.000 1
1 540 . 42 1 1 A 58 58 GLU H H 57 7.587 7.833 -0.246 1
1 541 . 42 1 1 A 58 58 GLU HA H 57 3.941 4.343 -0.402 1
1 546 . 42 1 1 A 58 58 GLU C C 57 176.849 175.955 0.894 1
1 547 . 42 1 1 A 58 58 GLU CA C 57 56.924 56.383 0.541 1
1 548 . 42 1 1 A 58 58 GLU CB C 57 30.251 30.458 -0.207 1
1 550 . 42 1 1 A 58 58 GLU N N 57 119.183 121.547 -2.364 1
1 551 . 42 1 1 A 59 59 ASN H H 58 9.120 8.748 0.372 1
1 552 . 42 1 1 A 59 59 ASN HA H 58 4.922 5.313 -0.391 1
1 557 . 42 1 1 A 59 59 ASN C C 58 174.254 174.415 -0.161 1
1 558 . 42 1 1 A 59 59 ASN CA C 58 51.956 52.134 -0.178 1
1 559 . 42 1 1 A 59 59 ASN CB C 58 37.404 40.626 -3.222 1
1 560 . 42 1 1 A 59 59 ASN N N 58 126.767 124.145 2.622 1
1 562 . 42 1 1 A 60 60 LYS H H 59 5.892 9.180 -3.288 1
1 563 . 42 1 1 A 60 60 LYS HA H 59 3.798 4.673 -0.875 1
1 572 . 42 1 1 A 60 60 LYS C C 59 177.908 177.510 0.398 1
1 573 . 42 1 1 A 60 60 LYS CA C 59 56.623 54.398 2.225 1
1 574 . 42 1 1 A 60 60 LYS CB C 59 32.279 34.779 -2.500 1
1 578 . 42 1 1 A 60 60 LYS N N 59 121.527 125.597 -4.070 1
1 579 . 42 1 1 A 61 61 LEU H H 60 8.473 8.886 -0.413 1
1 580 . 42 1 1 A 61 61 LEU HA H 60 3.891 4.315 -0.424 1
1 590 . 42 1 1 A 61 61 LEU C C 60 179.843 177.897 1.946 1
1 591 . 42 1 1 A 61 61 LEU CA C 60 58.301 56.762 1.539 1
1 592 . 42 1 1 A 61 61 LEU CB C 60 41.305 42.313 -1.008 1
1 596 . 42 1 1 A 61 61 LEU N N 60 125.639 125.806 -0.167 1
1 597 . 42 1 1 A 62 62 ILE H H 61 7.698 7.697 0.001 1
1 598 . 42 1 1 A 62 62 ILE HA H 61 3.952 3.857 0.095 1
1 608 . 42 1 1 A 62 62 ILE C C 61 175.392 177.202 -1.810 1
1 609 . 42 1 1 A 62 62 ILE CA C 61 61.743 63.222 -1.479 1
1 610 . 42 1 1 A 62 62 ILE CB C 61 39.108 37.736 1.372 1
1 614 . 42 1 1 A 62 62 ILE N N 61 114.111 118.976 -4.865 1
1 615 . 42 1 1 A 63 63 TYR H H 62 7.273 7.631 -0.358 1
1 616 . 42 1 1 A 63 63 TYR HA H 62 4.343 4.450 -0.107 1
1 623 . 42 1 1 A 63 63 TYR C C 62 178.264 178.541 -0.277 1
1 624 . 42 1 1 A 63 63 TYR CA C 62 57.231 61.106 -3.875 1
1 625 . 42 1 1 A 63 63 TYR CB C 62 36.332 37.373 -1.041 1
1 630 . 42 1 1 A 63 63 TYR N N 62 117.689 121.350 -3.661 1
1 631 . 42 1 1 A 64 64 THR H H 63 7.747 8.093 -0.346 1
1 632 . 42 1 1 A 64 64 THR HA H 63 4.266 4.204 0.062 1
1 637 . 42 1 1 A 64 64 THR CA C 63 69.362 67.544 1.818 1
1 638 . 42 1 1 A 64 64 THR CB C 63 66.962 67.900 -0.938 1
1 640 . 42 1 1 A 64 64 THR N N 63 113.755 116.259 -2.504 1
1 641 . 42 1 1 A 65 65 PRO HA H 64 4.372 4.395 -0.023 1
1 648 . 42 1 1 A 65 65 PRO C C 64 179.913 179.420 0.493 1
1 649 . 42 1 1 A 65 65 PRO CA C 64 66.011 65.972 0.039 1
1 650 . 42 1 1 A 65 65 PRO CB C 64 30.642 30.636 0.006 1
1 653 . 42 1 1 A 66 66 ILE H H 65 7.377 7.264 0.113 1
1 654 . 42 1 1 A 66 66 ILE HA H 65 3.530 3.919 -0.389 1
1 664 . 42 1 1 A 66 66 ILE C C 65 177.543 178.470 -0.927 1
1 665 . 42 1 1 A 66 66 ILE CA C 65 66.647 64.268 2.379 1
1 666 . 42 1 1 A 66 66 ILE CB C 65 38.029 37.729 0.300 1
1 670 . 42 1 1 A 66 66 ILE N N 65 118.353 116.916 1.437 1
1 671 . 42 1 1 A 67 67 PHE H H 66 8.480 8.373 0.107 1
1 672 . 42 1 1 A 67 67 PHE HA H 66 4.115 4.310 -0.195 1
1 680 . 42 1 1 A 67 67 PHE C C 66 177.293 177.522 -0.229 1
1 681 . 42 1 1 A 67 67 PHE CA C 66 59.570 62.454 -2.884 1
1 682 . 42 1 1 A 67 67 PHE CB C 66 38.865 39.170 -0.305 1
1 688 . 42 1 1 A 67 67 PHE N N 66 122.420 120.486 1.934 1
1 689 . 42 1 1 A 68 68 ASN H H 67 8.595 8.317 0.278 1
1 690 . 42 1 1 A 68 68 ASN HA H 67 4.211 4.391 -0.180 1
1 695 . 42 1 1 A 68 68 ASN C C 67 178.697 177.993 0.704 1
1 696 . 42 1 1 A 68 68 ASN CA C 67 56.056 56.299 -0.243 1
1 697 . 42 1 1 A 68 68 ASN CB C 67 37.704 38.143 -0.439 1
1 698 . 42 1 1 A 68 68 ASN N N 67 115.573 117.473 -1.900 1
1 700 . 42 1 1 A 69 69 GLU H H 68 8.414 7.979 0.435 1
1 701 . 42 1 1 A 69 69 GLU HA H 68 4.102 4.179 -0.077 1
1 706 . 42 1 1 A 69 69 GLU C C 68 177.880 178.871 -0.991 1
1 707 . 42 1 1 A 69 69 GLU CA C 68 59.399 59.413 -0.014 1
1 708 . 42 1 1 A 69 69 GLU CB C 68 29.855 29.528 0.327 1
1 710 . 42 1 1 A 69 69 GLU N N 68 123.510 120.119 3.391 1
1 711 . 42 1 1 A 70 70 TYR H H 69 8.659 8.187 0.472 1
1 712 . 42 1 1 A 70 70 TYR HA H 69 3.362 4.014 -0.652 1
1 719 . 42 1 1 A 70 70 TYR C C 69 178.143 176.777 1.366 1
1 720 . 42 1 1 A 70 70 TYR CA C 69 60.686 61.198 -0.512 1
1 721 . 42 1 1 A 70 70 TYR CB C 69 38.560 38.852 -0.292 1
1 726 . 42 1 1 A 70 70 TYR N N 69 122.130 120.991 1.139 1
1 727 . 42 1 1 A 71 71 ILE H H 70 8.031 7.903 0.128 1
1 728 . 42 1 1 A 71 71 ILE HA H 70 3.265 3.547 -0.282 1
1 738 . 42 1 1 A 71 71 ILE C C 70 178.056 177.592 0.464 1
1 739 . 42 1 1 A 71 71 ILE CA C 70 63.756 63.890 -0.134 1
1 740 . 42 1 1 A 71 71 ILE CB C 70 37.321 36.620 0.701 1
1 744 . 42 1 1 A 71 71 ILE N N 70 118.906 120.341 -1.435 1
1 745 . 42 1 1 A 72 72 SER H H 71 7.803 7.683 0.120 1
1 746 . 42 1 1 A 72 72 SER HA H 71 4.029 4.288 -0.259 1
1 749 . 42 1 1 A 72 72 SER CA C 71 61.380 61.161 0.219 1
1 750 . 42 1 1 A 72 72 SER CB C 71 63.288 63.211 0.077 1
1 751 . 42 1 1 A 72 72 SER N N 71 113.735 116.868 -3.133 1
1 752 . 42 1 1 A 73 73 LEU H H 72 7.952 8.060 -0.108 1
1 753 . 42 1 1 A 73 73 LEU HA H 72 4.418 4.188 0.230 1
1 763 . 42 1 1 A 73 73 LEU C C 72 177.767 178.285 -0.518 1
1 764 . 42 1 1 A 73 73 LEU CA C 72 56.543 57.534 -0.991 1
1 765 . 42 1 1 A 73 73 LEU CB C 72 44.517 42.042 2.475 1
1 769 . 42 1 1 A 73 73 LEU N N 72 119.411 122.434 -3.023 1
1 770 . 42 1 1 A 74 74 VAL H H 73 8.021 7.550 0.471 1
1 771 . 42 1 1 A 74 74 VAL HA H 73 3.532 3.331 0.201 1
1 779 . 42 1 1 A 74 74 VAL C C 73 177.126 177.925 -0.799 1
1 780 . 42 1 1 A 74 74 VAL CA C 73 66.250 66.276 -0.026 1
1 781 . 42 1 1 A 74 74 VAL CB C 73 31.212 31.150 0.062 1
1 784 . 42 1 1 A 74 74 VAL N N 73 118.747 119.104 -0.357 1
1 785 . 42 1 1 A 75 75 GLU H H 74 7.232 7.764 -0.532 1
1 786 . 42 1 1 A 75 75 GLU HA H 74 3.013 4.049 -1.036 1
1 791 . 42 1 1 A 75 75 GLU C C 74 178.804 178.966 -0.162 1
1 792 . 42 1 1 A 75 75 GLU CA C 74 60.536 59.922 0.614 1
1 793 . 42 1 1 A 75 75 GLU CB C 74 27.009 28.953 -1.944 1
1 795 . 42 1 1 A 75 75 GLU N N 74 118.660 119.664 -1.004 1
1 796 . 42 1 1 A 76 76 LYS H H 75 7.051 7.407 -0.356 1
1 797 . 42 1 1 A 76 76 LYS HA H 75 3.765 4.043 -0.278 1
1 806 . 42 1 1 A 76 76 LYS C C 75 177.765 178.207 -0.442 1
1 807 . 42 1 1 A 76 76 LYS CA C 75 58.357 58.655 -0.298 1
1 808 . 42 1 1 A 76 76 LYS CB C 75 31.939 31.993 -0.054 1
1 812 . 42 1 1 A 76 76 LYS N N 75 116.112 120.112 -4.000 1
1 813 . 42 1 1 A 77 77 TYR H H 76 7.067 7.702 -0.635 1
1 814 . 42 1 1 A 77 77 TYR HA H 76 4.036 4.121 -0.085 1
1 821 . 42 1 1 A 77 77 TYR C C 76 177.752 176.974 0.778 1
1 822 . 42 1 1 A 77 77 TYR CA C 76 61.820 61.119 0.701 1
1 823 . 42 1 1 A 77 77 TYR CB C 76 38.480 38.561 -0.081 1
1 828 . 42 1 1 A 77 77 TYR N N 76 118.434 120.727 -2.293 1
1 829 . 42 1 1 A 78 78 ILE H H 77 7.554 8.217 -0.663 1
1 830 . 42 1 1 A 78 78 ILE HA H 77 3.159 3.576 -0.417 1
1 840 . 42 1 1 A 78 78 ILE C C 77 177.341 177.871 -0.530 1
1 841 . 42 1 1 A 78 78 ILE CA C 77 65.177 65.293 -0.116 1
1 842 . 42 1 1 A 78 78 ILE CB C 77 37.339 38.031 -0.692 1
1 846 . 42 1 1 A 78 78 ILE N N 77 117.672 121.337 -3.665 1
1 847 . 42 1 1 A 79 79 GLU H H 78 8.296 7.994 0.302 1
1 848 . 42 1 1 A 79 79 GLU HA H 78 3.557 3.767 -0.210 1
1 853 . 42 1 1 A 79 79 GLU C C 78 177.742 178.753 -1.011 1
1 854 . 42 1 1 A 79 79 GLU CA C 78 60.847 60.075 0.772 1
1 855 . 42 1 1 A 79 79 GLU CB C 78 29.594 29.210 0.384 1
1 857 . 42 1 1 A 79 79 GLU N N 78 118.701 120.854 -2.153 1
1 858 . 42 1 1 A 80 80 GLU H H 79 8.330 8.202 0.128 1
1 859 . 42 1 1 A 80 80 GLU HA H 79 3.774 3.985 -0.211 1
1 864 . 42 1 1 A 80 80 GLU C C 79 179.926 179.095 0.831 1
1 865 . 42 1 1 A 80 80 GLU CA C 79 59.581 59.072 0.509 1
1 866 . 42 1 1 A 80 80 GLU CB C 79 29.062 29.297 -0.235 1
1 868 . 42 1 1 A 80 80 GLU N N 79 116.767 117.837 -1.070 1
1 869 . 42 1 1 A 81 81 GLN H H 80 7.634 7.648 -0.014 1
1 870 . 42 1 1 A 81 81 GLN HA H 80 3.605 3.852 -0.247 1
1 877 . 42 1 1 A 81 81 GLN C C 80 179.681 178.586 1.095 1
1 878 . 42 1 1 A 81 81 GLN CA C 80 57.765 58.554 -0.789 1
1 879 . 42 1 1 A 81 81 GLN CB C 80 28.079 27.770 0.309 1
1 881 . 42 1 1 A 81 81 GLN N N 80 116.325 118.684 -2.359 1
1 883 . 42 1 1 A 82 82 LEU H H 81 8.156 7.436 0.720 1
1 884 . 42 1 1 A 82 82 LEU HA H 81 3.536 3.756 -0.220 1
1 894 . 42 1 1 A 82 82 LEU C C 81 178.945 179.499 -0.554 1
1 895 . 42 1 1 A 82 82 LEU CA C 81 57.761 56.799 0.962 1
1 896 . 42 1 1 A 82 82 LEU CB C 81 40.961 40.685 0.276 1
1 900 . 42 1 1 A 82 82 LEU N N 81 121.546 119.720 1.826 1
1 901 . 42 1 1 A 83 83 LEU H H 82 8.326 8.005 0.321 1
1 902 . 42 1 1 A 83 83 LEU HA H 82 4.198 4.237 -0.039 1
1 912 . 42 1 1 A 83 83 LEU C C 82 178.631 179.336 -0.705 1
1 913 . 42 1 1 A 83 83 LEU CA C 82 57.016 57.223 -0.207 1
1 914 . 42 1 1 A 83 83 LEU CB C 82 42.182 40.713 1.469 1
1 918 . 42 1 1 A 83 83 LEU N N 82 120.426 119.814 0.612 1
1 919 . 42 1 1 A 84 84 GLN H H 83 6.992 7.423 -0.431 1
1 920 . 42 1 1 A 84 84 GLN HA H 83 3.877 4.000 -0.123 1
1 927 . 42 1 1 A 84 84 GLN C C 83 177.008 176.968 0.040 1
1 928 . 42 1 1 A 84 84 GLN CA C 83 57.543 58.368 -0.825 1
1 929 . 42 1 1 A 84 84 GLN CB C 83 28.688 28.467 0.221 1
1 931 . 42 1 1 A 84 84 GLN N N 83 114.001 117.324 -3.323 1
1 933 . 42 1 1 A 85 85 ARG H H 84 7.072 7.456 -0.384 1
1 934 . 42 1 1 A 85 85 ARG HA H 84 4.047 4.392 -0.345 1
1 942 . 42 1 1 A 85 85 ARG C C 84 175.999 175.394 0.605 1
1 943 . 42 1 1 A 85 85 ARG CA C 84 56.764 55.795 0.969 1
1 944 . 42 1 1 A 85 85 ARG CB C 84 32.044 32.412 -0.368 1
1 947 . 42 1 1 A 85 85 ARG N N 84 115.827 116.861 -1.034 1
1 949 . 42 1 1 A 86 86 ILE H H 85 8.238 7.720 0.518 1
1 950 . 42 1 1 A 86 86 ILE HA H 85 4.389 4.596 -0.207 1
1 960 . 42 1 1 A 86 86 ILE CA C 85 58.007 57.934 0.073 1
1 961 . 42 1 1 A 86 86 ILE CB C 85 39.604 38.945 0.659 1
1 965 . 42 1 1 A 86 86 ILE N N 85 119.285 119.211 0.074 1
1 966 . 42 1 1 A 87 87 PRO HA H 86 4.392 4.526 -0.134 1
1 973 . 42 1 1 A 87 87 PRO C C 86 177.622 177.379 0.243 1
1 974 . 42 1 1 A 87 87 PRO CA C 86 64.665 64.272 0.393 1
1 975 . 42 1 1 A 87 87 PRO CB C 86 32.020 31.605 0.415 1
1 978 . 42 1 1 A 88 88 GLU H H 87 8.312 8.592 -0.280 1
1 979 . 42 1 1 A 88 88 GLU HA H 87 4.208 4.388 -0.180 1
1 984 . 42 1 1 A 88 88 GLU C C 87 175.554 176.448 -0.894 1
1 985 . 42 1 1 A 88 88 GLU CA C 87 56.045 55.846 0.199 1
1 986 . 42 1 1 A 88 88 GLU CB C 87 28.654 29.350 -0.696 1
1 988 . 42 1 1 A 88 88 GLU N N 87 114.256 115.564 -1.308 1
1 989 . 42 1 1 A 89 89 PHE H H 88 7.946 7.604 0.342 1
1 990 . 42 1 1 A 89 89 PHE HA H 88 3.993 4.515 -0.522 1
1 998 . 42 1 1 A 89 89 PHE C C 88 173.460 174.626 -1.166 1
1 999 . 42 1 1 A 89 89 PHE CA C 88 60.119 59.062 1.057 1
1 1000 . 42 1 1 A 89 89 PHE CB C 88 39.994 39.745 0.249 1
1 1006 . 42 1 1 A 89 89 PHE N N 88 121.550 122.077 -0.527 1
1 1007 . 42 1 1 A 90 90 ASN H H 89 7.266 7.884 -0.618 1
1 1008 . 42 1 1 A 90 90 ASN HA H 89 4.454 4.928 -0.474 1
1 1013 . 42 1 1 A 90 90 ASN C C 89 173.921 175.077 -1.156 1
1 1014 . 42 1 1 A 90 90 ASN CA C 89 51.839 51.217 0.622 1
1 1015 . 42 1 1 A 90 90 ASN CB C 89 40.674 39.591 1.083 1
1 1016 . 42 1 1 A 90 90 ASN N N 89 125.344 125.346 -0.002 1
1 1018 . 42 1 1 A 91 91 MET H H 90 8.968 8.885 0.083 1
1 1019 . 42 1 1 A 91 91 MET HA H 90 4.049 4.171 -0.122 1
1 1027 . 42 1 1 A 91 91 MET C C 90 177.475 178.035 -0.560 1
1 1028 . 42 1 1 A 91 91 MET CA C 90 57.758 58.371 -0.613 1
1 1029 . 42 1 1 A 91 91 MET CB C 90 32.250 32.185 0.065 1
1 1032 . 42 1 1 A 91 91 MET N N 90 127.052 125.276 1.776 1
1 1033 . 42 1 1 A 92 92 ALA H H 91 8.292 8.030 0.262 1
1 1034 . 42 1 1 A 92 92 ALA HA H 91 4.059 4.101 -0.042 1
1 1038 . 42 1 1 A 92 92 ALA C C 91 180.412 179.589 0.823 1
1 1039 . 42 1 1 A 92 92 ALA CA C 91 55.368 54.932 0.436 1
1 1040 . 42 1 1 A 92 92 ALA CB C 91 17.527 18.347 -0.820 1
1 1041 . 42 1 1 A 92 92 ALA N N 91 123.752 121.562 2.190 1
1 1042 . 42 1 1 A 93 93 ALA H H 92 7.931 8.228 -0.297 1
1 1043 . 42 1 1 A 93 93 ALA HA H 92 4.054 4.081 -0.027 1
1 1047 . 42 1 1 A 93 93 ALA C C 92 180.482 179.749 0.733 1
1 1048 . 42 1 1 A 93 93 ALA CA C 92 54.614 54.834 -0.220 1
1 1049 . 42 1 1 A 93 93 ALA CB C 92 18.098 18.102 -0.004 1
1 1050 . 42 1 1 A 93 93 ALA N N 92 121.158 120.339 0.819 1
1 1051 . 42 1 1 A 94 94 PHE H H 93 8.110 7.756 0.354 1
1 1052 . 42 1 1 A 94 94 PHE HA H 93 4.304 4.119 0.185 1
1 1060 . 42 1 1 A 94 94 PHE C C 93 177.350 177.162 0.188 1
1 1061 . 42 1 1 A 94 94 PHE CA C 93 61.641 61.453 0.188 1
1 1062 . 42 1 1 A 94 94 PHE CB C 93 40.014 39.160 0.854 1
1 1068 . 42 1 1 A 94 94 PHE N N 93 119.807 119.620 0.187 1
1 1069 . 42 1 1 A 95 95 THR H H 94 8.726 8.173 0.553 1
1 1070 . 42 1 1 A 95 95 THR HA H 94 3.569 3.898 -0.329 1
1 1075 . 42 1 1 A 95 95 THR C C 94 176.932 176.860 0.072 1
1 1076 . 42 1 1 A 95 95 THR CA C 94 66.833 65.478 1.355 1
1 1077 . 42 1 1 A 95 95 THR CB C 94 68.445 68.379 0.066 1
1 1079 . 42 1 1 A 95 95 THR N N 94 113.074 112.174 0.900 1
1 1080 . 42 1 1 A 96 96 THR H H 95 7.657 7.832 -0.175 1
1 1081 . 42 1 1 A 96 96 THR HA H 95 3.945 4.196 -0.251 1
1 1086 . 42 1 1 A 96 96 THR C C 95 176.386 176.480 -0.094 1
1 1087 . 42 1 1 A 96 96 THR CA C 95 66.550 66.130 0.420 1
1 1088 . 42 1 1 A 96 96 THR CB C 95 68.583 68.829 -0.246 1
1 1090 . 42 1 1 A 96 96 THR N N 95 117.927 117.167 0.760 1
1 1091 . 42 1 1 A 97 97 THR H H 96 7.699 7.826 -0.127 1
1 1092 . 42 1 1 A 97 97 THR HA H 96 3.905 4.112 -0.207 1
1 1097 . 42 1 1 A 97 97 THR C C 96 176.572 176.285 0.287 1
1 1098 . 42 1 1 A 97 97 THR CA C 96 65.979 66.732 -0.753 1
1 1099 . 42 1 1 A 97 97 THR CB C 96 68.553 68.256 0.297 1
1 1101 . 42 1 1 A 97 97 THR N N 96 118.518 116.748 1.770 1
1 1102 . 42 1 1 A 98 98 LEU H H 97 8.304 8.197 0.107 1
1 1103 . 42 1 1 A 98 98 LEU HA H 97 3.725 3.899 -0.174 1
1 1113 . 42 1 1 A 98 98 LEU C C 97 178.490 178.768 -0.278 1
1 1114 . 42 1 1 A 98 98 LEU CA C 97 58.517 58.035 0.482 1
1 1115 . 42 1 1 A 98 98 LEU CB C 97 41.697 41.100 0.597 1
1 1119 . 42 1 1 A 98 98 LEU N N 97 122.882 121.910 0.972 1
1 1120 . 42 1 1 A 99 99 GLN H H 98 7.639 7.871 -0.232 1
1 1121 . 42 1 1 A 99 99 GLN HA H 98 3.927 3.986 -0.059 1
1 1128 . 42 1 1 A 99 99 GLN C C 98 178.068 178.134 -0.066 1
1 1129 . 42 1 1 A 99 99 GLN CA C 98 58.735 58.876 -0.141 1
1 1130 . 42 1 1 A 99 99 GLN CB C 98 27.986 28.151 -0.165 1
1 1132 . 42 1 1 A 99 99 GLN N N 98 114.302 117.972 -3.670 1
1 1134 . 42 1 1 A 100 100 HIS H H 99 7.575 7.386 0.189 1
1 1135 . 42 1 1 A 100 100 HIS HA H 99 4.524 4.435 0.089 1
1 1139 . 42 1 1 A 100 100 HIS C C 99 174.789 177.824 -3.035 1
1 1140 . 42 1 1 A 100 100 HIS CA C 99 56.154 59.507 -3.353 1
1 1141 . 42 1 1 A 100 100 HIS CB C 99 28.946 30.710 -1.764 1
1 1143 . 42 1 1 A 100 100 HIS N N 99 114.778 118.736 -3.958 1
1 1144 . 42 1 1 A 101 101 HIS H H 100 7.773 8.083 -0.310 1
1 1145 . 42 1 1 A 101 101 HIS HA H 100 4.704 4.299 0.405 1
1 1149 . 42 1 1 A 101 101 HIS C C 100 174.818 177.170 -2.352 1
1 1150 . 42 1 1 A 101 101 HIS CA C 100 54.830 58.703 -3.873 1
1 1151 . 42 1 1 A 101 101 HIS CB C 100 29.749 28.492 1.257 1
1 1153 . 42 1 1 A 101 101 HIS N N 100 117.397 117.240 0.157 1
1 1154 . 42 1 1 A 102 102 LYS H H 101 7.324 8.110 -0.786 1
1 1155 . 42 1 1 A 102 102 LYS HA H 101 3.611 4.054 -0.443 1
1 1164 . 42 1 1 A 102 102 LYS C C 101 176.823 178.142 -1.319 1
1 1165 . 42 1 1 A 102 102 LYS CA C 101 59.915 58.925 0.990 1
1 1166 . 42 1 1 A 102 102 LYS CB C 101 32.825 32.080 0.745 1
1 1170 . 42 1 1 A 102 102 LYS N N 101 120.533 121.758 -1.225 1
1 1171 . 42 1 1 A 103 103 ASP H H 102 8.361 7.591 0.770 1
1 1172 . 42 1 1 A 103 103 ASP HA H 102 4.421 4.458 -0.037 1
1 1175 . 42 1 1 A 103 103 ASP C C 102 176.793 177.207 -0.414 1
1 1176 . 42 1 1 A 103 103 ASP CA C 102 55.500 56.068 -0.568 1
1 1177 . 42 1 1 A 103 103 ASP CB C 102 40.178 40.691 -0.513 1
1 1178 . 42 1 1 A 103 103 ASP N N 102 114.814 119.394 -4.580 1
1 1179 . 42 1 1 A 104 104 GLU H H 103 7.858 7.725 0.133 1
1 1180 . 42 1 1 A 104 104 GLU HA H 103 4.339 4.418 -0.079 1
1 1183 . 42 1 1 A 104 104 GLU C C 103 175.777 176.452 -0.675 1
1 1184 . 42 1 1 A 104 104 GLU CA C 103 56.356 57.561 -1.205 1
1 1185 . 42 1 1 A 104 104 GLU CB C 103 31.293 31.304 -0.011 1
1 1186 . 42 1 1 A 104 104 GLU N N 103 116.826 117.172 -0.346 1
1 1187 . 42 1 1 A 105 105 VAL H H 104 7.201 7.718 -0.517 1
1 1188 . 42 1 1 A 105 105 VAL HA H 104 4.296 4.090 0.206 1
1 1196 . 42 1 1 A 105 105 VAL C C 104 174.482 175.557 -1.075 1
1 1197 . 42 1 1 A 105 105 VAL CA C 104 60.370 62.597 -2.227 1
1 1198 . 42 1 1 A 105 105 VAL CB C 104 34.341 33.034 1.307 1
1 1201 . 42 1 1 A 105 105 VAL N N 104 116.422 119.521 -3.099 1
1 1202 . 42 1 1 A 106 106 ALA H H 105 8.487 8.452 0.035 1
1 1203 . 42 1 1 A 106 106 ALA HA H 105 4.172 4.410 -0.238 1
1 1207 . 42 1 1 A 106 106 ALA C C 105 179.030 178.864 0.166 1
1 1208 . 42 1 1 A 106 106 ALA CA C 105 52.966 52.656 0.310 1
1 1209 . 42 1 1 A 106 106 ALA CB C 105 19.371 19.705 -0.334 1
1 1210 . 42 1 1 A 106 106 ALA N N 105 128.313 128.704 -0.391 1
1 1211 . 42 1 1 A 107 107 GLY H H 106 8.738 8.799 -0.061 1
1 1212 . 42 1 1 A 107 107 GLY HA2 H 106 3.773 3.880 -0.107 1
1 1213 . 42 1 1 A 107 107 GLY HA3 H 106 3.998 3.943 0.055 1
1 1214 . 42 1 1 A 107 107 GLY C C 106 174.958 175.535 -0.577 1
1 1215 . 42 1 1 A 107 107 GLY CA C 106 47.449 47.176 0.273 1
1 1216 . 42 1 1 A 107 107 GLY N N 106 110.612 110.831 -0.219 1
1 1217 . 42 1 1 A 108 108 ASP H H 107 8.535 8.350 0.185 1
1 1218 . 42 1 1 A 108 108 ASP HA H 107 4.333 4.351 -0.018 1
1 1221 . 42 1 1 A 108 108 ASP C C 107 179.133 178.906 0.227 1
1 1222 . 42 1 1 A 108 108 ASP CA C 107 56.721 57.086 -0.365 1
1 1223 . 42 1 1 A 108 108 ASP CB C 107 39.336 41.155 -1.819 1
1 1224 . 42 1 1 A 108 108 ASP N N 107 117.474 121.433 -3.959 1
1 1225 . 42 1 1 A 109 109 ILE H H 108 7.459 7.879 -0.420 1
1 1226 . 42 1 1 A 109 109 ILE HA H 108 3.688 3.654 0.034 1
1 1236 . 42 1 1 A 109 109 ILE C C 108 176.735 178.130 -1.395 1
1 1237 . 42 1 1 A 109 109 ILE CA C 108 63.474 65.548 -2.074 1
1 1238 . 42 1 1 A 109 109 ILE CB C 108 37.340 37.965 -0.625 1
1 1242 . 42 1 1 A 109 109 ILE N N 108 119.609 119.691 -0.082 1
1 1243 . 42 1 1 A 110 110 PHE H H 109 7.920 8.347 -0.427 1
1 1244 . 42 1 1 A 110 110 PHE HA H 109 3.759 4.108 -0.349 1
1 1252 . 42 1 1 A 110 110 PHE C C 109 177.132 177.402 -0.270 1
1 1253 . 42 1 1 A 110 110 PHE CA C 109 62.766 61.262 1.504 1
1 1254 . 42 1 1 A 110 110 PHE CB C 109 39.752 39.326 0.426 1
1 1260 . 42 1 1 A 110 110 PHE N N 109 120.906 120.398 0.508 1
1 1261 . 42 1 1 A 111 111 ASP H H 110 8.639 8.258 0.381 1
1 1262 . 42 1 1 A 111 111 ASP HA H 110 4.216 4.213 0.003 1
1 1265 . 42 1 1 A 111 111 ASP C C 110 178.900 178.430 0.470 1
1 1266 . 42 1 1 A 111 111 ASP CA C 110 57.105 57.237 -0.132 1
1 1267 . 42 1 1 A 111 111 ASP CB C 110 39.697 41.706 -2.009 1
1 1268 . 42 1 1 A 111 111 ASP N N 110 117.124 119.039 -1.915 1
1 1269 . 42 1 1 A 112 112 MET H H 111 7.331 7.537 -0.206 1
1 1270 . 42 1 1 A 112 112 MET HA H 111 4.081 4.150 -0.069 1
1 1278 . 42 1 1 A 112 112 MET C C 111 179.052 178.179 0.873 1
1 1279 . 42 1 1 A 112 112 MET CA C 111 58.202 58.118 0.084 1
1 1280 . 42 1 1 A 112 112 MET CB C 111 31.827 32.376 -0.549 1
1 1283 . 42 1 1 A 112 112 MET N N 111 118.061 119.465 -1.404 1
1 1284 . 42 1 1 A 113 113 LEU H H 112 8.001 8.082 -0.081 1
1 1285 . 42 1 1 A 113 113 LEU HA H 112 3.723 3.572 0.151 1
1 1295 . 42 1 1 A 113 113 LEU C C 112 179.747 178.669 1.078 1
1 1296 . 42 1 1 A 113 113 LEU CA C 112 57.371 57.439 -0.068 1
1 1297 . 42 1 1 A 113 113 LEU CB C 112 40.671 41.140 -0.469 1
1 1301 . 42 1 1 A 113 113 LEU N N 112 120.426 119.843 0.583 1
1 1302 . 42 1 1 A 114 114 LEU H H 113 7.744 7.644 0.100 1
1 1303 . 42 1 1 A 114 114 LEU HA H 113 4.007 3.529 0.478 1
1 1313 . 42 1 1 A 114 114 LEU C C 113 179.358 178.545 0.813 1
1 1314 . 42 1 1 A 114 114 LEU CA C 113 57.202 57.526 -0.324 1
1 1315 . 42 1 1 A 114 114 LEU CB C 113 41.727 41.603 0.124 1
1 1319 . 42 1 1 A 114 114 LEU N N 113 119.584 119.652 -0.068 1
1 1320 . 42 1 1 A 115 115 THR H H 114 7.353 7.611 -0.258 1
1 1321 . 42 1 1 A 115 115 THR HA H 114 4.071 4.112 -0.041 1
1 1327 . 42 1 1 A 115 115 THR C C 114 173.591 176.331 -2.740 1
1 1328 . 42 1 1 A 115 115 THR CA C 114 65.332 64.746 0.586 1
1 1329 . 42 1 1 A 115 115 THR CB C 114 70.319 68.628 1.691 1
1 1331 . 42 1 1 A 115 115 THR N N 114 107.535 112.379 -4.844 1
1 1332 . 42 1 1 A 116 116 PHE H H 115 6.979 7.900 -0.921 1
1 1333 . 42 1 1 A 116 116 PHE HA H 115 5.022 4.326 0.696 1
1 1341 . 42 1 1 A 116 116 PHE C C 115 176.488 176.466 0.022 1
1 1342 . 42 1 1 A 116 116 PHE CA C 115 55.911 61.159 -5.248 1
1 1343 . 42 1 1 A 116 116 PHE CB C 115 38.521 38.988 -0.467 1
1 1349 . 42 1 1 A 116 116 PHE N N 115 112.366 120.008 -7.642 1
1 1350 . 42 1 1 A 117 117 THR H H 116 7.564 7.548 0.016 1
1 1351 . 42 1 1 A 117 117 THR HA H 116 4.626 4.763 -0.137 1
1 1356 . 42 1 1 A 117 117 THR C C 116 174.085 174.572 -0.487 1
1 1357 . 42 1 1 A 117 117 THR CA C 116 61.636 62.440 -0.804 1
1 1358 . 42 1 1 A 117 117 THR CB C 116 70.915 70.511 0.404 1
1 1360 . 42 1 1 A 117 117 THR N N 116 105.498 106.604 -1.106 1
1 1361 . 42 1 1 A 118 118 ASP H H 117 8.270 7.426 0.844 1
1 1362 . 42 1 1 A 118 118 ASP HA H 117 4.955 4.975 -0.020 1
1 1365 . 42 1 1 A 118 118 ASP C C 117 176.328 176.287 0.041 1
1 1366 . 42 1 1 A 118 118 ASP CA C 117 53.417 53.801 -0.384 1
1 1367 . 42 1 1 A 118 118 ASP CB C 117 43.388 39.090 4.298 1
1 1368 . 42 1 1 A 118 118 ASP N N 117 124.409 122.095 2.314 1
1 1369 . 42 1 1 A 119 119 PHE H H 118 8.973 8.863 0.110 1
1 1370 . 42 1 1 A 119 119 PHE HA H 118 3.506 4.249 -0.743 1
1 1378 . 42 1 1 A 119 119 PHE CA C 118 61.490 61.155 0.335 1
1 1379 . 42 1 1 A 119 119 PHE CB C 118 39.246 39.531 -0.285 1
1 1385 . 42 1 1 A 119 119 PHE N N 118 126.688 125.814 0.874 1
1 1386 . 42 1 1 A 120 120 LEU H H 119 8.099 8.359 -0.260 1
1 1387 . 42 1 1 A 120 120 LEU HA H 119 3.842 3.962 -0.120 1
1 1397 . 42 1 1 A 120 120 LEU C C 119 179.601 179.646 -0.045 1
1 1398 . 42 1 1 A 120 120 LEU CA C 119 58.174 57.894 0.280 1
1 1399 . 42 1 1 A 120 120 LEU CB C 119 40.315 40.972 -0.657 1
1 1403 . 42 1 1 A 120 120 LEU N N 119 117.930 119.902 -1.972 1
1 1404 . 42 1 1 A 121 121 ALA H H 120 7.729 7.574 0.155 1
1 1405 . 42 1 1 A 121 121 ALA HA H 120 3.996 4.146 -0.150 1
1 1409 . 42 1 1 A 121 121 ALA C C 120 180.995 179.681 1.314 1
1 1410 . 42 1 1 A 121 121 ALA CA C 120 54.832 54.674 0.158 1
1 1411 . 42 1 1 A 121 121 ALA CB C 120 17.706 18.322 -0.616 1
1 1412 . 42 1 1 A 121 121 ALA N N 120 123.195 121.379 1.816 1
1 1413 . 42 1 1 A 122 122 PHE H H 121 7.943 7.824 0.119 1
1 1414 . 42 1 1 A 122 122 PHE HA H 121 3.887 3.923 -0.036 1
1 1419 . 42 1 1 A 122 122 PHE C C 121 175.410 176.928 -1.518 1
1 1420 . 42 1 1 A 122 122 PHE CA C 121 61.075 60.786 0.289 1
1 1421 . 42 1 1 A 122 122 PHE CB C 121 38.115 38.897 -0.782 1
1 1424 . 42 1 1 A 122 122 PHE N N 121 121.798 120.221 1.577 1
1 1425 . 42 1 1 A 123 123 LYS H H 122 8.468 7.878 0.590 1
1 1426 . 42 1 1 A 123 123 LYS HA H 122 3.077 3.786 -0.709 1
1 1435 . 42 1 1 A 123 123 LYS C C 122 178.453 178.762 -0.309 1
1 1436 . 42 1 1 A 123 123 LYS CA C 122 59.855 60.027 -0.172 1
1 1437 . 42 1 1 A 123 123 LYS CB C 122 32.374 32.557 -0.183 1
1 1441 . 42 1 1 A 123 123 LYS N N 122 120.614 118.494 2.120 1
1 1442 . 42 1 1 A 124 124 GLU H H 123 8.100 7.836 0.264 1
1 1443 . 42 1 1 A 124 124 GLU HA H 123 3.652 4.029 -0.377 1
1 1448 . 42 1 1 A 124 124 GLU C C 123 177.743 178.450 -0.707 1
1 1449 . 42 1 1 A 124 124 GLU CA C 123 59.406 59.578 -0.172 1
1 1450 . 42 1 1 A 124 124 GLU CB C 123 28.811 29.253 -0.442 1
1 1452 . 42 1 1 A 124 124 GLU N N 123 117.404 118.823 -1.419 1
1 1453 . 42 1 1 A 125 125 MET H H 124 7.537 7.677 -0.140 1
1 1454 . 42 1 1 A 125 125 MET HA H 124 3.860 3.918 -0.058 1
1 1462 . 42 1 1 A 125 125 MET C C 124 179.522 178.366 1.156 1
1 1463 . 42 1 1 A 125 125 MET CA C 124 58.832 58.485 0.347 1
1 1464 . 42 1 1 A 125 125 MET CB C 124 31.765 31.336 0.429 1
1 1467 . 42 1 1 A 125 125 MET N N 124 119.413 118.910 0.503 1
1 1468 . 42 1 1 A 126 126 PHE H H 125 7.148 7.474 -0.326 1
1 1469 . 42 1 1 A 126 126 PHE HA H 125 3.633 4.181 -0.548 1
1 1476 . 42 1 1 A 126 126 PHE C C 125 178.994 178.243 0.751 1
1 1477 . 42 1 1 A 126 126 PHE CA C 125 63.148 61.117 2.031 1
1 1478 . 42 1 1 A 126 126 PHE CB C 125 39.830 38.277 1.553 1
1 1483 . 42 1 1 A 126 126 PHE N N 125 120.013 118.707 1.306 1
1 1484 . 42 1 1 A 127 127 LEU H H 126 8.369 8.423 -0.054 1
1 1485 . 42 1 1 A 127 127 LEU HA H 126 3.972 3.994 -0.022 1
1 1495 . 42 1 1 A 127 127 LEU C C 126 180.621 179.149 1.472 1
1 1496 . 42 1 1 A 127 127 LEU CA C 126 57.944 57.830 0.114 1
1 1497 . 42 1 1 A 127 127 LEU CB C 126 40.543 40.983 -0.440 1
1 1501 . 42 1 1 A 127 127 LEU N N 126 119.692 119.575 0.117 1
1 1502 . 42 1 1 A 128 128 ASP H H 127 8.578 8.188 0.390 1
1 1503 . 42 1 1 A 128 128 ASP HA H 127 4.308 4.335 -0.027 1
1 1506 . 42 1 1 A 128 128 ASP C C 127 178.254 178.039 0.215 1
1 1507 . 42 1 1 A 128 128 ASP CA C 127 56.964 57.187 -0.223 1
1 1508 . 42 1 1 A 128 128 ASP CB C 127 39.735 40.868 -1.133 1
1 1509 . 42 1 1 A 128 128 ASP N N 127 121.926 119.773 2.153 1
1 1510 . 42 1 1 A 129 129 TYR H H 128 7.710 7.981 -0.271 1
1 1511 . 42 1 1 A 129 129 TYR HA H 128 3.908 4.075 -0.167 1
1 1518 . 42 1 1 A 129 129 TYR C C 128 177.633 177.299 0.334 1
1 1519 . 42 1 1 A 129 129 TYR CA C 128 61.796 61.463 0.333 1
1 1520 . 42 1 1 A 129 129 TYR CB C 128 39.372 38.612 0.760 1
1 1525 . 42 1 1 A 129 129 TYR N N 128 122.548 120.147 2.401 1
1 1526 . 42 1 1 A 130 130 ARG H H 129 8.622 8.379 0.243 1
1 1527 . 42 1 1 A 130 130 ARG HA H 129 3.722 3.764 -0.042 1
1 1535 . 42 1 1 A 130 130 ARG CA C 129 60.084 59.734 0.350 1
1 1536 . 42 1 1 A 130 130 ARG CB C 129 29.902 29.670 0.232 1
1 1539 . 42 1 1 A 130 130 ARG N N 129 118.302 119.209 -0.907 1
1 1541 . 42 1 1 A 131 131 ALA H H 130 7.936 7.968 -0.032 1
1 1542 . 42 1 1 A 131 131 ALA HA H 130 3.997 4.074 -0.077 1
1 1546 . 42 1 1 A 131 131 ALA C C 130 180.456 179.825 0.631 1
1 1547 . 42 1 1 A 131 131 ALA CA C 130 55.133 55.011 0.122 1
1 1548 . 42 1 1 A 131 131 ALA CB C 130 17.750 18.419 -0.669 1
1 1549 . 42 1 1 A 131 131 ALA N N 130 119.788 121.484 -1.696 1
1 1550 . 42 1 1 A 132 132 GLU H H 131 7.622 7.779 -0.157 1
1 1551 . 42 1 1 A 132 132 GLU HA H 131 3.862 4.003 -0.141 1
1 1556 . 42 1 1 A 132 132 GLU C C 131 179.528 178.909 0.619 1
1 1557 . 42 1 1 A 132 132 GLU CA C 131 58.849 58.500 0.349 1
1 1558 . 42 1 1 A 132 132 GLU CB C 131 28.930 29.049 -0.119 1
1 1560 . 42 1 1 A 132 132 GLU N N 131 118.428 117.971 0.457 1
1 1561 . 42 1 1 A 133 133 LYS H H 132 7.853 7.746 0.107 1
1 1562 . 42 1 1 A 133 133 LYS HA H 132 3.722 3.793 -0.071 1
1 1571 . 42 1 1 A 133 133 LYS C C 132 175.725 178.162 -2.437 1
1 1572 . 42 1 1 A 133 133 LYS CA C 132 57.544 58.821 -1.277 1
1 1573 . 42 1 1 A 133 133 LYS CB C 132 31.770 31.694 0.076 1
1 1577 . 42 1 1 A 133 133 LYS N N 132 119.473 120.016 -0.543 1
1 1578 . 42 1 1 A 134 134 GLU H H 133 8.151 7.765 0.386 1
1 1579 . 42 1 1 A 134 134 GLU HA H 133 4.161 4.295 -0.134 1
1 1584 . 42 1 1 A 134 134 GLU C C 133 177.453 176.583 0.870 1
1 1585 . 42 1 1 A 134 134 GLU CA C 133 57.222 56.529 0.693 1
1 1586 . 42 1 1 A 134 134 GLU CB C 133 30.091 29.876 0.215 1
1 1588 . 42 1 1 A 134 134 GLU N N 133 116.525 117.817 -1.292 1
1 1589 . 42 1 1 A 135 135 GLY H H 134 7.702 7.270 0.432 1
1 1590 . 42 1 1 A 135 135 GLY HA2 H 134 3.896 4.006 -0.110 1
1 1591 . 42 1 1 A 135 135 GLY HA3 H 134 3.897 4.015 -0.118 1
1 1592 . 42 1 1 A 135 135 GLY C C 134 174.538 173.549 0.989 1
1 1593 . 42 1 1 A 135 135 GLY CA C 134 45.975 45.850 0.125 1
1 1594 . 42 1 1 A 135 135 GLY N N 134 107.924 106.404 1.520 1
1 1595 . 42 1 1 A 136 136 ARG H H 135 8.045 7.961 0.084 1
1 1596 . 42 1 1 A 136 136 ARG HA H 135 4.323 4.429 -0.106 1
1 1604 . 42 1 1 A 136 136 ARG C C 135 175.864 176.668 -0.804 1
1 1605 . 42 1 1 A 136 136 ARG CA C 135 56.016 55.241 0.775 1
1 1606 . 42 1 1 A 136 136 ARG CB C 135 30.987 31.369 -0.382 1
1 1609 . 42 1 1 A 136 136 ARG N N 135 119.708 116.850 2.858 1
1 1 . 43 1 1 A 14 14 PHE CA C 13 58.199 59.973 -1.774 1
1 2 . 43 1 1 A 14 14 PHE CB C 13 39.717 38.849 0.868 1
1 3 . 43 1 1 A 15 15 SER H H 14 8.299 8.456 -0.157 1
1 4 . 43 1 1 A 15 15 SER HA H 14 4.359 4.183 0.176 1
1 7 . 43 1 1 A 15 15 SER CA C 14 58.249 59.060 -0.811 1
1 8 . 43 1 1 A 15 15 SER CB C 14 63.936 61.855 2.081 1
1 9 . 43 1 1 A 15 15 SER N N 14 117.379 115.345 2.034 1
1 10 . 43 1 1 A 16 16 SER H H 15 8.255 8.451 -0.196 1
1 11 . 43 1 1 A 16 16 SER HA H 15 3.729 4.720 -0.991 1
1 14 . 43 1 1 A 16 16 SER CA C 15 58.224 57.724 0.500 1
1 15 . 43 1 1 A 16 16 SER CB C 15 63.886 64.712 -0.826 1
1 16 . 43 1 1 A 16 16 SER N N 15 117.694 120.303 -2.609 1
1 17 . 43 1 1 A 17 17 ALA H H 16 8.333 8.088 0.245 1
1 18 . 43 1 1 A 17 17 ALA HA H 16 4.252 4.164 0.088 1
1 22 . 43 1 1 A 17 17 ALA CA C 16 53.377 55.055 -1.678 1
1 23 . 43 1 1 A 17 17 ALA CB C 16 18.896 18.483 0.413 1
1 24 . 43 1 1 A 17 17 ALA N N 16 125.462 124.276 1.186 1
1 25 . 43 1 1 A 18 18 SER H H 17 8.219 7.742 0.477 1
1 26 . 43 1 1 A 18 18 SER HA H 17 4.332 4.502 -0.170 1
1 29 . 43 1 1 A 18 18 SER CA C 17 59.105 58.594 0.511 1
1 30 . 43 1 1 A 18 18 SER CB C 17 63.592 63.708 -0.116 1
1 31 . 43 1 1 A 18 18 SER N N 17 114.821 109.500 5.321 1
1 32 . 43 1 1 A 19 19 ASP H H 18 8.309 7.697 0.612 1
1 33 . 43 1 1 A 19 19 ASP HA H 18 4.554 5.070 -0.516 1
1 36 . 43 1 1 A 19 19 ASP C C 18 176.528 176.542 -0.014 1
1 37 . 43 1 1 A 19 19 ASP CA C 18 55.272 52.628 2.644 1
1 38 . 43 1 1 A 19 19 ASP CB C 18 40.883 43.924 -3.041 1
1 39 . 43 1 1 A 19 19 ASP N N 18 123.367 120.708 2.659 1
1 40 . 43 1 1 A 20 20 ALA H H 19 8.133 8.677 -0.544 1
1 41 . 43 1 1 A 20 20 ALA HA H 19 4.170 4.053 0.117 1
1 45 . 43 1 1 A 20 20 ALA C C 19 179.857 179.466 0.391 1
1 46 . 43 1 1 A 20 20 ALA CA C 19 54.341 55.050 -0.709 1
1 47 . 43 1 1 A 20 20 ALA CB C 19 18.660 18.308 0.352 1
1 48 . 43 1 1 A 20 20 ALA N N 19 123.350 121.141 2.209 1
1 49 . 43 1 1 A 21 21 GLU H H 20 8.140 8.143 -0.003 1
1 50 . 43 1 1 A 21 21 GLU HA H 20 4.128 4.050 0.078 1
1 55 . 43 1 1 A 21 21 GLU C C 20 177.675 178.693 -1.018 1
1 56 . 43 1 1 A 21 21 GLU CA C 20 58.520 59.507 -0.987 1
1 57 . 43 1 1 A 21 21 GLU CB C 20 29.765 29.383 0.382 1
1 59 . 43 1 1 A 21 21 GLU N N 20 119.063 119.368 -0.305 1
1 60 . 43 1 1 A 22 22 PHE H H 21 8.009 8.040 -0.031 1
1 61 . 43 1 1 A 22 22 PHE HA H 21 4.123 4.160 -0.037 1
1 68 . 43 1 1 A 22 22 PHE C C 21 176.410 177.735 -1.325 1
1 69 . 43 1 1 A 22 22 PHE CA C 21 62.202 61.480 0.722 1
1 70 . 43 1 1 A 22 22 PHE CB C 21 39.223 39.093 0.130 1
1 75 . 43 1 1 A 22 22 PHE N N 21 121.211 120.733 0.478 1
1 76 . 43 1 1 A 23 23 ASP H H 22 8.261 8.554 -0.293 1
1 77 . 43 1 1 A 23 23 ASP HA H 22 4.041 4.491 -0.450 1
1 80 . 43 1 1 A 23 23 ASP C C 22 179.078 178.374 0.704 1
1 81 . 43 1 1 A 23 23 ASP CA C 22 57.048 57.767 -0.719 1
1 82 . 43 1 1 A 23 23 ASP CB C 22 40.154 41.541 -1.387 1
1 83 . 43 1 1 A 23 23 ASP N N 22 116.876 118.784 -1.908 1
1 84 . 43 1 1 A 24 24 ALA H H 23 7.651 7.740 -0.089 1
1 85 . 43 1 1 A 24 24 ALA HA H 23 3.785 3.819 -0.034 1
1 89 . 43 1 1 A 24 24 ALA C C 23 179.577 179.449 0.128 1
1 90 . 43 1 1 A 24 24 ALA CA C 23 54.341 54.960 -0.619 1
1 91 . 43 1 1 A 24 24 ALA CB C 23 17.762 18.177 -0.415 1
1 92 . 43 1 1 A 24 24 ALA N N 23 121.873 121.373 0.500 1
1 93 . 43 1 1 A 25 25 VAL H H 24 7.718 7.890 -0.172 1
1 94 . 43 1 1 A 25 25 VAL HA H 24 3.216 3.810 -0.594 1
1 102 . 43 1 1 A 25 25 VAL C C 24 177.805 177.567 0.238 1
1 103 . 43 1 1 A 25 25 VAL CA C 24 66.789 65.367 1.422 1
1 104 . 43 1 1 A 25 25 VAL CB C 24 31.277 31.311 -0.034 1
1 107 . 43 1 1 A 25 25 VAL N N 24 117.890 117.198 0.692 1
1 108 . 43 1 1 A 26 26 VAL H H 25 7.867 7.719 0.148 1
1 109 . 43 1 1 A 26 26 VAL HA H 25 3.274 3.487 -0.213 1
1 117 . 43 1 1 A 26 26 VAL C C 25 177.788 177.963 -0.175 1
1 118 . 43 1 1 A 26 26 VAL CA C 25 67.282 66.331 0.951 1
1 119 . 43 1 1 A 26 26 VAL CB C 25 31.266 31.384 -0.118 1
1 122 . 43 1 1 A 26 26 VAL N N 25 118.170 121.660 -3.490 1
1 123 . 43 1 1 A 27 27 GLY H H 26 7.544 7.558 -0.014 1
1 124 . 43 1 1 A 27 27 GLY HA2 H 26 3.592 3.534 0.058 1
1 125 . 43 1 1 A 27 27 GLY HA3 H 26 3.721 3.647 0.074 1
1 126 . 43 1 1 A 27 27 GLY C C 26 176.717 176.589 0.128 1
1 127 . 43 1 1 A 27 27 GLY CA C 26 47.085 47.332 -0.247 1
1 128 . 43 1 1 A 27 27 GLY N N 26 105.795 107.441 -1.646 1
1 129 . 43 1 1 A 28 28 TYR H H 27 7.625 7.469 0.156 1
1 130 . 43 1 1 A 28 28 TYR HA H 27 4.546 4.570 -0.024 1
1 137 . 43 1 1 A 28 28 TYR C C 27 178.991 178.095 0.896 1
1 138 . 43 1 1 A 28 28 TYR CA C 27 58.845 59.749 -0.904 1
1 139 . 43 1 1 A 28 28 TYR CB C 27 37.602 37.416 0.186 1
1 144 . 43 1 1 A 28 28 TYR N N 27 119.933 121.873 -1.940 1
1 145 . 43 1 1 A 29 29 LEU H H 28 8.517 8.548 -0.031 1
1 146 . 43 1 1 A 29 29 LEU HA H 28 3.728 3.833 -0.105 1
1 156 . 43 1 1 A 29 29 LEU CA C 28 58.281 58.130 0.151 1
1 157 . 43 1 1 A 29 29 LEU CB C 28 41.948 41.451 0.497 1
1 161 . 43 1 1 A 29 29 LEU N N 28 119.669 120.257 -0.588 1
1 162 . 43 1 1 A 30 30 GLU H H 29 8.072 8.075 -0.003 1
1 163 . 43 1 1 A 30 30 GLU HA H 29 3.722 3.889 -0.167 1
1 168 . 43 1 1 A 30 30 GLU C C 29 177.731 178.878 -1.147 1
1 169 . 43 1 1 A 30 30 GLU CA C 29 59.763 59.926 -0.163 1
1 170 . 43 1 1 A 30 30 GLU CB C 29 28.844 29.325 -0.481 1
1 172 . 43 1 1 A 30 30 GLU N N 29 117.666 117.618 0.048 1
1 173 . 43 1 1 A 31 31 ASP H H 30 7.243 8.025 -0.782 1
1 174 . 43 1 1 A 31 31 ASP HA H 30 4.297 4.376 -0.079 1
1 177 . 43 1 1 A 31 31 ASP CA C 30 56.953 57.280 -0.327 1
1 178 . 43 1 1 A 31 31 ASP CB C 30 40.730 42.161 -1.431 1
1 179 . 43 1 1 A 31 31 ASP N N 30 116.720 119.375 -2.655 1
1 180 . 43 1 1 A 32 32 ILE H H 31 7.940 7.515 0.425 1
1 181 . 43 1 1 A 32 32 ILE HA H 31 3.640 3.747 -0.107 1
1 191 . 43 1 1 A 32 32 ILE C C 31 177.980 178.236 -0.256 1
1 192 . 43 1 1 A 32 32 ILE CA C 31 64.692 64.106 0.586 1
1 193 . 43 1 1 A 32 32 ILE CB C 31 38.938 36.914 2.024 1
1 197 . 43 1 1 A 32 32 ILE N N 31 119.728 117.882 1.846 1
1 198 . 43 1 1 A 33 33 ILE H H 32 7.984 7.942 0.042 1
1 199 . 43 1 1 A 33 33 ILE HA H 32 3.598 3.113 0.485 1
1 209 . 43 1 1 A 33 33 ILE C C 32 176.723 176.940 -0.217 1
1 210 . 43 1 1 A 33 33 ILE CA C 32 63.241 64.461 -1.220 1
1 211 . 43 1 1 A 33 33 ILE CB C 32 37.580 37.892 -0.312 1
1 215 . 43 1 1 A 33 33 ILE N N 32 113.919 120.764 -6.845 1
1 216 . 43 1 1 A 34 34 MET H H 33 7.288 7.677 -0.389 1
1 217 . 43 1 1 A 34 34 MET HA H 33 4.496 4.720 -0.224 1
1 225 . 43 1 1 A 34 34 MET C C 33 176.423 175.649 0.774 1
1 226 . 43 1 1 A 34 34 MET CA C 33 54.634 54.213 0.421 1
1 227 . 43 1 1 A 34 34 MET CB C 33 31.934 31.470 0.464 1
1 230 . 43 1 1 A 34 34 MET N N 33 115.130 116.764 -1.634 1
1 231 . 43 1 1 A 35 35 ASP H H 34 7.405 7.739 -0.334 1
1 232 . 43 1 1 A 35 35 ASP HA H 34 4.484 4.724 -0.240 1
1 235 . 43 1 1 A 35 35 ASP C C 34 177.139 175.974 1.165 1
1 236 . 43 1 1 A 35 35 ASP CA C 34 54.625 54.321 0.304 1
1 237 . 43 1 1 A 35 35 ASP CB C 34 43.554 43.152 0.402 1
1 238 . 43 1 1 A 35 35 ASP N N 34 121.814 122.616 -0.802 1
1 239 . 43 1 1 A 36 36 ASP H H 35 8.765 9.144 -0.379 1
1 240 . 43 1 1 A 36 36 ASP HA H 35 4.235 4.219 0.016 1
1 243 . 43 1 1 A 36 36 ASP C C 35 178.320 177.778 0.542 1
1 244 . 43 1 1 A 36 36 ASP CA C 35 57.832 58.669 -0.837 1
1 245 . 43 1 1 A 36 36 ASP CB C 35 40.914 41.298 -0.384 1
1 246 . 43 1 1 A 36 36 ASP N N 35 125.883 127.853 -1.970 1
1 247 . 43 1 1 A 37 37 GLU H H 36 8.905 8.136 0.769 1
1 248 . 43 1 1 A 37 37 GLU HA H 36 3.933 4.127 -0.194 1
1 253 . 43 1 1 A 37 37 GLU C C 36 179.304 179.101 0.203 1
1 254 . 43 1 1 A 37 37 GLU CA C 36 59.828 59.218 0.610 1
1 255 . 43 1 1 A 37 37 GLU CB C 36 29.380 29.238 0.142 1
1 257 . 43 1 1 A 37 37 GLU N N 36 119.077 118.894 0.183 1
1 258 . 43 1 1 A 38 38 PHE H H 37 7.460 8.289 -0.829 1
1 259 . 43 1 1 A 38 38 PHE HA H 37 3.642 4.036 -0.394 1
1 267 . 43 1 1 A 38 38 PHE C C 37 176.483 177.770 -1.287 1
1 268 . 43 1 1 A 38 38 PHE CA C 37 61.411 61.091 0.320 1
1 269 . 43 1 1 A 38 38 PHE CB C 37 39.355 39.084 0.271 1
1 275 . 43 1 1 A 38 38 PHE N N 37 119.968 120.821 -0.853 1
1 276 . 43 1 1 A 39 39 GLN H H 38 7.968 8.281 -0.313 1
1 277 . 43 1 1 A 39 39 GLN HA H 38 3.712 3.755 -0.043 1
1 284 . 43 1 1 A 39 39 GLN CA C 38 59.153 58.635 0.518 1
1 285 . 43 1 1 A 39 39 GLN CB C 38 28.213 28.120 0.093 1
1 287 . 43 1 1 A 39 39 GLN N N 38 116.433 118.389 -1.956 1
1 289 . 43 1 1 A 40 40 LEU H H 39 7.930 7.534 0.396 1
1 290 . 43 1 1 A 40 40 LEU HA H 39 3.916 4.017 -0.101 1
1 300 . 43 1 1 A 40 40 LEU C C 39 177.731 178.300 -0.569 1
1 301 . 43 1 1 A 40 40 LEU CA C 39 57.915 57.950 -0.035 1
1 302 . 43 1 1 A 40 40 LEU CB C 39 41.989 41.632 0.357 1
1 306 . 43 1 1 A 40 40 LEU N N 39 119.505 121.440 -1.935 1
1 307 . 43 1 1 A 41 41 LEU H H 40 7.174 7.746 -0.572 1
1 308 . 43 1 1 A 41 41 LEU HA H 40 3.835 3.923 -0.088 1
1 318 . 43 1 1 A 41 41 LEU C C 40 179.738 178.363 1.375 1
1 319 . 43 1 1 A 41 41 LEU CA C 40 58.266 57.954 0.312 1
1 320 . 43 1 1 A 41 41 LEU CB C 40 42.050 41.248 0.802 1
1 324 . 43 1 1 A 41 41 LEU N N 40 120.971 119.677 1.294 1
1 325 . 43 1 1 A 42 42 GLN H H 41 8.058 8.003 0.055 1
1 326 . 43 1 1 A 42 42 GLN HA H 41 3.556 3.940 -0.384 1
1 333 . 43 1 1 A 42 42 GLN C C 41 177.642 177.935 -0.293 1
1 334 . 43 1 1 A 42 42 GLN CA C 41 59.826 59.121 0.705 1
1 335 . 43 1 1 A 42 42 GLN CB C 41 28.762 28.406 0.356 1
1 337 . 43 1 1 A 42 42 GLN N N 41 117.899 118.454 -0.555 1
1 339 . 43 1 1 A 43 43 ARG H H 42 8.179 7.692 0.487 1
1 340 . 43 1 1 A 43 43 ARG HA H 42 3.655 3.948 -0.293 1
1 347 . 43 1 1 A 43 43 ARG C C 42 178.051 178.693 -0.642 1
1 348 . 43 1 1 A 43 43 ARG CA C 42 59.766 58.562 1.204 1
1 349 . 43 1 1 A 43 43 ARG CB C 42 29.941 29.410 0.531 1
1 352 . 43 1 1 A 43 43 ARG N N 42 119.392 119.652 -0.260 1
1 353 . 43 1 1 A 44 44 ASN H H 43 8.525 8.314 0.211 1
1 354 . 43 1 1 A 44 44 ASN HA H 43 4.332 4.488 -0.156 1
1 359 . 43 1 1 A 44 44 ASN C C 43 178.150 178.144 0.006 1
1 360 . 43 1 1 A 44 44 ASN CA C 43 55.841 56.251 -0.410 1
1 361 . 43 1 1 A 44 44 ASN CB C 43 37.632 37.869 -0.237 1
1 362 . 43 1 1 A 44 44 ASN N N 43 116.214 117.636 -1.422 1
1 364 . 43 1 1 A 45 45 PHE H H 44 7.586 7.823 -0.237 1
1 365 . 43 1 1 A 45 45 PHE HA H 44 4.132 4.300 -0.168 1
1 372 . 43 1 1 A 45 45 PHE C C 44 176.691 177.274 -0.583 1
1 373 . 43 1 1 A 45 45 PHE CA C 44 62.333 60.787 1.546 1
1 374 . 43 1 1 A 45 45 PHE CB C 44 39.449 38.438 1.011 1
1 379 . 43 1 1 A 45 45 PHE N N 44 121.501 120.293 1.208 1
1 380 . 43 1 1 A 46 46 MET H H 45 8.190 7.467 0.723 1
1 381 . 43 1 1 A 46 46 MET HA H 45 4.060 3.447 0.613 1
1 389 . 43 1 1 A 46 46 MET C C 45 179.754 177.674 2.080 1
1 390 . 43 1 1 A 46 46 MET CA C 45 57.742 57.010 0.732 1
1 391 . 43 1 1 A 46 46 MET CB C 45 29.912 32.101 -2.189 1
1 394 . 43 1 1 A 46 46 MET N N 45 116.727 117.163 -0.436 1
1 395 . 43 1 1 A 47 47 ASP H H 46 8.579 8.066 0.513 1
1 396 . 43 1 1 A 47 47 ASP HA H 46 4.804 4.581 0.223 1
1 399 . 43 1 1 A 47 47 ASP C C 46 177.854 177.780 0.074 1
1 400 . 43 1 1 A 47 47 ASP CA C 46 57.277 57.166 0.111 1
1 401 . 43 1 1 A 47 47 ASP CB C 46 40.776 41.590 -0.814 1
1 402 . 43 1 1 A 47 47 ASP N N 46 117.798 120.511 -2.713 1
1 403 . 43 1 1 A 48 48 LYS H H 47 7.339 7.494 -0.155 1
1 404 . 43 1 1 A 48 48 LYS HA H 47 3.828 4.260 -0.432 1
1 413 . 43 1 1 A 48 48 LYS C C 47 178.812 178.691 0.121 1
1 414 . 43 1 1 A 48 48 LYS CA C 47 58.953 58.008 0.945 1
1 415 . 43 1 1 A 48 48 LYS CB C 47 32.796 33.527 -0.731 1
1 419 . 43 1 1 A 48 48 LYS N N 47 117.852 118.660 -0.808 1
1 420 . 43 1 1 A 49 49 TYR H H 48 6.841 8.171 -1.330 1
1 421 . 43 1 1 A 49 49 TYR HA H 48 4.995 4.155 0.840 1
1 428 . 43 1 1 A 49 49 TYR C C 48 178.138 178.575 -0.437 1
1 429 . 43 1 1 A 49 49 TYR CA C 48 58.620 59.915 -1.295 1
1 430 . 43 1 1 A 49 49 TYR CB C 48 42.939 37.661 5.278 1
1 435 . 43 1 1 A 49 49 TYR N N 48 112.109 119.545 -7.436 1
1 436 . 43 1 1 A 50 50 TYR H H 49 8.491 7.772 0.719 1
1 437 . 43 1 1 A 50 50 TYR HA H 49 4.598 4.163 0.435 1
1 444 . 43 1 1 A 50 50 TYR C C 49 176.015 177.630 -1.615 1
1 445 . 43 1 1 A 50 50 TYR CA C 49 62.442 59.495 2.947 1
1 446 . 43 1 1 A 50 50 TYR CB C 49 36.588 36.977 -0.389 1
1 451 . 43 1 1 A 50 50 TYR N N 49 118.294 119.211 -0.917 1
1 452 . 43 1 1 A 51 51 LEU H H 50 7.512 7.403 0.109 1
1 453 . 43 1 1 A 51 51 LEU HA H 50 3.878 3.506 0.372 1
1 463 . 43 1 1 A 51 51 LEU C C 50 178.625 178.491 0.134 1
1 464 . 43 1 1 A 51 51 LEU CA C 50 55.994 57.204 -1.210 1
1 465 . 43 1 1 A 51 51 LEU CB C 50 40.743 41.579 -0.836 1
1 469 . 43 1 1 A 51 51 LEU N N 50 118.478 121.810 -3.332 1
1 470 . 43 1 1 A 52 52 GLU H H 51 8.042 7.736 0.306 1
1 471 . 43 1 1 A 52 52 GLU HA H 51 4.197 3.943 0.254 1
1 476 . 43 1 1 A 52 52 GLU C C 51 177.629 177.717 -0.088 1
1 477 . 43 1 1 A 52 52 GLU CA C 51 56.141 59.583 -3.442 1
1 478 . 43 1 1 A 52 52 GLU CB C 51 29.162 28.965 0.197 1
1 480 . 43 1 1 A 52 52 GLU N N 51 115.067 117.208 -2.141 1
1 481 . 43 1 1 A 53 53 PHE H H 52 7.465 8.154 -0.689 1
1 482 . 43 1 1 A 53 53 PHE HA H 52 4.431 4.663 -0.232 1
1 490 . 43 1 1 A 53 53 PHE C C 52 174.325 174.688 -0.363 1
1 491 . 43 1 1 A 53 53 PHE CA C 52 58.986 56.964 2.022 1
1 492 . 43 1 1 A 53 53 PHE CB C 52 40.183 37.395 2.788 1
1 498 . 43 1 1 A 53 53 PHE N N 52 116.768 118.772 -2.004 1
1 499 . 43 1 1 A 54 54 GLU H H 53 7.484 8.646 -1.162 1
1 500 . 43 1 1 A 54 54 GLU HA H 53 4.583 4.779 -0.196 1
1 505 . 43 1 1 A 54 54 GLU C C 53 175.722 175.744 -0.022 1
1 506 . 43 1 1 A 54 54 GLU CA C 53 54.248 55.245 -0.997 1
1 507 . 43 1 1 A 54 54 GLU CB C 53 34.409 31.783 2.626 1
1 509 . 43 1 1 A 54 54 GLU N N 53 118.844 124.098 -5.254 1
1 510 . 43 1 1 A 55 55 ASP H H 54 9.008 8.605 0.403 1
1 511 . 43 1 1 A 55 55 ASP HA H 54 4.735 4.715 0.020 1
1 514 . 43 1 1 A 55 55 ASP C C 54 175.421 176.095 -0.674 1
1 515 . 43 1 1 A 55 55 ASP CA C 54 52.888 54.086 -1.198 1
1 516 . 43 1 1 A 55 55 ASP CB C 54 38.894 40.257 -1.363 1
1 517 . 43 1 1 A 55 55 ASP N N 54 123.654 123.676 -0.022 1
1 518 . 43 1 1 A 56 56 THR H H 55 7.819 7.991 -0.172 1
1 519 . 43 1 1 A 56 56 THR HA H 55 4.574 4.955 -0.381 1
1 524 . 43 1 1 A 56 56 THR C C 55 174.096 174.193 -0.097 1
1 525 . 43 1 1 A 56 56 THR CA C 55 59.172 59.422 -0.250 1
1 526 . 43 1 1 A 56 56 THR CB C 55 71.889 72.494 -0.605 1
1 528 . 43 1 1 A 56 56 THR N N 55 112.015 115.368 -3.353 1
1 529 . 43 1 1 A 57 57 GLU H H 56 8.527 8.912 -0.385 1
1 530 . 43 1 1 A 57 57 GLU HA H 56 4.217 4.373 -0.156 1
1 535 . 43 1 1 A 57 57 GLU C C 56 177.042 176.809 0.233 1
1 536 . 43 1 1 A 57 57 GLU CA C 56 56.869 57.282 -0.413 1
1 537 . 43 1 1 A 57 57 GLU CB C 56 29.731 31.197 -1.466 1
1 539 . 43 1 1 A 57 57 GLU N N 56 117.531 121.296 -3.765 1
1 540 . 43 1 1 A 58 58 GLU H H 57 7.587 7.855 -0.268 1
1 541 . 43 1 1 A 58 58 GLU HA H 57 3.941 4.410 -0.469 1
1 546 . 43 1 1 A 58 58 GLU C C 57 176.849 175.942 0.907 1
1 547 . 43 1 1 A 58 58 GLU CA C 57 56.924 56.084 0.840 1
1 548 . 43 1 1 A 58 58 GLU CB C 57 30.251 30.350 -0.099 1
1 550 . 43 1 1 A 58 58 GLU N N 57 119.183 119.694 -0.511 1
1 551 . 43 1 1 A 59 59 ASN H H 58 9.120 8.727 0.393 1
1 552 . 43 1 1 A 59 59 ASN HA H 58 4.922 5.098 -0.176 1
1 557 . 43 1 1 A 59 59 ASN C C 58 174.254 175.446 -1.192 1
1 558 . 43 1 1 A 59 59 ASN CA C 58 51.956 53.708 -1.752 1
1 559 . 43 1 1 A 59 59 ASN CB C 58 37.404 39.827 -2.423 1
1 560 . 43 1 1 A 59 59 ASN N N 58 126.767 121.987 4.780 1
1 562 . 43 1 1 A 60 60 LYS H H 59 5.892 8.957 -3.065 1
1 563 . 43 1 1 A 60 60 LYS HA H 59 3.798 4.835 -1.037 1
1 572 . 43 1 1 A 60 60 LYS C C 59 177.908 177.098 0.810 1
1 573 . 43 1 1 A 60 60 LYS CA C 59 56.623 54.764 1.859 1
1 574 . 43 1 1 A 60 60 LYS CB C 59 32.279 34.881 -2.602 1
1 578 . 43 1 1 A 60 60 LYS N N 59 121.527 121.969 -0.442 1
1 579 . 43 1 1 A 61 61 LEU H H 60 8.473 8.719 -0.246 1
1 580 . 43 1 1 A 61 61 LEU HA H 60 3.891 4.328 -0.437 1
1 590 . 43 1 1 A 61 61 LEU C C 60 179.843 177.883 1.960 1
1 591 . 43 1 1 A 61 61 LEU CA C 60 58.301 56.921 1.380 1
1 592 . 43 1 1 A 61 61 LEU CB C 60 41.305 42.287 -0.982 1
1 596 . 43 1 1 A 61 61 LEU N N 60 125.639 125.381 0.258 1
1 597 . 43 1 1 A 62 62 ILE H H 61 7.698 7.777 -0.079 1
1 598 . 43 1 1 A 62 62 ILE HA H 61 3.952 3.825 0.127 1
1 608 . 43 1 1 A 62 62 ILE C C 61 175.392 177.251 -1.859 1
1 609 . 43 1 1 A 62 62 ILE CA C 61 61.743 63.117 -1.374 1
1 610 . 43 1 1 A 62 62 ILE CB C 61 39.108 37.662 1.446 1
1 614 . 43 1 1 A 62 62 ILE N N 61 114.111 118.793 -4.682 1
1 615 . 43 1 1 A 63 63 TYR H H 62 7.273 7.645 -0.372 1
1 616 . 43 1 1 A 63 63 TYR HA H 62 4.343 4.227 0.116 1
1 623 . 43 1 1 A 63 63 TYR C C 62 178.264 178.545 -0.281 1
1 624 . 43 1 1 A 63 63 TYR CA C 62 57.231 60.976 -3.745 1
1 625 . 43 1 1 A 63 63 TYR CB C 62 36.332 37.390 -1.058 1
1 630 . 43 1 1 A 63 63 TYR N N 62 117.689 121.385 -3.696 1
1 631 . 43 1 1 A 64 64 THR H H 63 7.747 7.874 -0.127 1
1 632 . 43 1 1 A 64 64 THR HA H 63 4.266 4.211 0.055 1
1 637 . 43 1 1 A 64 64 THR CA C 63 69.362 67.550 1.812 1
1 638 . 43 1 1 A 64 64 THR CB C 63 66.962 67.688 -0.726 1
1 640 . 43 1 1 A 64 64 THR N N 63 113.755 116.262 -2.507 1
1 641 . 43 1 1 A 65 65 PRO HA H 64 4.372 4.383 -0.011 1
1 648 . 43 1 1 A 65 65 PRO C C 64 179.913 179.377 0.536 1
1 649 . 43 1 1 A 65 65 PRO CA C 64 66.011 66.199 -0.188 1
1 650 . 43 1 1 A 65 65 PRO CB C 64 30.642 30.633 0.009 1
1 653 . 43 1 1 A 66 66 ILE H H 65 7.377 7.346 0.031 1
1 654 . 43 1 1 A 66 66 ILE HA H 65 3.530 3.898 -0.368 1
1 664 . 43 1 1 A 66 66 ILE C C 65 177.543 178.236 -0.693 1
1 665 . 43 1 1 A 66 66 ILE CA C 65 66.647 64.225 2.422 1
1 666 . 43 1 1 A 66 66 ILE CB C 65 38.029 37.674 0.355 1
1 670 . 43 1 1 A 66 66 ILE N N 65 118.353 116.636 1.717 1
1 671 . 43 1 1 A 67 67 PHE H H 66 8.480 8.364 0.116 1
1 672 . 43 1 1 A 67 67 PHE HA H 66 4.115 4.446 -0.331 1
1 680 . 43 1 1 A 67 67 PHE C C 66 177.293 178.261 -0.968 1
1 681 . 43 1 1 A 67 67 PHE CA C 66 59.570 62.076 -2.506 1
1 682 . 43 1 1 A 67 67 PHE CB C 66 38.865 39.697 -0.832 1
1 688 . 43 1 1 A 67 67 PHE N N 66 122.420 120.323 2.097 1
1 689 . 43 1 1 A 68 68 ASN H H 67 8.595 8.105 0.490 1
1 690 . 43 1 1 A 68 68 ASN HA H 67 4.211 4.400 -0.189 1
1 695 . 43 1 1 A 68 68 ASN C C 67 178.697 178.087 0.610 1
1 696 . 43 1 1 A 68 68 ASN CA C 67 56.056 56.410 -0.354 1
1 697 . 43 1 1 A 68 68 ASN CB C 67 37.704 37.960 -0.256 1
1 698 . 43 1 1 A 68 68 ASN N N 67 115.573 116.665 -1.092 1
1 700 . 43 1 1 A 69 69 GLU H H 68 8.414 8.007 0.407 1
1 701 . 43 1 1 A 69 69 GLU HA H 68 4.102 4.225 -0.123 1
1 706 . 43 1 1 A 69 69 GLU C C 68 177.880 178.825 -0.945 1
1 707 . 43 1 1 A 69 69 GLU CA C 68 59.399 59.400 -0.001 1
1 708 . 43 1 1 A 69 69 GLU CB C 68 29.855 29.392 0.463 1
1 710 . 43 1 1 A 69 69 GLU N N 68 123.510 120.102 3.408 1
1 711 . 43 1 1 A 70 70 TYR H H 69 8.659 8.054 0.605 1
1 712 . 43 1 1 A 70 70 TYR HA H 69 3.362 4.228 -0.866 1
1 719 . 43 1 1 A 70 70 TYR C C 69 178.143 176.916 1.227 1
1 720 . 43 1 1 A 70 70 TYR CA C 69 60.686 61.544 -0.858 1
1 721 . 43 1 1 A 70 70 TYR CB C 69 38.560 38.822 -0.262 1
1 726 . 43 1 1 A 70 70 TYR N N 69 122.130 121.292 0.838 1
1 727 . 43 1 1 A 71 71 ILE H H 70 8.031 7.961 0.070 1
1 728 . 43 1 1 A 71 71 ILE HA H 70 3.265 3.492 -0.227 1
1 738 . 43 1 1 A 71 71 ILE C C 70 178.056 177.587 0.469 1
1 739 . 43 1 1 A 71 71 ILE CA C 70 63.756 64.075 -0.319 1
1 740 . 43 1 1 A 71 71 ILE CB C 70 37.321 36.830 0.491 1
1 744 . 43 1 1 A 71 71 ILE N N 70 118.906 120.818 -1.912 1
1 745 . 43 1 1 A 72 72 SER H H 71 7.803 7.746 0.057 1
1 746 . 43 1 1 A 72 72 SER HA H 71 4.029 4.336 -0.307 1
1 749 . 43 1 1 A 72 72 SER CA C 71 61.380 61.179 0.201 1
1 750 . 43 1 1 A 72 72 SER CB C 71 63.288 63.267 0.021 1
1 751 . 43 1 1 A 72 72 SER N N 71 113.735 116.818 -3.083 1
1 752 . 43 1 1 A 73 73 LEU H H 72 7.952 8.098 -0.146 1
1 753 . 43 1 1 A 73 73 LEU HA H 72 4.418 4.222 0.196 1
1 763 . 43 1 1 A 73 73 LEU C C 72 177.767 178.421 -0.654 1
1 764 . 43 1 1 A 73 73 LEU CA C 72 56.543 57.575 -1.032 1
1 765 . 43 1 1 A 73 73 LEU CB C 72 44.517 41.976 2.541 1
1 769 . 43 1 1 A 73 73 LEU N N 72 119.411 122.476 -3.065 1
1 770 . 43 1 1 A 74 74 VAL H H 73 8.021 7.636 0.385 1
1 771 . 43 1 1 A 74 74 VAL HA H 73 3.532 3.347 0.185 1
1 779 . 43 1 1 A 74 74 VAL C C 73 177.126 177.929 -0.803 1
1 780 . 43 1 1 A 74 74 VAL CA C 73 66.250 66.322 -0.072 1
1 781 . 43 1 1 A 74 74 VAL CB C 73 31.212 31.254 -0.042 1
1 784 . 43 1 1 A 74 74 VAL N N 73 118.747 119.146 -0.399 1
1 785 . 43 1 1 A 75 75 GLU H H 74 7.232 7.768 -0.536 1
1 786 . 43 1 1 A 75 75 GLU HA H 74 3.013 3.863 -0.850 1
1 791 . 43 1 1 A 75 75 GLU C C 74 178.804 178.961 -0.157 1
1 792 . 43 1 1 A 75 75 GLU CA C 74 60.536 59.536 1.000 1
1 793 . 43 1 1 A 75 75 GLU CB C 74 27.009 28.891 -1.882 1
1 795 . 43 1 1 A 75 75 GLU N N 74 118.660 119.807 -1.147 1
1 796 . 43 1 1 A 76 76 LYS H H 75 7.051 7.770 -0.719 1
1 797 . 43 1 1 A 76 76 LYS HA H 75 3.765 4.006 -0.241 1
1 806 . 43 1 1 A 76 76 LYS C C 75 177.765 178.371 -0.606 1
1 807 . 43 1 1 A 76 76 LYS CA C 75 58.357 58.903 -0.546 1
1 808 . 43 1 1 A 76 76 LYS CB C 75 31.939 31.823 0.116 1
1 812 . 43 1 1 A 76 76 LYS N N 75 116.112 119.570 -3.458 1
1 813 . 43 1 1 A 77 77 TYR H H 76 7.067 7.686 -0.619 1
1 814 . 43 1 1 A 77 77 TYR HA H 76 4.036 4.203 -0.167 1
1 821 . 43 1 1 A 77 77 TYR C C 76 177.752 177.218 0.534 1
1 822 . 43 1 1 A 77 77 TYR CA C 76 61.820 61.297 0.523 1
1 823 . 43 1 1 A 77 77 TYR CB C 76 38.480 38.616 -0.136 1
1 828 . 43 1 1 A 77 77 TYR N N 76 118.434 120.719 -2.285 1
1 829 . 43 1 1 A 78 78 ILE H H 77 7.554 8.318 -0.764 1
1 830 . 43 1 1 A 78 78 ILE HA H 77 3.159 3.664 -0.505 1
1 840 . 43 1 1 A 78 78 ILE C C 77 177.341 177.900 -0.559 1
1 841 . 43 1 1 A 78 78 ILE CA C 77 65.177 65.344 -0.167 1
1 842 . 43 1 1 A 78 78 ILE CB C 77 37.339 38.095 -0.756 1
1 846 . 43 1 1 A 78 78 ILE N N 77 117.672 121.058 -3.386 1
1 847 . 43 1 1 A 79 79 GLU H H 78 8.296 8.004 0.292 1
1 848 . 43 1 1 A 79 79 GLU HA H 78 3.557 3.777 -0.220 1
1 853 . 43 1 1 A 79 79 GLU C C 78 177.742 178.962 -1.220 1
1 854 . 43 1 1 A 79 79 GLU CA C 78 60.847 60.093 0.754 1
1 855 . 43 1 1 A 79 79 GLU CB C 78 29.594 29.185 0.409 1
1 857 . 43 1 1 A 79 79 GLU N N 78 118.701 120.846 -2.145 1
1 858 . 43 1 1 A 80 80 GLU H H 79 8.330 8.154 0.176 1
1 859 . 43 1 1 A 80 80 GLU HA H 79 3.774 4.012 -0.238 1
1 864 . 43 1 1 A 80 80 GLU C C 79 179.926 179.247 0.679 1
1 865 . 43 1 1 A 80 80 GLU CA C 79 59.581 59.041 0.540 1
1 866 . 43 1 1 A 80 80 GLU CB C 79 29.062 29.367 -0.305 1
1 868 . 43 1 1 A 80 80 GLU N N 79 116.767 117.979 -1.212 1
1 869 . 43 1 1 A 81 81 GLN H H 80 7.634 7.656 -0.022 1
1 870 . 43 1 1 A 81 81 GLN HA H 80 3.605 3.829 -0.224 1
1 877 . 43 1 1 A 81 81 GLN C C 80 179.681 178.752 0.929 1
1 878 . 43 1 1 A 81 81 GLN CA C 80 57.765 58.549 -0.784 1
1 879 . 43 1 1 A 81 81 GLN CB C 80 28.079 27.735 0.344 1
1 881 . 43 1 1 A 81 81 GLN N N 80 116.325 118.700 -2.375 1
1 883 . 43 1 1 A 82 82 LEU H H 81 8.156 7.550 0.606 1
1 884 . 43 1 1 A 82 82 LEU HA H 81 3.536 3.765 -0.229 1
1 894 . 43 1 1 A 82 82 LEU C C 81 178.945 179.408 -0.463 1
1 895 . 43 1 1 A 82 82 LEU CA C 81 57.761 56.905 0.856 1
1 896 . 43 1 1 A 82 82 LEU CB C 81 40.961 40.800 0.161 1
1 900 . 43 1 1 A 82 82 LEU N N 81 121.546 120.032 1.514 1
1 901 . 43 1 1 A 83 83 LEU H H 82 8.326 7.986 0.340 1
1 902 . 43 1 1 A 83 83 LEU HA H 82 4.198 4.192 0.006 1
1 912 . 43 1 1 A 83 83 LEU C C 82 178.631 179.258 -0.627 1
1 913 . 43 1 1 A 83 83 LEU CA C 82 57.016 57.404 -0.388 1
1 914 . 43 1 1 A 83 83 LEU CB C 82 42.182 40.837 1.345 1
1 918 . 43 1 1 A 83 83 LEU N N 82 120.426 119.448 0.978 1
1 919 . 43 1 1 A 84 84 GLN H H 83 6.992 7.564 -0.572 1
1 920 . 43 1 1 A 84 84 GLN HA H 83 3.877 4.022 -0.145 1
1 927 . 43 1 1 A 84 84 GLN C C 83 177.008 176.966 0.042 1
1 928 . 43 1 1 A 84 84 GLN CA C 83 57.543 58.291 -0.748 1
1 929 . 43 1 1 A 84 84 GLN CB C 83 28.688 28.584 0.104 1
1 931 . 43 1 1 A 84 84 GLN N N 83 114.001 117.339 -3.338 1
1 933 . 43 1 1 A 85 85 ARG H H 84 7.072 7.445 -0.373 1
1 934 . 43 1 1 A 85 85 ARG HA H 84 4.047 4.385 -0.338 1
1 942 . 43 1 1 A 85 85 ARG C C 84 175.999 175.406 0.593 1
1 943 . 43 1 1 A 85 85 ARG CA C 84 56.764 55.825 0.939 1
1 944 . 43 1 1 A 85 85 ARG CB C 84 32.044 32.426 -0.382 1
1 947 . 43 1 1 A 85 85 ARG N N 84 115.827 116.930 -1.103 1
1 949 . 43 1 1 A 86 86 ILE H H 85 8.238 7.726 0.512 1
1 950 . 43 1 1 A 86 86 ILE HA H 85 4.389 4.601 -0.212 1
1 960 . 43 1 1 A 86 86 ILE CA C 85 58.007 57.925 0.082 1
1 961 . 43 1 1 A 86 86 ILE CB C 85 39.604 38.979 0.625 1
1 965 . 43 1 1 A 86 86 ILE N N 85 119.285 119.831 -0.546 1
1 966 . 43 1 1 A 87 87 PRO HA H 86 4.392 4.542 -0.150 1
1 973 . 43 1 1 A 87 87 PRO C C 86 177.622 176.321 1.301 1
1 974 . 43 1 1 A 87 87 PRO CA C 86 64.665 64.290 0.375 1
1 975 . 43 1 1 A 87 87 PRO CB C 86 32.020 31.677 0.343 1
1 978 . 43 1 1 A 88 88 GLU H H 87 8.312 8.222 0.090 1
1 979 . 43 1 1 A 88 88 GLU HA H 87 4.208 4.597 -0.389 1
1 984 . 43 1 1 A 88 88 GLU C C 87 175.554 175.831 -0.277 1
1 985 . 43 1 1 A 88 88 GLU CA C 87 56.045 56.289 -0.244 1
1 986 . 43 1 1 A 88 88 GLU CB C 87 28.654 30.666 -2.012 1
1 988 . 43 1 1 A 88 88 GLU N N 87 114.256 116.702 -2.446 1
1 989 . 43 1 1 A 89 89 PHE H H 88 7.946 7.670 0.276 1
1 990 . 43 1 1 A 89 89 PHE HA H 88 3.993 4.603 -0.610 1
1 998 . 43 1 1 A 89 89 PHE C C 88 173.460 174.373 -0.913 1
1 999 . 43 1 1 A 89 89 PHE CA C 88 60.119 58.900 1.219 1
1 1000 . 43 1 1 A 89 89 PHE CB C 88 39.994 39.852 0.142 1
1 1006 . 43 1 1 A 89 89 PHE N N 88 121.550 123.136 -1.586 1
1 1007 . 43 1 1 A 90 90 ASN H H 89 7.266 7.821 -0.555 1
1 1008 . 43 1 1 A 90 90 ASN HA H 89 4.454 5.043 -0.589 1
1 1013 . 43 1 1 A 90 90 ASN C C 89 173.921 175.352 -1.431 1
1 1014 . 43 1 1 A 90 90 ASN CA C 89 51.839 51.427 0.412 1
1 1015 . 43 1 1 A 90 90 ASN CB C 89 40.674 39.424 1.250 1
1 1016 . 43 1 1 A 90 90 ASN N N 89 125.344 125.047 0.297 1
1 1018 . 43 1 1 A 91 91 MET H H 90 8.968 8.845 0.123 1
1 1019 . 43 1 1 A 91 91 MET HA H 90 4.049 4.179 -0.130 1
1 1027 . 43 1 1 A 91 91 MET C C 90 177.475 178.293 -0.818 1
1 1028 . 43 1 1 A 91 91 MET CA C 90 57.758 58.491 -0.733 1
1 1029 . 43 1 1 A 91 91 MET CB C 90 32.250 32.477 -0.227 1
1 1032 . 43 1 1 A 91 91 MET N N 90 127.052 124.987 2.065 1
1 1033 . 43 1 1 A 92 92 ALA H H 91 8.292 8.091 0.201 1
1 1034 . 43 1 1 A 92 92 ALA HA H 91 4.059 4.141 -0.082 1
1 1038 . 43 1 1 A 92 92 ALA C C 91 180.412 179.913 0.499 1
1 1039 . 43 1 1 A 92 92 ALA CA C 91 55.368 55.051 0.317 1
1 1040 . 43 1 1 A 92 92 ALA CB C 91 17.527 18.537 -1.010 1
1 1041 . 43 1 1 A 92 92 ALA N N 91 123.752 121.386 2.366 1
1 1042 . 43 1 1 A 93 93 ALA H H 92 7.931 7.958 -0.027 1
1 1043 . 43 1 1 A 93 93 ALA HA H 92 4.054 4.089 -0.035 1
1 1047 . 43 1 1 A 93 93 ALA C C 92 180.482 179.840 0.642 1
1 1048 . 43 1 1 A 93 93 ALA CA C 92 54.614 54.878 -0.264 1
1 1049 . 43 1 1 A 93 93 ALA CB C 92 18.098 18.145 -0.047 1
1 1050 . 43 1 1 A 93 93 ALA N N 92 121.158 120.066 1.092 1
1 1051 . 43 1 1 A 94 94 PHE H H 93 8.110 7.873 0.237 1
1 1052 . 43 1 1 A 94 94 PHE HA H 93 4.304 4.167 0.137 1
1 1060 . 43 1 1 A 94 94 PHE C C 93 177.350 177.488 -0.138 1
1 1061 . 43 1 1 A 94 94 PHE CA C 93 61.641 61.495 0.146 1
1 1062 . 43 1 1 A 94 94 PHE CB C 93 40.014 39.187 0.827 1
1 1068 . 43 1 1 A 94 94 PHE N N 93 119.807 120.014 -0.207 1
1 1069 . 43 1 1 A 95 95 THR H H 94 8.726 8.227 0.499 1
1 1070 . 43 1 1 A 95 95 THR HA H 94 3.569 3.951 -0.382 1
1 1075 . 43 1 1 A 95 95 THR C C 94 176.932 176.983 -0.051 1
1 1076 . 43 1 1 A 95 95 THR CA C 94 66.833 65.622 1.211 1
1 1077 . 43 1 1 A 95 95 THR CB C 94 68.445 68.320 0.125 1
1 1079 . 43 1 1 A 95 95 THR N N 94 113.074 112.255 0.819 1
1 1080 . 43 1 1 A 96 96 THR H H 95 7.657 7.906 -0.249 1
1 1081 . 43 1 1 A 96 96 THR HA H 95 3.945 4.289 -0.344 1
1 1086 . 43 1 1 A 96 96 THR C C 95 176.386 176.262 0.124 1
1 1087 . 43 1 1 A 96 96 THR CA C 95 66.550 66.129 0.421 1
1 1088 . 43 1 1 A 96 96 THR CB C 95 68.583 68.547 0.036 1
1 1090 . 43 1 1 A 96 96 THR N N 95 117.927 116.647 1.280 1
1 1091 . 43 1 1 A 97 97 THR H H 96 7.699 7.913 -0.214 1
1 1092 . 43 1 1 A 97 97 THR HA H 96 3.905 4.117 -0.212 1
1 1097 . 43 1 1 A 97 97 THR C C 96 176.572 176.618 -0.046 1
1 1098 . 43 1 1 A 97 97 THR CA C 96 65.979 66.560 -0.581 1
1 1099 . 43 1 1 A 97 97 THR CB C 96 68.553 68.445 0.108 1
1 1101 . 43 1 1 A 97 97 THR N N 96 118.518 116.949 1.569 1
1 1102 . 43 1 1 A 98 98 LEU H H 97 8.304 8.082 0.222 1
1 1103 . 43 1 1 A 98 98 LEU HA H 97 3.725 3.956 -0.231 1
1 1113 . 43 1 1 A 98 98 LEU C C 97 178.490 178.882 -0.392 1
1 1114 . 43 1 1 A 98 98 LEU CA C 97 58.517 57.987 0.530 1
1 1115 . 43 1 1 A 98 98 LEU CB C 97 41.697 41.138 0.559 1
1 1119 . 43 1 1 A 98 98 LEU N N 97 122.882 122.276 0.606 1
1 1120 . 43 1 1 A 99 99 GLN H H 98 7.639 8.040 -0.401 1
1 1121 . 43 1 1 A 99 99 GLN HA H 98 3.927 4.083 -0.156 1
1 1128 . 43 1 1 A 99 99 GLN C C 98 178.068 178.115 -0.047 1
1 1129 . 43 1 1 A 99 99 GLN CA C 98 58.735 59.012 -0.277 1
1 1130 . 43 1 1 A 99 99 GLN CB C 98 27.986 28.232 -0.246 1
1 1132 . 43 1 1 A 99 99 GLN N N 98 114.302 118.544 -4.242 1
1 1134 . 43 1 1 A 100 100 HIS H H 99 7.575 7.652 -0.077 1
1 1135 . 43 1 1 A 100 100 HIS HA H 99 4.524 4.460 0.064 1
1 1139 . 43 1 1 A 100 100 HIS C C 99 174.789 177.557 -2.768 1
1 1140 . 43 1 1 A 100 100 HIS CA C 99 56.154 58.744 -2.590 1
1 1141 . 43 1 1 A 100 100 HIS CB C 99 28.946 31.064 -2.118 1
1 1143 . 43 1 1 A 100 100 HIS N N 99 114.778 118.361 -3.583 1
1 1144 . 43 1 1 A 101 101 HIS H H 100 7.773 8.013 -0.240 1
1 1145 . 43 1 1 A 101 101 HIS HA H 100 4.704 3.981 0.723 1
1 1149 . 43 1 1 A 101 101 HIS C C 100 174.818 176.958 -2.140 1
1 1150 . 43 1 1 A 101 101 HIS CA C 100 54.830 58.339 -3.509 1
1 1151 . 43 1 1 A 101 101 HIS CB C 100 29.749 30.000 -0.251 1
1 1153 . 43 1 1 A 101 101 HIS N N 100 117.397 119.205 -1.808 1
1 1154 . 43 1 1 A 102 102 LYS H H 101 7.324 8.106 -0.782 1
1 1155 . 43 1 1 A 102 102 LYS HA H 101 3.611 4.055 -0.444 1
1 1164 . 43 1 1 A 102 102 LYS C C 101 176.823 178.601 -1.778 1
1 1165 . 43 1 1 A 102 102 LYS CA C 101 59.915 59.315 0.600 1
1 1166 . 43 1 1 A 102 102 LYS CB C 101 32.825 32.283 0.542 1
1 1170 . 43 1 1 A 102 102 LYS N N 101 120.533 117.631 2.902 1
1 1171 . 43 1 1 A 103 103 ASP H H 102 8.361 8.702 -0.341 1
1 1172 . 43 1 1 A 103 103 ASP HA H 102 4.421 4.383 0.038 1
1 1175 . 43 1 1 A 103 103 ASP C C 102 176.793 176.953 -0.160 1
1 1176 . 43 1 1 A 103 103 ASP CA C 102 55.500 54.947 0.553 1
1 1177 . 43 1 1 A 103 103 ASP CB C 102 40.178 39.428 0.750 1
1 1178 . 43 1 1 A 103 103 ASP N N 102 114.814 118.405 -3.591 1
1 1179 . 43 1 1 A 104 104 GLU H H 103 7.858 8.275 -0.417 1
1 1180 . 43 1 1 A 104 104 GLU HA H 103 4.339 4.602 -0.263 1
1 1183 . 43 1 1 A 104 104 GLU C C 103 175.777 176.456 -0.679 1
1 1184 . 43 1 1 A 104 104 GLU CA C 103 56.356 57.925 -1.569 1
1 1185 . 43 1 1 A 104 104 GLU CB C 103 31.293 32.128 -0.835 1
1 1186 . 43 1 1 A 104 104 GLU N N 103 116.826 118.565 -1.739 1
1 1187 . 43 1 1 A 105 105 VAL H H 104 7.201 7.498 -0.297 1
1 1188 . 43 1 1 A 105 105 VAL HA H 104 4.296 4.158 0.138 1
1 1196 . 43 1 1 A 105 105 VAL C C 104 174.482 175.664 -1.182 1
1 1197 . 43 1 1 A 105 105 VAL CA C 104 60.370 62.771 -2.401 1
1 1198 . 43 1 1 A 105 105 VAL CB C 104 34.341 32.993 1.348 1
1 1201 . 43 1 1 A 105 105 VAL N N 104 116.422 119.743 -3.321 1
1 1202 . 43 1 1 A 106 106 ALA H H 105 8.487 8.483 0.004 1
1 1203 . 43 1 1 A 106 106 ALA HA H 105 4.172 4.427 -0.255 1
1 1207 . 43 1 1 A 106 106 ALA C C 105 179.030 178.668 0.362 1
1 1208 . 43 1 1 A 106 106 ALA CA C 105 52.966 52.329 0.637 1
1 1209 . 43 1 1 A 106 106 ALA CB C 105 19.371 19.046 0.325 1
1 1210 . 43 1 1 A 106 106 ALA N N 105 128.313 128.764 -0.451 1
1 1211 . 43 1 1 A 107 107 GLY H H 106 8.738 8.782 -0.044 1
1 1212 . 43 1 1 A 107 107 GLY HA2 H 106 3.773 3.870 -0.097 1
1 1213 . 43 1 1 A 107 107 GLY HA3 H 106 3.998 3.934 0.064 1
1 1214 . 43 1 1 A 107 107 GLY C C 106 174.958 175.468 -0.510 1
1 1215 . 43 1 1 A 107 107 GLY CA C 106 47.449 47.188 0.261 1
1 1216 . 43 1 1 A 107 107 GLY N N 106 110.612 110.776 -0.164 1
1 1217 . 43 1 1 A 108 108 ASP H H 107 8.535 7.836 0.699 1
1 1218 . 43 1 1 A 108 108 ASP HA H 107 4.333 4.364 -0.031 1
1 1221 . 43 1 1 A 108 108 ASP C C 107 179.133 179.054 0.079 1
1 1222 . 43 1 1 A 108 108 ASP CA C 107 56.721 56.436 0.285 1
1 1223 . 43 1 1 A 108 108 ASP CB C 107 39.336 40.588 -1.252 1
1 1224 . 43 1 1 A 108 108 ASP N N 107 117.474 122.158 -4.684 1
1 1225 . 43 1 1 A 109 109 ILE H H 108 7.459 7.892 -0.433 1
1 1226 . 43 1 1 A 109 109 ILE HA H 108 3.688 3.816 -0.128 1
1 1236 . 43 1 1 A 109 109 ILE C C 108 176.735 178.430 -1.695 1
1 1237 . 43 1 1 A 109 109 ILE CA C 108 63.474 65.436 -1.962 1
1 1238 . 43 1 1 A 109 109 ILE CB C 108 37.340 37.602 -0.262 1
1 1242 . 43 1 1 A 109 109 ILE N N 108 119.609 119.826 -0.217 1
1 1243 . 43 1 1 A 110 110 PHE H H 109 7.920 8.358 -0.438 1
1 1244 . 43 1 1 A 110 110 PHE HA H 109 3.759 4.106 -0.347 1
1 1252 . 43 1 1 A 110 110 PHE C C 109 177.132 177.397 -0.265 1
1 1253 . 43 1 1 A 110 110 PHE CA C 109 62.766 61.259 1.507 1
1 1254 . 43 1 1 A 110 110 PHE CB C 109 39.752 39.315 0.437 1
1 1260 . 43 1 1 A 110 110 PHE N N 109 120.906 120.442 0.464 1
1 1261 . 43 1 1 A 111 111 ASP H H 110 8.639 8.197 0.442 1
1 1262 . 43 1 1 A 111 111 ASP HA H 110 4.216 4.229 -0.013 1
1 1265 . 43 1 1 A 111 111 ASP C C 110 178.900 178.388 0.512 1
1 1266 . 43 1 1 A 111 111 ASP CA C 110 57.105 57.303 -0.198 1
1 1267 . 43 1 1 A 111 111 ASP CB C 110 39.697 42.023 -2.326 1
1 1268 . 43 1 1 A 111 111 ASP N N 110 117.124 118.757 -1.633 1
1 1269 . 43 1 1 A 112 112 MET H H 111 7.331 7.558 -0.227 1
1 1270 . 43 1 1 A 112 112 MET HA H 111 4.081 4.154 -0.073 1
1 1278 . 43 1 1 A 112 112 MET C C 111 179.052 178.174 0.878 1
1 1279 . 43 1 1 A 112 112 MET CA C 111 58.202 58.106 0.096 1
1 1280 . 43 1 1 A 112 112 MET CB C 111 31.827 32.455 -0.628 1
1 1283 . 43 1 1 A 112 112 MET N N 111 118.061 119.429 -1.368 1
1 1284 . 43 1 1 A 113 113 LEU H H 112 8.001 8.078 -0.077 1
1 1285 . 43 1 1 A 113 113 LEU HA H 112 3.723 3.664 0.059 1
1 1295 . 43 1 1 A 113 113 LEU C C 112 179.747 178.655 1.092 1
1 1296 . 43 1 1 A 113 113 LEU CA C 112 57.371 57.483 -0.112 1
1 1297 . 43 1 1 A 113 113 LEU CB C 112 40.671 41.265 -0.594 1
1 1301 . 43 1 1 A 113 113 LEU N N 112 120.426 119.719 0.707 1
1 1302 . 43 1 1 A 114 114 LEU H H 113 7.744 7.811 -0.067 1
1 1303 . 43 1 1 A 114 114 LEU HA H 113 4.007 3.515 0.492 1
1 1313 . 43 1 1 A 114 114 LEU C C 113 179.358 178.508 0.850 1
1 1314 . 43 1 1 A 114 114 LEU CA C 113 57.202 57.532 -0.330 1
1 1315 . 43 1 1 A 114 114 LEU CB C 113 41.727 41.622 0.105 1
1 1319 . 43 1 1 A 114 114 LEU N N 113 119.584 119.670 -0.086 1
1 1320 . 43 1 1 A 115 115 THR H H 114 7.353 7.614 -0.261 1
1 1321 . 43 1 1 A 115 115 THR HA H 114 4.071 4.053 0.018 1
1 1327 . 43 1 1 A 115 115 THR C C 114 173.591 176.423 -2.832 1
1 1328 . 43 1 1 A 115 115 THR CA C 114 65.332 64.811 0.521 1
1 1329 . 43 1 1 A 115 115 THR CB C 114 70.319 68.475 1.844 1
1 1331 . 43 1 1 A 115 115 THR N N 114 107.535 112.391 -4.856 1
1 1332 . 43 1 1 A 116 116 PHE H H 115 6.979 7.893 -0.914 1
1 1333 . 43 1 1 A 116 116 PHE HA H 115 5.022 4.430 0.592 1
1 1341 . 43 1 1 A 116 116 PHE C C 115 176.488 176.557 -0.069 1
1 1342 . 43 1 1 A 116 116 PHE CA C 115 55.911 61.284 -5.373 1
1 1343 . 43 1 1 A 116 116 PHE CB C 115 38.521 38.892 -0.371 1
1 1349 . 43 1 1 A 116 116 PHE N N 115 112.366 120.037 -7.671 1
1 1350 . 43 1 1 A 117 117 THR H H 116 7.564 7.622 -0.058 1
1 1351 . 43 1 1 A 117 117 THR HA H 116 4.626 4.768 -0.142 1
1 1356 . 43 1 1 A 117 117 THR C C 116 174.085 174.360 -0.275 1
1 1357 . 43 1 1 A 117 117 THR CA C 116 61.636 62.431 -0.795 1
1 1358 . 43 1 1 A 117 117 THR CB C 116 70.915 70.495 0.420 1
1 1360 . 43 1 1 A 117 117 THR N N 116 105.498 107.175 -1.677 1
1 1361 . 43 1 1 A 118 118 ASP H H 117 8.270 7.849 0.421 1
1 1362 . 43 1 1 A 118 118 ASP HA H 117 4.955 4.690 0.265 1
1 1365 . 43 1 1 A 118 118 ASP C C 117 176.328 176.381 -0.053 1
1 1366 . 43 1 1 A 118 118 ASP CA C 117 53.417 53.457 -0.040 1
1 1367 . 43 1 1 A 118 118 ASP CB C 117 43.388 40.489 2.899 1
1 1368 . 43 1 1 A 118 118 ASP N N 117 124.409 121.843 2.566 1
1 1369 . 43 1 1 A 119 119 PHE H H 118 8.973 8.806 0.167 1
1 1370 . 43 1 1 A 119 119 PHE HA H 118 3.506 4.201 -0.695 1
1 1378 . 43 1 1 A 119 119 PHE CA C 118 61.490 61.340 0.150 1
1 1379 . 43 1 1 A 119 119 PHE CB C 118 39.246 39.512 -0.266 1
1 1385 . 43 1 1 A 119 119 PHE N N 118 126.688 126.459 0.229 1
1 1386 . 43 1 1 A 120 120 LEU H H 119 8.099 8.406 -0.307 1
1 1387 . 43 1 1 A 120 120 LEU HA H 119 3.842 3.926 -0.084 1
1 1397 . 43 1 1 A 120 120 LEU C C 119 179.601 179.572 0.029 1
1 1398 . 43 1 1 A 120 120 LEU CA C 119 58.174 57.862 0.312 1
1 1399 . 43 1 1 A 120 120 LEU CB C 119 40.315 41.221 -0.906 1
1 1403 . 43 1 1 A 120 120 LEU N N 119 117.930 119.895 -1.965 1
1 1404 . 43 1 1 A 121 121 ALA H H 120 7.729 7.825 -0.096 1
1 1405 . 43 1 1 A 121 121 ALA HA H 120 3.996 4.079 -0.083 1
1 1409 . 43 1 1 A 121 121 ALA C C 120 180.995 179.596 1.399 1
1 1410 . 43 1 1 A 121 121 ALA CA C 120 54.832 54.609 0.223 1
1 1411 . 43 1 1 A 121 121 ALA CB C 120 17.706 18.283 -0.577 1
1 1412 . 43 1 1 A 121 121 ALA N N 120 123.195 121.365 1.830 1
1 1413 . 43 1 1 A 122 122 PHE H H 121 7.943 7.803 0.140 1
1 1414 . 43 1 1 A 122 122 PHE HA H 121 3.887 3.792 0.095 1
1 1419 . 43 1 1 A 122 122 PHE C C 121 175.410 176.899 -1.489 1
1 1420 . 43 1 1 A 122 122 PHE CA C 121 61.075 60.683 0.392 1
1 1421 . 43 1 1 A 122 122 PHE CB C 121 38.115 38.890 -0.775 1
1 1424 . 43 1 1 A 122 122 PHE N N 121 121.798 120.459 1.339 1
1 1425 . 43 1 1 A 123 123 LYS H H 122 8.468 7.713 0.755 1
1 1426 . 43 1 1 A 123 123 LYS HA H 122 3.077 3.712 -0.635 1
1 1435 . 43 1 1 A 123 123 LYS C C 122 178.453 178.253 0.200 1
1 1436 . 43 1 1 A 123 123 LYS CA C 122 59.855 59.788 0.067 1
1 1437 . 43 1 1 A 123 123 LYS CB C 122 32.374 31.914 0.460 1
1 1441 . 43 1 1 A 123 123 LYS N N 122 120.614 118.637 1.977 1
1 1442 . 43 1 1 A 124 124 GLU H H 123 8.100 7.784 0.316 1
1 1443 . 43 1 1 A 124 124 GLU HA H 123 3.652 4.058 -0.406 1
1 1448 . 43 1 1 A 124 124 GLU C C 123 177.743 178.654 -0.911 1
1 1449 . 43 1 1 A 124 124 GLU CA C 123 59.406 59.304 0.102 1
1 1450 . 43 1 1 A 124 124 GLU CB C 123 28.811 29.214 -0.403 1
1 1452 . 43 1 1 A 124 124 GLU N N 123 117.404 118.836 -1.432 1
1 1453 . 43 1 1 A 125 125 MET H H 124 7.537 7.594 -0.057 1
1 1454 . 43 1 1 A 125 125 MET HA H 124 3.860 3.946 -0.086 1
1 1462 . 43 1 1 A 125 125 MET C C 124 179.522 178.296 1.226 1
1 1463 . 43 1 1 A 125 125 MET CA C 124 58.832 58.223 0.609 1
1 1464 . 43 1 1 A 125 125 MET CB C 124 31.765 31.490 0.275 1
1 1467 . 43 1 1 A 125 125 MET N N 124 119.413 119.112 0.301 1
1 1468 . 43 1 1 A 126 126 PHE H H 125 7.148 7.406 -0.258 1
1 1469 . 43 1 1 A 126 126 PHE HA H 125 3.633 4.175 -0.542 1
1 1476 . 43 1 1 A 126 126 PHE C C 125 178.994 178.134 0.860 1
1 1477 . 43 1 1 A 126 126 PHE CA C 125 63.148 61.084 2.064 1
1 1478 . 43 1 1 A 126 126 PHE CB C 125 39.830 38.371 1.459 1
1 1483 . 43 1 1 A 126 126 PHE N N 125 120.013 118.432 1.581 1
1 1484 . 43 1 1 A 127 127 LEU H H 126 8.369 8.401 -0.032 1
1 1485 . 43 1 1 A 127 127 LEU HA H 126 3.972 3.988 -0.016 1
1 1495 . 43 1 1 A 127 127 LEU C C 126 180.621 178.687 1.934 1
1 1496 . 43 1 1 A 127 127 LEU CA C 126 57.944 57.937 0.007 1
1 1497 . 43 1 1 A 127 127 LEU CB C 126 40.543 41.328 -0.785 1
1 1501 . 43 1 1 A 127 127 LEU N N 126 119.692 119.778 -0.086 1
1 1502 . 43 1 1 A 128 128 ASP H H 127 8.578 8.172 0.406 1
1 1503 . 43 1 1 A 128 128 ASP HA H 127 4.308 4.316 -0.008 1
1 1506 . 43 1 1 A 128 128 ASP C C 127 178.254 177.970 0.284 1
1 1507 . 43 1 1 A 128 128 ASP CA C 127 56.964 57.297 -0.333 1
1 1508 . 43 1 1 A 128 128 ASP CB C 127 39.735 41.271 -1.536 1
1 1509 . 43 1 1 A 128 128 ASP N N 127 121.926 119.395 2.531 1
1 1510 . 43 1 1 A 129 129 TYR H H 128 7.710 8.118 -0.408 1
1 1511 . 43 1 1 A 129 129 TYR HA H 128 3.908 4.294 -0.386 1
1 1518 . 43 1 1 A 129 129 TYR C C 128 177.633 177.605 0.028 1
1 1519 . 43 1 1 A 129 129 TYR CA C 128 61.796 61.355 0.441 1
1 1520 . 43 1 1 A 129 129 TYR CB C 128 39.372 38.592 0.780 1
1 1525 . 43 1 1 A 129 129 TYR N N 128 122.548 120.347 2.201 1
1 1526 . 43 1 1 A 130 130 ARG H H 129 8.622 8.390 0.232 1
1 1527 . 43 1 1 A 130 130 ARG HA H 129 3.722 3.948 -0.226 1
1 1535 . 43 1 1 A 130 130 ARG CA C 129 60.084 59.673 0.411 1
1 1536 . 43 1 1 A 130 130 ARG CB C 129 29.902 29.898 0.004 1
1 1539 . 43 1 1 A 130 130 ARG N N 129 118.302 119.265 -0.963 1
1 1541 . 43 1 1 A 131 131 ALA H H 130 7.936 8.074 -0.138 1
1 1542 . 43 1 1 A 131 131 ALA HA H 130 3.997 3.996 0.001 1
1 1546 . 43 1 1 A 131 131 ALA C C 130 180.456 179.889 0.567 1
1 1547 . 43 1 1 A 131 131 ALA CA C 130 55.133 55.064 0.069 1
1 1548 . 43 1 1 A 131 131 ALA CB C 130 17.750 18.244 -0.494 1
1 1549 . 43 1 1 A 131 131 ALA N N 130 119.788 121.531 -1.743 1
1 1550 . 43 1 1 A 132 132 GLU H H 131 7.622 7.759 -0.137 1
1 1551 . 43 1 1 A 132 132 GLU HA H 131 3.862 4.000 -0.138 1
1 1556 . 43 1 1 A 132 132 GLU C C 131 179.528 178.100 1.428 1
1 1557 . 43 1 1 A 132 132 GLU CA C 131 58.849 58.724 0.125 1
1 1558 . 43 1 1 A 132 132 GLU CB C 131 28.930 29.050 -0.120 1
1 1560 . 43 1 1 A 132 132 GLU N N 131 118.428 117.800 0.628 1
1 1561 . 43 1 1 A 133 133 LYS H H 132 7.853 7.699 0.154 1
1 1562 . 43 1 1 A 133 133 LYS HA H 132 3.722 4.039 -0.317 1
1 1571 . 43 1 1 A 133 133 LYS C C 132 175.725 177.648 -1.923 1
1 1572 . 43 1 1 A 133 133 LYS CA C 132 57.544 58.535 -0.991 1
1 1573 . 43 1 1 A 133 133 LYS CB C 132 31.770 31.994 -0.224 1
1 1577 . 43 1 1 A 133 133 LYS N N 132 119.473 118.722 0.751 1
1 1578 . 43 1 1 A 134 134 GLU H H 133 8.151 7.925 0.226 1
1 1579 . 43 1 1 A 134 134 GLU HA H 133 4.161 4.453 -0.292 1
1 1584 . 43 1 1 A 134 134 GLU C C 133 177.453 177.661 -0.208 1
1 1585 . 43 1 1 A 134 134 GLU CA C 133 57.222 56.586 0.636 1
1 1586 . 43 1 1 A 134 134 GLU CB C 133 30.091 29.915 0.176 1
1 1588 . 43 1 1 A 134 134 GLU N N 133 116.525 118.093 -1.568 1
1 1589 . 43 1 1 A 135 135 GLY H H 134 7.702 7.890 -0.188 1
1 1590 . 43 1 1 A 135 135 GLY HA2 H 134 3.896 3.958 -0.062 1
1 1591 . 43 1 1 A 135 135 GLY HA3 H 134 3.897 3.968 -0.071 1
1 1592 . 43 1 1 A 135 135 GLY C C 134 174.538 174.228 0.310 1
1 1593 . 43 1 1 A 135 135 GLY CA C 134 45.975 45.760 0.215 1
1 1594 . 43 1 1 A 135 135 GLY N N 134 107.924 108.178 -0.254 1
1 1595 . 43 1 1 A 136 136 ARG H H 135 8.045 7.678 0.367 1
1 1596 . 43 1 1 A 136 136 ARG HA H 135 4.323 4.700 -0.377 1
1 1604 . 43 1 1 A 136 136 ARG C C 135 175.864 175.915 -0.051 1
1 1605 . 43 1 1 A 136 136 ARG CA C 135 56.016 54.809 1.207 1
1 1606 . 43 1 1 A 136 136 ARG CB C 135 30.987 31.933 -0.946 1
1 1609 . 43 1 1 A 136 136 ARG N N 135 119.708 120.042 -0.334 1
1 1 . 44 1 1 A 14 14 PHE CA C 13 58.199 56.371 1.828 1
1 2 . 44 1 1 A 14 14 PHE CB C 13 39.717 41.968 -2.251 1
1 3 . 44 1 1 A 15 15 SER H H 14 8.299 8.883 -0.584 1
1 4 . 44 1 1 A 15 15 SER HA H 14 4.359 4.938 -0.579 1
1 7 . 44 1 1 A 15 15 SER CA C 14 58.249 57.686 0.563 1
1 8 . 44 1 1 A 15 15 SER CB C 14 63.936 67.112 -3.176 1
1 9 . 44 1 1 A 15 15 SER N N 14 117.379 116.101 1.278 1
1 10 . 44 1 1 A 16 16 SER H H 15 8.255 8.916 -0.661 1
1 11 . 44 1 1 A 16 16 SER HA H 15 3.729 4.588 -0.859 1
1 14 . 44 1 1 A 16 16 SER CA C 15 58.224 59.304 -1.080 1
1 15 . 44 1 1 A 16 16 SER CB C 15 63.886 63.977 -0.091 1
1 16 . 44 1 1 A 16 16 SER N N 15 117.694 119.290 -1.596 1
1 17 . 44 1 1 A 17 17 ALA H H 16 8.333 7.988 0.345 1
1 18 . 44 1 1 A 17 17 ALA HA H 16 4.252 4.343 -0.091 1
1 22 . 44 1 1 A 17 17 ALA CA C 16 53.377 53.714 -0.337 1
1 23 . 44 1 1 A 17 17 ALA CB C 16 18.896 18.325 0.571 1
1 24 . 44 1 1 A 17 17 ALA N N 16 125.462 123.635 1.827 1
1 25 . 44 1 1 A 18 18 SER H H 17 8.219 8.020 0.199 1
1 26 . 44 1 1 A 18 18 SER HA H 17 4.332 4.147 0.185 1
1 29 . 44 1 1 A 18 18 SER CA C 17 59.105 62.272 -3.167 1
1 30 . 44 1 1 A 18 18 SER CB C 17 63.592 63.174 0.418 1
1 31 . 44 1 1 A 18 18 SER N N 17 114.821 115.600 -0.779 1
1 32 . 44 1 1 A 19 19 ASP H H 18 8.309 7.839 0.470 1
1 33 . 44 1 1 A 19 19 ASP HA H 18 4.554 4.906 -0.352 1
1 36 . 44 1 1 A 19 19 ASP C C 18 176.528 176.553 -0.025 1
1 37 . 44 1 1 A 19 19 ASP CA C 18 55.272 55.665 -0.393 1
1 38 . 44 1 1 A 19 19 ASP CB C 18 40.883 41.458 -0.575 1
1 39 . 44 1 1 A 19 19 ASP N N 18 123.367 116.338 7.029 1
1 40 . 44 1 1 A 20 20 ALA H H 19 8.133 8.555 -0.422 1
1 41 . 44 1 1 A 20 20 ALA HA H 19 4.170 4.164 0.006 1
1 45 . 44 1 1 A 20 20 ALA C C 19 179.857 179.202 0.655 1
1 46 . 44 1 1 A 20 20 ALA CA C 19 54.341 55.243 -0.902 1
1 47 . 44 1 1 A 20 20 ALA CB C 19 18.660 18.167 0.493 1
1 48 . 44 1 1 A 20 20 ALA N N 19 123.350 123.872 -0.522 1
1 49 . 44 1 1 A 21 21 GLU H H 20 8.140 8.232 -0.092 1
1 50 . 44 1 1 A 21 21 GLU HA H 20 4.128 4.070 0.058 1
1 55 . 44 1 1 A 21 21 GLU C C 20 177.675 178.556 -0.881 1
1 56 . 44 1 1 A 21 21 GLU CA C 20 58.520 59.529 -1.009 1
1 57 . 44 1 1 A 21 21 GLU CB C 20 29.765 29.616 0.149 1
1 59 . 44 1 1 A 21 21 GLU N N 20 119.063 119.463 -0.400 1
1 60 . 44 1 1 A 22 22 PHE H H 21 8.009 7.956 0.053 1
1 61 . 44 1 1 A 22 22 PHE HA H 21 4.123 4.267 -0.144 1
1 68 . 44 1 1 A 22 22 PHE C C 21 176.410 176.987 -0.577 1
1 69 . 44 1 1 A 22 22 PHE CA C 21 62.202 61.236 0.966 1
1 70 . 44 1 1 A 22 22 PHE CB C 21 39.223 39.079 0.144 1
1 75 . 44 1 1 A 22 22 PHE N N 21 121.211 120.958 0.253 1
1 76 . 44 1 1 A 23 23 ASP H H 22 8.261 7.979 0.282 1
1 77 . 44 1 1 A 23 23 ASP HA H 22 4.041 4.353 -0.312 1
1 80 . 44 1 1 A 23 23 ASP C C 22 179.078 178.691 0.387 1
1 81 . 44 1 1 A 23 23 ASP CA C 22 57.048 57.320 -0.272 1
1 82 . 44 1 1 A 23 23 ASP CB C 22 40.154 40.062 0.092 1
1 83 . 44 1 1 A 23 23 ASP N N 22 116.876 118.825 -1.949 1
1 84 . 44 1 1 A 24 24 ALA H H 23 7.651 7.559 0.092 1
1 85 . 44 1 1 A 24 24 ALA HA H 23 3.785 3.888 -0.103 1
1 89 . 44 1 1 A 24 24 ALA C C 23 179.577 179.738 -0.161 1
1 90 . 44 1 1 A 24 24 ALA CA C 23 54.341 55.120 -0.779 1
1 91 . 44 1 1 A 24 24 ALA CB C 23 17.762 18.329 -0.567 1
1 92 . 44 1 1 A 24 24 ALA N N 23 121.873 121.810 0.063 1
1 93 . 44 1 1 A 25 25 VAL H H 24 7.718 7.704 0.014 1
1 94 . 44 1 1 A 25 25 VAL HA H 24 3.216 3.613 -0.397 1
1 102 . 44 1 1 A 25 25 VAL C C 24 177.805 178.331 -0.526 1
1 103 . 44 1 1 A 25 25 VAL CA C 24 66.789 66.796 -0.007 1
1 104 . 44 1 1 A 25 25 VAL CB C 24 31.277 31.338 -0.061 1
1 107 . 44 1 1 A 25 25 VAL N N 24 117.890 118.461 -0.571 1
1 108 . 44 1 1 A 26 26 VAL H H 25 7.867 7.756 0.111 1
1 109 . 44 1 1 A 26 26 VAL HA H 25 3.274 3.560 -0.286 1
1 117 . 44 1 1 A 26 26 VAL C C 25 177.788 177.734 0.054 1
1 118 . 44 1 1 A 26 26 VAL CA C 25 67.282 66.201 1.081 1
1 119 . 44 1 1 A 26 26 VAL CB C 25 31.266 31.346 -0.080 1
1 122 . 44 1 1 A 26 26 VAL N N 25 118.170 120.300 -2.130 1
1 123 . 44 1 1 A 27 27 GLY H H 26 7.544 7.697 -0.153 1
1 124 . 44 1 1 A 27 27 GLY HA2 H 26 3.592 3.449 0.143 1
1 125 . 44 1 1 A 27 27 GLY HA3 H 26 3.721 3.582 0.139 1
1 126 . 44 1 1 A 27 27 GLY C C 26 176.717 176.197 0.520 1
1 127 . 44 1 1 A 27 27 GLY CA C 26 47.085 47.173 -0.088 1
1 128 . 44 1 1 A 27 27 GLY N N 26 105.795 107.598 -1.803 1
1 129 . 44 1 1 A 28 28 TYR H H 27 7.625 7.296 0.329 1
1 130 . 44 1 1 A 28 28 TYR HA H 27 4.546 4.554 -0.008 1
1 137 . 44 1 1 A 28 28 TYR C C 27 178.991 178.436 0.555 1
1 138 . 44 1 1 A 28 28 TYR CA C 27 58.845 59.865 -1.020 1
1 139 . 44 1 1 A 28 28 TYR CB C 27 37.602 37.666 -0.064 1
1 144 . 44 1 1 A 28 28 TYR N N 27 119.933 121.641 -1.708 1
1 145 . 44 1 1 A 29 29 LEU H H 28 8.517 7.938 0.579 1
1 146 . 44 1 1 A 29 29 LEU HA H 28 3.728 3.803 -0.075 1
1 156 . 44 1 1 A 29 29 LEU CA C 28 58.281 57.971 0.310 1
1 157 . 44 1 1 A 29 29 LEU CB C 28 41.948 41.462 0.486 1
1 161 . 44 1 1 A 29 29 LEU N N 28 119.669 120.772 -1.103 1
1 162 . 44 1 1 A 30 30 GLU H H 29 8.072 8.044 0.028 1
1 163 . 44 1 1 A 30 30 GLU HA H 29 3.722 3.866 -0.144 1
1 168 . 44 1 1 A 30 30 GLU C C 29 177.731 179.396 -1.665 1
1 169 . 44 1 1 A 30 30 GLU CA C 29 59.763 59.908 -0.145 1
1 170 . 44 1 1 A 30 30 GLU CB C 29 28.844 29.337 -0.493 1
1 172 . 44 1 1 A 30 30 GLU N N 29 117.666 117.676 -0.010 1
1 173 . 44 1 1 A 31 31 ASP H H 30 7.243 7.833 -0.590 1
1 174 . 44 1 1 A 31 31 ASP HA H 30 4.297 4.387 -0.090 1
1 177 . 44 1 1 A 31 31 ASP CA C 30 56.953 57.356 -0.403 1
1 178 . 44 1 1 A 31 31 ASP CB C 30 40.730 40.475 0.255 1
1 179 . 44 1 1 A 31 31 ASP N N 30 116.720 119.316 -2.596 1
1 180 . 44 1 1 A 32 32 ILE H H 31 7.940 7.477 0.463 1
1 181 . 44 1 1 A 32 32 ILE HA H 31 3.640 3.698 -0.058 1
1 191 . 44 1 1 A 32 32 ILE C C 31 177.980 178.106 -0.126 1
1 192 . 44 1 1 A 32 32 ILE CA C 31 64.692 64.261 0.431 1
1 193 . 44 1 1 A 32 32 ILE CB C 31 38.938 37.819 1.119 1
1 197 . 44 1 1 A 32 32 ILE N N 31 119.728 120.075 -0.347 1
1 198 . 44 1 1 A 33 33 ILE H H 32 7.984 7.921 0.063 1
1 199 . 44 1 1 A 33 33 ILE HA H 32 3.598 3.011 0.587 1
1 209 . 44 1 1 A 33 33 ILE C C 32 176.723 176.908 -0.185 1
1 210 . 44 1 1 A 33 33 ILE CA C 32 63.241 64.581 -1.340 1
1 211 . 44 1 1 A 33 33 ILE CB C 32 37.580 37.682 -0.102 1
1 215 . 44 1 1 A 33 33 ILE N N 32 113.919 120.256 -6.337 1
1 216 . 44 1 1 A 34 34 MET H H 33 7.288 7.773 -0.485 1
1 217 . 44 1 1 A 34 34 MET HA H 33 4.496 4.666 -0.170 1
1 225 . 44 1 1 A 34 34 MET C C 33 176.423 175.772 0.651 1
1 226 . 44 1 1 A 34 34 MET CA C 33 54.634 54.252 0.382 1
1 227 . 44 1 1 A 34 34 MET CB C 33 31.934 31.522 0.412 1
1 230 . 44 1 1 A 34 34 MET N N 33 115.130 116.913 -1.783 1
1 231 . 44 1 1 A 35 35 ASP H H 34 7.405 7.782 -0.377 1
1 232 . 44 1 1 A 35 35 ASP HA H 34 4.484 4.625 -0.141 1
1 235 . 44 1 1 A 35 35 ASP C C 34 177.139 176.613 0.526 1
1 236 . 44 1 1 A 35 35 ASP CA C 34 54.625 54.561 0.064 1
1 237 . 44 1 1 A 35 35 ASP CB C 34 43.554 42.795 0.759 1
1 238 . 44 1 1 A 35 35 ASP N N 34 121.814 122.401 -0.587 1
1 239 . 44 1 1 A 36 36 ASP H H 35 8.765 8.821 -0.056 1
1 240 . 44 1 1 A 36 36 ASP HA H 35 4.235 4.328 -0.093 1
1 243 . 44 1 1 A 36 36 ASP C C 35 178.320 178.439 -0.119 1
1 244 . 44 1 1 A 36 36 ASP CA C 35 57.832 57.854 -0.022 1
1 245 . 44 1 1 A 36 36 ASP CB C 35 40.914 40.610 0.304 1
1 246 . 44 1 1 A 36 36 ASP N N 35 125.883 125.316 0.567 1
1 247 . 44 1 1 A 37 37 GLU H H 36 8.905 8.199 0.706 1
1 248 . 44 1 1 A 37 37 GLU HA H 36 3.933 4.137 -0.204 1
1 253 . 44 1 1 A 37 37 GLU C C 36 179.304 179.119 0.185 1
1 254 . 44 1 1 A 37 37 GLU CA C 36 59.828 59.254 0.574 1
1 255 . 44 1 1 A 37 37 GLU CB C 36 29.380 29.247 0.133 1
1 257 . 44 1 1 A 37 37 GLU N N 36 119.077 120.015 -0.938 1
1 258 . 44 1 1 A 38 38 PHE H H 37 7.460 8.237 -0.777 1
1 259 . 44 1 1 A 38 38 PHE HA H 37 3.642 4.054 -0.412 1
1 267 . 44 1 1 A 38 38 PHE C C 37 176.483 177.800 -1.317 1
1 268 . 44 1 1 A 38 38 PHE CA C 37 61.411 61.053 0.358 1
1 269 . 44 1 1 A 38 38 PHE CB C 37 39.355 39.136 0.219 1
1 275 . 44 1 1 A 38 38 PHE N N 37 119.968 120.759 -0.791 1
1 276 . 44 1 1 A 39 39 GLN H H 38 7.968 8.083 -0.115 1
1 277 . 44 1 1 A 39 39 GLN HA H 38 3.712 3.880 -0.168 1
1 284 . 44 1 1 A 39 39 GLN CA C 38 59.153 58.628 0.525 1
1 285 . 44 1 1 A 39 39 GLN CB C 38 28.213 28.298 -0.085 1
1 287 . 44 1 1 A 39 39 GLN N N 38 116.433 118.469 -2.036 1
1 289 . 44 1 1 A 40 40 LEU H H 39 7.930 7.693 0.237 1
1 290 . 44 1 1 A 40 40 LEU HA H 39 3.916 4.025 -0.109 1
1 300 . 44 1 1 A 40 40 LEU C C 39 177.731 178.002 -0.271 1
1 301 . 44 1 1 A 40 40 LEU CA C 39 57.915 57.977 -0.062 1
1 302 . 44 1 1 A 40 40 LEU CB C 39 41.989 41.620 0.369 1
1 306 . 44 1 1 A 40 40 LEU N N 39 119.505 121.628 -2.123 1
1 307 . 44 1 1 A 41 41 LEU H H 40 7.174 7.924 -0.750 1
1 308 . 44 1 1 A 41 41 LEU HA H 40 3.835 4.035 -0.200 1
1 318 . 44 1 1 A 41 41 LEU C C 40 179.738 178.371 1.367 1
1 319 . 44 1 1 A 41 41 LEU CA C 40 58.266 58.234 0.032 1
1 320 . 44 1 1 A 41 41 LEU CB C 40 42.050 41.614 0.436 1
1 324 . 44 1 1 A 41 41 LEU N N 40 120.971 119.719 1.252 1
1 325 . 44 1 1 A 42 42 GLN H H 41 8.058 7.897 0.161 1
1 326 . 44 1 1 A 42 42 GLN HA H 41 3.556 3.708 -0.152 1
1 333 . 44 1 1 A 42 42 GLN C C 41 177.642 178.541 -0.899 1
1 334 . 44 1 1 A 42 42 GLN CA C 41 59.826 59.260 0.566 1
1 335 . 44 1 1 A 42 42 GLN CB C 41 28.762 28.184 0.578 1
1 337 . 44 1 1 A 42 42 GLN N N 41 117.899 117.981 -0.082 1
1 339 . 44 1 1 A 43 43 ARG H H 42 8.179 7.854 0.325 1
1 340 . 44 1 1 A 43 43 ARG HA H 42 3.655 3.970 -0.315 1
1 347 . 44 1 1 A 43 43 ARG C C 42 178.051 178.319 -0.268 1
1 348 . 44 1 1 A 43 43 ARG CA C 42 59.766 58.720 1.046 1
1 349 . 44 1 1 A 43 43 ARG CB C 42 29.941 29.980 -0.039 1
1 352 . 44 1 1 A 43 43 ARG N N 42 119.392 119.675 -0.283 1
1 353 . 44 1 1 A 44 44 ASN H H 43 8.525 7.905 0.620 1
1 354 . 44 1 1 A 44 44 ASN HA H 43 4.332 4.374 -0.042 1
1 359 . 44 1 1 A 44 44 ASN C C 43 178.150 177.820 0.330 1
1 360 . 44 1 1 A 44 44 ASN CA C 43 55.841 56.200 -0.359 1
1 361 . 44 1 1 A 44 44 ASN CB C 43 37.632 39.252 -1.620 1
1 362 . 44 1 1 A 44 44 ASN N N 43 116.214 117.624 -1.410 1
1 364 . 44 1 1 A 45 45 PHE H H 44 7.586 7.900 -0.314 1
1 365 . 44 1 1 A 45 45 PHE HA H 44 4.132 4.272 -0.140 1
1 372 . 44 1 1 A 45 45 PHE C C 44 176.691 178.602 -1.911 1
1 373 . 44 1 1 A 45 45 PHE CA C 44 62.333 60.553 1.780 1
1 374 . 44 1 1 A 45 45 PHE CB C 44 39.449 38.895 0.554 1
1 379 . 44 1 1 A 45 45 PHE N N 44 121.501 117.512 3.989 1
1 380 . 44 1 1 A 46 46 MET H H 45 8.190 8.336 -0.146 1
1 381 . 44 1 1 A 46 46 MET HA H 45 4.060 4.241 -0.181 1
1 389 . 44 1 1 A 46 46 MET C C 45 179.754 178.029 1.725 1
1 390 . 44 1 1 A 46 46 MET CA C 45 57.742 57.955 -0.213 1
1 391 . 44 1 1 A 46 46 MET CB C 45 29.912 31.205 -1.293 1
1 394 . 44 1 1 A 46 46 MET N N 45 116.727 117.899 -1.172 1
1 395 . 44 1 1 A 47 47 ASP H H 46 8.579 8.186 0.393 1
1 396 . 44 1 1 A 47 47 ASP HA H 46 4.804 4.465 0.339 1
1 399 . 44 1 1 A 47 47 ASP C C 46 177.854 177.632 0.222 1
1 400 . 44 1 1 A 47 47 ASP CA C 46 57.277 57.166 0.111 1
1 401 . 44 1 1 A 47 47 ASP CB C 46 40.776 41.860 -1.084 1
1 402 . 44 1 1 A 47 47 ASP N N 46 117.798 120.669 -2.871 1
1 403 . 44 1 1 A 48 48 LYS H H 47 7.339 8.059 -0.720 1
1 404 . 44 1 1 A 48 48 LYS HA H 47 3.828 4.511 -0.683 1
1 413 . 44 1 1 A 48 48 LYS C C 47 178.812 178.518 0.294 1
1 414 . 44 1 1 A 48 48 LYS CA C 47 58.953 57.477 1.476 1
1 415 . 44 1 1 A 48 48 LYS CB C 47 32.796 33.790 -0.994 1
1 419 . 44 1 1 A 48 48 LYS N N 47 117.852 117.510 0.342 1
1 420 . 44 1 1 A 49 49 TYR H H 48 6.841 8.614 -1.773 1
1 421 . 44 1 1 A 49 49 TYR HA H 48 4.995 4.287 0.708 1
1 428 . 44 1 1 A 49 49 TYR C C 48 178.138 178.301 -0.163 1
1 429 . 44 1 1 A 49 49 TYR CA C 48 58.620 59.969 -1.349 1
1 430 . 44 1 1 A 49 49 TYR CB C 48 42.939 38.084 4.855 1
1 435 . 44 1 1 A 49 49 TYR N N 48 112.109 119.165 -7.056 1
1 436 . 44 1 1 A 50 50 TYR H H 49 8.491 8.315 0.176 1
1 437 . 44 1 1 A 50 50 TYR HA H 49 4.598 4.262 0.336 1
1 444 . 44 1 1 A 50 50 TYR C C 49 176.015 176.895 -0.880 1
1 445 . 44 1 1 A 50 50 TYR CA C 49 62.442 59.891 2.551 1
1 446 . 44 1 1 A 50 50 TYR CB C 49 36.588 37.501 -0.913 1
1 451 . 44 1 1 A 50 50 TYR N N 49 118.294 119.751 -1.457 1
1 452 . 44 1 1 A 51 51 LEU H H 50 7.512 7.586 -0.074 1
1 453 . 44 1 1 A 51 51 LEU HA H 50 3.878 3.537 0.341 1
1 463 . 44 1 1 A 51 51 LEU C C 50 178.625 178.112 0.513 1
1 464 . 44 1 1 A 51 51 LEU CA C 50 55.994 57.334 -1.340 1
1 465 . 44 1 1 A 51 51 LEU CB C 50 40.743 41.347 -0.604 1
1 469 . 44 1 1 A 51 51 LEU N N 50 118.478 119.330 -0.852 1
1 470 . 44 1 1 A 52 52 GLU H H 51 8.042 7.925 0.117 1
1 471 . 44 1 1 A 52 52 GLU HA H 51 4.197 3.813 0.384 1
1 476 . 44 1 1 A 52 52 GLU C C 51 177.629 177.613 0.016 1
1 477 . 44 1 1 A 52 52 GLU CA C 51 56.141 59.509 -3.368 1
1 478 . 44 1 1 A 52 52 GLU CB C 51 29.162 28.925 0.237 1
1 480 . 44 1 1 A 52 52 GLU N N 51 115.067 118.434 -3.367 1
1 481 . 44 1 1 A 53 53 PHE H H 52 7.465 8.005 -0.540 1
1 482 . 44 1 1 A 53 53 PHE HA H 52 4.431 4.722 -0.291 1
1 490 . 44 1 1 A 53 53 PHE C C 52 174.325 175.299 -0.974 1
1 491 . 44 1 1 A 53 53 PHE CA C 52 58.986 57.268 1.718 1
1 492 . 44 1 1 A 53 53 PHE CB C 52 40.183 37.668 2.515 1
1 498 . 44 1 1 A 53 53 PHE N N 52 116.768 119.013 -2.245 1
1 499 . 44 1 1 A 54 54 GLU H H 53 7.484 8.332 -0.848 1
1 500 . 44 1 1 A 54 54 GLU HA H 53 4.583 4.448 0.135 1
1 505 . 44 1 1 A 54 54 GLU C C 53 175.722 177.608 -1.886 1
1 506 . 44 1 1 A 54 54 GLU CA C 53 54.248 56.336 -2.088 1
1 507 . 44 1 1 A 54 54 GLU CB C 53 34.409 31.379 3.030 1
1 509 . 44 1 1 A 54 54 GLU N N 53 118.844 125.458 -6.614 1
1 510 . 44 1 1 A 55 55 ASP H H 54 9.008 8.977 0.031 1
1 511 . 44 1 1 A 55 55 ASP HA H 54 4.735 4.502 0.233 1
1 514 . 44 1 1 A 55 55 ASP C C 54 175.421 176.522 -1.101 1
1 515 . 44 1 1 A 55 55 ASP CA C 54 52.888 55.569 -2.681 1
1 516 . 44 1 1 A 55 55 ASP CB C 54 38.894 40.170 -1.276 1
1 517 . 44 1 1 A 55 55 ASP N N 54 123.654 124.190 -0.536 1
1 518 . 44 1 1 A 56 56 THR H H 55 7.819 7.567 0.252 1
1 519 . 44 1 1 A 56 56 THR HA H 55 4.574 4.240 0.334 1
1 524 . 44 1 1 A 56 56 THR C C 55 174.096 174.781 -0.685 1
1 525 . 44 1 1 A 56 56 THR CA C 55 59.172 61.916 -2.744 1
1 526 . 44 1 1 A 56 56 THR CB C 55 71.889 70.118 1.771 1
1 528 . 44 1 1 A 56 56 THR N N 55 112.015 113.235 -1.220 1
1 529 . 44 1 1 A 57 57 GLU H H 56 8.527 9.022 -0.495 1
1 530 . 44 1 1 A 57 57 GLU HA H 56 4.217 4.388 -0.171 1
1 535 . 44 1 1 A 57 57 GLU C C 56 177.042 176.362 0.680 1
1 536 . 44 1 1 A 57 57 GLU CA C 56 56.869 57.368 -0.499 1
1 537 . 44 1 1 A 57 57 GLU CB C 56 29.731 29.789 -0.058 1
1 539 . 44 1 1 A 57 57 GLU N N 56 117.531 121.806 -4.275 1
1 540 . 44 1 1 A 58 58 GLU H H 57 7.587 7.802 -0.215 1
1 541 . 44 1 1 A 58 58 GLU HA H 57 3.941 4.451 -0.510 1
1 546 . 44 1 1 A 58 58 GLU C C 57 176.849 175.614 1.235 1
1 547 . 44 1 1 A 58 58 GLU CA C 57 56.924 56.335 0.589 1
1 548 . 44 1 1 A 58 58 GLU CB C 57 30.251 30.430 -0.179 1
1 550 . 44 1 1 A 58 58 GLU N N 57 119.183 121.923 -2.740 1
1 551 . 44 1 1 A 59 59 ASN H H 58 9.120 8.892 0.228 1
1 552 . 44 1 1 A 59 59 ASN HA H 58 4.922 4.859 0.063 1
1 557 . 44 1 1 A 59 59 ASN C C 58 174.254 175.227 -0.973 1
1 558 . 44 1 1 A 59 59 ASN CA C 58 51.956 52.600 -0.644 1
1 559 . 44 1 1 A 59 59 ASN CB C 58 37.404 39.451 -2.047 1
1 560 . 44 1 1 A 59 59 ASN N N 58 126.767 125.801 0.966 1
1 562 . 44 1 1 A 60 60 LYS H H 59 5.892 9.363 -3.471 1
1 563 . 44 1 1 A 60 60 LYS HA H 59 3.798 4.675 -0.877 1
1 572 . 44 1 1 A 60 60 LYS C C 59 177.908 178.372 -0.464 1
1 573 . 44 1 1 A 60 60 LYS CA C 59 56.623 55.094 1.529 1
1 574 . 44 1 1 A 60 60 LYS CB C 59 32.279 34.469 -2.190 1
1 578 . 44 1 1 A 60 60 LYS N N 59 121.527 122.843 -1.316 1
1 579 . 44 1 1 A 61 61 LEU H H 60 8.473 8.966 -0.493 1
1 580 . 44 1 1 A 61 61 LEU HA H 60 3.891 4.195 -0.304 1
1 590 . 44 1 1 A 61 61 LEU C C 60 179.843 178.242 1.601 1
1 591 . 44 1 1 A 61 61 LEU CA C 60 58.301 57.297 1.004 1
1 592 . 44 1 1 A 61 61 LEU CB C 60 41.305 41.706 -0.401 1
1 596 . 44 1 1 A 61 61 LEU N N 60 125.639 125.545 0.094 1
1 597 . 44 1 1 A 62 62 ILE H H 61 7.698 8.013 -0.315 1
1 598 . 44 1 1 A 62 62 ILE HA H 61 3.952 3.859 0.093 1
1 608 . 44 1 1 A 62 62 ILE C C 61 175.392 177.160 -1.768 1
1 609 . 44 1 1 A 62 62 ILE CA C 61 61.743 63.508 -1.765 1
1 610 . 44 1 1 A 62 62 ILE CB C 61 39.108 37.782 1.326 1
1 614 . 44 1 1 A 62 62 ILE N N 61 114.111 118.813 -4.702 1
1 615 . 44 1 1 A 63 63 TYR H H 62 7.273 7.885 -0.612 1
1 616 . 44 1 1 A 63 63 TYR HA H 62 4.343 4.202 0.141 1
1 623 . 44 1 1 A 63 63 TYR C C 62 178.264 178.576 -0.312 1
1 624 . 44 1 1 A 63 63 TYR CA C 62 57.231 61.099 -3.868 1
1 625 . 44 1 1 A 63 63 TYR CB C 62 36.332 37.349 -1.017 1
1 630 . 44 1 1 A 63 63 TYR N N 62 117.689 121.278 -3.589 1
1 631 . 44 1 1 A 64 64 THR H H 63 7.747 8.028 -0.281 1
1 632 . 44 1 1 A 64 64 THR HA H 63 4.266 4.239 0.027 1
1 637 . 44 1 1 A 64 64 THR CA C 63 69.362 67.574 1.788 1
1 638 . 44 1 1 A 64 64 THR CB C 63 66.962 67.490 -0.528 1
1 640 . 44 1 1 A 64 64 THR N N 63 113.755 116.287 -2.532 1
1 641 . 44 1 1 A 65 65 PRO HA H 64 4.372 4.378 -0.006 1
1 648 . 44 1 1 A 65 65 PRO C C 64 179.913 179.362 0.551 1
1 649 . 44 1 1 A 65 65 PRO CA C 64 66.011 66.001 0.010 1
1 650 . 44 1 1 A 65 65 PRO CB C 64 30.642 30.716 -0.074 1
1 653 . 44 1 1 A 66 66 ILE H H 65 7.377 7.303 0.074 1
1 654 . 44 1 1 A 66 66 ILE HA H 65 3.530 3.888 -0.358 1
1 664 . 44 1 1 A 66 66 ILE C C 65 177.543 178.282 -0.739 1
1 665 . 44 1 1 A 66 66 ILE CA C 65 66.647 64.296 2.351 1
1 666 . 44 1 1 A 66 66 ILE CB C 65 38.029 37.609 0.420 1
1 670 . 44 1 1 A 66 66 ILE N N 65 118.353 116.660 1.693 1
1 671 . 44 1 1 A 67 67 PHE H H 66 8.480 8.468 0.012 1
1 672 . 44 1 1 A 67 67 PHE HA H 66 4.115 4.432 -0.317 1
1 680 . 44 1 1 A 67 67 PHE C C 66 177.293 177.947 -0.654 1
1 681 . 44 1 1 A 67 67 PHE CA C 66 59.570 62.241 -2.671 1
1 682 . 44 1 1 A 67 67 PHE CB C 66 38.865 39.654 -0.789 1
1 688 . 44 1 1 A 67 67 PHE N N 66 122.420 120.502 1.918 1
1 689 . 44 1 1 A 68 68 ASN H H 67 8.595 8.124 0.471 1
1 690 . 44 1 1 A 68 68 ASN HA H 67 4.211 4.329 -0.118 1
1 695 . 44 1 1 A 68 68 ASN C C 67 178.697 177.989 0.708 1
1 696 . 44 1 1 A 68 68 ASN CA C 67 56.056 56.158 -0.102 1
1 697 . 44 1 1 A 68 68 ASN CB C 67 37.704 38.045 -0.341 1
1 698 . 44 1 1 A 68 68 ASN N N 67 115.573 117.485 -1.912 1
1 700 . 44 1 1 A 69 69 GLU H H 68 8.414 8.043 0.371 1
1 701 . 44 1 1 A 69 69 GLU HA H 68 4.102 4.183 -0.081 1
1 706 . 44 1 1 A 69 69 GLU C C 68 177.880 178.820 -0.940 1
1 707 . 44 1 1 A 69 69 GLU CA C 68 59.399 59.349 0.050 1
1 708 . 44 1 1 A 69 69 GLU CB C 68 29.855 29.457 0.398 1
1 710 . 44 1 1 A 69 69 GLU N N 68 123.510 119.977 3.533 1
1 711 . 44 1 1 A 70 70 TYR H H 69 8.659 8.044 0.615 1
1 712 . 44 1 1 A 70 70 TYR HA H 69 3.362 4.098 -0.736 1
1 719 . 44 1 1 A 70 70 TYR C C 69 178.143 176.980 1.163 1
1 720 . 44 1 1 A 70 70 TYR CA C 69 60.686 61.144 -0.458 1
1 721 . 44 1 1 A 70 70 TYR CB C 69 38.560 38.828 -0.268 1
1 726 . 44 1 1 A 70 70 TYR N N 69 122.130 120.789 1.341 1
1 727 . 44 1 1 A 71 71 ILE H H 70 8.031 7.911 0.120 1
1 728 . 44 1 1 A 71 71 ILE HA H 70 3.265 3.728 -0.463 1
1 738 . 44 1 1 A 71 71 ILE C C 70 178.056 178.009 0.047 1
1 739 . 44 1 1 A 71 71 ILE CA C 70 63.756 63.947 -0.191 1
1 740 . 44 1 1 A 71 71 ILE CB C 70 37.321 36.560 0.761 1
1 744 . 44 1 1 A 71 71 ILE N N 70 118.906 120.322 -1.416 1
1 745 . 44 1 1 A 72 72 SER H H 71 7.803 7.971 -0.168 1
1 746 . 44 1 1 A 72 72 SER HA H 71 4.029 4.331 -0.302 1
1 749 . 44 1 1 A 72 72 SER CA C 71 61.380 61.560 -0.180 1
1 750 . 44 1 1 A 72 72 SER CB C 71 63.288 63.120 0.168 1
1 751 . 44 1 1 A 72 72 SER N N 71 113.735 118.669 -4.934 1
1 752 . 44 1 1 A 73 73 LEU H H 72 7.952 8.031 -0.079 1
1 753 . 44 1 1 A 73 73 LEU HA H 72 4.418 4.146 0.272 1
1 763 . 44 1 1 A 73 73 LEU C C 72 177.767 178.343 -0.576 1
1 764 . 44 1 1 A 73 73 LEU CA C 72 56.543 57.432 -0.889 1
1 765 . 44 1 1 A 73 73 LEU CB C 72 44.517 41.771 2.746 1
1 769 . 44 1 1 A 73 73 LEU N N 72 119.411 122.035 -2.624 1
1 770 . 44 1 1 A 74 74 VAL H H 73 8.021 7.438 0.583 1
1 771 . 44 1 1 A 74 74 VAL HA H 73 3.532 3.302 0.230 1
1 779 . 44 1 1 A 74 74 VAL C C 73 177.126 178.087 -0.961 1
1 780 . 44 1 1 A 74 74 VAL CA C 73 66.250 66.521 -0.271 1
1 781 . 44 1 1 A 74 74 VAL CB C 73 31.212 31.027 0.185 1
1 784 . 44 1 1 A 74 74 VAL N N 73 118.747 119.239 -0.492 1
1 785 . 44 1 1 A 75 75 GLU H H 74 7.232 7.991 -0.759 1
1 786 . 44 1 1 A 75 75 GLU HA H 74 3.013 4.232 -1.219 1
1 791 . 44 1 1 A 75 75 GLU C C 74 178.804 179.501 -0.697 1
1 792 . 44 1 1 A 75 75 GLU CA C 74 60.536 59.940 0.596 1
1 793 . 44 1 1 A 75 75 GLU CB C 74 27.009 29.037 -2.028 1
1 795 . 44 1 1 A 75 75 GLU N N 74 118.660 119.756 -1.096 1
1 796 . 44 1 1 A 76 76 LYS H H 75 7.051 8.136 -1.085 1
1 797 . 44 1 1 A 76 76 LYS HA H 75 3.765 4.132 -0.367 1
1 806 . 44 1 1 A 76 76 LYS C C 75 177.765 178.041 -0.276 1
1 807 . 44 1 1 A 76 76 LYS CA C 75 58.357 58.249 0.108 1
1 808 . 44 1 1 A 76 76 LYS CB C 75 31.939 32.078 -0.139 1
1 812 . 44 1 1 A 76 76 LYS N N 75 116.112 119.297 -3.185 1
1 813 . 44 1 1 A 77 77 TYR H H 76 7.067 8.012 -0.945 1
1 814 . 44 1 1 A 77 77 TYR HA H 76 4.036 4.178 -0.142 1
1 821 . 44 1 1 A 77 77 TYR C C 76 177.752 177.054 0.698 1
1 822 . 44 1 1 A 77 77 TYR CA C 76 61.820 61.345 0.475 1
1 823 . 44 1 1 A 77 77 TYR CB C 76 38.480 38.776 -0.296 1
1 828 . 44 1 1 A 77 77 TYR N N 76 118.434 122.338 -3.904 1
1 829 . 44 1 1 A 78 78 ILE H H 77 7.554 8.423 -0.869 1
1 830 . 44 1 1 A 78 78 ILE HA H 77 3.159 3.537 -0.378 1
1 840 . 44 1 1 A 78 78 ILE C C 77 177.341 177.685 -0.344 1
1 841 . 44 1 1 A 78 78 ILE CA C 77 65.177 65.139 0.038 1
1 842 . 44 1 1 A 78 78 ILE CB C 77 37.339 37.552 -0.213 1
1 846 . 44 1 1 A 78 78 ILE N N 77 117.672 121.569 -3.897 1
1 847 . 44 1 1 A 79 79 GLU H H 78 8.296 8.136 0.160 1
1 848 . 44 1 1 A 79 79 GLU HA H 78 3.557 3.765 -0.208 1
1 853 . 44 1 1 A 79 79 GLU C C 78 177.742 178.928 -1.186 1
1 854 . 44 1 1 A 79 79 GLU CA C 78 60.847 60.084 0.763 1
1 855 . 44 1 1 A 79 79 GLU CB C 78 29.594 29.215 0.379 1
1 857 . 44 1 1 A 79 79 GLU N N 78 118.701 120.929 -2.228 1
1 858 . 44 1 1 A 80 80 GLU H H 79 8.330 8.316 0.014 1
1 859 . 44 1 1 A 80 80 GLU HA H 79 3.774 4.013 -0.239 1
1 864 . 44 1 1 A 80 80 GLU C C 79 179.926 179.252 0.674 1
1 865 . 44 1 1 A 80 80 GLU CA C 79 59.581 58.968 0.613 1
1 866 . 44 1 1 A 80 80 GLU CB C 79 29.062 29.337 -0.275 1
1 868 . 44 1 1 A 80 80 GLU N N 79 116.767 117.966 -1.199 1
1 869 . 44 1 1 A 81 81 GLN H H 80 7.634 7.656 -0.022 1
1 870 . 44 1 1 A 81 81 GLN HA H 80 3.605 3.865 -0.260 1
1 877 . 44 1 1 A 81 81 GLN C C 80 179.681 178.530 1.151 1
1 878 . 44 1 1 A 81 81 GLN CA C 80 57.765 58.502 -0.737 1
1 879 . 44 1 1 A 81 81 GLN CB C 80 28.079 28.103 -0.024 1
1 881 . 44 1 1 A 81 81 GLN N N 80 116.325 118.647 -2.322 1
1 883 . 44 1 1 A 82 82 LEU H H 81 8.156 7.536 0.620 1
1 884 . 44 1 1 A 82 82 LEU HA H 81 3.536 3.776 -0.240 1
1 894 . 44 1 1 A 82 82 LEU C C 81 178.945 179.390 -0.445 1
1 895 . 44 1 1 A 82 82 LEU CA C 81 57.761 56.797 0.964 1
1 896 . 44 1 1 A 82 82 LEU CB C 81 40.961 40.862 0.099 1
1 900 . 44 1 1 A 82 82 LEU N N 81 121.546 120.171 1.375 1
1 901 . 44 1 1 A 83 83 LEU H H 82 8.326 8.000 0.326 1
1 902 . 44 1 1 A 83 83 LEU HA H 82 4.198 4.296 -0.098 1
1 912 . 44 1 1 A 83 83 LEU C C 82 178.631 179.268 -0.637 1
1 913 . 44 1 1 A 83 83 LEU CA C 82 57.016 57.058 -0.042 1
1 914 . 44 1 1 A 83 83 LEU CB C 82 42.182 40.675 1.507 1
1 918 . 44 1 1 A 83 83 LEU N N 82 120.426 119.237 1.189 1
1 919 . 44 1 1 A 84 84 GLN H H 83 6.992 7.617 -0.625 1
1 920 . 44 1 1 A 84 84 GLN HA H 83 3.877 3.974 -0.097 1
1 927 . 44 1 1 A 84 84 GLN C C 83 177.008 176.939 0.069 1
1 928 . 44 1 1 A 84 84 GLN CA C 83 57.543 58.757 -1.214 1
1 929 . 44 1 1 A 84 84 GLN CB C 83 28.688 28.597 0.091 1
1 931 . 44 1 1 A 84 84 GLN N N 83 114.001 117.350 -3.349 1
1 933 . 44 1 1 A 85 85 ARG H H 84 7.072 7.388 -0.316 1
1 934 . 44 1 1 A 85 85 ARG HA H 84 4.047 4.350 -0.303 1
1 942 . 44 1 1 A 85 85 ARG C C 84 175.999 175.480 0.519 1
1 943 . 44 1 1 A 85 85 ARG CA C 84 56.764 55.923 0.841 1
1 944 . 44 1 1 A 85 85 ARG CB C 84 32.044 32.515 -0.471 1
1 947 . 44 1 1 A 85 85 ARG N N 84 115.827 116.473 -0.646 1
1 949 . 44 1 1 A 86 86 ILE H H 85 8.238 7.677 0.561 1
1 950 . 44 1 1 A 86 86 ILE HA H 85 4.389 4.482 -0.093 1
1 960 . 44 1 1 A 86 86 ILE CA C 85 58.007 57.783 0.224 1
1 961 . 44 1 1 A 86 86 ILE CB C 85 39.604 38.740 0.864 1
1 965 . 44 1 1 A 86 86 ILE N N 85 119.285 120.089 -0.804 1
1 966 . 44 1 1 A 87 87 PRO HA H 86 4.392 4.507 -0.115 1
1 973 . 44 1 1 A 87 87 PRO C C 86 177.622 177.399 0.223 1
1 974 . 44 1 1 A 87 87 PRO CA C 86 64.665 64.226 0.439 1
1 975 . 44 1 1 A 87 87 PRO CB C 86 32.020 31.652 0.368 1
1 978 . 44 1 1 A 88 88 GLU H H 87 8.312 8.539 -0.227 1
1 979 . 44 1 1 A 88 88 GLU HA H 87 4.208 4.351 -0.143 1
1 984 . 44 1 1 A 88 88 GLU C C 87 175.554 176.503 -0.949 1
1 985 . 44 1 1 A 88 88 GLU CA C 87 56.045 55.808 0.237 1
1 986 . 44 1 1 A 88 88 GLU CB C 87 28.654 29.201 -0.547 1
1 988 . 44 1 1 A 88 88 GLU N N 87 114.256 115.667 -1.411 1
1 989 . 44 1 1 A 89 89 PHE H H 88 7.946 7.573 0.373 1
1 990 . 44 1 1 A 89 89 PHE HA H 88 3.993 4.483 -0.490 1
1 998 . 44 1 1 A 89 89 PHE C C 88 173.460 174.320 -0.860 1
1 999 . 44 1 1 A 89 89 PHE CA C 88 60.119 59.123 0.996 1
1 1000 . 44 1 1 A 89 89 PHE CB C 88 39.994 39.643 0.351 1
1 1006 . 44 1 1 A 89 89 PHE N N 88 121.550 122.201 -0.651 1
1 1007 . 44 1 1 A 90 90 ASN H H 89 7.266 7.984 -0.718 1
1 1008 . 44 1 1 A 90 90 ASN HA H 89 4.454 4.984 -0.530 1
1 1013 . 44 1 1 A 90 90 ASN C C 89 173.921 175.246 -1.325 1
1 1014 . 44 1 1 A 90 90 ASN CA C 89 51.839 51.544 0.295 1
1 1015 . 44 1 1 A 90 90 ASN CB C 89 40.674 39.054 1.620 1
1 1016 . 44 1 1 A 90 90 ASN N N 89 125.344 125.080 0.264 1
1 1018 . 44 1 1 A 91 91 MET H H 90 8.968 8.733 0.235 1
1 1019 . 44 1 1 A 91 91 MET HA H 90 4.049 4.062 -0.013 1
1 1027 . 44 1 1 A 91 91 MET C C 90 177.475 178.017 -0.542 1
1 1028 . 44 1 1 A 91 91 MET CA C 90 57.758 58.361 -0.603 1
1 1029 . 44 1 1 A 91 91 MET CB C 90 32.250 32.199 0.051 1
1 1032 . 44 1 1 A 91 91 MET N N 90 127.052 125.613 1.439 1
1 1033 . 44 1 1 A 92 92 ALA H H 91 8.292 8.057 0.235 1
1 1034 . 44 1 1 A 92 92 ALA HA H 91 4.059 4.144 -0.085 1
1 1038 . 44 1 1 A 92 92 ALA C C 91 180.412 179.793 0.619 1
1 1039 . 44 1 1 A 92 92 ALA CA C 91 55.368 54.998 0.370 1
1 1040 . 44 1 1 A 92 92 ALA CB C 91 17.527 18.527 -1.000 1
1 1041 . 44 1 1 A 92 92 ALA N N 91 123.752 121.450 2.302 1
1 1042 . 44 1 1 A 93 93 ALA H H 92 7.931 8.124 -0.193 1
1 1043 . 44 1 1 A 93 93 ALA HA H 92 4.054 4.095 -0.041 1
1 1047 . 44 1 1 A 93 93 ALA C C 92 180.482 179.937 0.545 1
1 1048 . 44 1 1 A 93 93 ALA CA C 92 54.614 54.951 -0.337 1
1 1049 . 44 1 1 A 93 93 ALA CB C 92 18.098 18.118 -0.020 1
1 1050 . 44 1 1 A 93 93 ALA N N 92 121.158 119.976 1.182 1
1 1051 . 44 1 1 A 94 94 PHE H H 93 8.110 7.866 0.244 1
1 1052 . 44 1 1 A 94 94 PHE HA H 93 4.304 4.167 0.137 1
1 1060 . 44 1 1 A 94 94 PHE C C 93 177.350 177.151 0.199 1
1 1061 . 44 1 1 A 94 94 PHE CA C 93 61.641 61.477 0.164 1
1 1062 . 44 1 1 A 94 94 PHE CB C 93 40.014 39.016 0.998 1
1 1068 . 44 1 1 A 94 94 PHE N N 93 119.807 119.861 -0.054 1
1 1069 . 44 1 1 A 95 95 THR H H 94 8.726 8.168 0.558 1
1 1070 . 44 1 1 A 95 95 THR HA H 94 3.569 3.959 -0.390 1
1 1075 . 44 1 1 A 95 95 THR C C 94 176.932 176.876 0.056 1
1 1076 . 44 1 1 A 95 95 THR CA C 94 66.833 65.496 1.337 1
1 1077 . 44 1 1 A 95 95 THR CB C 94 68.445 68.199 0.246 1
1 1079 . 44 1 1 A 95 95 THR N N 94 113.074 111.988 1.086 1
1 1080 . 44 1 1 A 96 96 THR H H 95 7.657 7.779 -0.122 1
1 1081 . 44 1 1 A 96 96 THR HA H 95 3.945 4.031 -0.086 1
1 1086 . 44 1 1 A 96 96 THR C C 95 176.386 176.288 0.098 1
1 1087 . 44 1 1 A 96 96 THR CA C 95 66.550 66.092 0.458 1
1 1088 . 44 1 1 A 96 96 THR CB C 95 68.583 68.793 -0.210 1
1 1090 . 44 1 1 A 96 96 THR N N 95 117.927 116.571 1.356 1
1 1091 . 44 1 1 A 97 97 THR H H 96 7.699 7.807 -0.108 1
1 1092 . 44 1 1 A 97 97 THR HA H 96 3.905 4.016 -0.111 1
1 1097 . 44 1 1 A 97 97 THR C C 96 176.572 176.447 0.125 1
1 1098 . 44 1 1 A 97 97 THR CA C 96 65.979 66.328 -0.349 1
1 1099 . 44 1 1 A 97 97 THR CB C 96 68.553 68.423 0.130 1
1 1101 . 44 1 1 A 97 97 THR N N 96 118.518 116.419 2.099 1
1 1102 . 44 1 1 A 98 98 LEU H H 97 8.304 8.054 0.250 1
1 1103 . 44 1 1 A 98 98 LEU HA H 97 3.725 3.846 -0.121 1
1 1113 . 44 1 1 A 98 98 LEU C C 97 178.490 178.843 -0.353 1
1 1114 . 44 1 1 A 98 98 LEU CA C 97 58.517 58.107 0.410 1
1 1115 . 44 1 1 A 98 98 LEU CB C 97 41.697 41.142 0.555 1
1 1119 . 44 1 1 A 98 98 LEU N N 97 122.882 122.075 0.807 1
1 1120 . 44 1 1 A 99 99 GLN H H 98 7.639 8.096 -0.457 1
1 1121 . 44 1 1 A 99 99 GLN HA H 98 3.927 4.037 -0.110 1
1 1128 . 44 1 1 A 99 99 GLN C C 98 178.068 178.056 0.012 1
1 1129 . 44 1 1 A 99 99 GLN CA C 98 58.735 58.821 -0.086 1
1 1130 . 44 1 1 A 99 99 GLN CB C 98 27.986 28.711 -0.725 1
1 1132 . 44 1 1 A 99 99 GLN N N 98 114.302 117.718 -3.416 1
1 1134 . 44 1 1 A 100 100 HIS H H 99 7.575 7.892 -0.317 1
1 1135 . 44 1 1 A 100 100 HIS HA H 99 4.524 4.215 0.309 1
1 1139 . 44 1 1 A 100 100 HIS C C 99 174.789 177.238 -2.449 1
1 1140 . 44 1 1 A 100 100 HIS CA C 99 56.154 59.026 -2.872 1
1 1141 . 44 1 1 A 100 100 HIS CB C 99 28.946 29.984 -1.038 1
1 1143 . 44 1 1 A 100 100 HIS N N 99 114.778 121.542 -6.764 1
1 1144 . 44 1 1 A 101 101 HIS H H 100 7.773 8.128 -0.355 1
1 1145 . 44 1 1 A 101 101 HIS HA H 100 4.704 3.697 1.007 1
1 1149 . 44 1 1 A 101 101 HIS C C 100 174.818 176.684 -1.866 1
1 1150 . 44 1 1 A 101 101 HIS CA C 100 54.830 57.902 -3.072 1
1 1151 . 44 1 1 A 101 101 HIS CB C 100 29.749 29.884 -0.135 1
1 1153 . 44 1 1 A 101 101 HIS N N 100 117.397 118.589 -1.192 1
1 1154 . 44 1 1 A 102 102 LYS H H 101 7.324 7.902 -0.578 1
1 1155 . 44 1 1 A 102 102 LYS HA H 101 3.611 3.990 -0.379 1
1 1164 . 44 1 1 A 102 102 LYS C C 101 176.823 179.295 -2.472 1
1 1165 . 44 1 1 A 102 102 LYS CA C 101 59.915 59.035 0.880 1
1 1166 . 44 1 1 A 102 102 LYS CB C 101 32.825 32.140 0.685 1
1 1170 . 44 1 1 A 102 102 LYS N N 101 120.533 117.724 2.809 1
1 1171 . 44 1 1 A 103 103 ASP H H 102 8.361 7.667 0.694 1
1 1172 . 44 1 1 A 103 103 ASP HA H 102 4.421 4.283 0.138 1
1 1175 . 44 1 1 A 103 103 ASP C C 102 176.793 176.603 0.190 1
1 1176 . 44 1 1 A 103 103 ASP CA C 102 55.500 56.952 -1.452 1
1 1177 . 44 1 1 A 103 103 ASP CB C 102 40.178 40.291 -0.113 1
1 1178 . 44 1 1 A 103 103 ASP N N 102 114.814 118.772 -3.958 1
1 1179 . 44 1 1 A 104 104 GLU H H 103 7.858 7.988 -0.130 1
1 1180 . 44 1 1 A 104 104 GLU HA H 103 4.339 4.595 -0.256 1
1 1183 . 44 1 1 A 104 104 GLU C C 103 175.777 176.802 -1.025 1
1 1184 . 44 1 1 A 104 104 GLU CA C 103 56.356 57.510 -1.154 1
1 1185 . 44 1 1 A 104 104 GLU CB C 103 31.293 32.304 -1.011 1
1 1186 . 44 1 1 A 104 104 GLU N N 103 116.826 118.266 -1.440 1
1 1187 . 44 1 1 A 105 105 VAL H H 104 7.201 7.659 -0.458 1
1 1188 . 44 1 1 A 105 105 VAL HA H 104 4.296 4.116 0.180 1
1 1196 . 44 1 1 A 105 105 VAL C C 104 174.482 176.037 -1.555 1
1 1197 . 44 1 1 A 105 105 VAL CA C 104 60.370 63.144 -2.774 1
1 1198 . 44 1 1 A 105 105 VAL CB C 104 34.341 32.157 2.184 1
1 1201 . 44 1 1 A 105 105 VAL N N 104 116.422 120.143 -3.721 1
1 1202 . 44 1 1 A 106 106 ALA H H 105 8.487 8.588 -0.101 1
1 1203 . 44 1 1 A 106 106 ALA HA H 105 4.172 4.520 -0.348 1
1 1207 . 44 1 1 A 106 106 ALA C C 105 179.030 178.680 0.350 1
1 1208 . 44 1 1 A 106 106 ALA CA C 105 52.966 52.350 0.616 1
1 1209 . 44 1 1 A 106 106 ALA CB C 105 19.371 19.236 0.135 1
1 1210 . 44 1 1 A 106 106 ALA N N 105 128.313 128.500 -0.187 1
1 1211 . 44 1 1 A 107 107 GLY H H 106 8.738 8.793 -0.055 1
1 1212 . 44 1 1 A 107 107 GLY HA2 H 106 3.773 3.879 -0.106 1
1 1213 . 44 1 1 A 107 107 GLY HA3 H 106 3.998 3.949 0.049 1
1 1214 . 44 1 1 A 107 107 GLY C C 106 174.958 175.614 -0.656 1
1 1215 . 44 1 1 A 107 107 GLY CA C 106 47.449 47.198 0.251 1
1 1216 . 44 1 1 A 107 107 GLY N N 106 110.612 111.077 -0.465 1
1 1217 . 44 1 1 A 108 108 ASP H H 107 8.535 8.333 0.202 1
1 1218 . 44 1 1 A 108 108 ASP HA H 107 4.333 4.376 -0.043 1
1 1221 . 44 1 1 A 108 108 ASP C C 107 179.133 178.810 0.323 1
1 1222 . 44 1 1 A 108 108 ASP CA C 107 56.721 57.080 -0.359 1
1 1223 . 44 1 1 A 108 108 ASP CB C 107 39.336 41.611 -2.275 1
1 1224 . 44 1 1 A 108 108 ASP N N 107 117.474 121.616 -4.142 1
1 1225 . 44 1 1 A 109 109 ILE H H 108 7.459 7.929 -0.470 1
1 1226 . 44 1 1 A 109 109 ILE HA H 108 3.688 3.819 -0.131 1
1 1236 . 44 1 1 A 109 109 ILE C C 108 176.735 178.503 -1.768 1
1 1237 . 44 1 1 A 109 109 ILE CA C 108 63.474 65.424 -1.950 1
1 1238 . 44 1 1 A 109 109 ILE CB C 108 37.340 37.639 -0.299 1
1 1242 . 44 1 1 A 109 109 ILE N N 108 119.609 119.383 0.226 1
1 1243 . 44 1 1 A 110 110 PHE H H 109 7.920 8.343 -0.423 1
1 1244 . 44 1 1 A 110 110 PHE HA H 109 3.759 4.101 -0.342 1
1 1252 . 44 1 1 A 110 110 PHE C C 109 177.132 177.403 -0.271 1
1 1253 . 44 1 1 A 110 110 PHE CA C 109 62.766 61.240 1.526 1
1 1254 . 44 1 1 A 110 110 PHE CB C 109 39.752 39.317 0.435 1
1 1260 . 44 1 1 A 110 110 PHE N N 109 120.906 120.433 0.473 1
1 1261 . 44 1 1 A 111 111 ASP H H 110 8.639 8.302 0.337 1
1 1262 . 44 1 1 A 111 111 ASP HA H 110 4.216 4.218 -0.002 1
1 1265 . 44 1 1 A 111 111 ASP C C 110 178.900 178.424 0.476 1
1 1266 . 44 1 1 A 111 111 ASP CA C 110 57.105 57.284 -0.179 1
1 1267 . 44 1 1 A 111 111 ASP CB C 110 39.697 41.726 -2.029 1
1 1268 . 44 1 1 A 111 111 ASP N N 110 117.124 118.748 -1.624 1
1 1269 . 44 1 1 A 112 112 MET H H 111 7.331 7.572 -0.241 1
1 1270 . 44 1 1 A 112 112 MET HA H 111 4.081 4.123 -0.042 1
1 1278 . 44 1 1 A 112 112 MET C C 111 179.052 178.165 0.887 1
1 1279 . 44 1 1 A 112 112 MET CA C 111 58.202 58.146 0.056 1
1 1280 . 44 1 1 A 112 112 MET CB C 111 31.827 32.449 -0.622 1
1 1283 . 44 1 1 A 112 112 MET N N 111 118.061 119.442 -1.381 1
1 1284 . 44 1 1 A 113 113 LEU H H 112 8.001 8.065 -0.064 1
1 1285 . 44 1 1 A 113 113 LEU HA H 112 3.723 3.551 0.172 1
1 1295 . 44 1 1 A 113 113 LEU C C 112 179.747 178.669 1.078 1
1 1296 . 44 1 1 A 113 113 LEU CA C 112 57.371 57.423 -0.052 1
1 1297 . 44 1 1 A 113 113 LEU CB C 112 40.671 41.138 -0.467 1
1 1301 . 44 1 1 A 113 113 LEU N N 112 120.426 119.663 0.763 1
1 1302 . 44 1 1 A 114 114 LEU H H 113 7.744 7.652 0.092 1
1 1303 . 44 1 1 A 114 114 LEU HA H 113 4.007 3.570 0.437 1
1 1313 . 44 1 1 A 114 114 LEU C C 113 179.358 178.543 0.815 1
1 1314 . 44 1 1 A 114 114 LEU CA C 113 57.202 57.541 -0.339 1
1 1315 . 44 1 1 A 114 114 LEU CB C 113 41.727 41.615 0.112 1
1 1319 . 44 1 1 A 114 114 LEU N N 113 119.584 119.663 -0.079 1
1 1320 . 44 1 1 A 115 115 THR H H 114 7.353 7.613 -0.260 1
1 1321 . 44 1 1 A 115 115 THR HA H 114 4.071 4.162 -0.091 1
1 1327 . 44 1 1 A 115 115 THR C C 114 173.591 176.336 -2.745 1
1 1328 . 44 1 1 A 115 115 THR CA C 114 65.332 64.466 0.866 1
1 1329 . 44 1 1 A 115 115 THR CB C 114 70.319 68.665 1.654 1
1 1331 . 44 1 1 A 115 115 THR N N 114 107.535 112.406 -4.871 1
1 1332 . 44 1 1 A 116 116 PHE H H 115 6.979 7.918 -0.939 1
1 1333 . 44 1 1 A 116 116 PHE HA H 115 5.022 4.297 0.725 1
1 1341 . 44 1 1 A 116 116 PHE C C 115 176.488 176.448 0.040 1
1 1342 . 44 1 1 A 116 116 PHE CA C 115 55.911 60.953 -5.042 1
1 1343 . 44 1 1 A 116 116 PHE CB C 115 38.521 39.134 -0.613 1
1 1349 . 44 1 1 A 116 116 PHE N N 115 112.366 119.983 -7.617 1
1 1350 . 44 1 1 A 117 117 THR H H 116 7.564 7.491 0.073 1
1 1351 . 44 1 1 A 117 117 THR HA H 116 4.626 4.833 -0.207 1
1 1356 . 44 1 1 A 117 117 THR C C 116 174.085 174.274 -0.189 1
1 1357 . 44 1 1 A 117 117 THR CA C 116 61.636 62.002 -0.366 1
1 1358 . 44 1 1 A 117 117 THR CB C 116 70.915 70.903 0.012 1
1 1360 . 44 1 1 A 117 117 THR N N 116 105.498 106.194 -0.696 1
1 1361 . 44 1 1 A 118 118 ASP H H 117 8.270 7.761 0.509 1
1 1362 . 44 1 1 A 118 118 ASP HA H 117 4.955 4.694 0.261 1
1 1365 . 44 1 1 A 118 118 ASP C C 117 176.328 176.390 -0.062 1
1 1366 . 44 1 1 A 118 118 ASP CA C 117 53.417 53.537 -0.120 1
1 1367 . 44 1 1 A 118 118 ASP CB C 117 43.388 40.806 2.582 1
1 1368 . 44 1 1 A 118 118 ASP N N 117 124.409 122.355 2.054 1
1 1369 . 44 1 1 A 119 119 PHE H H 118 8.973 8.682 0.291 1
1 1370 . 44 1 1 A 119 119 PHE HA H 118 3.506 4.194 -0.688 1
1 1378 . 44 1 1 A 119 119 PHE CA C 118 61.490 61.101 0.389 1
1 1379 . 44 1 1 A 119 119 PHE CB C 118 39.246 39.531 -0.285 1
1 1385 . 44 1 1 A 119 119 PHE N N 118 126.688 126.579 0.109 1
1 1386 . 44 1 1 A 120 120 LEU H H 119 8.099 8.258 -0.159 1
1 1387 . 44 1 1 A 120 120 LEU HA H 119 3.842 3.939 -0.097 1
1 1397 . 44 1 1 A 120 120 LEU C C 119 179.601 179.500 0.101 1
1 1398 . 44 1 1 A 120 120 LEU CA C 119 58.174 57.796 0.378 1
1 1399 . 44 1 1 A 120 120 LEU CB C 119 40.315 40.873 -0.558 1
1 1403 . 44 1 1 A 120 120 LEU N N 119 117.930 119.774 -1.844 1
1 1404 . 44 1 1 A 121 121 ALA H H 120 7.729 7.841 -0.112 1
1 1405 . 44 1 1 A 121 121 ALA HA H 120 3.996 4.099 -0.103 1
1 1409 . 44 1 1 A 121 121 ALA C C 120 180.995 179.565 1.430 1
1 1410 . 44 1 1 A 121 121 ALA CA C 120 54.832 54.615 0.217 1
1 1411 . 44 1 1 A 121 121 ALA CB C 120 17.706 18.329 -0.623 1
1 1412 . 44 1 1 A 121 121 ALA N N 120 123.195 121.347 1.848 1
1 1413 . 44 1 1 A 122 122 PHE H H 121 7.943 7.785 0.158 1
1 1414 . 44 1 1 A 122 122 PHE HA H 121 3.887 3.847 0.040 1
1 1419 . 44 1 1 A 122 122 PHE C C 121 175.410 176.774 -1.364 1
1 1420 . 44 1 1 A 122 122 PHE CA C 121 61.075 60.680 0.395 1
1 1421 . 44 1 1 A 122 122 PHE CB C 121 38.115 38.763 -0.648 1
1 1424 . 44 1 1 A 122 122 PHE N N 121 121.798 120.443 1.355 1
1 1425 . 44 1 1 A 123 123 LYS H H 122 8.468 7.789 0.679 1
1 1426 . 44 1 1 A 123 123 LYS HA H 122 3.077 3.675 -0.598 1
1 1435 . 44 1 1 A 123 123 LYS C C 122 178.453 178.917 -0.464 1
1 1436 . 44 1 1 A 123 123 LYS CA C 122 59.855 59.854 0.001 1
1 1437 . 44 1 1 A 123 123 LYS CB C 122 32.374 32.300 0.074 1
1 1441 . 44 1 1 A 123 123 LYS N N 122 120.614 118.285 2.329 1
1 1442 . 44 1 1 A 124 124 GLU H H 123 8.100 7.879 0.221 1
1 1443 . 44 1 1 A 124 124 GLU HA H 123 3.652 4.024 -0.372 1
1 1448 . 44 1 1 A 124 124 GLU C C 123 177.743 178.479 -0.736 1
1 1449 . 44 1 1 A 124 124 GLU CA C 123 59.406 59.475 -0.069 1
1 1450 . 44 1 1 A 124 124 GLU CB C 123 28.811 29.291 -0.480 1
1 1452 . 44 1 1 A 124 124 GLU N N 123 117.404 118.843 -1.439 1
1 1453 . 44 1 1 A 125 125 MET H H 124 7.537 7.551 -0.014 1
1 1454 . 44 1 1 A 125 125 MET HA H 124 3.860 3.945 -0.085 1
1 1462 . 44 1 1 A 125 125 MET C C 124 179.522 178.365 1.157 1
1 1463 . 44 1 1 A 125 125 MET CA C 124 58.832 58.505 0.327 1
1 1464 . 44 1 1 A 125 125 MET CB C 124 31.765 31.308 0.457 1
1 1467 . 44 1 1 A 125 125 MET N N 124 119.413 118.946 0.467 1
1 1468 . 44 1 1 A 126 126 PHE H H 125 7.148 7.493 -0.345 1
1 1469 . 44 1 1 A 126 126 PHE HA H 125 3.633 4.242 -0.609 1
1 1476 . 44 1 1 A 126 126 PHE C C 125 178.994 178.246 0.748 1
1 1477 . 44 1 1 A 126 126 PHE CA C 125 63.148 61.090 2.058 1
1 1478 . 44 1 1 A 126 126 PHE CB C 125 39.830 38.282 1.548 1
1 1483 . 44 1 1 A 126 126 PHE N N 125 120.013 118.832 1.181 1
1 1484 . 44 1 1 A 127 127 LEU H H 126 8.369 8.343 0.026 1
1 1485 . 44 1 1 A 127 127 LEU HA H 126 3.972 4.013 -0.041 1
1 1495 . 44 1 1 A 127 127 LEU C C 126 180.621 178.777 1.844 1
1 1496 . 44 1 1 A 127 127 LEU CA C 126 57.944 58.125 -0.181 1
1 1497 . 44 1 1 A 127 127 LEU CB C 126 40.543 41.431 -0.888 1
1 1501 . 44 1 1 A 127 127 LEU N N 126 119.692 119.878 -0.186 1
1 1502 . 44 1 1 A 128 128 ASP H H 127 8.578 8.228 0.350 1
1 1503 . 44 1 1 A 128 128 ASP HA H 127 4.308 4.335 -0.027 1
1 1506 . 44 1 1 A 128 128 ASP C C 127 178.254 178.086 0.168 1
1 1507 . 44 1 1 A 128 128 ASP CA C 127 56.964 57.336 -0.372 1
1 1508 . 44 1 1 A 128 128 ASP CB C 127 39.735 40.951 -1.216 1
1 1509 . 44 1 1 A 128 128 ASP N N 127 121.926 119.026 2.900 1
1 1510 . 44 1 1 A 129 129 TYR H H 128 7.710 8.372 -0.662 1
1 1511 . 44 1 1 A 129 129 TYR HA H 128 3.908 4.340 -0.432 1
1 1518 . 44 1 1 A 129 129 TYR C C 128 177.633 177.726 -0.093 1
1 1519 . 44 1 1 A 129 129 TYR CA C 128 61.796 61.528 0.268 1
1 1520 . 44 1 1 A 129 129 TYR CB C 128 39.372 38.850 0.522 1
1 1525 . 44 1 1 A 129 129 TYR N N 128 122.548 120.616 1.932 1
1 1526 . 44 1 1 A 130 130 ARG H H 129 8.622 8.458 0.164 1
1 1527 . 44 1 1 A 130 130 ARG HA H 129 3.722 4.137 -0.415 1
1 1535 . 44 1 1 A 130 130 ARG CA C 129 60.084 59.652 0.432 1
1 1536 . 44 1 1 A 130 130 ARG CB C 129 29.902 29.839 0.063 1
1 1539 . 44 1 1 A 130 130 ARG N N 129 118.302 119.357 -1.055 1
1 1541 . 44 1 1 A 131 131 ALA H H 130 7.936 7.965 -0.029 1
1 1542 . 44 1 1 A 131 131 ALA HA H 130 3.997 4.012 -0.015 1
1 1546 . 44 1 1 A 131 131 ALA C C 130 180.456 179.797 0.659 1
1 1547 . 44 1 1 A 131 131 ALA CA C 130 55.133 55.087 0.046 1
1 1548 . 44 1 1 A 131 131 ALA CB C 130 17.750 18.169 -0.419 1
1 1549 . 44 1 1 A 131 131 ALA N N 130 119.788 121.923 -2.135 1
1 1550 . 44 1 1 A 132 132 GLU H H 131 7.622 7.655 -0.033 1
1 1551 . 44 1 1 A 132 132 GLU HA H 131 3.862 3.958 -0.096 1
1 1556 . 44 1 1 A 132 132 GLU C C 131 179.528 179.337 0.191 1
1 1557 . 44 1 1 A 132 132 GLU CA C 131 58.849 59.159 -0.310 1
1 1558 . 44 1 1 A 132 132 GLU CB C 131 28.930 29.178 -0.248 1
1 1560 . 44 1 1 A 132 132 GLU N N 131 118.428 117.955 0.473 1
1 1561 . 44 1 1 A 133 133 LYS H H 132 7.853 7.897 -0.044 1
1 1562 . 44 1 1 A 133 133 LYS HA H 132 3.722 4.018 -0.296 1
1 1571 . 44 1 1 A 133 133 LYS C C 132 175.725 178.981 -3.256 1
1 1572 . 44 1 1 A 133 133 LYS CA C 132 57.544 59.532 -1.988 1
1 1573 . 44 1 1 A 133 133 LYS CB C 132 31.770 31.813 -0.043 1
1 1577 . 44 1 1 A 133 133 LYS N N 132 119.473 120.102 -0.629 1
1 1578 . 44 1 1 A 134 134 GLU H H 133 8.151 7.917 0.234 1
1 1579 . 44 1 1 A 134 134 GLU HA H 133 4.161 4.134 0.027 1
1 1584 . 44 1 1 A 134 134 GLU C C 133 177.453 178.482 -1.029 1
1 1585 . 44 1 1 A 134 134 GLU CA C 133 57.222 58.314 -1.092 1
1 1586 . 44 1 1 A 134 134 GLU CB C 133 30.091 28.882 1.209 1
1 1588 . 44 1 1 A 134 134 GLU N N 133 116.525 118.547 -2.022 1
1 1589 . 44 1 1 A 135 135 GLY H H 134 7.702 8.053 -0.351 1
1 1590 . 44 1 1 A 135 135 GLY HA2 H 134 3.896 3.834 0.062 1
1 1591 . 44 1 1 A 135 135 GLY HA3 H 134 3.897 3.843 0.054 1
1 1592 . 44 1 1 A 135 135 GLY C C 134 174.538 174.462 0.076 1
1 1593 . 44 1 1 A 135 135 GLY CA C 134 45.975 46.642 -0.667 1
1 1594 . 44 1 1 A 135 135 GLY N N 134 107.924 108.858 -0.934 1
1 1595 . 44 1 1 A 136 136 ARG H H 135 8.045 8.236 -0.191 1
1 1596 . 44 1 1 A 136 136 ARG HA H 135 4.323 3.940 0.383 1
1 1604 . 44 1 1 A 136 136 ARG C C 135 175.864 175.245 0.619 1
1 1605 . 44 1 1 A 136 136 ARG CA C 135 56.016 56.826 -0.810 1
1 1606 . 44 1 1 A 136 136 ARG CB C 135 30.987 29.340 1.647 1
1 1609 . 44 1 1 A 136 136 ARG N N 135 119.708 120.194 -0.486 1
1 1 . 45 1 1 A 14 14 PHE CA C 13 58.199 58.340 -0.141 1
1 2 . 45 1 1 A 14 14 PHE CB C 13 39.717 38.456 1.261 1
1 3 . 45 1 1 A 15 15 SER H H 14 8.299 8.041 0.258 1
1 4 . 45 1 1 A 15 15 SER HA H 14 4.359 3.986 0.373 1
1 7 . 45 1 1 A 15 15 SER CA C 14 58.249 58.756 -0.507 1
1 8 . 45 1 1 A 15 15 SER CB C 14 63.936 60.819 3.117 1
1 9 . 45 1 1 A 15 15 SER N N 14 117.379 119.308 -1.929 1
1 10 . 45 1 1 A 16 16 SER H H 15 8.255 7.920 0.335 1
1 11 . 45 1 1 A 16 16 SER HA H 15 3.729 4.736 -1.007 1
1 14 . 45 1 1 A 16 16 SER CA C 15 58.224 59.557 -1.333 1
1 15 . 45 1 1 A 16 16 SER CB C 15 63.886 64.591 -0.705 1
1 16 . 45 1 1 A 16 16 SER N N 15 117.694 120.740 -3.046 1
1 17 . 45 1 1 A 17 17 ALA H H 16 8.333 8.534 -0.201 1
1 18 . 45 1 1 A 17 17 ALA HA H 16 4.252 4.177 0.075 1
1 22 . 45 1 1 A 17 17 ALA CA C 16 53.377 54.238 -0.861 1
1 23 . 45 1 1 A 17 17 ALA CB C 16 18.896 18.478 0.418 1
1 24 . 45 1 1 A 17 17 ALA N N 16 125.462 124.388 1.074 1
1 25 . 45 1 1 A 18 18 SER H H 17 8.219 8.377 -0.158 1
1 26 . 45 1 1 A 18 18 SER HA H 17 4.332 4.837 -0.505 1
1 29 . 45 1 1 A 18 18 SER CA C 17 59.105 57.251 1.854 1
1 30 . 45 1 1 A 18 18 SER CB C 17 63.592 64.200 -0.608 1
1 31 . 45 1 1 A 18 18 SER N N 17 114.821 112.902 1.919 1
1 32 . 45 1 1 A 19 19 ASP H H 18 8.309 8.175 0.134 1
1 33 . 45 1 1 A 19 19 ASP HA H 18 4.554 4.969 -0.415 1
1 36 . 45 1 1 A 19 19 ASP C C 18 176.528 176.691 -0.163 1
1 37 . 45 1 1 A 19 19 ASP CA C 18 55.272 55.719 -0.447 1
1 38 . 45 1 1 A 19 19 ASP CB C 18 40.883 41.186 -0.303 1
1 39 . 45 1 1 A 19 19 ASP N N 18 123.367 121.245 2.122 1
1 40 . 45 1 1 A 20 20 ALA H H 19 8.133 8.572 -0.439 1
1 41 . 45 1 1 A 20 20 ALA HA H 19 4.170 4.074 0.096 1
1 45 . 45 1 1 A 20 20 ALA C C 19 179.857 179.057 0.800 1
1 46 . 45 1 1 A 20 20 ALA CA C 19 54.341 55.528 -1.187 1
1 47 . 45 1 1 A 20 20 ALA CB C 19 18.660 18.575 0.085 1
1 48 . 45 1 1 A 20 20 ALA N N 19 123.350 122.849 0.501 1
1 49 . 45 1 1 A 21 21 GLU H H 20 8.140 8.067 0.073 1
1 50 . 45 1 1 A 21 21 GLU HA H 20 4.128 4.097 0.031 1
1 55 . 45 1 1 A 21 21 GLU C C 20 177.675 178.602 -0.927 1
1 56 . 45 1 1 A 21 21 GLU CA C 20 58.520 59.406 -0.886 1
1 57 . 45 1 1 A 21 21 GLU CB C 20 29.765 29.582 0.183 1
1 59 . 45 1 1 A 21 21 GLU N N 20 119.063 119.197 -0.134 1
1 60 . 45 1 1 A 22 22 PHE H H 21 8.009 8.060 -0.051 1
1 61 . 45 1 1 A 22 22 PHE HA H 21 4.123 4.332 -0.209 1
1 68 . 45 1 1 A 22 22 PHE C C 21 176.410 177.227 -0.817 1
1 69 . 45 1 1 A 22 22 PHE CA C 21 62.202 61.151 1.051 1
1 70 . 45 1 1 A 22 22 PHE CB C 21 39.223 38.954 0.269 1
1 75 . 45 1 1 A 22 22 PHE N N 21 121.211 121.015 0.196 1
1 76 . 45 1 1 A 23 23 ASP H H 22 8.261 8.452 -0.191 1
1 77 . 45 1 1 A 23 23 ASP HA H 22 4.041 4.461 -0.420 1
1 80 . 45 1 1 A 23 23 ASP C C 22 179.078 178.204 0.874 1
1 81 . 45 1 1 A 23 23 ASP CA C 22 57.048 57.932 -0.884 1
1 82 . 45 1 1 A 23 23 ASP CB C 22 40.154 42.117 -1.963 1
1 83 . 45 1 1 A 23 23 ASP N N 22 116.876 119.200 -2.324 1
1 84 . 45 1 1 A 24 24 ALA H H 23 7.651 7.618 0.033 1
1 85 . 45 1 1 A 24 24 ALA HA H 23 3.785 3.826 -0.041 1
1 89 . 45 1 1 A 24 24 ALA C C 23 179.577 179.636 -0.059 1
1 90 . 45 1 1 A 24 24 ALA CA C 23 54.341 55.142 -0.801 1
1 91 . 45 1 1 A 24 24 ALA CB C 23 17.762 18.161 -0.399 1
1 92 . 45 1 1 A 24 24 ALA N N 23 121.873 121.787 0.086 1
1 93 . 45 1 1 A 25 25 VAL H H 24 7.718 7.885 -0.167 1
1 94 . 45 1 1 A 25 25 VAL HA H 24 3.216 3.571 -0.355 1
1 102 . 45 1 1 A 25 25 VAL C C 24 177.805 178.338 -0.533 1
1 103 . 45 1 1 A 25 25 VAL CA C 24 66.789 66.813 -0.024 1
1 104 . 45 1 1 A 25 25 VAL CB C 24 31.277 31.236 0.041 1
1 107 . 45 1 1 A 25 25 VAL N N 24 117.890 118.604 -0.714 1
1 108 . 45 1 1 A 26 26 VAL H H 25 7.867 7.828 0.039 1
1 109 . 45 1 1 A 26 26 VAL HA H 25 3.274 3.604 -0.330 1
1 117 . 45 1 1 A 26 26 VAL C C 25 177.788 177.569 0.219 1
1 118 . 45 1 1 A 26 26 VAL CA C 25 67.282 66.528 0.754 1
1 119 . 45 1 1 A 26 26 VAL CB C 25 31.266 31.569 -0.303 1
1 122 . 45 1 1 A 26 26 VAL N N 25 118.170 120.108 -1.938 1
1 123 . 45 1 1 A 27 27 GLY H H 26 7.544 7.621 -0.077 1
1 124 . 45 1 1 A 27 27 GLY HA2 H 26 3.592 3.500 0.092 1
1 125 . 45 1 1 A 27 27 GLY HA3 H 26 3.721 3.638 0.083 1
1 126 . 45 1 1 A 27 27 GLY C C 26 176.717 176.141 0.576 1
1 127 . 45 1 1 A 27 27 GLY CA C 26 47.085 47.168 -0.083 1
1 128 . 45 1 1 A 27 27 GLY N N 26 105.795 107.621 -1.826 1
1 129 . 45 1 1 A 28 28 TYR H H 27 7.625 7.265 0.360 1
1 130 . 45 1 1 A 28 28 TYR HA H 27 4.546 4.585 -0.039 1
1 137 . 45 1 1 A 28 28 TYR C C 27 178.991 178.288 0.703 1
1 138 . 45 1 1 A 28 28 TYR CA C 27 58.845 59.899 -1.054 1
1 139 . 45 1 1 A 28 28 TYR CB C 27 37.602 37.645 -0.043 1
1 144 . 45 1 1 A 28 28 TYR N N 27 119.933 121.506 -1.573 1
1 145 . 45 1 1 A 29 29 LEU H H 28 8.517 8.203 0.314 1
1 146 . 45 1 1 A 29 29 LEU HA H 28 3.728 3.839 -0.111 1
1 156 . 45 1 1 A 29 29 LEU CA C 28 58.281 58.106 0.175 1
1 157 . 45 1 1 A 29 29 LEU CB C 28 41.948 41.334 0.614 1
1 161 . 45 1 1 A 29 29 LEU N N 28 119.669 120.654 -0.985 1
1 162 . 45 1 1 A 30 30 GLU H H 29 8.072 8.090 -0.018 1
1 163 . 45 1 1 A 30 30 GLU HA H 29 3.722 3.886 -0.164 1
1 168 . 45 1 1 A 30 30 GLU C C 29 177.731 179.300 -1.569 1
1 169 . 45 1 1 A 30 30 GLU CA C 29 59.763 59.933 -0.170 1
1 170 . 45 1 1 A 30 30 GLU CB C 29 28.844 29.310 -0.466 1
1 172 . 45 1 1 A 30 30 GLU N N 29 117.666 117.660 0.006 1
1 173 . 45 1 1 A 31 31 ASP H H 30 7.243 7.812 -0.569 1
1 174 . 45 1 1 A 31 31 ASP HA H 30 4.297 4.394 -0.097 1
1 177 . 45 1 1 A 31 31 ASP CA C 30 56.953 57.400 -0.447 1
1 178 . 45 1 1 A 31 31 ASP CB C 30 40.730 40.920 -0.190 1
1 179 . 45 1 1 A 31 31 ASP N N 30 116.720 119.210 -2.490 1
1 180 . 45 1 1 A 32 32 ILE H H 31 7.940 7.510 0.430 1
1 181 . 45 1 1 A 32 32 ILE HA H 31 3.640 3.761 -0.121 1
1 191 . 45 1 1 A 32 32 ILE C C 31 177.980 178.255 -0.275 1
1 192 . 45 1 1 A 32 32 ILE CA C 31 64.692 64.001 0.691 1
1 193 . 45 1 1 A 32 32 ILE CB C 31 38.938 36.689 2.249 1
1 197 . 45 1 1 A 32 32 ILE N N 31 119.728 120.221 -0.493 1
1 198 . 45 1 1 A 33 33 ILE H H 32 7.984 7.764 0.220 1
1 199 . 45 1 1 A 33 33 ILE HA H 32 3.598 3.094 0.504 1
1 209 . 45 1 1 A 33 33 ILE C C 32 176.723 176.958 -0.235 1
1 210 . 45 1 1 A 33 33 ILE CA C 32 63.241 64.472 -1.231 1
1 211 . 45 1 1 A 33 33 ILE CB C 32 37.580 37.757 -0.177 1
1 215 . 45 1 1 A 33 33 ILE N N 32 113.919 121.518 -7.599 1
1 216 . 45 1 1 A 34 34 MET H H 33 7.288 7.700 -0.412 1
1 217 . 45 1 1 A 34 34 MET HA H 33 4.496 4.663 -0.167 1
1 225 . 45 1 1 A 34 34 MET C C 33 176.423 175.803 0.620 1
1 226 . 45 1 1 A 34 34 MET CA C 33 54.634 54.209 0.425 1
1 227 . 45 1 1 A 34 34 MET CB C 33 31.934 31.446 0.488 1
1 230 . 45 1 1 A 34 34 MET N N 33 115.130 116.739 -1.609 1
1 231 . 45 1 1 A 35 35 ASP H H 34 7.405 7.542 -0.137 1
1 232 . 45 1 1 A 35 35 ASP HA H 34 4.484 4.573 -0.089 1
1 235 . 45 1 1 A 35 35 ASP C C 34 177.139 176.712 0.427 1
1 236 . 45 1 1 A 35 35 ASP CA C 34 54.625 54.409 0.216 1
1 237 . 45 1 1 A 35 35 ASP CB C 34 43.554 42.574 0.980 1
1 238 . 45 1 1 A 35 35 ASP N N 34 121.814 122.545 -0.731 1
1 239 . 45 1 1 A 36 36 ASP H H 35 8.765 9.053 -0.288 1
1 240 . 45 1 1 A 36 36 ASP HA H 35 4.235 4.340 -0.105 1
1 243 . 45 1 1 A 36 36 ASP C C 35 178.320 178.447 -0.127 1
1 244 . 45 1 1 A 36 36 ASP CA C 35 57.832 57.247 0.585 1
1 245 . 45 1 1 A 36 36 ASP CB C 35 40.914 39.763 1.151 1
1 246 . 45 1 1 A 36 36 ASP N N 35 125.883 126.410 -0.527 1
1 247 . 45 1 1 A 37 37 GLU H H 36 8.905 8.082 0.823 1
1 248 . 45 1 1 A 37 37 GLU HA H 36 3.933 4.110 -0.177 1
1 253 . 45 1 1 A 37 37 GLU C C 36 179.304 179.127 0.177 1
1 254 . 45 1 1 A 37 37 GLU CA C 36 59.828 59.293 0.535 1
1 255 . 45 1 1 A 37 37 GLU CB C 36 29.380 29.267 0.113 1
1 257 . 45 1 1 A 37 37 GLU N N 36 119.077 120.481 -1.404 1
1 258 . 45 1 1 A 38 38 PHE H H 37 7.460 8.107 -0.647 1
1 259 . 45 1 1 A 38 38 PHE HA H 37 3.642 3.921 -0.279 1
1 267 . 45 1 1 A 38 38 PHE C C 37 176.483 177.988 -1.505 1
1 268 . 45 1 1 A 38 38 PHE CA C 37 61.411 61.272 0.139 1
1 269 . 45 1 1 A 38 38 PHE CB C 37 39.355 39.104 0.251 1
1 275 . 45 1 1 A 38 38 PHE N N 37 119.968 120.503 -0.535 1
1 276 . 45 1 1 A 39 39 GLN H H 38 7.968 7.941 0.027 1
1 277 . 45 1 1 A 39 39 GLN HA H 38 3.712 3.866 -0.154 1
1 284 . 45 1 1 A 39 39 GLN CA C 38 59.153 58.659 0.494 1
1 285 . 45 1 1 A 39 39 GLN CB C 38 28.213 28.412 -0.199 1
1 287 . 45 1 1 A 39 39 GLN N N 38 116.433 118.466 -2.033 1
1 289 . 45 1 1 A 40 40 LEU H H 39 7.930 7.409 0.521 1
1 290 . 45 1 1 A 40 40 LEU HA H 39 3.916 3.989 -0.073 1
1 300 . 45 1 1 A 40 40 LEU C C 39 177.731 178.041 -0.310 1
1 301 . 45 1 1 A 40 40 LEU CA C 39 57.915 58.002 -0.087 1
1 302 . 45 1 1 A 40 40 LEU CB C 39 41.989 41.790 0.199 1
1 306 . 45 1 1 A 40 40 LEU N N 39 119.505 121.807 -2.302 1
1 307 . 45 1 1 A 41 41 LEU H H 40 7.174 7.920 -0.746 1
1 308 . 45 1 1 A 41 41 LEU HA H 40 3.835 3.966 -0.131 1
1 318 . 45 1 1 A 41 41 LEU C C 40 179.738 178.244 1.494 1
1 319 . 45 1 1 A 41 41 LEU CA C 40 58.266 58.200 0.066 1
1 320 . 45 1 1 A 41 41 LEU CB C 40 42.050 41.680 0.370 1
1 324 . 45 1 1 A 41 41 LEU N N 40 120.971 119.630 1.341 1
1 325 . 45 1 1 A 42 42 GLN H H 41 8.058 7.863 0.195 1
1 326 . 45 1 1 A 42 42 GLN HA H 41 3.556 3.632 -0.076 1
1 333 . 45 1 1 A 42 42 GLN C C 41 177.642 178.307 -0.665 1
1 334 . 45 1 1 A 42 42 GLN CA C 41 59.826 59.015 0.811 1
1 335 . 45 1 1 A 42 42 GLN CB C 41 28.762 27.707 1.055 1
1 337 . 45 1 1 A 42 42 GLN N N 41 117.899 117.699 0.200 1
1 339 . 45 1 1 A 43 43 ARG H H 42 8.179 7.711 0.468 1
1 340 . 45 1 1 A 43 43 ARG HA H 42 3.655 3.987 -0.332 1
1 347 . 45 1 1 A 43 43 ARG C C 42 178.051 178.367 -0.316 1
1 348 . 45 1 1 A 43 43 ARG CA C 42 59.766 58.627 1.139 1
1 349 . 45 1 1 A 43 43 ARG CB C 42 29.941 29.897 0.044 1
1 352 . 45 1 1 A 43 43 ARG N N 42 119.392 119.973 -0.581 1
1 353 . 45 1 1 A 44 44 ASN H H 43 8.525 8.017 0.508 1
1 354 . 45 1 1 A 44 44 ASN HA H 43 4.332 4.405 -0.073 1
1 359 . 45 1 1 A 44 44 ASN C C 43 178.150 177.916 0.234 1
1 360 . 45 1 1 A 44 44 ASN CA C 43 55.841 56.216 -0.375 1
1 361 . 45 1 1 A 44 44 ASN CB C 43 37.632 39.303 -1.671 1
1 362 . 45 1 1 A 44 44 ASN N N 43 116.214 117.628 -1.414 1
1 364 . 45 1 1 A 45 45 PHE H H 44 7.586 7.828 -0.242 1
1 365 . 45 1 1 A 45 45 PHE HA H 44 4.132 4.343 -0.211 1
1 372 . 45 1 1 A 45 45 PHE C C 44 176.691 178.680 -1.989 1
1 373 . 45 1 1 A 45 45 PHE CA C 44 62.333 60.754 1.579 1
1 374 . 45 1 1 A 45 45 PHE CB C 44 39.449 38.995 0.454 1
1 379 . 45 1 1 A 45 45 PHE N N 44 121.501 117.595 3.906 1
1 380 . 45 1 1 A 46 46 MET H H 45 8.190 8.210 -0.020 1
1 381 . 45 1 1 A 46 46 MET HA H 45 4.060 4.221 -0.161 1
1 389 . 45 1 1 A 46 46 MET C C 45 179.754 178.159 1.595 1
1 390 . 45 1 1 A 46 46 MET CA C 45 57.742 58.137 -0.395 1
1 391 . 45 1 1 A 46 46 MET CB C 45 29.912 31.366 -1.454 1
1 394 . 45 1 1 A 46 46 MET N N 45 116.727 117.993 -1.266 1
1 395 . 45 1 1 A 47 47 ASP H H 46 8.579 8.273 0.306 1
1 396 . 45 1 1 A 47 47 ASP HA H 46 4.804 4.664 0.140 1
1 399 . 45 1 1 A 47 47 ASP C C 46 177.854 177.651 0.203 1
1 400 . 45 1 1 A 47 47 ASP CA C 46 57.277 57.264 0.013 1
1 401 . 45 1 1 A 47 47 ASP CB C 46 40.776 41.872 -1.096 1
1 402 . 45 1 1 A 47 47 ASP N N 46 117.798 120.706 -2.908 1
1 403 . 45 1 1 A 48 48 LYS H H 47 7.339 7.972 -0.633 1
1 404 . 45 1 1 A 48 48 LYS HA H 47 3.828 4.341 -0.513 1
1 413 . 45 1 1 A 48 48 LYS C C 47 178.812 178.523 0.289 1
1 414 . 45 1 1 A 48 48 LYS CA C 47 58.953 57.397 1.556 1
1 415 . 45 1 1 A 48 48 LYS CB C 47 32.796 33.437 -0.641 1
1 419 . 45 1 1 A 48 48 LYS N N 47 117.852 117.581 0.271 1
1 420 . 45 1 1 A 49 49 TYR H H 48 6.841 8.327 -1.486 1
1 421 . 45 1 1 A 49 49 TYR HA H 48 4.995 4.205 0.790 1
1 428 . 45 1 1 A 49 49 TYR C C 48 178.138 178.505 -0.367 1
1 429 . 45 1 1 A 49 49 TYR CA C 48 58.620 59.721 -1.101 1
1 430 . 45 1 1 A 49 49 TYR CB C 48 42.939 37.905 5.034 1
1 435 . 45 1 1 A 49 49 TYR N N 48 112.109 119.016 -6.907 1
1 436 . 45 1 1 A 50 50 TYR H H 49 8.491 8.039 0.452 1
1 437 . 45 1 1 A 50 50 TYR HA H 49 4.598 4.230 0.368 1
1 444 . 45 1 1 A 50 50 TYR C C 49 176.015 177.555 -1.540 1
1 445 . 45 1 1 A 50 50 TYR CA C 49 62.442 59.397 3.045 1
1 446 . 45 1 1 A 50 50 TYR CB C 49 36.588 36.871 -0.283 1
1 451 . 45 1 1 A 50 50 TYR N N 49 118.294 119.099 -0.805 1
1 452 . 45 1 1 A 51 51 LEU H H 50 7.512 7.567 -0.055 1
1 453 . 45 1 1 A 51 51 LEU HA H 50 3.878 3.539 0.339 1
1 463 . 45 1 1 A 51 51 LEU C C 50 178.625 178.837 -0.212 1
1 464 . 45 1 1 A 51 51 LEU CA C 50 55.994 57.202 -1.208 1
1 465 . 45 1 1 A 51 51 LEU CB C 50 40.743 41.704 -0.961 1
1 469 . 45 1 1 A 51 51 LEU N N 50 118.478 121.858 -3.380 1
1 470 . 45 1 1 A 52 52 GLU H H 51 8.042 7.933 0.109 1
1 471 . 45 1 1 A 52 52 GLU HA H 51 4.197 3.925 0.272 1
1 476 . 45 1 1 A 52 52 GLU C C 51 177.629 177.091 0.538 1
1 477 . 45 1 1 A 52 52 GLU CA C 51 56.141 59.178 -3.037 1
1 478 . 45 1 1 A 52 52 GLU CB C 51 29.162 29.328 -0.166 1
1 480 . 45 1 1 A 52 52 GLU N N 51 115.067 119.647 -4.580 1
1 481 . 45 1 1 A 53 53 PHE H H 52 7.465 7.961 -0.496 1
1 482 . 45 1 1 A 53 53 PHE HA H 52 4.431 4.632 -0.201 1
1 490 . 45 1 1 A 53 53 PHE C C 52 174.325 174.953 -0.628 1
1 491 . 45 1 1 A 53 53 PHE CA C 52 58.986 57.513 1.473 1
1 492 . 45 1 1 A 53 53 PHE CB C 52 40.183 37.764 2.419 1
1 498 . 45 1 1 A 53 53 PHE N N 52 116.768 117.259 -0.491 1
1 499 . 45 1 1 A 54 54 GLU H H 53 7.484 8.694 -1.210 1
1 500 . 45 1 1 A 54 54 GLU HA H 53 4.583 4.905 -0.322 1
1 505 . 45 1 1 A 54 54 GLU C C 53 175.722 175.496 0.226 1
1 506 . 45 1 1 A 54 54 GLU CA C 53 54.248 55.020 -0.772 1
1 507 . 45 1 1 A 54 54 GLU CB C 53 34.409 31.339 3.070 1
1 509 . 45 1 1 A 54 54 GLU N N 53 118.844 124.054 -5.210 1
1 510 . 45 1 1 A 55 55 ASP H H 54 9.008 8.664 0.344 1
1 511 . 45 1 1 A 55 55 ASP HA H 54 4.735 4.916 -0.181 1
1 514 . 45 1 1 A 55 55 ASP C C 54 175.421 175.471 -0.050 1
1 515 . 45 1 1 A 55 55 ASP CA C 54 52.888 53.461 -0.573 1
1 516 . 45 1 1 A 55 55 ASP CB C 54 38.894 40.718 -1.824 1
1 517 . 45 1 1 A 55 55 ASP N N 54 123.654 122.481 1.173 1
1 518 . 45 1 1 A 56 56 THR H H 55 7.819 7.899 -0.080 1
1 519 . 45 1 1 A 56 56 THR HA H 55 4.574 5.031 -0.457 1
1 524 . 45 1 1 A 56 56 THR C C 55 174.096 174.477 -0.381 1
1 525 . 45 1 1 A 56 56 THR CA C 55 59.172 59.413 -0.241 1
1 526 . 45 1 1 A 56 56 THR CB C 55 71.889 72.436 -0.547 1
1 528 . 45 1 1 A 56 56 THR N N 55 112.015 117.111 -5.096 1
1 529 . 45 1 1 A 57 57 GLU H H 56 8.527 8.753 -0.226 1
1 530 . 45 1 1 A 57 57 GLU HA H 56 4.217 4.355 -0.138 1
1 535 . 45 1 1 A 57 57 GLU C C 56 177.042 176.090 0.952 1
1 536 . 45 1 1 A 57 57 GLU CA C 56 56.869 57.230 -0.361 1
1 537 . 45 1 1 A 57 57 GLU CB C 56 29.731 30.023 -0.292 1
1 539 . 45 1 1 A 57 57 GLU N N 56 117.531 119.290 -1.759 1
1 540 . 45 1 1 A 58 58 GLU H H 57 7.587 7.641 -0.054 1
1 541 . 45 1 1 A 58 58 GLU HA H 57 3.941 4.856 -0.915 1
1 546 . 45 1 1 A 58 58 GLU C C 57 176.849 175.266 1.583 1
1 547 . 45 1 1 A 58 58 GLU CA C 57 56.924 55.242 1.682 1
1 548 . 45 1 1 A 58 58 GLU CB C 57 30.251 32.185 -1.934 1
1 550 . 45 1 1 A 58 58 GLU N N 57 119.183 121.322 -2.139 1
1 551 . 45 1 1 A 59 59 ASN H H 58 9.120 9.002 0.118 1
1 552 . 45 1 1 A 59 59 ASN HA H 58 4.922 5.237 -0.315 1
1 557 . 45 1 1 A 59 59 ASN C C 58 174.254 174.387 -0.133 1
1 558 . 45 1 1 A 59 59 ASN CA C 58 51.956 51.698 0.258 1
1 559 . 45 1 1 A 59 59 ASN CB C 58 37.404 40.134 -2.730 1
1 560 . 45 1 1 A 59 59 ASN N N 58 126.767 123.436 3.331 1
1 562 . 45 1 1 A 60 60 LYS H H 59 5.892 8.373 -2.481 1
1 563 . 45 1 1 A 60 60 LYS HA H 59 3.798 4.889 -1.091 1
1 572 . 45 1 1 A 60 60 LYS C C 59 177.908 176.980 0.928 1
1 573 . 45 1 1 A 60 60 LYS CA C 59 56.623 54.533 2.090 1
1 574 . 45 1 1 A 60 60 LYS CB C 59 32.279 35.856 -3.577 1
1 578 . 45 1 1 A 60 60 LYS N N 59 121.527 119.324 2.203 1
1 579 . 45 1 1 A 61 61 LEU H H 60 8.473 8.962 -0.489 1
1 580 . 45 1 1 A 61 61 LEU HA H 60 3.891 4.178 -0.287 1
1 590 . 45 1 1 A 61 61 LEU C C 60 179.843 178.882 0.961 1
1 591 . 45 1 1 A 61 61 LEU CA C 60 58.301 56.781 1.520 1
1 592 . 45 1 1 A 61 61 LEU CB C 60 41.305 41.807 -0.502 1
1 596 . 45 1 1 A 61 61 LEU N N 60 125.639 123.474 2.165 1
1 597 . 45 1 1 A 62 62 ILE H H 61 7.698 8.023 -0.325 1
1 598 . 45 1 1 A 62 62 ILE HA H 61 3.952 3.897 0.055 1
1 608 . 45 1 1 A 62 62 ILE C C 61 175.392 177.223 -1.831 1
1 609 . 45 1 1 A 62 62 ILE CA C 61 61.743 63.590 -1.847 1
1 610 . 45 1 1 A 62 62 ILE CB C 61 39.108 37.793 1.315 1
1 614 . 45 1 1 A 62 62 ILE N N 61 114.111 119.716 -5.605 1
1 615 . 45 1 1 A 63 63 TYR H H 62 7.273 8.084 -0.811 1
1 616 . 45 1 1 A 63 63 TYR HA H 62 4.343 4.195 0.148 1
1 623 . 45 1 1 A 63 63 TYR C C 62 178.264 178.613 -0.349 1
1 624 . 45 1 1 A 63 63 TYR CA C 62 57.231 60.865 -3.634 1
1 625 . 45 1 1 A 63 63 TYR CB C 62 36.332 37.341 -1.009 1
1 630 . 45 1 1 A 63 63 TYR N N 62 117.689 121.413 -3.724 1
1 631 . 45 1 1 A 64 64 THR H H 63 7.747 8.139 -0.392 1
1 632 . 45 1 1 A 64 64 THR HA H 63 4.266 4.256 0.010 1
1 637 . 45 1 1 A 64 64 THR CA C 63 69.362 67.589 1.773 1
1 638 . 45 1 1 A 64 64 THR CB C 63 66.962 67.571 -0.609 1
1 640 . 45 1 1 A 64 64 THR N N 63 113.755 116.316 -2.561 1
1 641 . 45 1 1 A 65 65 PRO HA H 64 4.372 4.394 -0.022 1
1 648 . 45 1 1 A 65 65 PRO C C 64 179.913 179.387 0.526 1
1 649 . 45 1 1 A 65 65 PRO CA C 64 66.011 66.168 -0.157 1
1 650 . 45 1 1 A 65 65 PRO CB C 64 30.642 30.652 -0.010 1
1 653 . 45 1 1 A 66 66 ILE H H 65 7.377 7.349 0.028 1
1 654 . 45 1 1 A 66 66 ILE HA H 65 3.530 3.918 -0.388 1
1 664 . 45 1 1 A 66 66 ILE C C 65 177.543 178.249 -0.706 1
1 665 . 45 1 1 A 66 66 ILE CA C 65 66.647 64.231 2.416 1
1 666 . 45 1 1 A 66 66 ILE CB C 65 38.029 37.683 0.346 1
1 670 . 45 1 1 A 66 66 ILE N N 65 118.353 116.656 1.697 1
1 671 . 45 1 1 A 67 67 PHE H H 66 8.480 8.441 0.039 1
1 672 . 45 1 1 A 67 67 PHE HA H 66 4.115 4.347 -0.232 1
1 680 . 45 1 1 A 67 67 PHE C C 66 177.293 177.747 -0.454 1
1 681 . 45 1 1 A 67 67 PHE CA C 66 59.570 62.204 -2.634 1
1 682 . 45 1 1 A 67 67 PHE CB C 66 38.865 39.424 -0.559 1
1 688 . 45 1 1 A 67 67 PHE N N 66 122.420 120.475 1.945 1
1 689 . 45 1 1 A 68 68 ASN H H 67 8.595 8.161 0.434 1
1 690 . 45 1 1 A 68 68 ASN HA H 67 4.211 4.302 -0.091 1
1 695 . 45 1 1 A 68 68 ASN C C 67 178.697 178.098 0.599 1
1 696 . 45 1 1 A 68 68 ASN CA C 67 56.056 56.372 -0.316 1
1 697 . 45 1 1 A 68 68 ASN CB C 67 37.704 37.934 -0.230 1
1 698 . 45 1 1 A 68 68 ASN N N 67 115.573 117.264 -1.691 1
1 700 . 45 1 1 A 69 69 GLU H H 68 8.414 8.108 0.306 1
1 701 . 45 1 1 A 69 69 GLU HA H 68 4.102 4.209 -0.107 1
1 706 . 45 1 1 A 69 69 GLU C C 68 177.880 178.750 -0.870 1
1 707 . 45 1 1 A 69 69 GLU CA C 68 59.399 59.536 -0.137 1
1 708 . 45 1 1 A 69 69 GLU CB C 68 29.855 29.516 0.339 1
1 710 . 45 1 1 A 69 69 GLU N N 68 123.510 120.125 3.385 1
1 711 . 45 1 1 A 70 70 TYR H H 69 8.659 8.019 0.640 1
1 712 . 45 1 1 A 70 70 TYR HA H 69 3.362 4.128 -0.766 1
1 719 . 45 1 1 A 70 70 TYR C C 69 178.143 177.122 1.021 1
1 720 . 45 1 1 A 70 70 TYR CA C 69 60.686 60.762 -0.076 1
1 721 . 45 1 1 A 70 70 TYR CB C 69 38.560 39.021 -0.461 1
1 726 . 45 1 1 A 70 70 TYR N N 69 122.130 120.742 1.388 1
1 727 . 45 1 1 A 71 71 ILE H H 70 8.031 7.694 0.337 1
1 728 . 45 1 1 A 71 71 ILE HA H 70 3.265 3.737 -0.472 1
1 738 . 45 1 1 A 71 71 ILE C C 70 178.056 177.313 0.743 1
1 739 . 45 1 1 A 71 71 ILE CA C 70 63.756 63.967 -0.211 1
1 740 . 45 1 1 A 71 71 ILE CB C 70 37.321 36.709 0.612 1
1 744 . 45 1 1 A 71 71 ILE N N 70 118.906 120.292 -1.386 1
1 745 . 45 1 1 A 72 72 SER H H 71 7.803 7.724 0.079 1
1 746 . 45 1 1 A 72 72 SER HA H 71 4.029 4.351 -0.322 1
1 749 . 45 1 1 A 72 72 SER CA C 71 61.380 60.948 0.432 1
1 750 . 45 1 1 A 72 72 SER CB C 71 63.288 63.272 0.016 1
1 751 . 45 1 1 A 72 72 SER N N 71 113.735 116.767 -3.032 1
1 752 . 45 1 1 A 73 73 LEU H H 72 7.952 7.967 -0.015 1
1 753 . 45 1 1 A 73 73 LEU HA H 72 4.418 4.079 0.339 1
1 763 . 45 1 1 A 73 73 LEU C C 72 177.767 178.323 -0.556 1
1 764 . 45 1 1 A 73 73 LEU CA C 72 56.543 57.384 -0.841 1
1 765 . 45 1 1 A 73 73 LEU CB C 72 44.517 41.569 2.948 1
1 769 . 45 1 1 A 73 73 LEU N N 72 119.411 122.476 -3.065 1
1 770 . 45 1 1 A 74 74 VAL H H 73 8.021 7.584 0.437 1
1 771 . 45 1 1 A 74 74 VAL HA H 73 3.532 3.337 0.195 1
1 779 . 45 1 1 A 74 74 VAL C C 73 177.126 177.994 -0.868 1
1 780 . 45 1 1 A 74 74 VAL CA C 73 66.250 66.333 -0.083 1
1 781 . 45 1 1 A 74 74 VAL CB C 73 31.212 31.218 -0.006 1
1 784 . 45 1 1 A 74 74 VAL N N 73 118.747 119.072 -0.325 1
1 785 . 45 1 1 A 75 75 GLU H H 74 7.232 7.972 -0.740 1
1 786 . 45 1 1 A 75 75 GLU HA H 74 3.013 4.185 -1.172 1
1 791 . 45 1 1 A 75 75 GLU C C 74 178.804 178.910 -0.106 1
1 792 . 45 1 1 A 75 75 GLU CA C 74 60.536 59.783 0.753 1
1 793 . 45 1 1 A 75 75 GLU CB C 74 27.009 29.107 -2.098 1
1 795 . 45 1 1 A 75 75 GLU N N 74 118.660 119.979 -1.319 1
1 796 . 45 1 1 A 76 76 LYS H H 75 7.051 7.850 -0.799 1
1 797 . 45 1 1 A 76 76 LYS HA H 75 3.765 4.008 -0.243 1
1 806 . 45 1 1 A 76 76 LYS C C 75 177.765 178.590 -0.825 1
1 807 . 45 1 1 A 76 76 LYS CA C 75 58.357 58.919 -0.562 1
1 808 . 45 1 1 A 76 76 LYS CB C 75 31.939 31.967 -0.028 1
1 812 . 45 1 1 A 76 76 LYS N N 75 116.112 119.588 -3.476 1
1 813 . 45 1 1 A 77 77 TYR H H 76 7.067 7.694 -0.627 1
1 814 . 45 1 1 A 77 77 TYR HA H 76 4.036 4.149 -0.113 1
1 821 . 45 1 1 A 77 77 TYR C C 76 177.752 177.016 0.736 1
1 822 . 45 1 1 A 77 77 TYR CA C 76 61.820 61.336 0.484 1
1 823 . 45 1 1 A 77 77 TYR CB C 76 38.480 38.669 -0.189 1
1 828 . 45 1 1 A 77 77 TYR N N 76 118.434 120.828 -2.394 1
1 829 . 45 1 1 A 78 78 ILE H H 77 7.554 8.312 -0.758 1
1 830 . 45 1 1 A 78 78 ILE HA H 77 3.159 3.627 -0.468 1
1 840 . 45 1 1 A 78 78 ILE C C 77 177.341 177.833 -0.492 1
1 841 . 45 1 1 A 78 78 ILE CA C 77 65.177 65.347 -0.170 1
1 842 . 45 1 1 A 78 78 ILE CB C 77 37.339 37.980 -0.641 1
1 846 . 45 1 1 A 78 78 ILE N N 77 117.672 121.671 -3.999 1
1 847 . 45 1 1 A 79 79 GLU H H 78 8.296 8.013 0.283 1
1 848 . 45 1 1 A 79 79 GLU HA H 78 3.557 3.773 -0.216 1
1 853 . 45 1 1 A 79 79 GLU C C 78 177.742 178.822 -1.080 1
1 854 . 45 1 1 A 79 79 GLU CA C 78 60.847 60.058 0.789 1
1 855 . 45 1 1 A 79 79 GLU CB C 78 29.594 29.200 0.394 1
1 857 . 45 1 1 A 79 79 GLU N N 78 118.701 120.937 -2.236 1
1 858 . 45 1 1 A 80 80 GLU H H 79 8.330 8.048 0.282 1
1 859 . 45 1 1 A 80 80 GLU HA H 79 3.774 3.986 -0.212 1
1 864 . 45 1 1 A 80 80 GLU C C 79 179.926 179.251 0.675 1
1 865 . 45 1 1 A 80 80 GLU CA C 79 59.581 58.913 0.668 1
1 866 . 45 1 1 A 80 80 GLU CB C 79 29.062 29.134 -0.072 1
1 868 . 45 1 1 A 80 80 GLU N N 79 116.767 118.134 -1.367 1
1 869 . 45 1 1 A 81 81 GLN H H 80 7.634 7.776 -0.142 1
1 870 . 45 1 1 A 81 81 GLN HA H 80 3.605 3.848 -0.243 1
1 877 . 45 1 1 A 81 81 GLN C C 80 179.681 178.421 1.260 1
1 878 . 45 1 1 A 81 81 GLN CA C 80 57.765 58.331 -0.566 1
1 879 . 45 1 1 A 81 81 GLN CB C 80 28.079 27.963 0.116 1
1 881 . 45 1 1 A 81 81 GLN N N 80 116.325 118.678 -2.353 1
1 883 . 45 1 1 A 82 82 LEU H H 81 8.156 7.468 0.688 1
1 884 . 45 1 1 A 82 82 LEU HA H 81 3.536 3.802 -0.266 1
1 894 . 45 1 1 A 82 82 LEU C C 81 178.945 179.297 -0.352 1
1 895 . 45 1 1 A 82 82 LEU CA C 81 57.761 56.799 0.962 1
1 896 . 45 1 1 A 82 82 LEU CB C 81 40.961 40.864 0.097 1
1 900 . 45 1 1 A 82 82 LEU N N 81 121.546 120.298 1.248 1
1 901 . 45 1 1 A 83 83 LEU H H 82 8.326 7.878 0.448 1
1 902 . 45 1 1 A 83 83 LEU HA H 82 4.198 4.213 -0.015 1
1 912 . 45 1 1 A 83 83 LEU C C 82 178.631 179.067 -0.436 1
1 913 . 45 1 1 A 83 83 LEU CA C 82 57.016 56.965 0.051 1
1 914 . 45 1 1 A 83 83 LEU CB C 82 42.182 40.790 1.392 1
1 918 . 45 1 1 A 83 83 LEU N N 82 120.426 119.044 1.382 1
1 919 . 45 1 1 A 84 84 GLN H H 83 6.992 7.596 -0.604 1
1 920 . 45 1 1 A 84 84 GLN HA H 83 3.877 3.985 -0.108 1
1 927 . 45 1 1 A 84 84 GLN C C 83 177.008 176.960 0.048 1
1 928 . 45 1 1 A 84 84 GLN CA C 83 57.543 58.351 -0.808 1
1 929 . 45 1 1 A 84 84 GLN CB C 83 28.688 28.411 0.277 1
1 931 . 45 1 1 A 84 84 GLN N N 83 114.001 117.249 -3.248 1
1 933 . 45 1 1 A 85 85 ARG H H 84 7.072 7.312 -0.240 1
1 934 . 45 1 1 A 85 85 ARG HA H 84 4.047 4.341 -0.294 1
1 942 . 45 1 1 A 85 85 ARG C C 84 175.999 175.377 0.622 1
1 943 . 45 1 1 A 85 85 ARG CA C 84 56.764 55.782 0.982 1
1 944 . 45 1 1 A 85 85 ARG CB C 84 32.044 32.476 -0.432 1
1 947 . 45 1 1 A 85 85 ARG N N 84 115.827 116.745 -0.918 1
1 949 . 45 1 1 A 86 86 ILE H H 85 8.238 7.389 0.849 1
1 950 . 45 1 1 A 86 86 ILE HA H 85 4.389 4.544 -0.155 1
1 960 . 45 1 1 A 86 86 ILE CA C 85 58.007 57.813 0.194 1
1 961 . 45 1 1 A 86 86 ILE CB C 85 39.604 38.992 0.612 1
1 965 . 45 1 1 A 86 86 ILE N N 85 119.285 119.497 -0.212 1
1 966 . 45 1 1 A 87 87 PRO HA H 86 4.392 4.541 -0.149 1
1 973 . 45 1 1 A 87 87 PRO C C 86 177.622 176.703 0.919 1
1 974 . 45 1 1 A 87 87 PRO CA C 86 64.665 64.275 0.390 1
1 975 . 45 1 1 A 87 87 PRO CB C 86 32.020 31.763 0.257 1
1 978 . 45 1 1 A 88 88 GLU H H 87 8.312 8.208 0.104 1
1 979 . 45 1 1 A 88 88 GLU HA H 87 4.208 4.562 -0.354 1
1 984 . 45 1 1 A 88 88 GLU C C 87 175.554 175.693 -0.139 1
1 985 . 45 1 1 A 88 88 GLU CA C 87 56.045 56.173 -0.128 1
1 986 . 45 1 1 A 88 88 GLU CB C 87 28.654 30.250 -1.596 1
1 988 . 45 1 1 A 88 88 GLU N N 87 114.256 117.017 -2.761 1
1 989 . 45 1 1 A 89 89 PHE H H 88 7.946 7.401 0.545 1
1 990 . 45 1 1 A 89 89 PHE HA H 88 3.993 4.326 -0.333 1
1 998 . 45 1 1 A 89 89 PHE C C 88 173.460 174.696 -1.236 1
1 999 . 45 1 1 A 89 89 PHE CA C 88 60.119 59.552 0.567 1
1 1000 . 45 1 1 A 89 89 PHE CB C 88 39.994 39.616 0.378 1
1 1006 . 45 1 1 A 89 89 PHE N N 88 121.550 123.498 -1.948 1
1 1007 . 45 1 1 A 90 90 ASN H H 89 7.266 7.801 -0.535 1
1 1008 . 45 1 1 A 90 90 ASN HA H 89 4.454 5.039 -0.585 1
1 1013 . 45 1 1 A 90 90 ASN C C 89 173.921 175.060 -1.139 1
1 1014 . 45 1 1 A 90 90 ASN CA C 89 51.839 51.686 0.153 1
1 1015 . 45 1 1 A 90 90 ASN CB C 89 40.674 39.445 1.229 1
1 1016 . 45 1 1 A 90 90 ASN N N 89 125.344 124.633 0.711 1
1 1018 . 45 1 1 A 91 91 MET H H 90 8.968 8.575 0.393 1
1 1019 . 45 1 1 A 91 91 MET HA H 90 4.049 4.152 -0.103 1
1 1027 . 45 1 1 A 91 91 MET C C 90 177.475 178.103 -0.628 1
1 1028 . 45 1 1 A 91 91 MET CA C 90 57.758 57.987 -0.229 1
1 1029 . 45 1 1 A 91 91 MET CB C 90 32.250 32.449 -0.199 1
1 1032 . 45 1 1 A 91 91 MET N N 90 127.052 124.442 2.610 1
1 1033 . 45 1 1 A 92 92 ALA H H 91 8.292 8.098 0.194 1
1 1034 . 45 1 1 A 92 92 ALA HA H 91 4.059 4.133 -0.074 1
1 1038 . 45 1 1 A 92 92 ALA C C 91 180.412 179.958 0.454 1
1 1039 . 45 1 1 A 92 92 ALA CA C 91 55.368 55.018 0.350 1
1 1040 . 45 1 1 A 92 92 ALA CB C 91 17.527 18.494 -0.967 1
1 1041 . 45 1 1 A 92 92 ALA N N 91 123.752 121.462 2.290 1
1 1042 . 45 1 1 A 93 93 ALA H H 92 7.931 7.957 -0.026 1
1 1043 . 45 1 1 A 93 93 ALA HA H 92 4.054 4.336 -0.282 1
1 1047 . 45 1 1 A 93 93 ALA C C 92 180.482 179.760 0.722 1
1 1048 . 45 1 1 A 93 93 ALA CA C 92 54.614 54.843 -0.229 1
1 1049 . 45 1 1 A 93 93 ALA CB C 92 18.098 18.170 -0.072 1
1 1050 . 45 1 1 A 93 93 ALA N N 92 121.158 119.977 1.181 1
1 1051 . 45 1 1 A 94 94 PHE H H 93 8.110 7.885 0.225 1
1 1052 . 45 1 1 A 94 94 PHE HA H 93 4.304 4.101 0.203 1
1 1060 . 45 1 1 A 94 94 PHE C C 93 177.350 177.111 0.239 1
1 1061 . 45 1 1 A 94 94 PHE CA C 93 61.641 61.413 0.228 1
1 1062 . 45 1 1 A 94 94 PHE CB C 93 40.014 38.968 1.046 1
1 1068 . 45 1 1 A 94 94 PHE N N 93 119.807 119.997 -0.190 1
1 1069 . 45 1 1 A 95 95 THR H H 94 8.726 8.300 0.426 1
1 1070 . 45 1 1 A 95 95 THR HA H 94 3.569 3.958 -0.389 1
1 1075 . 45 1 1 A 95 95 THR C C 94 176.932 176.330 0.602 1
1 1076 . 45 1 1 A 95 95 THR CA C 94 66.833 65.433 1.400 1
1 1077 . 45 1 1 A 95 95 THR CB C 94 68.445 68.324 0.121 1
1 1079 . 45 1 1 A 95 95 THR N N 94 113.074 112.132 0.942 1
1 1080 . 45 1 1 A 96 96 THR H H 95 7.657 7.824 -0.167 1
1 1081 . 45 1 1 A 96 96 THR HA H 95 3.945 4.104 -0.159 1
1 1086 . 45 1 1 A 96 96 THR C C 95 176.386 177.471 -1.085 1
1 1087 . 45 1 1 A 96 96 THR CA C 95 66.550 65.702 0.848 1
1 1088 . 45 1 1 A 96 96 THR CB C 95 68.583 67.949 0.634 1
1 1090 . 45 1 1 A 96 96 THR N N 95 117.927 113.901 4.026 1
1 1091 . 45 1 1 A 97 97 THR H H 96 7.699 7.959 -0.260 1
1 1092 . 45 1 1 A 97 97 THR HA H 96 3.905 4.043 -0.138 1
1 1097 . 45 1 1 A 97 97 THR C C 96 176.572 176.408 0.164 1
1 1098 . 45 1 1 A 97 97 THR CA C 96 65.979 66.739 -0.760 1
1 1099 . 45 1 1 A 97 97 THR CB C 96 68.553 68.301 0.252 1
1 1101 . 45 1 1 A 97 97 THR N N 96 118.518 117.634 0.884 1
1 1102 . 45 1 1 A 98 98 LEU H H 97 8.304 8.236 0.068 1
1 1103 . 45 1 1 A 98 98 LEU HA H 97 3.725 3.899 -0.174 1
1 1113 . 45 1 1 A 98 98 LEU C C 97 178.490 178.850 -0.360 1
1 1114 . 45 1 1 A 98 98 LEU CA C 97 58.517 58.131 0.386 1
1 1115 . 45 1 1 A 98 98 LEU CB C 97 41.697 41.089 0.608 1
1 1119 . 45 1 1 A 98 98 LEU N N 97 122.882 122.086 0.796 1
1 1120 . 45 1 1 A 99 99 GLN H H 98 7.639 7.700 -0.061 1
1 1121 . 45 1 1 A 99 99 GLN HA H 98 3.927 4.104 -0.177 1
1 1128 . 45 1 1 A 99 99 GLN C C 98 178.068 177.246 0.822 1
1 1129 . 45 1 1 A 99 99 GLN CA C 98 58.735 58.508 0.227 1
1 1130 . 45 1 1 A 99 99 GLN CB C 98 27.986 28.607 -0.621 1
1 1132 . 45 1 1 A 99 99 GLN N N 98 114.302 117.991 -3.689 1
1 1134 . 45 1 1 A 100 100 HIS H H 99 7.575 7.622 -0.047 1
1 1135 . 45 1 1 A 100 100 HIS HA H 99 4.524 4.519 0.005 1
1 1139 . 45 1 1 A 100 100 HIS C C 99 174.789 177.046 -2.257 1
1 1140 . 45 1 1 A 100 100 HIS CA C 99 56.154 57.367 -1.213 1
1 1141 . 45 1 1 A 100 100 HIS CB C 99 28.946 31.243 -2.297 1
1 1143 . 45 1 1 A 100 100 HIS N N 99 114.778 116.139 -1.361 1
1 1144 . 45 1 1 A 101 101 HIS H H 100 7.773 8.054 -0.281 1
1 1145 . 45 1 1 A 101 101 HIS HA H 100 4.704 3.940 0.764 1
1 1149 . 45 1 1 A 101 101 HIS C C 100 174.818 176.884 -2.066 1
1 1150 . 45 1 1 A 101 101 HIS CA C 100 54.830 58.148 -3.318 1
1 1151 . 45 1 1 A 101 101 HIS CB C 100 29.749 30.047 -0.298 1
1 1153 . 45 1 1 A 101 101 HIS N N 100 117.397 119.011 -1.614 1
1 1154 . 45 1 1 A 102 102 LYS H H 101 7.324 8.515 -1.191 1
1 1155 . 45 1 1 A 102 102 LYS HA H 101 3.611 4.066 -0.455 1
1 1164 . 45 1 1 A 102 102 LYS C C 101 176.823 177.074 -0.251 1
1 1165 . 45 1 1 A 102 102 LYS CA C 101 59.915 58.396 1.519 1
1 1166 . 45 1 1 A 102 102 LYS CB C 101 32.825 31.277 1.548 1
1 1170 . 45 1 1 A 102 102 LYS N N 101 120.533 117.040 3.493 1
1 1171 . 45 1 1 A 103 103 ASP H H 102 8.361 7.699 0.662 1
1 1172 . 45 1 1 A 103 103 ASP HA H 102 4.421 4.416 0.005 1
1 1175 . 45 1 1 A 103 103 ASP C C 102 176.793 176.557 0.236 1
1 1176 . 45 1 1 A 103 103 ASP CA C 102 55.500 55.915 -0.415 1
1 1177 . 45 1 1 A 103 103 ASP CB C 102 40.178 40.568 -0.390 1
1 1178 . 45 1 1 A 103 103 ASP N N 102 114.814 118.970 -4.156 1
1 1179 . 45 1 1 A 104 104 GLU H H 103 7.858 8.117 -0.259 1
1 1180 . 45 1 1 A 104 104 GLU HA H 103 4.339 4.498 -0.159 1
1 1183 . 45 1 1 A 104 104 GLU C C 103 175.777 176.287 -0.510 1
1 1184 . 45 1 1 A 104 104 GLU CA C 103 56.356 57.550 -1.194 1
1 1185 . 45 1 1 A 104 104 GLU CB C 103 31.293 32.223 -0.930 1
1 1186 . 45 1 1 A 104 104 GLU N N 103 116.826 118.512 -1.686 1
1 1187 . 45 1 1 A 105 105 VAL H H 104 7.201 7.539 -0.338 1
1 1188 . 45 1 1 A 105 105 VAL HA H 104 4.296 4.096 0.200 1
1 1196 . 45 1 1 A 105 105 VAL C C 104 174.482 175.623 -1.141 1
1 1197 . 45 1 1 A 105 105 VAL CA C 104 60.370 62.102 -1.732 1
1 1198 . 45 1 1 A 105 105 VAL CB C 104 34.341 33.435 0.906 1
1 1201 . 45 1 1 A 105 105 VAL N N 104 116.422 119.439 -3.017 1
1 1202 . 45 1 1 A 106 106 ALA H H 105 8.487 8.496 -0.009 1
1 1203 . 45 1 1 A 106 106 ALA HA H 105 4.172 4.372 -0.200 1
1 1207 . 45 1 1 A 106 106 ALA C C 105 179.030 178.662 0.368 1
1 1208 . 45 1 1 A 106 106 ALA CA C 105 52.966 52.467 0.499 1
1 1209 . 45 1 1 A 106 106 ALA CB C 105 19.371 19.306 0.065 1
1 1210 . 45 1 1 A 106 106 ALA N N 105 128.313 128.724 -0.411 1
1 1211 . 45 1 1 A 107 107 GLY H H 106 8.738 8.777 -0.039 1
1 1212 . 45 1 1 A 107 107 GLY HA2 H 106 3.773 3.866 -0.093 1
1 1213 . 45 1 1 A 107 107 GLY HA3 H 106 3.998 3.938 0.060 1
1 1214 . 45 1 1 A 107 107 GLY C C 106 174.958 175.852 -0.894 1
1 1215 . 45 1 1 A 107 107 GLY CA C 106 47.449 47.144 0.305 1
1 1216 . 45 1 1 A 107 107 GLY N N 106 110.612 110.783 -0.171 1
1 1217 . 45 1 1 A 108 108 ASP H H 107 8.535 8.453 0.082 1
1 1218 . 45 1 1 A 108 108 ASP HA H 107 4.333 4.344 -0.011 1
1 1221 . 45 1 1 A 108 108 ASP C C 107 179.133 178.240 0.893 1
1 1222 . 45 1 1 A 108 108 ASP CA C 107 56.721 56.702 0.019 1
1 1223 . 45 1 1 A 108 108 ASP CB C 107 39.336 39.716 -0.380 1
1 1224 . 45 1 1 A 108 108 ASP N N 107 117.474 121.020 -3.546 1
1 1225 . 45 1 1 A 109 109 ILE H H 108 7.459 7.856 -0.397 1
1 1226 . 45 1 1 A 109 109 ILE HA H 108 3.688 3.813 -0.125 1
1 1236 . 45 1 1 A 109 109 ILE C C 108 176.735 178.443 -1.708 1
1 1237 . 45 1 1 A 109 109 ILE CA C 108 63.474 65.405 -1.931 1
1 1238 . 45 1 1 A 109 109 ILE CB C 108 37.340 37.616 -0.276 1
1 1242 . 45 1 1 A 109 109 ILE N N 108 119.609 121.142 -1.533 1
1 1243 . 45 1 1 A 110 110 PHE H H 109 7.920 8.332 -0.412 1
1 1244 . 45 1 1 A 110 110 PHE HA H 109 3.759 4.096 -0.337 1
1 1252 . 45 1 1 A 110 110 PHE C C 109 177.132 177.395 -0.263 1
1 1253 . 45 1 1 A 110 110 PHE CA C 109 62.766 61.243 1.523 1
1 1254 . 45 1 1 A 110 110 PHE CB C 109 39.752 39.312 0.440 1
1 1260 . 45 1 1 A 110 110 PHE N N 109 120.906 120.468 0.438 1
1 1261 . 45 1 1 A 111 111 ASP H H 110 8.639 8.344 0.295 1
1 1262 . 45 1 1 A 111 111 ASP HA H 110 4.216 4.197 0.019 1
1 1265 . 45 1 1 A 111 111 ASP C C 110 178.900 178.414 0.486 1
1 1266 . 45 1 1 A 111 111 ASP CA C 110 57.105 57.257 -0.152 1
1 1267 . 45 1 1 A 111 111 ASP CB C 110 39.697 41.710 -2.013 1
1 1268 . 45 1 1 A 111 111 ASP N N 110 117.124 119.029 -1.905 1
1 1269 . 45 1 1 A 112 112 MET H H 111 7.331 7.545 -0.214 1
1 1270 . 45 1 1 A 112 112 MET HA H 111 4.081 4.120 -0.039 1
1 1278 . 45 1 1 A 112 112 MET C C 111 179.052 178.162 0.890 1
1 1279 . 45 1 1 A 112 112 MET CA C 111 58.202 58.116 0.086 1
1 1280 . 45 1 1 A 112 112 MET CB C 111 31.827 32.426 -0.599 1
1 1283 . 45 1 1 A 112 112 MET N N 111 118.061 119.443 -1.382 1
1 1284 . 45 1 1 A 113 113 LEU H H 112 8.001 8.044 -0.043 1
1 1285 . 45 1 1 A 113 113 LEU HA H 112 3.723 3.563 0.160 1
1 1295 . 45 1 1 A 113 113 LEU C C 112 179.747 178.643 1.104 1
1 1296 . 45 1 1 A 113 113 LEU CA C 112 57.371 57.396 -0.025 1
1 1297 . 45 1 1 A 113 113 LEU CB C 112 40.671 41.012 -0.341 1
1 1301 . 45 1 1 A 113 113 LEU N N 112 120.426 119.671 0.755 1
1 1302 . 45 1 1 A 114 114 LEU H H 113 7.744 7.619 0.125 1
1 1303 . 45 1 1 A 114 114 LEU HA H 113 4.007 3.521 0.486 1
1 1313 . 45 1 1 A 114 114 LEU C C 113 179.358 178.559 0.799 1
1 1314 . 45 1 1 A 114 114 LEU CA C 113 57.202 57.491 -0.289 1
1 1315 . 45 1 1 A 114 114 LEU CB C 113 41.727 41.600 0.127 1
1 1319 . 45 1 1 A 114 114 LEU N N 113 119.584 119.640 -0.056 1
1 1320 . 45 1 1 A 115 115 THR H H 114 7.353 7.620 -0.267 1
1 1321 . 45 1 1 A 115 115 THR HA H 114 4.071 4.137 -0.066 1
1 1327 . 45 1 1 A 115 115 THR C C 114 173.591 176.366 -2.775 1
1 1328 . 45 1 1 A 115 115 THR CA C 114 65.332 64.402 0.930 1
1 1329 . 45 1 1 A 115 115 THR CB C 114 70.319 68.761 1.558 1
1 1331 . 45 1 1 A 115 115 THR N N 114 107.535 112.381 -4.846 1
1 1332 . 45 1 1 A 116 116 PHE H H 115 6.979 7.797 -0.818 1
1 1333 . 45 1 1 A 116 116 PHE HA H 115 5.022 4.331 0.691 1
1 1341 . 45 1 1 A 116 116 PHE C C 115 176.488 176.360 0.128 1
1 1342 . 45 1 1 A 116 116 PHE CA C 115 55.911 61.037 -5.126 1
1 1343 . 45 1 1 A 116 116 PHE CB C 115 38.521 39.122 -0.601 1
1 1349 . 45 1 1 A 116 116 PHE N N 115 112.366 120.041 -7.675 1
1 1350 . 45 1 1 A 117 117 THR H H 116 7.564 7.995 -0.431 1
1 1351 . 45 1 1 A 117 117 THR HA H 116 4.626 4.906 -0.280 1
1 1356 . 45 1 1 A 117 117 THR C C 116 174.085 174.425 -0.340 1
1 1357 . 45 1 1 A 117 117 THR CA C 116 61.636 62.704 -1.068 1
1 1358 . 45 1 1 A 117 117 THR CB C 116 70.915 72.278 -1.363 1
1 1360 . 45 1 1 A 117 117 THR N N 116 105.498 112.294 -6.796 1
1 1361 . 45 1 1 A 118 118 ASP H H 117 8.270 7.501 0.769 1
1 1362 . 45 1 1 A 118 118 ASP HA H 117 4.955 4.944 0.011 1
1 1365 . 45 1 1 A 118 118 ASP C C 117 176.328 176.271 0.057 1
1 1366 . 45 1 1 A 118 118 ASP CA C 117 53.417 53.905 -0.488 1
1 1367 . 45 1 1 A 118 118 ASP CB C 117 43.388 39.235 4.153 1
1 1368 . 45 1 1 A 118 118 ASP N N 117 124.409 121.183 3.226 1
1 1369 . 45 1 1 A 119 119 PHE H H 118 8.973 8.744 0.229 1
1 1370 . 45 1 1 A 119 119 PHE HA H 118 3.506 4.158 -0.652 1
1 1378 . 45 1 1 A 119 119 PHE CA C 118 61.490 61.555 -0.065 1
1 1379 . 45 1 1 A 119 119 PHE CB C 118 39.246 39.474 -0.228 1
1 1385 . 45 1 1 A 119 119 PHE N N 118 126.688 125.919 0.769 1
1 1386 . 45 1 1 A 120 120 LEU H H 119 8.099 8.452 -0.353 1
1 1387 . 45 1 1 A 120 120 LEU HA H 119 3.842 3.979 -0.137 1
1 1397 . 45 1 1 A 120 120 LEU C C 119 179.601 179.469 0.132 1
1 1398 . 45 1 1 A 120 120 LEU CA C 119 58.174 57.974 0.200 1
1 1399 . 45 1 1 A 120 120 LEU CB C 119 40.315 41.342 -1.027 1
1 1403 . 45 1 1 A 120 120 LEU N N 119 117.930 120.236 -2.306 1
1 1404 . 45 1 1 A 121 121 ALA H H 120 7.729 7.628 0.101 1
1 1405 . 45 1 1 A 121 121 ALA HA H 120 3.996 4.150 -0.154 1
1 1409 . 45 1 1 A 121 121 ALA C C 120 180.995 179.747 1.248 1
1 1410 . 45 1 1 A 121 121 ALA CA C 120 54.832 54.652 0.180 1
1 1411 . 45 1 1 A 121 121 ALA CB C 120 17.706 18.301 -0.595 1
1 1412 . 45 1 1 A 121 121 ALA N N 120 123.195 121.386 1.809 1
1 1413 . 45 1 1 A 122 122 PHE H H 121 7.943 7.884 0.059 1
1 1414 . 45 1 1 A 122 122 PHE HA H 121 3.887 3.919 -0.032 1
1 1419 . 45 1 1 A 122 122 PHE C C 121 175.410 177.206 -1.796 1
1 1420 . 45 1 1 A 122 122 PHE CA C 121 61.075 60.773 0.302 1
1 1421 . 45 1 1 A 122 122 PHE CB C 121 38.115 38.830 -0.715 1
1 1424 . 45 1 1 A 122 122 PHE N N 121 121.798 120.200 1.598 1
1 1425 . 45 1 1 A 123 123 LYS H H 122 8.468 7.977 0.491 1
1 1426 . 45 1 1 A 123 123 LYS HA H 122 3.077 3.954 -0.877 1
1 1435 . 45 1 1 A 123 123 LYS C C 122 178.453 178.592 -0.139 1
1 1436 . 45 1 1 A 123 123 LYS CA C 122 59.855 59.293 0.562 1
1 1437 . 45 1 1 A 123 123 LYS CB C 122 32.374 32.361 0.013 1
1 1441 . 45 1 1 A 123 123 LYS N N 122 120.614 118.134 2.480 1
1 1442 . 45 1 1 A 124 124 GLU H H 123 8.100 8.049 0.051 1
1 1443 . 45 1 1 A 124 124 GLU HA H 123 3.652 4.053 -0.401 1
1 1448 . 45 1 1 A 124 124 GLU C C 123 177.743 178.597 -0.854 1
1 1449 . 45 1 1 A 124 124 GLU CA C 123 59.406 59.400 0.006 1
1 1450 . 45 1 1 A 124 124 GLU CB C 123 28.811 29.481 -0.670 1
1 1452 . 45 1 1 A 124 124 GLU N N 123 117.404 119.472 -2.068 1
1 1453 . 45 1 1 A 125 125 MET H H 124 7.537 7.521 0.016 1
1 1454 . 45 1 1 A 125 125 MET HA H 124 3.860 4.026 -0.166 1
1 1462 . 45 1 1 A 125 125 MET C C 124 179.522 178.261 1.261 1
1 1463 . 45 1 1 A 125 125 MET CA C 124 58.832 58.268 0.564 1
1 1464 . 45 1 1 A 125 125 MET CB C 124 31.765 31.644 0.121 1
1 1467 . 45 1 1 A 125 125 MET N N 124 119.413 119.182 0.231 1
1 1468 . 45 1 1 A 126 126 PHE H H 125 7.148 7.573 -0.425 1
1 1469 . 45 1 1 A 126 126 PHE HA H 125 3.633 4.210 -0.577 1
1 1476 . 45 1 1 A 126 126 PHE C C 125 178.994 178.290 0.704 1
1 1477 . 45 1 1 A 126 126 PHE CA C 125 63.148 61.065 2.083 1
1 1478 . 45 1 1 A 126 126 PHE CB C 125 39.830 38.804 1.026 1
1 1483 . 45 1 1 A 126 126 PHE N N 125 120.013 118.974 1.039 1
1 1484 . 45 1 1 A 127 127 LEU H H 126 8.369 8.778 -0.409 1
1 1485 . 45 1 1 A 127 127 LEU HA H 126 3.972 4.066 -0.094 1
1 1495 . 45 1 1 A 127 127 LEU C C 126 180.621 178.995 1.626 1
1 1496 . 45 1 1 A 127 127 LEU CA C 126 57.944 57.965 -0.021 1
1 1497 . 45 1 1 A 127 127 LEU CB C 126 40.543 41.298 -0.755 1
1 1501 . 45 1 1 A 127 127 LEU N N 126 119.692 119.804 -0.112 1
1 1502 . 45 1 1 A 128 128 ASP H H 127 8.578 8.082 0.496 1
1 1503 . 45 1 1 A 128 128 ASP HA H 127 4.308 4.325 -0.017 1
1 1506 . 45 1 1 A 128 128 ASP C C 127 178.254 178.038 0.216 1
1 1507 . 45 1 1 A 128 128 ASP CA C 127 56.964 57.348 -0.384 1
1 1508 . 45 1 1 A 128 128 ASP CB C 127 39.735 41.199 -1.464 1
1 1509 . 45 1 1 A 128 128 ASP N N 127 121.926 119.322 2.604 1
1 1510 . 45 1 1 A 129 129 TYR H H 128 7.710 8.295 -0.585 1
1 1511 . 45 1 1 A 129 129 TYR HA H 128 3.908 4.073 -0.165 1
1 1518 . 45 1 1 A 129 129 TYR C C 128 177.633 177.467 0.166 1
1 1519 . 45 1 1 A 129 129 TYR CA C 128 61.796 61.254 0.542 1
1 1520 . 45 1 1 A 129 129 TYR CB C 128 39.372 38.465 0.907 1
1 1525 . 45 1 1 A 129 129 TYR N N 128 122.548 120.226 2.322 1
1 1526 . 45 1 1 A 130 130 ARG H H 129 8.622 8.380 0.242 1
1 1527 . 45 1 1 A 130 130 ARG HA H 129 3.722 3.695 0.027 1
1 1535 . 45 1 1 A 130 130 ARG CA C 129 60.084 59.888 0.196 1
1 1536 . 45 1 1 A 130 130 ARG CB C 129 29.902 29.942 -0.040 1
1 1539 . 45 1 1 A 130 130 ARG N N 129 118.302 119.431 -1.129 1
1 1541 . 45 1 1 A 131 131 ALA H H 130 7.936 7.924 0.012 1
1 1542 . 45 1 1 A 131 131 ALA HA H 130 3.997 4.012 -0.015 1
1 1546 . 45 1 1 A 131 131 ALA C C 130 180.456 180.119 0.337 1
1 1547 . 45 1 1 A 131 131 ALA CA C 130 55.133 55.034 0.099 1
1 1548 . 45 1 1 A 131 131 ALA CB C 130 17.750 18.453 -0.703 1
1 1549 . 45 1 1 A 131 131 ALA N N 130 119.788 120.592 -0.804 1
1 1550 . 45 1 1 A 132 132 GLU H H 131 7.622 7.912 -0.290 1
1 1551 . 45 1 1 A 132 132 GLU HA H 131 3.862 3.920 -0.058 1
1 1556 . 45 1 1 A 132 132 GLU C C 131 179.528 179.098 0.430 1
1 1557 . 45 1 1 A 132 132 GLU CA C 131 58.849 59.429 -0.580 1
1 1558 . 45 1 1 A 132 132 GLU CB C 131 28.930 29.016 -0.086 1
1 1560 . 45 1 1 A 132 132 GLU N N 131 118.428 117.989 0.439 1
1 1561 . 45 1 1 A 133 133 LYS H H 132 7.853 7.626 0.227 1
1 1562 . 45 1 1 A 133 133 LYS HA H 132 3.722 4.055 -0.333 1
1 1571 . 45 1 1 A 133 133 LYS C C 132 175.725 178.131 -2.406 1
1 1572 . 45 1 1 A 133 133 LYS CA C 132 57.544 58.839 -1.295 1
1 1573 . 45 1 1 A 133 133 LYS CB C 132 31.770 32.102 -0.332 1
1 1577 . 45 1 1 A 133 133 LYS N N 132 119.473 118.711 0.762 1
1 1578 . 45 1 1 A 134 134 GLU H H 133 8.151 7.916 0.235 1
1 1579 . 45 1 1 A 134 134 GLU HA H 133 4.161 4.428 -0.267 1
1 1584 . 45 1 1 A 134 134 GLU C C 133 177.453 177.588 -0.135 1
1 1585 . 45 1 1 A 134 134 GLU CA C 133 57.222 56.611 0.611 1
1 1586 . 45 1 1 A 134 134 GLU CB C 133 30.091 29.864 0.227 1
1 1588 . 45 1 1 A 134 134 GLU N N 133 116.525 117.401 -0.876 1
1 1589 . 45 1 1 A 135 135 GLY H H 134 7.702 7.580 0.122 1
1 1590 . 45 1 1 A 135 135 GLY HA2 H 134 3.896 4.050 -0.154 1
1 1591 . 45 1 1 A 135 135 GLY HA3 H 134 3.897 4.058 -0.161 1
1 1592 . 45 1 1 A 135 135 GLY C C 134 174.538 175.268 -0.730 1
1 1593 . 45 1 1 A 135 135 GLY CA C 134 45.975 45.590 0.385 1
1 1594 . 45 1 1 A 135 135 GLY N N 134 107.924 108.245 -0.321 1
1 1595 . 45 1 1 A 136 136 ARG H H 135 8.045 7.639 0.406 1
1 1596 . 45 1 1 A 136 136 ARG HA H 135 4.323 4.126 0.197 1
1 1604 . 45 1 1 A 136 136 ARG C C 135 175.864 178.604 -2.740 1
1 1605 . 45 1 1 A 136 136 ARG CA C 135 56.016 58.885 -2.869 1
1 1606 . 45 1 1 A 136 136 ARG CB C 135 30.987 29.627 1.360 1
1 1609 . 45 1 1 A 136 136 ARG N N 135 119.708 121.445 -1.737 1
1 1 . 46 1 1 A 14 14 PHE CA C 13 58.199 56.675 1.524 1
1 2 . 46 1 1 A 14 14 PHE CB C 13 39.717 41.480 -1.763 1
1 3 . 46 1 1 A 15 15 SER H H 14 8.299 9.068 -0.769 1
1 4 . 46 1 1 A 15 15 SER HA H 14 4.359 4.437 -0.078 1
1 7 . 46 1 1 A 15 15 SER CA C 14 58.249 60.320 -2.071 1
1 8 . 46 1 1 A 15 15 SER CB C 14 63.936 62.740 1.196 1
1 9 . 46 1 1 A 15 15 SER N N 14 117.379 121.681 -4.302 1
1 10 . 46 1 1 A 16 16 SER H H 15 8.255 8.402 -0.147 1
1 11 . 46 1 1 A 16 16 SER HA H 15 3.729 4.180 -0.451 1
1 14 . 46 1 1 A 16 16 SER CA C 15 58.224 60.941 -2.717 1
1 15 . 46 1 1 A 16 16 SER CB C 15 63.886 61.813 2.073 1
1 16 . 46 1 1 A 16 16 SER N N 15 117.694 116.055 1.639 1
1 17 . 46 1 1 A 17 17 ALA H H 16 8.333 8.460 -0.127 1
1 18 . 46 1 1 A 17 17 ALA HA H 16 4.252 4.091 0.161 1
1 22 . 46 1 1 A 17 17 ALA CA C 16 53.377 54.936 -1.559 1
1 23 . 46 1 1 A 17 17 ALA CB C 16 18.896 18.457 0.439 1
1 24 . 46 1 1 A 17 17 ALA N N 16 125.462 124.569 0.893 1
1 25 . 46 1 1 A 18 18 SER H H 17 8.219 7.857 0.362 1
1 26 . 46 1 1 A 18 18 SER HA H 17 4.332 4.539 -0.207 1
1 29 . 46 1 1 A 18 18 SER CA C 17 59.105 58.063 1.042 1
1 30 . 46 1 1 A 18 18 SER CB C 17 63.592 63.386 0.206 1
1 31 . 46 1 1 A 18 18 SER N N 17 114.821 108.452 6.369 1
1 32 . 46 1 1 A 19 19 ASP H H 18 8.309 7.810 0.499 1
1 33 . 46 1 1 A 19 19 ASP HA H 18 4.554 5.067 -0.513 1
1 36 . 46 1 1 A 19 19 ASP C C 18 176.528 176.122 0.406 1
1 37 . 46 1 1 A 19 19 ASP CA C 18 55.272 52.390 2.882 1
1 38 . 46 1 1 A 19 19 ASP CB C 18 40.883 44.241 -3.358 1
1 39 . 46 1 1 A 19 19 ASP N N 18 123.367 121.481 1.886 1
1 40 . 46 1 1 A 20 20 ALA H H 19 8.133 8.835 -0.702 1
1 41 . 46 1 1 A 20 20 ALA HA H 19 4.170 4.088 0.082 1
1 45 . 46 1 1 A 20 20 ALA C C 19 179.857 179.408 0.449 1
1 46 . 46 1 1 A 20 20 ALA CA C 19 54.341 55.201 -0.860 1
1 47 . 46 1 1 A 20 20 ALA CB C 19 18.660 18.473 0.187 1
1 48 . 46 1 1 A 20 20 ALA N N 19 123.350 126.002 -2.652 1
1 49 . 46 1 1 A 21 21 GLU H H 20 8.140 7.965 0.175 1
1 50 . 46 1 1 A 21 21 GLU HA H 20 4.128 4.080 0.048 1
1 55 . 46 1 1 A 21 21 GLU C C 20 177.675 178.532 -0.857 1
1 56 . 46 1 1 A 21 21 GLU CA C 20 58.520 59.523 -1.003 1
1 57 . 46 1 1 A 21 21 GLU CB C 20 29.765 29.518 0.247 1
1 59 . 46 1 1 A 21 21 GLU N N 20 119.063 119.412 -0.349 1
1 60 . 46 1 1 A 22 22 PHE H H 21 8.009 7.993 0.016 1
1 61 . 46 1 1 A 22 22 PHE HA H 21 4.123 4.321 -0.198 1
1 68 . 46 1 1 A 22 22 PHE C C 21 176.410 176.941 -0.531 1
1 69 . 46 1 1 A 22 22 PHE CA C 21 62.202 61.275 0.927 1
1 70 . 46 1 1 A 22 22 PHE CB C 21 39.223 39.158 0.065 1
1 75 . 46 1 1 A 22 22 PHE N N 21 121.211 120.924 0.287 1
1 76 . 46 1 1 A 23 23 ASP H H 22 8.261 8.469 -0.208 1
1 77 . 46 1 1 A 23 23 ASP HA H 22 4.041 4.205 -0.164 1
1 80 . 46 1 1 A 23 23 ASP C C 22 179.078 178.682 0.396 1
1 81 . 46 1 1 A 23 23 ASP CA C 22 57.048 57.232 -0.184 1
1 82 . 46 1 1 A 23 23 ASP CB C 22 40.154 40.048 0.106 1
1 83 . 46 1 1 A 23 23 ASP N N 22 116.876 118.403 -1.527 1
1 84 . 46 1 1 A 24 24 ALA H H 23 7.651 7.573 0.078 1
1 85 . 46 1 1 A 24 24 ALA HA H 23 3.785 3.872 -0.087 1
1 89 . 46 1 1 A 24 24 ALA C C 23 179.577 179.660 -0.083 1
1 90 . 46 1 1 A 24 24 ALA CA C 23 54.341 55.017 -0.676 1
1 91 . 46 1 1 A 24 24 ALA CB C 23 17.762 18.324 -0.562 1
1 92 . 46 1 1 A 24 24 ALA N N 23 121.873 122.269 -0.396 1
1 93 . 46 1 1 A 25 25 VAL H H 24 7.718 7.787 -0.069 1
1 94 . 46 1 1 A 25 25 VAL HA H 24 3.216 3.505 -0.289 1
1 102 . 46 1 1 A 25 25 VAL C C 24 177.805 178.237 -0.432 1
1 103 . 46 1 1 A 25 25 VAL CA C 24 66.789 66.785 0.004 1
1 104 . 46 1 1 A 25 25 VAL CB C 24 31.277 31.175 0.102 1
1 107 . 46 1 1 A 25 25 VAL N N 24 117.890 118.488 -0.598 1
1 108 . 46 1 1 A 26 26 VAL H H 25 7.867 7.632 0.235 1
1 109 . 46 1 1 A 26 26 VAL HA H 25 3.274 3.463 -0.189 1
1 117 . 46 1 1 A 26 26 VAL C C 25 177.788 177.717 0.071 1
1 118 . 46 1 1 A 26 26 VAL CA C 25 67.282 66.293 0.989 1
1 119 . 46 1 1 A 26 26 VAL CB C 25 31.266 31.267 -0.001 1
1 122 . 46 1 1 A 26 26 VAL N N 25 118.170 119.592 -1.422 1
1 123 . 46 1 1 A 27 27 GLY H H 26 7.544 7.561 -0.017 1
1 124 . 46 1 1 A 27 27 GLY HA2 H 26 3.592 3.465 0.127 1
1 125 . 46 1 1 A 27 27 GLY HA3 H 26 3.721 3.592 0.129 1
1 126 . 46 1 1 A 27 27 GLY C C 26 176.717 176.351 0.366 1
1 127 . 46 1 1 A 27 27 GLY CA C 26 47.085 47.140 -0.055 1
1 128 . 46 1 1 A 27 27 GLY N N 26 105.795 107.572 -1.777 1
1 129 . 46 1 1 A 28 28 TYR H H 27 7.625 7.341 0.284 1
1 130 . 46 1 1 A 28 28 TYR HA H 27 4.546 4.554 -0.008 1
1 137 . 46 1 1 A 28 28 TYR C C 27 178.991 178.266 0.725 1
1 138 . 46 1 1 A 28 28 TYR CA C 27 58.845 59.797 -0.952 1
1 139 . 46 1 1 A 28 28 TYR CB C 27 37.602 37.545 0.057 1
1 144 . 46 1 1 A 28 28 TYR N N 27 119.933 121.653 -1.720 1
1 145 . 46 1 1 A 29 29 LEU H H 28 8.517 8.032 0.485 1
1 146 . 46 1 1 A 29 29 LEU HA H 28 3.728 3.809 -0.081 1
1 156 . 46 1 1 A 29 29 LEU CA C 28 58.281 57.958 0.323 1
1 157 . 46 1 1 A 29 29 LEU CB C 28 41.948 41.303 0.645 1
1 161 . 46 1 1 A 29 29 LEU N N 28 119.669 120.545 -0.876 1
1 162 . 46 1 1 A 30 30 GLU H H 29 8.072 7.980 0.092 1
1 163 . 46 1 1 A 30 30 GLU HA H 29 3.722 3.915 -0.193 1
1 168 . 46 1 1 A 30 30 GLU C C 29 177.731 179.111 -1.380 1
1 169 . 46 1 1 A 30 30 GLU CA C 29 59.763 59.837 -0.074 1
1 170 . 46 1 1 A 30 30 GLU CB C 29 28.844 29.245 -0.401 1
1 172 . 46 1 1 A 30 30 GLU N N 29 117.666 117.815 -0.149 1
1 173 . 46 1 1 A 31 31 ASP H H 30 7.243 7.721 -0.478 1
1 174 . 46 1 1 A 31 31 ASP HA H 30 4.297 4.355 -0.058 1
1 177 . 46 1 1 A 31 31 ASP CA C 30 56.953 57.444 -0.491 1
1 178 . 46 1 1 A 31 31 ASP CB C 30 40.730 40.998 -0.268 1
1 179 . 46 1 1 A 31 31 ASP N N 30 116.720 119.413 -2.693 1
1 180 . 46 1 1 A 32 32 ILE H H 31 7.940 7.570 0.370 1
1 181 . 46 1 1 A 32 32 ILE HA H 31 3.640 3.686 -0.046 1
1 191 . 46 1 1 A 32 32 ILE C C 31 177.980 178.277 -0.297 1
1 192 . 46 1 1 A 32 32 ILE CA C 31 64.692 64.309 0.383 1
1 193 . 46 1 1 A 32 32 ILE CB C 31 38.938 37.316 1.622 1
1 197 . 46 1 1 A 32 32 ILE N N 31 119.728 119.919 -0.191 1
1 198 . 46 1 1 A 33 33 ILE H H 32 7.984 7.827 0.157 1
1 199 . 46 1 1 A 33 33 ILE HA H 32 3.598 3.398 0.200 1
1 209 . 46 1 1 A 33 33 ILE C C 32 176.723 176.966 -0.243 1
1 210 . 46 1 1 A 33 33 ILE CA C 32 63.241 64.776 -1.535 1
1 211 . 46 1 1 A 33 33 ILE CB C 32 37.580 37.980 -0.400 1
1 215 . 46 1 1 A 33 33 ILE N N 32 113.919 121.009 -7.090 1
1 216 . 46 1 1 A 34 34 MET H H 33 7.288 7.884 -0.596 1
1 217 . 46 1 1 A 34 34 MET HA H 33 4.496 4.520 -0.024 1
1 225 . 46 1 1 A 34 34 MET C C 33 176.423 176.084 0.339 1
1 226 . 46 1 1 A 34 34 MET CA C 33 54.634 55.325 -0.691 1
1 227 . 46 1 1 A 34 34 MET CB C 33 31.934 32.584 -0.650 1
1 230 . 46 1 1 A 34 34 MET N N 33 115.130 117.016 -1.886 1
1 231 . 46 1 1 A 35 35 ASP H H 34 7.405 7.662 -0.257 1
1 232 . 46 1 1 A 35 35 ASP HA H 34 4.484 4.493 -0.009 1
1 235 . 46 1 1 A 35 35 ASP C C 34 177.139 176.555 0.584 1
1 236 . 46 1 1 A 35 35 ASP CA C 34 54.625 54.779 -0.154 1
1 237 . 46 1 1 A 35 35 ASP CB C 34 43.554 42.758 0.796 1
1 238 . 46 1 1 A 35 35 ASP N N 34 121.814 121.610 0.204 1
1 239 . 46 1 1 A 36 36 ASP H H 35 8.765 9.144 -0.379 1
1 240 . 46 1 1 A 36 36 ASP HA H 35 4.235 4.278 -0.043 1
1 243 . 46 1 1 A 36 36 ASP C C 35 178.320 178.077 0.243 1
1 244 . 46 1 1 A 36 36 ASP CA C 35 57.832 58.445 -0.613 1
1 245 . 46 1 1 A 36 36 ASP CB C 35 40.914 41.324 -0.410 1
1 246 . 46 1 1 A 36 36 ASP N N 35 125.883 128.613 -2.730 1
1 247 . 46 1 1 A 37 37 GLU H H 36 8.905 8.409 0.496 1
1 248 . 46 1 1 A 37 37 GLU HA H 36 3.933 3.971 -0.038 1
1 253 . 46 1 1 A 37 37 GLU C C 36 179.304 179.065 0.239 1
1 254 . 46 1 1 A 37 37 GLU CA C 36 59.828 59.336 0.492 1
1 255 . 46 1 1 A 37 37 GLU CB C 36 29.380 29.437 -0.057 1
1 257 . 46 1 1 A 37 37 GLU N N 36 119.077 118.988 0.089 1
1 258 . 46 1 1 A 38 38 PHE H H 37 7.460 8.271 -0.811 1
1 259 . 46 1 1 A 38 38 PHE HA H 37 3.642 4.042 -0.400 1
1 267 . 46 1 1 A 38 38 PHE C C 37 176.483 177.916 -1.433 1
1 268 . 46 1 1 A 38 38 PHE CA C 37 61.411 61.364 0.047 1
1 269 . 46 1 1 A 38 38 PHE CB C 37 39.355 39.179 0.176 1
1 275 . 46 1 1 A 38 38 PHE N N 37 119.968 120.469 -0.501 1
1 276 . 46 1 1 A 39 39 GLN H H 38 7.968 8.047 -0.079 1
1 277 . 46 1 1 A 39 39 GLN HA H 38 3.712 3.725 -0.013 1
1 284 . 46 1 1 A 39 39 GLN CA C 38 59.153 58.782 0.371 1
1 285 . 46 1 1 A 39 39 GLN CB C 38 28.213 28.235 -0.022 1
1 287 . 46 1 1 A 39 39 GLN N N 38 116.433 118.312 -1.879 1
1 289 . 46 1 1 A 40 40 LEU H H 39 7.930 7.644 0.286 1
1 290 . 46 1 1 A 40 40 LEU HA H 39 3.916 4.019 -0.103 1
1 300 . 46 1 1 A 40 40 LEU C C 39 177.731 178.047 -0.316 1
1 301 . 46 1 1 A 40 40 LEU CA C 39 57.915 57.935 -0.020 1
1 302 . 46 1 1 A 40 40 LEU CB C 39 41.989 41.491 0.498 1
1 306 . 46 1 1 A 40 40 LEU N N 39 119.505 121.355 -1.850 1
1 307 . 46 1 1 A 41 41 LEU H H 40 7.174 7.620 -0.446 1
1 308 . 46 1 1 A 41 41 LEU HA H 40 3.835 3.915 -0.080 1
1 318 . 46 1 1 A 41 41 LEU C C 40 179.738 178.306 1.432 1
1 319 . 46 1 1 A 41 41 LEU CA C 40 58.266 58.276 -0.010 1
1 320 . 46 1 1 A 41 41 LEU CB C 40 42.050 41.151 0.899 1
1 324 . 46 1 1 A 41 41 LEU N N 40 120.971 119.726 1.245 1
1 325 . 46 1 1 A 42 42 GLN H H 41 8.058 7.761 0.297 1
1 326 . 46 1 1 A 42 42 GLN HA H 41 3.556 3.718 -0.162 1
1 333 . 46 1 1 A 42 42 GLN C C 41 177.642 178.422 -0.780 1
1 334 . 46 1 1 A 42 42 GLN CA C 41 59.826 59.109 0.717 1
1 335 . 46 1 1 A 42 42 GLN CB C 41 28.762 27.967 0.795 1
1 337 . 46 1 1 A 42 42 GLN N N 41 117.899 117.669 0.230 1
1 339 . 46 1 1 A 43 43 ARG H H 42 8.179 7.886 0.293 1
1 340 . 46 1 1 A 43 43 ARG HA H 42 3.655 3.945 -0.290 1
1 347 . 46 1 1 A 43 43 ARG C C 42 178.051 178.652 -0.601 1
1 348 . 46 1 1 A 43 43 ARG CA C 42 59.766 59.149 0.617 1
1 349 . 46 1 1 A 43 43 ARG CB C 42 29.941 29.880 0.061 1
1 352 . 46 1 1 A 43 43 ARG N N 42 119.392 118.501 0.891 1
1 353 . 46 1 1 A 44 44 ASN H H 43 8.525 8.121 0.404 1
1 354 . 46 1 1 A 44 44 ASN HA H 43 4.332 4.382 -0.050 1
1 359 . 46 1 1 A 44 44 ASN C C 43 178.150 177.762 0.388 1
1 360 . 46 1 1 A 44 44 ASN CA C 43 55.841 56.166 -0.325 1
1 361 . 46 1 1 A 44 44 ASN CB C 43 37.632 39.213 -1.581 1
1 362 . 46 1 1 A 44 44 ASN N N 43 116.214 117.593 -1.379 1
1 364 . 46 1 1 A 45 45 PHE H H 44 7.586 7.728 -0.142 1
1 365 . 46 1 1 A 45 45 PHE HA H 44 4.132 4.314 -0.182 1
1 372 . 46 1 1 A 45 45 PHE C C 44 176.691 178.307 -1.616 1
1 373 . 46 1 1 A 45 45 PHE CA C 44 62.333 60.626 1.707 1
1 374 . 46 1 1 A 45 45 PHE CB C 44 39.449 38.783 0.666 1
1 379 . 46 1 1 A 45 45 PHE N N 44 121.501 117.405 4.096 1
1 380 . 46 1 1 A 46 46 MET H H 45 8.190 8.494 -0.304 1
1 381 . 46 1 1 A 46 46 MET HA H 45 4.060 4.322 -0.262 1
1 389 . 46 1 1 A 46 46 MET C C 45 179.754 178.196 1.558 1
1 390 . 46 1 1 A 46 46 MET CA C 45 57.742 57.945 -0.203 1
1 391 . 46 1 1 A 46 46 MET CB C 45 29.912 31.294 -1.382 1
1 394 . 46 1 1 A 46 46 MET N N 45 116.727 117.509 -0.782 1
1 395 . 46 1 1 A 47 47 ASP H H 46 8.579 8.235 0.344 1
1 396 . 46 1 1 A 47 47 ASP HA H 46 4.804 4.642 0.162 1
1 399 . 46 1 1 A 47 47 ASP C C 46 177.854 177.653 0.201 1
1 400 . 46 1 1 A 47 47 ASP CA C 46 57.277 57.267 0.010 1
1 401 . 46 1 1 A 47 47 ASP CB C 46 40.776 41.625 -0.849 1
1 402 . 46 1 1 A 47 47 ASP N N 46 117.798 120.860 -3.062 1
1 403 . 46 1 1 A 48 48 LYS H H 47 7.339 7.751 -0.412 1
1 404 . 46 1 1 A 48 48 LYS HA H 47 3.828 4.366 -0.538 1
1 413 . 46 1 1 A 48 48 LYS C C 47 178.812 178.641 0.171 1
1 414 . 46 1 1 A 48 48 LYS CA C 47 58.953 57.374 1.579 1
1 415 . 46 1 1 A 48 48 LYS CB C 47 32.796 33.478 -0.682 1
1 419 . 46 1 1 A 48 48 LYS N N 47 117.852 117.535 0.317 1
1 420 . 46 1 1 A 49 49 TYR H H 48 6.841 8.741 -1.900 1
1 421 . 46 1 1 A 49 49 TYR HA H 48 4.995 4.312 0.683 1
1 428 . 46 1 1 A 49 49 TYR C C 48 178.138 178.595 -0.457 1
1 429 . 46 1 1 A 49 49 TYR CA C 48 58.620 59.856 -1.236 1
1 430 . 46 1 1 A 49 49 TYR CB C 48 42.939 38.443 4.496 1
1 435 . 46 1 1 A 49 49 TYR N N 48 112.109 119.200 -7.091 1
1 436 . 46 1 1 A 50 50 TYR H H 49 8.491 8.249 0.242 1
1 437 . 46 1 1 A 50 50 TYR HA H 49 4.598 4.085 0.513 1
1 444 . 46 1 1 A 50 50 TYR C C 49 176.015 177.766 -1.751 1
1 445 . 46 1 1 A 50 50 TYR CA C 49 62.442 59.563 2.879 1
1 446 . 46 1 1 A 50 50 TYR CB C 49 36.588 36.909 -0.321 1
1 451 . 46 1 1 A 50 50 TYR N N 49 118.294 119.267 -0.973 1
1 452 . 46 1 1 A 51 51 LEU H H 50 7.512 7.500 0.012 1
1 453 . 46 1 1 A 51 51 LEU HA H 50 3.878 3.509 0.369 1
1 463 . 46 1 1 A 51 51 LEU C C 50 178.625 178.536 0.089 1
1 464 . 46 1 1 A 51 51 LEU CA C 50 55.994 57.335 -1.341 1
1 465 . 46 1 1 A 51 51 LEU CB C 50 40.743 41.428 -0.685 1
1 469 . 46 1 1 A 51 51 LEU N N 50 118.478 121.991 -3.513 1
1 470 . 46 1 1 A 52 52 GLU H H 51 8.042 7.712 0.330 1
1 471 . 46 1 1 A 52 52 GLU HA H 51 4.197 3.898 0.299 1
1 476 . 46 1 1 A 52 52 GLU C C 51 177.629 177.724 -0.095 1
1 477 . 46 1 1 A 52 52 GLU CA C 51 56.141 59.502 -3.361 1
1 478 . 46 1 1 A 52 52 GLU CB C 51 29.162 29.033 0.129 1
1 480 . 46 1 1 A 52 52 GLU N N 51 115.067 117.749 -2.682 1
1 481 . 46 1 1 A 53 53 PHE H H 52 7.465 7.691 -0.226 1
1 482 . 46 1 1 A 53 53 PHE HA H 52 4.431 4.340 0.091 1
1 490 . 46 1 1 A 53 53 PHE C C 52 174.325 174.612 -0.287 1
1 491 . 46 1 1 A 53 53 PHE CA C 52 58.986 57.203 1.783 1
1 492 . 46 1 1 A 53 53 PHE CB C 52 40.183 37.583 2.600 1
1 498 . 46 1 1 A 53 53 PHE N N 52 116.768 118.648 -1.880 1
1 499 . 46 1 1 A 54 54 GLU H H 53 7.484 7.723 -0.239 1
1 500 . 46 1 1 A 54 54 GLU HA H 53 4.583 4.904 -0.321 1
1 505 . 46 1 1 A 54 54 GLU C C 53 175.722 175.255 0.467 1
1 506 . 46 1 1 A 54 54 GLU CA C 53 54.248 55.548 -1.300 1
1 507 . 46 1 1 A 54 54 GLU CB C 53 34.409 31.382 3.027 1
1 509 . 46 1 1 A 54 54 GLU N N 53 118.844 122.345 -3.501 1
1 510 . 46 1 1 A 55 55 ASP H H 54 9.008 8.723 0.285 1
1 511 . 46 1 1 A 55 55 ASP HA H 54 4.735 4.805 -0.070 1
1 514 . 46 1 1 A 55 55 ASP C C 54 175.421 175.975 -0.554 1
1 515 . 46 1 1 A 55 55 ASP CA C 54 52.888 54.608 -1.720 1
1 516 . 46 1 1 A 55 55 ASP CB C 54 38.894 40.858 -1.964 1
1 517 . 46 1 1 A 55 55 ASP N N 54 123.654 123.769 -0.115 1
1 518 . 46 1 1 A 56 56 THR H H 55 7.819 8.351 -0.532 1
1 519 . 46 1 1 A 56 56 THR HA H 55 4.574 4.900 -0.326 1
1 524 . 46 1 1 A 56 56 THR C C 55 174.096 174.652 -0.556 1
1 525 . 46 1 1 A 56 56 THR CA C 55 59.172 59.551 -0.379 1
1 526 . 46 1 1 A 56 56 THR CB C 55 71.889 72.435 -0.546 1
1 528 . 46 1 1 A 56 56 THR N N 55 112.015 118.069 -6.054 1
1 529 . 46 1 1 A 57 57 GLU H H 56 8.527 8.897 -0.370 1
1 530 . 46 1 1 A 57 57 GLU HA H 56 4.217 4.400 -0.183 1
1 535 . 46 1 1 A 57 57 GLU C C 56 177.042 176.710 0.332 1
1 536 . 46 1 1 A 57 57 GLU CA C 56 56.869 58.377 -1.508 1
1 537 . 46 1 1 A 57 57 GLU CB C 56 29.731 31.123 -1.392 1
1 539 . 46 1 1 A 57 57 GLU N N 56 117.531 118.916 -1.385 1
1 540 . 46 1 1 A 58 58 GLU H H 57 7.587 7.810 -0.223 1
1 541 . 46 1 1 A 58 58 GLU HA H 57 3.941 4.765 -0.824 1
1 546 . 46 1 1 A 58 58 GLU C C 57 176.849 175.321 1.528 1
1 547 . 46 1 1 A 58 58 GLU CA C 57 56.924 54.997 1.927 1
1 548 . 46 1 1 A 58 58 GLU CB C 57 30.251 32.463 -2.212 1
1 550 . 46 1 1 A 58 58 GLU N N 57 119.183 120.169 -0.986 1
1 551 . 46 1 1 A 59 59 ASN H H 58 9.120 8.532 0.588 1
1 552 . 46 1 1 A 59 59 ASN HA H 58 4.922 4.445 0.477 1
1 557 . 46 1 1 A 59 59 ASN C C 58 174.254 175.546 -1.292 1
1 558 . 46 1 1 A 59 59 ASN CA C 58 51.956 53.626 -1.670 1
1 559 . 46 1 1 A 59 59 ASN CB C 58 37.404 38.807 -1.403 1
1 560 . 46 1 1 A 59 59 ASN N N 58 126.767 125.453 1.314 1
1 562 . 46 1 1 A 60 60 LYS H H 59 5.892 8.833 -2.941 1
1 563 . 46 1 1 A 60 60 LYS HA H 59 3.798 4.533 -0.735 1
1 572 . 46 1 1 A 60 60 LYS C C 59 177.908 178.388 -0.480 1
1 573 . 46 1 1 A 60 60 LYS CA C 59 56.623 55.681 0.942 1
1 574 . 46 1 1 A 60 60 LYS CB C 59 32.279 33.651 -1.372 1
1 578 . 46 1 1 A 60 60 LYS N N 59 121.527 122.123 -0.596 1
1 579 . 46 1 1 A 61 61 LEU H H 60 8.473 8.920 -0.447 1
1 580 . 46 1 1 A 61 61 LEU HA H 60 3.891 4.209 -0.318 1
1 590 . 46 1 1 A 61 61 LEU C C 60 179.843 178.281 1.562 1
1 591 . 46 1 1 A 61 61 LEU CA C 60 58.301 57.314 0.987 1
1 592 . 46 1 1 A 61 61 LEU CB C 60 41.305 41.853 -0.548 1
1 596 . 46 1 1 A 61 61 LEU N N 60 125.639 125.215 0.424 1
1 597 . 46 1 1 A 62 62 ILE H H 61 7.698 8.160 -0.462 1
1 598 . 46 1 1 A 62 62 ILE HA H 61 3.952 3.929 0.023 1
1 608 . 46 1 1 A 62 62 ILE C C 61 175.392 177.190 -1.798 1
1 609 . 46 1 1 A 62 62 ILE CA C 61 61.743 63.371 -1.628 1
1 610 . 46 1 1 A 62 62 ILE CB C 61 39.108 37.801 1.307 1
1 614 . 46 1 1 A 62 62 ILE N N 61 114.111 118.854 -4.743 1
1 615 . 46 1 1 A 63 63 TYR H H 62 7.273 7.970 -0.697 1
1 616 . 46 1 1 A 63 63 TYR HA H 62 4.343 4.121 0.222 1
1 623 . 46 1 1 A 63 63 TYR C C 62 178.264 178.532 -0.268 1
1 624 . 46 1 1 A 63 63 TYR CA C 62 57.231 60.734 -3.503 1
1 625 . 46 1 1 A 63 63 TYR CB C 62 36.332 37.593 -1.261 1
1 630 . 46 1 1 A 63 63 TYR N N 62 117.689 121.411 -3.722 1
1 631 . 46 1 1 A 64 64 THR H H 63 7.747 8.119 -0.372 1
1 632 . 46 1 1 A 64 64 THR HA H 63 4.266 4.243 0.023 1
1 637 . 46 1 1 A 64 64 THR CA C 63 69.362 67.581 1.781 1
1 638 . 46 1 1 A 64 64 THR CB C 63 66.962 67.609 -0.647 1
1 640 . 46 1 1 A 64 64 THR N N 63 113.755 116.311 -2.556 1
1 641 . 46 1 1 A 65 65 PRO HA H 64 4.372 4.395 -0.023 1
1 648 . 46 1 1 A 65 65 PRO C C 64 179.913 179.453 0.460 1
1 649 . 46 1 1 A 65 65 PRO CA C 64 66.011 66.311 -0.300 1
1 650 . 46 1 1 A 65 65 PRO CB C 64 30.642 30.754 -0.112 1
1 653 . 46 1 1 A 66 66 ILE H H 65 7.377 7.355 0.022 1
1 654 . 46 1 1 A 66 66 ILE HA H 65 3.530 3.880 -0.350 1
1 664 . 46 1 1 A 66 66 ILE C C 65 177.543 178.404 -0.861 1
1 665 . 46 1 1 A 66 66 ILE CA C 65 66.647 64.218 2.429 1
1 666 . 46 1 1 A 66 66 ILE CB C 65 38.029 37.670 0.359 1
1 670 . 46 1 1 A 66 66 ILE N N 65 118.353 116.642 1.711 1
1 671 . 46 1 1 A 67 67 PHE H H 66 8.480 8.387 0.093 1
1 672 . 46 1 1 A 67 67 PHE HA H 66 4.115 4.358 -0.243 1
1 680 . 46 1 1 A 67 67 PHE C C 66 177.293 178.032 -0.739 1
1 681 . 46 1 1 A 67 67 PHE CA C 66 59.570 62.132 -2.562 1
1 682 . 46 1 1 A 67 67 PHE CB C 66 38.865 39.497 -0.632 1
1 688 . 46 1 1 A 67 67 PHE N N 66 122.420 120.381 2.039 1
1 689 . 46 1 1 A 68 68 ASN H H 67 8.595 8.173 0.422 1
1 690 . 46 1 1 A 68 68 ASN HA H 67 4.211 4.374 -0.163 1
1 695 . 46 1 1 A 68 68 ASN C C 67 178.697 178.148 0.549 1
1 696 . 46 1 1 A 68 68 ASN CA C 67 56.056 56.482 -0.426 1
1 697 . 46 1 1 A 68 68 ASN CB C 67 37.704 37.926 -0.222 1
1 698 . 46 1 1 A 68 68 ASN N N 67 115.573 116.958 -1.385 1
1 700 . 46 1 1 A 69 69 GLU H H 68 8.414 8.059 0.355 1
1 701 . 46 1 1 A 69 69 GLU HA H 68 4.102 4.193 -0.091 1
1 706 . 46 1 1 A 69 69 GLU C C 68 177.880 178.828 -0.948 1
1 707 . 46 1 1 A 69 69 GLU CA C 68 59.399 59.314 0.085 1
1 708 . 46 1 1 A 69 69 GLU CB C 68 29.855 29.401 0.454 1
1 710 . 46 1 1 A 69 69 GLU N N 68 123.510 119.981 3.529 1
1 711 . 46 1 1 A 70 70 TYR H H 69 8.659 8.051 0.608 1
1 712 . 46 1 1 A 70 70 TYR HA H 69 3.362 4.122 -0.760 1
1 719 . 46 1 1 A 70 70 TYR C C 69 178.143 177.001 1.142 1
1 720 . 46 1 1 A 70 70 TYR CA C 69 60.686 61.041 -0.355 1
1 721 . 46 1 1 A 70 70 TYR CB C 69 38.560 38.885 -0.325 1
1 726 . 46 1 1 A 70 70 TYR N N 69 122.130 120.850 1.280 1
1 727 . 46 1 1 A 71 71 ILE H H 70 8.031 7.712 0.319 1
1 728 . 46 1 1 A 71 71 ILE HA H 70 3.265 3.707 -0.442 1
1 738 . 46 1 1 A 71 71 ILE C C 70 178.056 177.677 0.379 1
1 739 . 46 1 1 A 71 71 ILE CA C 70 63.756 63.944 -0.188 1
1 740 . 46 1 1 A 71 71 ILE CB C 70 37.321 36.702 0.619 1
1 744 . 46 1 1 A 71 71 ILE N N 70 118.906 120.123 -1.217 1
1 745 . 46 1 1 A 72 72 SER H H 71 7.803 7.741 0.062 1
1 746 . 46 1 1 A 72 72 SER HA H 71 4.029 4.385 -0.356 1
1 749 . 46 1 1 A 72 72 SER CA C 71 61.380 60.975 0.405 1
1 750 . 46 1 1 A 72 72 SER CB C 71 63.288 63.528 -0.240 1
1 751 . 46 1 1 A 72 72 SER N N 71 113.735 118.677 -4.942 1
1 752 . 46 1 1 A 73 73 LEU H H 72 7.952 7.973 -0.021 1
1 753 . 46 1 1 A 73 73 LEU HA H 72 4.418 4.097 0.321 1
1 763 . 46 1 1 A 73 73 LEU C C 72 177.767 178.220 -0.453 1
1 764 . 46 1 1 A 73 73 LEU CA C 72 56.543 57.400 -0.857 1
1 765 . 46 1 1 A 73 73 LEU CB C 72 44.517 41.638 2.879 1
1 769 . 46 1 1 A 73 73 LEU N N 72 119.411 122.559 -3.148 1
1 770 . 46 1 1 A 74 74 VAL H H 73 8.021 7.519 0.502 1
1 771 . 46 1 1 A 74 74 VAL HA H 73 3.532 3.319 0.213 1
1 779 . 46 1 1 A 74 74 VAL C C 73 177.126 177.992 -0.866 1
1 780 . 46 1 1 A 74 74 VAL CA C 73 66.250 66.317 -0.067 1
1 781 . 46 1 1 A 74 74 VAL CB C 73 31.212 31.165 0.047 1
1 784 . 46 1 1 A 74 74 VAL N N 73 118.747 119.209 -0.462 1
1 785 . 46 1 1 A 75 75 GLU H H 74 7.232 7.963 -0.731 1
1 786 . 46 1 1 A 75 75 GLU HA H 74 3.013 4.144 -1.131 1
1 791 . 46 1 1 A 75 75 GLU C C 74 178.804 179.122 -0.318 1
1 792 . 46 1 1 A 75 75 GLU CA C 74 60.536 59.983 0.553 1
1 793 . 46 1 1 A 75 75 GLU CB C 74 27.009 28.995 -1.986 1
1 795 . 46 1 1 A 75 75 GLU N N 74 118.660 119.776 -1.116 1
1 796 . 46 1 1 A 76 76 LYS H H 75 7.051 7.772 -0.721 1
1 797 . 46 1 1 A 76 76 LYS HA H 75 3.765 4.029 -0.264 1
1 806 . 46 1 1 A 76 76 LYS C C 75 177.765 178.358 -0.593 1
1 807 . 46 1 1 A 76 76 LYS CA C 75 58.357 58.766 -0.409 1
1 808 . 46 1 1 A 76 76 LYS CB C 75 31.939 31.970 -0.031 1
1 812 . 46 1 1 A 76 76 LYS N N 75 116.112 119.900 -3.788 1
1 813 . 46 1 1 A 77 77 TYR H H 76 7.067 7.697 -0.630 1
1 814 . 46 1 1 A 77 77 TYR HA H 76 4.036 4.163 -0.127 1
1 821 . 46 1 1 A 77 77 TYR C C 76 177.752 177.089 0.663 1
1 822 . 46 1 1 A 77 77 TYR CA C 76 61.820 61.181 0.639 1
1 823 . 46 1 1 A 77 77 TYR CB C 76 38.480 38.606 -0.126 1
1 828 . 46 1 1 A 77 77 TYR N N 76 118.434 120.648 -2.214 1
1 829 . 46 1 1 A 78 78 ILE H H 77 7.554 8.297 -0.743 1
1 830 . 46 1 1 A 78 78 ILE HA H 77 3.159 3.631 -0.472 1
1 840 . 46 1 1 A 78 78 ILE C C 77 177.341 178.064 -0.723 1
1 841 . 46 1 1 A 78 78 ILE CA C 77 65.177 65.326 -0.149 1
1 842 . 46 1 1 A 78 78 ILE CB C 77 37.339 37.998 -0.659 1
1 846 . 46 1 1 A 78 78 ILE N N 77 117.672 121.458 -3.786 1
1 847 . 46 1 1 A 79 79 GLU H H 78 8.296 8.120 0.176 1
1 848 . 46 1 1 A 79 79 GLU HA H 78 3.557 3.917 -0.360 1
1 853 . 46 1 1 A 79 79 GLU C C 78 177.742 178.801 -1.059 1
1 854 . 46 1 1 A 79 79 GLU CA C 78 60.847 60.010 0.837 1
1 855 . 46 1 1 A 79 79 GLU CB C 78 29.594 29.104 0.490 1
1 857 . 46 1 1 A 79 79 GLU N N 78 118.701 120.864 -2.163 1
1 858 . 46 1 1 A 80 80 GLU H H 79 8.330 8.103 0.227 1
1 859 . 46 1 1 A 80 80 GLU HA H 79 3.774 4.040 -0.266 1
1 864 . 46 1 1 A 80 80 GLU C C 79 179.926 179.232 0.694 1
1 865 . 46 1 1 A 80 80 GLU CA C 79 59.581 58.928 0.653 1
1 866 . 46 1 1 A 80 80 GLU CB C 79 29.062 29.236 -0.174 1
1 868 . 46 1 1 A 80 80 GLU N N 79 116.767 118.822 -2.055 1
1 869 . 46 1 1 A 81 81 GLN H H 80 7.634 7.782 -0.148 1
1 870 . 46 1 1 A 81 81 GLN HA H 80 3.605 3.875 -0.270 1
1 877 . 46 1 1 A 81 81 GLN C C 80 179.681 178.668 1.013 1
1 878 . 46 1 1 A 81 81 GLN CA C 80 57.765 58.528 -0.763 1
1 879 . 46 1 1 A 81 81 GLN CB C 80 28.079 28.080 -0.001 1
1 881 . 46 1 1 A 81 81 GLN N N 80 116.325 118.697 -2.372 1
1 883 . 46 1 1 A 82 82 LEU H H 81 8.156 7.698 0.458 1
1 884 . 46 1 1 A 82 82 LEU HA H 81 3.536 3.785 -0.249 1
1 894 . 46 1 1 A 82 82 LEU C C 81 178.945 179.568 -0.623 1
1 895 . 46 1 1 A 82 82 LEU CA C 81 57.761 56.872 0.889 1
1 896 . 46 1 1 A 82 82 LEU CB C 81 40.961 40.947 0.014 1
1 900 . 46 1 1 A 82 82 LEU N N 81 121.546 120.350 1.196 1
1 901 . 46 1 1 A 83 83 LEU H H 82 8.326 8.004 0.322 1
1 902 . 46 1 1 A 83 83 LEU HA H 82 4.198 4.168 0.030 1
1 912 . 46 1 1 A 83 83 LEU C C 82 178.631 179.371 -0.740 1
1 913 . 46 1 1 A 83 83 LEU CA C 82 57.016 57.008 0.008 1
1 914 . 46 1 1 A 83 83 LEU CB C 82 42.182 40.944 1.238 1
1 918 . 46 1 1 A 83 83 LEU N N 82 120.426 119.472 0.954 1
1 919 . 46 1 1 A 84 84 GLN H H 83 6.992 7.686 -0.694 1
1 920 . 46 1 1 A 84 84 GLN HA H 83 3.877 4.018 -0.141 1
1 927 . 46 1 1 A 84 84 GLN C C 83 177.008 177.133 -0.125 1
1 928 . 46 1 1 A 84 84 GLN CA C 83 57.543 58.364 -0.821 1
1 929 . 46 1 1 A 84 84 GLN CB C 83 28.688 28.428 0.260 1
1 931 . 46 1 1 A 84 84 GLN N N 83 114.001 117.687 -3.686 1
1 933 . 46 1 1 A 85 85 ARG H H 84 7.072 7.299 -0.227 1
1 934 . 46 1 1 A 85 85 ARG HA H 84 4.047 4.349 -0.302 1
1 942 . 46 1 1 A 85 85 ARG C C 84 175.999 175.814 0.185 1
1 943 . 46 1 1 A 85 85 ARG CA C 84 56.764 56.583 0.181 1
1 944 . 46 1 1 A 85 85 ARG CB C 84 32.044 32.024 0.020 1
1 947 . 46 1 1 A 85 85 ARG N N 84 115.827 116.677 -0.850 1
1 949 . 46 1 1 A 86 86 ILE H H 85 8.238 7.800 0.438 1
1 950 . 46 1 1 A 86 86 ILE HA H 85 4.389 4.529 -0.140 1
1 960 . 46 1 1 A 86 86 ILE CA C 85 58.007 57.822 0.185 1
1 961 . 46 1 1 A 86 86 ILE CB C 85 39.604 38.733 0.871 1
1 965 . 46 1 1 A 86 86 ILE N N 85 119.285 120.403 -1.118 1
1 966 . 46 1 1 A 87 87 PRO HA H 86 4.392 4.459 -0.067 1
1 973 . 46 1 1 A 87 87 PRO C C 86 177.622 176.930 0.692 1
1 974 . 46 1 1 A 87 87 PRO CA C 86 64.665 64.314 0.351 1
1 975 . 46 1 1 A 87 87 PRO CB C 86 32.020 31.846 0.174 1
1 978 . 46 1 1 A 88 88 GLU H H 87 8.312 8.183 0.129 1
1 979 . 46 1 1 A 88 88 GLU HA H 87 4.208 4.549 -0.341 1
1 984 . 46 1 1 A 88 88 GLU C C 87 175.554 175.890 -0.336 1
1 985 . 46 1 1 A 88 88 GLU CA C 87 56.045 56.245 -0.200 1
1 986 . 46 1 1 A 88 88 GLU CB C 87 28.654 30.259 -1.605 1
1 988 . 46 1 1 A 88 88 GLU N N 87 114.256 116.941 -2.685 1
1 989 . 46 1 1 A 89 89 PHE H H 88 7.946 7.854 0.092 1
1 990 . 46 1 1 A 89 89 PHE HA H 88 3.993 4.641 -0.648 1
1 998 . 46 1 1 A 89 89 PHE C C 88 173.460 174.258 -0.798 1
1 999 . 46 1 1 A 89 89 PHE CA C 88 60.119 58.831 1.288 1
1 1000 . 46 1 1 A 89 89 PHE CB C 88 39.994 39.951 0.043 1
1 1006 . 46 1 1 A 89 89 PHE N N 88 121.550 123.133 -1.583 1
1 1007 . 46 1 1 A 90 90 ASN H H 89 7.266 7.653 -0.387 1
1 1008 . 46 1 1 A 90 90 ASN HA H 89 4.454 5.015 -0.561 1
1 1013 . 46 1 1 A 90 90 ASN C C 89 173.921 175.238 -1.317 1
1 1014 . 46 1 1 A 90 90 ASN CA C 89 51.839 51.689 0.150 1
1 1015 . 46 1 1 A 90 90 ASN CB C 89 40.674 40.001 0.673 1
1 1016 . 46 1 1 A 90 90 ASN N N 89 125.344 125.022 0.322 1
1 1018 . 46 1 1 A 91 91 MET H H 90 8.968 8.777 0.191 1
1 1019 . 46 1 1 A 91 91 MET HA H 90 4.049 4.270 -0.221 1
1 1027 . 46 1 1 A 91 91 MET C C 90 177.475 178.155 -0.680 1
1 1028 . 46 1 1 A 91 91 MET CA C 90 57.758 58.203 -0.445 1
1 1029 . 46 1 1 A 91 91 MET CB C 90 32.250 32.604 -0.354 1
1 1032 . 46 1 1 A 91 91 MET N N 90 127.052 126.364 0.688 1
1 1033 . 46 1 1 A 92 92 ALA H H 91 8.292 8.125 0.167 1
1 1034 . 46 1 1 A 92 92 ALA HA H 91 4.059 4.119 -0.060 1
1 1038 . 46 1 1 A 92 92 ALA C C 91 180.412 179.818 0.594 1
1 1039 . 46 1 1 A 92 92 ALA CA C 91 55.368 55.011 0.357 1
1 1040 . 46 1 1 A 92 92 ALA CB C 91 17.527 18.426 -0.899 1
1 1041 . 46 1 1 A 92 92 ALA N N 91 123.752 121.454 2.298 1
1 1042 . 46 1 1 A 93 93 ALA H H 92 7.931 8.134 -0.203 1
1 1043 . 46 1 1 A 93 93 ALA HA H 92 4.054 4.137 -0.083 1
1 1047 . 46 1 1 A 93 93 ALA C C 92 180.482 179.942 0.540 1
1 1048 . 46 1 1 A 93 93 ALA CA C 92 54.614 54.981 -0.367 1
1 1049 . 46 1 1 A 93 93 ALA CB C 92 18.098 18.122 -0.024 1
1 1050 . 46 1 1 A 93 93 ALA N N 92 121.158 119.941 1.217 1
1 1051 . 46 1 1 A 94 94 PHE H H 93 8.110 7.659 0.451 1
1 1052 . 46 1 1 A 94 94 PHE HA H 93 4.304 4.159 0.145 1
1 1060 . 46 1 1 A 94 94 PHE C C 93 177.350 177.325 0.025 1
1 1061 . 46 1 1 A 94 94 PHE CA C 93 61.641 61.485 0.156 1
1 1062 . 46 1 1 A 94 94 PHE CB C 93 40.014 39.355 0.659 1
1 1068 . 46 1 1 A 94 94 PHE N N 93 119.807 119.780 0.027 1
1 1069 . 46 1 1 A 95 95 THR H H 94 8.726 8.196 0.530 1
1 1070 . 46 1 1 A 95 95 THR HA H 94 3.569 3.876 -0.307 1
1 1075 . 46 1 1 A 95 95 THR C C 94 176.932 176.287 0.645 1
1 1076 . 46 1 1 A 95 95 THR CA C 94 66.833 65.446 1.387 1
1 1077 . 46 1 1 A 95 95 THR CB C 94 68.445 68.210 0.235 1
1 1079 . 46 1 1 A 95 95 THR N N 94 113.074 112.358 0.716 1
1 1080 . 46 1 1 A 96 96 THR H H 95 7.657 7.852 -0.195 1
1 1081 . 46 1 1 A 96 96 THR HA H 95 3.945 4.063 -0.118 1
1 1086 . 46 1 1 A 96 96 THR C C 95 176.386 177.495 -1.109 1
1 1087 . 46 1 1 A 96 96 THR CA C 95 66.550 65.669 0.881 1
1 1088 . 46 1 1 A 96 96 THR CB C 95 68.583 67.942 0.641 1
1 1090 . 46 1 1 A 96 96 THR N N 95 117.927 113.857 4.070 1
1 1091 . 46 1 1 A 97 97 THR H H 96 7.699 7.718 -0.019 1
1 1092 . 46 1 1 A 97 97 THR HA H 96 3.905 4.011 -0.106 1
1 1097 . 46 1 1 A 97 97 THR C C 96 176.572 176.526 0.046 1
1 1098 . 46 1 1 A 97 97 THR CA C 96 65.979 66.646 -0.667 1
1 1099 . 46 1 1 A 97 97 THR CB C 96 68.553 68.341 0.212 1
1 1101 . 46 1 1 A 97 97 THR N N 96 118.518 117.453 1.065 1
1 1102 . 46 1 1 A 98 98 LEU H H 97 8.304 8.081 0.223 1
1 1103 . 46 1 1 A 98 98 LEU HA H 97 3.725 3.837 -0.112 1
1 1113 . 46 1 1 A 98 98 LEU C C 97 178.490 178.809 -0.319 1
1 1114 . 46 1 1 A 98 98 LEU CA C 97 58.517 57.849 0.668 1
1 1115 . 46 1 1 A 98 98 LEU CB C 97 41.697 41.030 0.667 1
1 1119 . 46 1 1 A 98 98 LEU N N 97 122.882 121.921 0.961 1
1 1120 . 46 1 1 A 99 99 GLN H H 98 7.639 8.086 -0.447 1
1 1121 . 46 1 1 A 99 99 GLN HA H 98 3.927 4.084 -0.157 1
1 1128 . 46 1 1 A 99 99 GLN C C 98 178.068 178.421 -0.353 1
1 1129 . 46 1 1 A 99 99 GLN CA C 98 58.735 59.005 -0.270 1
1 1130 . 46 1 1 A 99 99 GLN CB C 98 27.986 28.384 -0.398 1
1 1132 . 46 1 1 A 99 99 GLN N N 98 114.302 117.449 -3.147 1
1 1134 . 46 1 1 A 100 100 HIS H H 99 7.575 8.230 -0.655 1
1 1135 . 46 1 1 A 100 100 HIS HA H 99 4.524 4.267 0.257 1
1 1139 . 46 1 1 A 100 100 HIS C C 99 174.789 177.439 -2.650 1
1 1140 . 46 1 1 A 100 100 HIS CA C 99 56.154 59.137 -2.983 1
1 1141 . 46 1 1 A 100 100 HIS CB C 99 28.946 30.048 -1.102 1
1 1143 . 46 1 1 A 100 100 HIS N N 99 114.778 121.335 -6.557 1
1 1144 . 46 1 1 A 101 101 HIS H H 100 7.773 8.231 -0.458 1
1 1145 . 46 1 1 A 101 101 HIS HA H 100 4.704 4.141 0.563 1
1 1149 . 46 1 1 A 101 101 HIS C C 100 174.818 177.228 -2.410 1
1 1150 . 46 1 1 A 101 101 HIS CA C 100 54.830 58.470 -3.640 1
1 1151 . 46 1 1 A 101 101 HIS CB C 100 29.749 28.473 1.276 1
1 1153 . 46 1 1 A 101 101 HIS N N 100 117.397 116.141 1.256 1
1 1154 . 46 1 1 A 102 102 LYS H H 101 7.324 8.133 -0.809 1
1 1155 . 46 1 1 A 102 102 LYS HA H 101 3.611 4.027 -0.416 1
1 1164 . 46 1 1 A 102 102 LYS C C 101 176.823 178.423 -1.600 1
1 1165 . 46 1 1 A 102 102 LYS CA C 101 59.915 58.898 1.017 1
1 1166 . 46 1 1 A 102 102 LYS CB C 101 32.825 32.025 0.800 1
1 1170 . 46 1 1 A 102 102 LYS N N 101 120.533 122.142 -1.609 1
1 1171 . 46 1 1 A 103 103 ASP H H 102 8.361 7.564 0.797 1
1 1172 . 46 1 1 A 103 103 ASP HA H 102 4.421 4.531 -0.110 1
1 1175 . 46 1 1 A 103 103 ASP C C 102 176.793 177.199 -0.406 1
1 1176 . 46 1 1 A 103 103 ASP CA C 102 55.500 56.369 -0.869 1
1 1177 . 46 1 1 A 103 103 ASP CB C 102 40.178 40.897 -0.719 1
1 1178 . 46 1 1 A 103 103 ASP N N 102 114.814 117.968 -3.154 1
1 1179 . 46 1 1 A 104 104 GLU H H 103 7.858 8.064 -0.206 1
1 1180 . 46 1 1 A 104 104 GLU HA H 103 4.339 4.419 -0.080 1
1 1183 . 46 1 1 A 104 104 GLU C C 103 175.777 176.793 -1.016 1
1 1184 . 46 1 1 A 104 104 GLU CA C 103 56.356 57.946 -1.590 1
1 1185 . 46 1 1 A 104 104 GLU CB C 103 31.293 31.203 0.090 1
1 1186 . 46 1 1 A 104 104 GLU N N 103 116.826 119.020 -2.194 1
1 1187 . 46 1 1 A 105 105 VAL H H 104 7.201 7.784 -0.583 1
1 1188 . 46 1 1 A 105 105 VAL HA H 104 4.296 4.119 0.177 1
1 1196 . 46 1 1 A 105 105 VAL C C 104 174.482 175.610 -1.128 1
1 1197 . 46 1 1 A 105 105 VAL CA C 104 60.370 62.733 -2.363 1
1 1198 . 46 1 1 A 105 105 VAL CB C 104 34.341 33.007 1.334 1
1 1201 . 46 1 1 A 105 105 VAL N N 104 116.422 119.899 -3.477 1
1 1202 . 46 1 1 A 106 106 ALA H H 105 8.487 8.453 0.034 1
1 1203 . 46 1 1 A 106 106 ALA HA H 105 4.172 4.328 -0.156 1
1 1207 . 46 1 1 A 106 106 ALA C C 105 179.030 178.870 0.160 1
1 1208 . 46 1 1 A 106 106 ALA CA C 105 52.966 52.684 0.282 1
1 1209 . 46 1 1 A 106 106 ALA CB C 105 19.371 19.629 -0.258 1
1 1210 . 46 1 1 A 106 106 ALA N N 105 128.313 128.723 -0.410 1
1 1211 . 46 1 1 A 107 107 GLY H H 106 8.738 8.791 -0.053 1
1 1212 . 46 1 1 A 107 107 GLY HA2 H 106 3.773 3.873 -0.100 1
1 1213 . 46 1 1 A 107 107 GLY HA3 H 106 3.998 3.939 0.059 1
1 1214 . 46 1 1 A 107 107 GLY C C 106 174.958 175.966 -1.008 1
1 1215 . 46 1 1 A 107 107 GLY CA C 106 47.449 47.141 0.308 1
1 1216 . 46 1 1 A 107 107 GLY N N 106 110.612 110.880 -0.268 1
1 1217 . 46 1 1 A 108 108 ASP H H 107 8.535 8.448 0.087 1
1 1218 . 46 1 1 A 108 108 ASP HA H 107 4.333 4.345 -0.012 1
1 1221 . 46 1 1 A 108 108 ASP C C 107 179.133 178.397 0.736 1
1 1222 . 46 1 1 A 108 108 ASP CA C 107 56.721 56.722 -0.001 1
1 1223 . 46 1 1 A 108 108 ASP CB C 107 39.336 39.724 -0.388 1
1 1224 . 46 1 1 A 108 108 ASP N N 107 117.474 121.034 -3.560 1
1 1225 . 46 1 1 A 109 109 ILE H H 108 7.459 7.907 -0.448 1
1 1226 . 46 1 1 A 109 109 ILE HA H 108 3.688 3.836 -0.148 1
1 1236 . 46 1 1 A 109 109 ILE C C 108 176.735 178.478 -1.743 1
1 1237 . 46 1 1 A 109 109 ILE CA C 108 63.474 65.352 -1.878 1
1 1238 . 46 1 1 A 109 109 ILE CB C 108 37.340 37.718 -0.378 1
1 1242 . 46 1 1 A 109 109 ILE N N 108 119.609 121.074 -1.465 1
1 1243 . 46 1 1 A 110 110 PHE H H 109 7.920 8.342 -0.422 1
1 1244 . 46 1 1 A 110 110 PHE HA H 109 3.759 4.073 -0.314 1
1 1252 . 46 1 1 A 110 110 PHE C C 109 177.132 177.380 -0.248 1
1 1253 . 46 1 1 A 110 110 PHE CA C 109 62.766 61.220 1.546 1
1 1254 . 46 1 1 A 110 110 PHE CB C 109 39.752 39.304 0.448 1
1 1260 . 46 1 1 A 110 110 PHE N N 109 120.906 120.383 0.523 1
1 1261 . 46 1 1 A 111 111 ASP H H 110 8.639 8.268 0.371 1
1 1262 . 46 1 1 A 111 111 ASP HA H 110 4.216 4.212 0.004 1
1 1265 . 46 1 1 A 111 111 ASP C C 110 178.900 178.376 0.524 1
1 1266 . 46 1 1 A 111 111 ASP CA C 110 57.105 57.279 -0.174 1
1 1267 . 46 1 1 A 111 111 ASP CB C 110 39.697 41.812 -2.115 1
1 1268 . 46 1 1 A 111 111 ASP N N 110 117.124 118.740 -1.616 1
1 1269 . 46 1 1 A 112 112 MET H H 111 7.331 7.542 -0.211 1
1 1270 . 46 1 1 A 112 112 MET HA H 111 4.081 4.144 -0.063 1
1 1278 . 46 1 1 A 112 112 MET C C 111 179.052 178.145 0.907 1
1 1279 . 46 1 1 A 112 112 MET CA C 111 58.202 58.111 0.091 1
1 1280 . 46 1 1 A 112 112 MET CB C 111 31.827 32.446 -0.619 1
1 1283 . 46 1 1 A 112 112 MET N N 111 118.061 119.424 -1.363 1
1 1284 . 46 1 1 A 113 113 LEU H H 112 8.001 8.034 -0.033 1
1 1285 . 46 1 1 A 113 113 LEU HA H 112 3.723 3.564 0.159 1
1 1295 . 46 1 1 A 113 113 LEU C C 112 179.747 178.534 1.213 1
1 1296 . 46 1 1 A 113 113 LEU CA C 112 57.371 57.377 -0.006 1
1 1297 . 46 1 1 A 113 113 LEU CB C 112 40.671 41.070 -0.399 1
1 1301 . 46 1 1 A 113 113 LEU N N 112 120.426 119.629 0.797 1
1 1302 . 46 1 1 A 114 114 LEU H H 113 7.744 7.646 0.098 1
1 1303 . 46 1 1 A 114 114 LEU HA H 113 4.007 3.479 0.528 1
1 1313 . 46 1 1 A 114 114 LEU C C 113 179.358 178.535 0.823 1
1 1314 . 46 1 1 A 114 114 LEU CA C 113 57.202 57.502 -0.300 1
1 1315 . 46 1 1 A 114 114 LEU CB C 113 41.727 41.598 0.129 1
1 1319 . 46 1 1 A 114 114 LEU N N 113 119.584 119.612 -0.028 1
1 1320 . 46 1 1 A 115 115 THR H H 114 7.353 7.594 -0.241 1
1 1321 . 46 1 1 A 115 115 THR HA H 114 4.071 4.110 -0.039 1
1 1327 . 46 1 1 A 115 115 THR C C 114 173.591 176.473 -2.882 1
1 1328 . 46 1 1 A 115 115 THR CA C 114 65.332 64.457 0.875 1
1 1329 . 46 1 1 A 115 115 THR CB C 114 70.319 68.614 1.705 1
1 1331 . 46 1 1 A 115 115 THR N N 114 107.535 112.331 -4.796 1
1 1332 . 46 1 1 A 116 116 PHE H H 115 6.979 7.785 -0.806 1
1 1333 . 46 1 1 A 116 116 PHE HA H 115 5.022 4.243 0.779 1
1 1341 . 46 1 1 A 116 116 PHE C C 115 176.488 176.556 -0.068 1
1 1342 . 46 1 1 A 116 116 PHE CA C 115 55.911 60.901 -4.990 1
1 1343 . 46 1 1 A 116 116 PHE CB C 115 38.521 39.138 -0.617 1
1 1349 . 46 1 1 A 116 116 PHE N N 115 112.366 120.226 -7.860 1
1 1350 . 46 1 1 A 117 117 THR H H 116 7.564 8.114 -0.550 1
1 1351 . 46 1 1 A 117 117 THR HA H 116 4.626 4.947 -0.321 1
1 1356 . 46 1 1 A 117 117 THR C C 116 174.085 174.319 -0.234 1
1 1357 . 46 1 1 A 117 117 THR CA C 116 61.636 62.923 -1.287 1
1 1358 . 46 1 1 A 117 117 THR CB C 116 70.915 72.103 -1.188 1
1 1360 . 46 1 1 A 117 117 THR N N 116 105.498 112.613 -7.115 1
1 1361 . 46 1 1 A 118 118 ASP H H 117 8.270 7.549 0.721 1
1 1362 . 46 1 1 A 118 118 ASP HA H 117 4.955 4.952 0.003 1
1 1365 . 46 1 1 A 118 118 ASP C C 117 176.328 176.305 0.023 1
1 1366 . 46 1 1 A 118 118 ASP CA C 117 53.417 53.956 -0.539 1
1 1367 . 46 1 1 A 118 118 ASP CB C 117 43.388 39.278 4.110 1
1 1368 . 46 1 1 A 118 118 ASP N N 117 124.409 120.707 3.702 1
1 1369 . 46 1 1 A 119 119 PHE H H 118 8.973 8.782 0.191 1
1 1370 . 46 1 1 A 119 119 PHE HA H 118 3.506 4.223 -0.717 1
1 1378 . 46 1 1 A 119 119 PHE CA C 118 61.490 61.594 -0.104 1
1 1379 . 46 1 1 A 119 119 PHE CB C 118 39.246 39.542 -0.296 1
1 1385 . 46 1 1 A 119 119 PHE N N 118 126.688 125.967 0.721 1
1 1386 . 46 1 1 A 120 120 LEU H H 119 8.099 8.369 -0.270 1
1 1387 . 46 1 1 A 120 120 LEU HA H 119 3.842 4.121 -0.279 1
1 1397 . 46 1 1 A 120 120 LEU C C 119 179.601 178.718 0.883 1
1 1398 . 46 1 1 A 120 120 LEU CA C 119 58.174 58.110 0.064 1
1 1399 . 46 1 1 A 120 120 LEU CB C 119 40.315 41.348 -1.033 1
1 1403 . 46 1 1 A 120 120 LEU N N 119 117.930 120.777 -2.847 1
1 1404 . 46 1 1 A 121 121 ALA H H 120 7.729 7.597 0.132 1
1 1405 . 46 1 1 A 121 121 ALA HA H 120 3.996 4.150 -0.154 1
1 1409 . 46 1 1 A 121 121 ALA C C 120 180.995 179.784 1.211 1
1 1410 . 46 1 1 A 121 121 ALA CA C 120 54.832 54.663 0.169 1
1 1411 . 46 1 1 A 121 121 ALA CB C 120 17.706 18.381 -0.675 1
1 1412 . 46 1 1 A 121 121 ALA N N 120 123.195 121.019 2.176 1
1 1413 . 46 1 1 A 122 122 PHE H H 121 7.943 7.979 -0.036 1
1 1414 . 46 1 1 A 122 122 PHE HA H 121 3.887 3.857 0.030 1
1 1419 . 46 1 1 A 122 122 PHE C C 121 175.410 177.003 -1.593 1
1 1420 . 46 1 1 A 122 122 PHE CA C 121 61.075 60.748 0.327 1
1 1421 . 46 1 1 A 122 122 PHE CB C 121 38.115 39.121 -1.006 1
1 1424 . 46 1 1 A 122 122 PHE N N 121 121.798 120.223 1.575 1
1 1425 . 46 1 1 A 123 123 LYS H H 122 8.468 8.038 0.430 1
1 1426 . 46 1 1 A 123 123 LYS HA H 122 3.077 3.907 -0.830 1
1 1435 . 46 1 1 A 123 123 LYS C C 122 178.453 178.915 -0.462 1
1 1436 . 46 1 1 A 123 123 LYS CA C 122 59.855 60.012 -0.157 1
1 1437 . 46 1 1 A 123 123 LYS CB C 122 32.374 32.152 0.222 1
1 1441 . 46 1 1 A 123 123 LYS N N 122 120.614 118.487 2.127 1
1 1442 . 46 1 1 A 124 124 GLU H H 123 8.100 7.882 0.218 1
1 1443 . 46 1 1 A 124 124 GLU HA H 123 3.652 4.053 -0.401 1
1 1448 . 46 1 1 A 124 124 GLU C C 123 177.743 178.581 -0.838 1
1 1449 . 46 1 1 A 124 124 GLU CA C 123 59.406 59.515 -0.109 1
1 1450 . 46 1 1 A 124 124 GLU CB C 123 28.811 29.266 -0.455 1
1 1452 . 46 1 1 A 124 124 GLU N N 123 117.404 119.028 -1.624 1
1 1453 . 46 1 1 A 125 125 MET H H 124 7.537 7.551 -0.014 1
1 1454 . 46 1 1 A 125 125 MET HA H 124 3.860 3.974 -0.114 1
1 1462 . 46 1 1 A 125 125 MET C C 124 179.522 178.265 1.257 1
1 1463 . 46 1 1 A 125 125 MET CA C 124 58.832 58.396 0.436 1
1 1464 . 46 1 1 A 125 125 MET CB C 124 31.765 31.381 0.384 1
1 1467 . 46 1 1 A 125 125 MET N N 124 119.413 119.141 0.272 1
1 1468 . 46 1 1 A 126 126 PHE H H 125 7.148 7.451 -0.303 1
1 1469 . 46 1 1 A 126 126 PHE HA H 125 3.633 4.240 -0.607 1
1 1476 . 46 1 1 A 126 126 PHE C C 125 178.994 178.370 0.624 1
1 1477 . 46 1 1 A 126 126 PHE CA C 125 63.148 60.896 2.252 1
1 1478 . 46 1 1 A 126 126 PHE CB C 125 39.830 38.740 1.090 1
1 1483 . 46 1 1 A 126 126 PHE N N 125 120.013 119.045 0.968 1
1 1484 . 46 1 1 A 127 127 LEU H H 126 8.369 8.482 -0.113 1
1 1485 . 46 1 1 A 127 127 LEU HA H 126 3.972 4.032 -0.060 1
1 1495 . 46 1 1 A 127 127 LEU C C 126 180.621 179.423 1.198 1
1 1496 . 46 1 1 A 127 127 LEU CA C 126 57.944 57.746 0.198 1
1 1497 . 46 1 1 A 127 127 LEU CB C 126 40.543 40.850 -0.307 1
1 1501 . 46 1 1 A 127 127 LEU N N 126 119.692 119.848 -0.156 1
1 1502 . 46 1 1 A 128 128 ASP H H 127 8.578 8.116 0.462 1
1 1503 . 46 1 1 A 128 128 ASP HA H 127 4.308 4.349 -0.041 1
1 1506 . 46 1 1 A 128 128 ASP C C 127 178.254 178.010 0.244 1
1 1507 . 46 1 1 A 128 128 ASP CA C 127 56.964 57.281 -0.317 1
1 1508 . 46 1 1 A 128 128 ASP CB C 127 39.735 41.011 -1.276 1
1 1509 . 46 1 1 A 128 128 ASP N N 127 121.926 119.829 2.097 1
1 1510 . 46 1 1 A 129 129 TYR H H 128 7.710 8.213 -0.503 1
1 1511 . 46 1 1 A 129 129 TYR HA H 128 3.908 4.049 -0.141 1
1 1518 . 46 1 1 A 129 129 TYR C C 128 177.633 177.493 0.140 1
1 1519 . 46 1 1 A 129 129 TYR CA C 128 61.796 61.249 0.547 1
1 1520 . 46 1 1 A 129 129 TYR CB C 128 39.372 38.523 0.849 1
1 1525 . 46 1 1 A 129 129 TYR N N 128 122.548 120.159 2.389 1
1 1526 . 46 1 1 A 130 130 ARG H H 129 8.622 8.455 0.167 1
1 1527 . 46 1 1 A 130 130 ARG HA H 129 3.722 3.810 -0.088 1
1 1535 . 46 1 1 A 130 130 ARG CA C 129 60.084 59.833 0.251 1
1 1536 . 46 1 1 A 130 130 ARG CB C 129 29.902 29.843 0.059 1
1 1539 . 46 1 1 A 130 130 ARG N N 129 118.302 119.637 -1.335 1
1 1541 . 46 1 1 A 131 131 ALA H H 130 7.936 7.985 -0.049 1
1 1542 . 46 1 1 A 131 131 ALA HA H 130 3.997 4.070 -0.073 1
1 1546 . 46 1 1 A 131 131 ALA C C 130 180.456 180.128 0.328 1
1 1547 . 46 1 1 A 131 131 ALA CA C 130 55.133 55.029 0.104 1
1 1548 . 46 1 1 A 131 131 ALA CB C 130 17.750 18.367 -0.617 1
1 1549 . 46 1 1 A 131 131 ALA N N 130 119.788 120.910 -1.122 1
1 1550 . 46 1 1 A 132 132 GLU H H 131 7.622 7.895 -0.273 1
1 1551 . 46 1 1 A 132 132 GLU HA H 131 3.862 3.917 -0.055 1
1 1556 . 46 1 1 A 132 132 GLU C C 131 179.528 178.966 0.562 1
1 1557 . 46 1 1 A 132 132 GLU CA C 131 58.849 59.451 -0.602 1
1 1558 . 46 1 1 A 132 132 GLU CB C 131 28.930 29.147 -0.217 1
1 1560 . 46 1 1 A 132 132 GLU N N 131 118.428 117.836 0.592 1
1 1561 . 46 1 1 A 133 133 LYS H H 132 7.853 7.636 0.217 1
1 1562 . 46 1 1 A 133 133 LYS HA H 132 3.722 4.101 -0.379 1
1 1571 . 46 1 1 A 133 133 LYS C C 132 175.725 177.883 -2.158 1
1 1572 . 46 1 1 A 133 133 LYS CA C 132 57.544 58.546 -1.002 1
1 1573 . 46 1 1 A 133 133 LYS CB C 132 31.770 32.101 -0.331 1
1 1577 . 46 1 1 A 133 133 LYS N N 132 119.473 118.288 1.185 1
1 1578 . 46 1 1 A 134 134 GLU H H 133 8.151 7.845 0.306 1
1 1579 . 46 1 1 A 134 134 GLU HA H 133 4.161 4.224 -0.063 1
1 1584 . 46 1 1 A 134 134 GLU C C 133 177.453 178.020 -0.567 1
1 1585 . 46 1 1 A 134 134 GLU CA C 133 57.222 57.174 0.048 1
1 1586 . 46 1 1 A 134 134 GLU CB C 133 30.091 29.645 0.446 1
1 1588 . 46 1 1 A 134 134 GLU N N 133 116.525 118.250 -1.725 1
1 1589 . 46 1 1 A 135 135 GLY H H 134 7.702 7.716 -0.014 1
1 1590 . 46 1 1 A 135 135 GLY HA2 H 134 3.896 3.947 -0.051 1
1 1591 . 46 1 1 A 135 135 GLY HA3 H 134 3.897 3.956 -0.059 1
1 1592 . 46 1 1 A 135 135 GLY C C 134 174.538 173.450 1.088 1
1 1593 . 46 1 1 A 135 135 GLY CA C 134 45.975 45.180 0.795 1
1 1594 . 46 1 1 A 135 135 GLY N N 134 107.924 108.106 -0.182 1
1 1595 . 46 1 1 A 136 136 ARG H H 135 8.045 7.646 0.399 1
1 1596 . 46 1 1 A 136 136 ARG HA H 135 4.323 4.613 -0.290 1
1 1604 . 46 1 1 A 136 136 ARG C C 135 175.864 176.164 -0.300 1
1 1605 . 46 1 1 A 136 136 ARG CA C 135 56.016 54.887 1.129 1
1 1606 . 46 1 1 A 136 136 ARG CB C 135 30.987 31.542 -0.555 1
1 1609 . 46 1 1 A 136 136 ARG N N 135 119.708 122.032 -2.324 1
1 1 . 47 1 1 A 14 14 PHE CA C 13 58.199 59.158 -0.959 1
1 2 . 47 1 1 A 14 14 PHE CB C 13 39.717 39.648 0.069 1
1 3 . 47 1 1 A 15 15 SER H H 14 8.299 8.729 -0.430 1
1 4 . 47 1 1 A 15 15 SER HA H 14 4.359 4.528 -0.169 1
1 7 . 47 1 1 A 15 15 SER CA C 14 58.249 59.066 -0.817 1
1 8 . 47 1 1 A 15 15 SER CB C 14 63.936 64.213 -0.277 1
1 9 . 47 1 1 A 15 15 SER N N 14 117.379 119.623 -2.244 1
1 10 . 47 1 1 A 16 16 SER H H 15 8.255 8.584 -0.329 1
1 11 . 47 1 1 A 16 16 SER HA H 15 3.729 4.716 -0.987 1
1 14 . 47 1 1 A 16 16 SER CA C 15 58.224 58.481 -0.257 1
1 15 . 47 1 1 A 16 16 SER CB C 15 63.886 64.705 -0.819 1
1 16 . 47 1 1 A 16 16 SER N N 15 117.694 113.767 3.927 1
1 17 . 47 1 1 A 17 17 ALA H H 16 8.333 8.369 -0.036 1
1 18 . 47 1 1 A 17 17 ALA HA H 16 4.252 4.284 -0.032 1
1 22 . 47 1 1 A 17 17 ALA CA C 16 53.377 55.242 -1.865 1
1 23 . 47 1 1 A 17 17 ALA CB C 16 18.896 18.384 0.512 1
1 24 . 47 1 1 A 17 17 ALA N N 16 125.462 124.261 1.201 1
1 25 . 47 1 1 A 18 18 SER H H 17 8.219 7.776 0.443 1
1 26 . 47 1 1 A 18 18 SER HA H 17 4.332 4.571 -0.239 1
1 29 . 47 1 1 A 18 18 SER CA C 17 59.105 58.215 0.890 1
1 30 . 47 1 1 A 18 18 SER CB C 17 63.592 63.695 -0.103 1
1 31 . 47 1 1 A 18 18 SER N N 17 114.821 112.079 2.742 1
1 32 . 47 1 1 A 19 19 ASP H H 18 8.309 7.795 0.514 1
1 33 . 47 1 1 A 19 19 ASP HA H 18 4.554 4.813 -0.259 1
1 36 . 47 1 1 A 19 19 ASP C C 18 176.528 176.861 -0.333 1
1 37 . 47 1 1 A 19 19 ASP CA C 18 55.272 53.241 2.031 1
1 38 . 47 1 1 A 19 19 ASP CB C 18 40.883 42.984 -2.101 1
1 39 . 47 1 1 A 19 19 ASP N N 18 123.367 121.787 1.580 1
1 40 . 47 1 1 A 20 20 ALA H H 19 8.133 8.880 -0.747 1
1 41 . 47 1 1 A 20 20 ALA HA H 19 4.170 4.199 -0.029 1
1 45 . 47 1 1 A 20 20 ALA C C 19 179.857 179.572 0.285 1
1 46 . 47 1 1 A 20 20 ALA CA C 19 54.341 55.236 -0.895 1
1 47 . 47 1 1 A 20 20 ALA CB C 19 18.660 18.480 0.180 1
1 48 . 47 1 1 A 20 20 ALA N N 19 123.350 127.096 -3.746 1
1 49 . 47 1 1 A 21 21 GLU H H 20 8.140 7.903 0.237 1
1 50 . 47 1 1 A 21 21 GLU HA H 20 4.128 4.090 0.038 1
1 55 . 47 1 1 A 21 21 GLU C C 20 177.675 178.496 -0.821 1
1 56 . 47 1 1 A 21 21 GLU CA C 20 58.520 59.570 -1.050 1
1 57 . 47 1 1 A 21 21 GLU CB C 20 29.765 29.433 0.332 1
1 59 . 47 1 1 A 21 21 GLU N N 20 119.063 119.400 -0.337 1
1 60 . 47 1 1 A 22 22 PHE H H 21 8.009 7.926 0.083 1
1 61 . 47 1 1 A 22 22 PHE HA H 21 4.123 4.316 -0.193 1
1 68 . 47 1 1 A 22 22 PHE C C 21 176.410 177.558 -1.148 1
1 69 . 47 1 1 A 22 22 PHE CA C 21 62.202 60.936 1.266 1
1 70 . 47 1 1 A 22 22 PHE CB C 21 39.223 39.063 0.160 1
1 75 . 47 1 1 A 22 22 PHE N N 21 121.211 120.966 0.245 1
1 76 . 47 1 1 A 23 23 ASP H H 22 8.261 8.493 -0.232 1
1 77 . 47 1 1 A 23 23 ASP HA H 22 4.041 4.482 -0.441 1
1 80 . 47 1 1 A 23 23 ASP C C 22 179.078 178.566 0.512 1
1 81 . 47 1 1 A 23 23 ASP CA C 22 57.048 57.401 -0.353 1
1 82 . 47 1 1 A 23 23 ASP CB C 22 40.154 40.442 -0.288 1
1 83 . 47 1 1 A 23 23 ASP N N 22 116.876 119.106 -2.230 1
1 84 . 47 1 1 A 24 24 ALA H H 23 7.651 7.690 -0.039 1
1 85 . 47 1 1 A 24 24 ALA HA H 23 3.785 3.890 -0.105 1
1 89 . 47 1 1 A 24 24 ALA C C 23 179.577 179.869 -0.292 1
1 90 . 47 1 1 A 24 24 ALA CA C 23 54.341 55.224 -0.883 1
1 91 . 47 1 1 A 24 24 ALA CB C 23 17.762 18.182 -0.420 1
1 92 . 47 1 1 A 24 24 ALA N N 23 121.873 122.794 -0.921 1
1 93 . 47 1 1 A 25 25 VAL H H 24 7.718 7.810 -0.092 1
1 94 . 47 1 1 A 25 25 VAL HA H 24 3.216 3.617 -0.401 1
1 102 . 47 1 1 A 25 25 VAL C C 24 177.805 178.296 -0.491 1
1 103 . 47 1 1 A 25 25 VAL CA C 24 66.789 66.821 -0.032 1
1 104 . 47 1 1 A 25 25 VAL CB C 24 31.277 31.169 0.108 1
1 107 . 47 1 1 A 25 25 VAL N N 24 117.890 118.577 -0.687 1
1 108 . 47 1 1 A 26 26 VAL H H 25 7.867 7.837 0.030 1
1 109 . 47 1 1 A 26 26 VAL HA H 25 3.274 3.567 -0.293 1
1 117 . 47 1 1 A 26 26 VAL C C 25 177.788 177.946 -0.158 1
1 118 . 47 1 1 A 26 26 VAL CA C 25 67.282 66.481 0.801 1
1 119 . 47 1 1 A 26 26 VAL CB C 25 31.266 31.572 -0.306 1
1 122 . 47 1 1 A 26 26 VAL N N 25 118.170 119.907 -1.737 1
1 123 . 47 1 1 A 27 27 GLY H H 26 7.544 7.673 -0.129 1
1 124 . 47 1 1 A 27 27 GLY HA2 H 26 3.592 3.536 0.056 1
1 125 . 47 1 1 A 27 27 GLY HA3 H 26 3.721 3.656 0.065 1
1 126 . 47 1 1 A 27 27 GLY C C 26 176.717 176.560 0.157 1
1 127 . 47 1 1 A 27 27 GLY CA C 26 47.085 47.213 -0.128 1
1 128 . 47 1 1 A 27 27 GLY N N 26 105.795 107.532 -1.737 1
1 129 . 47 1 1 A 28 28 TYR H H 27 7.625 7.426 0.199 1
1 130 . 47 1 1 A 28 28 TYR HA H 27 4.546 4.568 -0.022 1
1 137 . 47 1 1 A 28 28 TYR C C 27 178.991 178.184 0.807 1
1 138 . 47 1 1 A 28 28 TYR CA C 27 58.845 59.562 -0.717 1
1 139 . 47 1 1 A 28 28 TYR CB C 27 37.602 37.516 0.086 1
1 144 . 47 1 1 A 28 28 TYR N N 27 119.933 121.928 -1.995 1
1 145 . 47 1 1 A 29 29 LEU H H 28 8.517 8.559 -0.042 1
1 146 . 47 1 1 A 29 29 LEU HA H 28 3.728 3.854 -0.126 1
1 156 . 47 1 1 A 29 29 LEU CA C 28 58.281 57.972 0.309 1
1 157 . 47 1 1 A 29 29 LEU CB C 28 41.948 41.197 0.751 1
1 161 . 47 1 1 A 29 29 LEU N N 28 119.669 120.146 -0.477 1
1 162 . 47 1 1 A 30 30 GLU H H 29 8.072 7.854 0.218 1
1 163 . 47 1 1 A 30 30 GLU HA H 29 3.722 3.895 -0.173 1
1 168 . 47 1 1 A 30 30 GLU C C 29 177.731 178.797 -1.066 1
1 169 . 47 1 1 A 30 30 GLU CA C 29 59.763 59.947 -0.184 1
1 170 . 47 1 1 A 30 30 GLU CB C 29 28.844 29.395 -0.551 1
1 172 . 47 1 1 A 30 30 GLU N N 29 117.666 117.947 -0.281 1
1 173 . 47 1 1 A 31 31 ASP H H 30 7.243 8.026 -0.783 1
1 174 . 47 1 1 A 31 31 ASP HA H 30 4.297 4.358 -0.061 1
1 177 . 47 1 1 A 31 31 ASP CA C 30 56.953 57.415 -0.462 1
1 178 . 47 1 1 A 31 31 ASP CB C 30 40.730 42.315 -1.585 1
1 179 . 47 1 1 A 31 31 ASP N N 30 116.720 119.599 -2.879 1
1 180 . 47 1 1 A 32 32 ILE H H 31 7.940 7.476 0.464 1
1 181 . 47 1 1 A 32 32 ILE HA H 31 3.640 3.601 0.039 1
1 191 . 47 1 1 A 32 32 ILE C C 31 177.980 178.084 -0.104 1
1 192 . 47 1 1 A 32 32 ILE CA C 31 64.692 65.079 -0.387 1
1 193 . 47 1 1 A 32 32 ILE CB C 31 38.938 37.571 1.367 1
1 197 . 47 1 1 A 32 32 ILE N N 31 119.728 119.270 0.458 1
1 198 . 47 1 1 A 33 33 ILE H H 32 7.984 7.589 0.395 1
1 199 . 47 1 1 A 33 33 ILE HA H 32 3.598 3.364 0.234 1
1 209 . 47 1 1 A 33 33 ILE C C 32 176.723 177.032 -0.309 1
1 210 . 47 1 1 A 33 33 ILE CA C 32 63.241 64.675 -1.434 1
1 211 . 47 1 1 A 33 33 ILE CB C 32 37.580 37.953 -0.373 1
1 215 . 47 1 1 A 33 33 ILE N N 32 113.919 120.552 -6.633 1
1 216 . 47 1 1 A 34 34 MET H H 33 7.288 7.579 -0.291 1
1 217 . 47 1 1 A 34 34 MET HA H 33 4.496 4.663 -0.167 1
1 225 . 47 1 1 A 34 34 MET C C 33 176.423 175.747 0.676 1
1 226 . 47 1 1 A 34 34 MET CA C 33 54.634 54.092 0.542 1
1 227 . 47 1 1 A 34 34 MET CB C 33 31.934 31.662 0.272 1
1 230 . 47 1 1 A 34 34 MET N N 33 115.130 116.758 -1.628 1
1 231 . 47 1 1 A 35 35 ASP H H 34 7.405 7.775 -0.370 1
1 232 . 47 1 1 A 35 35 ASP HA H 34 4.484 4.580 -0.096 1
1 235 . 47 1 1 A 35 35 ASP C C 34 177.139 176.464 0.675 1
1 236 . 47 1 1 A 35 35 ASP CA C 34 54.625 54.466 0.159 1
1 237 . 47 1 1 A 35 35 ASP CB C 34 43.554 42.606 0.948 1
1 238 . 47 1 1 A 35 35 ASP N N 34 121.814 122.522 -0.708 1
1 239 . 47 1 1 A 36 36 ASP H H 35 8.765 9.185 -0.420 1
1 240 . 47 1 1 A 36 36 ASP HA H 35 4.235 4.217 0.018 1
1 243 . 47 1 1 A 36 36 ASP C C 35 178.320 177.861 0.459 1
1 244 . 47 1 1 A 36 36 ASP CA C 35 57.832 58.361 -0.529 1
1 245 . 47 1 1 A 36 36 ASP CB C 35 40.914 41.169 -0.255 1
1 246 . 47 1 1 A 36 36 ASP N N 35 125.883 128.234 -2.351 1
1 247 . 47 1 1 A 37 37 GLU H H 36 8.905 8.287 0.618 1
1 248 . 47 1 1 A 37 37 GLU HA H 36 3.933 4.084 -0.151 1
1 253 . 47 1 1 A 37 37 GLU C C 36 179.304 179.125 0.179 1
1 254 . 47 1 1 A 37 37 GLU CA C 36 59.828 59.088 0.740 1
1 255 . 47 1 1 A 37 37 GLU CB C 36 29.380 29.374 0.006 1
1 257 . 47 1 1 A 37 37 GLU N N 36 119.077 117.951 1.126 1
1 258 . 47 1 1 A 38 38 PHE H H 37 7.460 8.172 -0.712 1
1 259 . 47 1 1 A 38 38 PHE HA H 37 3.642 3.945 -0.303 1
1 267 . 47 1 1 A 38 38 PHE C C 37 176.483 178.089 -1.606 1
1 268 . 47 1 1 A 38 38 PHE CA C 37 61.411 60.794 0.617 1
1 269 . 47 1 1 A 38 38 PHE CB C 37 39.355 38.961 0.394 1
1 275 . 47 1 1 A 38 38 PHE N N 37 119.968 122.623 -2.655 1
1 276 . 47 1 1 A 39 39 GLN H H 38 7.968 8.041 -0.073 1
1 277 . 47 1 1 A 39 39 GLN HA H 38 3.712 3.808 -0.096 1
1 284 . 47 1 1 A 39 39 GLN CA C 38 59.153 58.840 0.313 1
1 285 . 47 1 1 A 39 39 GLN CB C 38 28.213 28.504 -0.291 1
1 287 . 47 1 1 A 39 39 GLN N N 38 116.433 118.650 -2.217 1
1 289 . 47 1 1 A 40 40 LEU H H 39 7.930 7.752 0.178 1
1 290 . 47 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 47 1 1 A 40 40 LEU C C 39 177.731 178.201 -0.470 1
1 301 . 47 1 1 A 40 40 LEU CA C 39 57.915 57.967 -0.052 1
1 302 . 47 1 1 A 40 40 LEU CB C 39 41.989 41.573 0.416 1
1 306 . 47 1 1 A 40 40 LEU N N 39 119.505 121.504 -1.999 1
1 307 . 47 1 1 A 41 41 LEU H H 40 7.174 7.787 -0.613 1
1 308 . 47 1 1 A 41 41 LEU HA H 40 3.835 3.912 -0.077 1
1 318 . 47 1 1 A 41 41 LEU C C 40 179.738 178.144 1.594 1
1 319 . 47 1 1 A 41 41 LEU CA C 40 58.266 58.296 -0.030 1
1 320 . 47 1 1 A 41 41 LEU CB C 40 42.050 41.413 0.637 1
1 324 . 47 1 1 A 41 41 LEU N N 40 120.971 119.700 1.271 1
1 325 . 47 1 1 A 42 42 GLN H H 41 8.058 7.986 0.072 1
1 326 . 47 1 1 A 42 42 GLN HA H 41 3.556 4.041 -0.485 1
1 333 . 47 1 1 A 42 42 GLN C C 41 177.642 178.365 -0.723 1
1 334 . 47 1 1 A 42 42 GLN CA C 41 59.826 59.304 0.522 1
1 335 . 47 1 1 A 42 42 GLN CB C 41 28.762 27.885 0.877 1
1 337 . 47 1 1 A 42 42 GLN N N 41 117.899 118.180 -0.281 1
1 339 . 47 1 1 A 43 43 ARG H H 42 8.179 7.821 0.358 1
1 340 . 47 1 1 A 43 43 ARG HA H 42 3.655 3.866 -0.211 1
1 347 . 47 1 1 A 43 43 ARG C C 42 178.051 178.359 -0.308 1
1 348 . 47 1 1 A 43 43 ARG CA C 42 59.766 58.670 1.096 1
1 349 . 47 1 1 A 43 43 ARG CB C 42 29.941 29.997 -0.056 1
1 352 . 47 1 1 A 43 43 ARG N N 42 119.392 119.815 -0.423 1
1 353 . 47 1 1 A 44 44 ASN H H 43 8.525 8.188 0.337 1
1 354 . 47 1 1 A 44 44 ASN HA H 43 4.332 4.458 -0.126 1
1 359 . 47 1 1 A 44 44 ASN C C 43 178.150 177.449 0.701 1
1 360 . 47 1 1 A 44 44 ASN CA C 43 55.841 56.213 -0.372 1
1 361 . 47 1 1 A 44 44 ASN CB C 43 37.632 38.889 -1.257 1
1 362 . 47 1 1 A 44 44 ASN N N 43 116.214 118.002 -1.788 1
1 364 . 47 1 1 A 45 45 PHE H H 44 7.586 7.602 -0.016 1
1 365 . 47 1 1 A 45 45 PHE HA H 44 4.132 4.217 -0.085 1
1 372 . 47 1 1 A 45 45 PHE C C 44 176.691 176.958 -0.267 1
1 373 . 47 1 1 A 45 45 PHE CA C 44 62.333 60.593 1.740 1
1 374 . 47 1 1 A 45 45 PHE CB C 44 39.449 38.628 0.821 1
1 379 . 47 1 1 A 45 45 PHE N N 44 121.501 118.724 2.777 1
1 380 . 47 1 1 A 46 46 MET H H 45 8.190 7.444 0.746 1
1 381 . 47 1 1 A 46 46 MET HA H 45 4.060 3.513 0.547 1
1 389 . 47 1 1 A 46 46 MET C C 45 179.754 177.832 1.922 1
1 390 . 47 1 1 A 46 46 MET CA C 45 57.742 56.497 1.245 1
1 391 . 47 1 1 A 46 46 MET CB C 45 29.912 31.522 -1.610 1
1 394 . 47 1 1 A 46 46 MET N N 45 116.727 117.841 -1.114 1
1 395 . 47 1 1 A 47 47 ASP H H 46 8.579 8.150 0.429 1
1 396 . 47 1 1 A 47 47 ASP HA H 46 4.804 4.564 0.240 1
1 399 . 47 1 1 A 47 47 ASP C C 46 177.854 178.366 -0.512 1
1 400 . 47 1 1 A 47 47 ASP CA C 46 57.277 57.246 0.031 1
1 401 . 47 1 1 A 47 47 ASP CB C 46 40.776 41.443 -0.667 1
1 402 . 47 1 1 A 47 47 ASP N N 46 117.798 120.929 -3.131 1
1 403 . 47 1 1 A 48 48 LYS H H 47 7.339 7.511 -0.172 1
1 404 . 47 1 1 A 48 48 LYS HA H 47 3.828 4.168 -0.340 1
1 413 . 47 1 1 A 48 48 LYS C C 47 178.812 178.621 0.191 1
1 414 . 47 1 1 A 48 48 LYS CA C 47 58.953 58.433 0.520 1
1 415 . 47 1 1 A 48 48 LYS CB C 47 32.796 32.851 -0.055 1
1 419 . 47 1 1 A 48 48 LYS N N 47 117.852 119.632 -1.780 1
1 420 . 47 1 1 A 49 49 TYR H H 48 6.841 8.292 -1.451 1
1 421 . 47 1 1 A 49 49 TYR HA H 48 4.995 4.092 0.903 1
1 428 . 47 1 1 A 49 49 TYR C C 48 178.138 178.552 -0.414 1
1 429 . 47 1 1 A 49 49 TYR CA C 48 58.620 59.855 -1.235 1
1 430 . 47 1 1 A 49 49 TYR CB C 48 42.939 37.597 5.342 1
1 435 . 47 1 1 A 49 49 TYR N N 48 112.109 119.615 -7.506 1
1 436 . 47 1 1 A 50 50 TYR H H 49 8.491 7.920 0.571 1
1 437 . 47 1 1 A 50 50 TYR HA H 49 4.598 4.234 0.364 1
1 444 . 47 1 1 A 50 50 TYR C C 49 176.015 177.746 -1.731 1
1 445 . 47 1 1 A 50 50 TYR CA C 49 62.442 59.502 2.940 1
1 446 . 47 1 1 A 50 50 TYR CB C 49 36.588 36.777 -0.189 1
1 451 . 47 1 1 A 50 50 TYR N N 49 118.294 119.206 -0.912 1
1 452 . 47 1 1 A 51 51 LEU H H 50 7.512 7.419 0.093 1
1 453 . 47 1 1 A 51 51 LEU HA H 50 3.878 3.514 0.364 1
1 463 . 47 1 1 A 51 51 LEU C C 50 178.625 178.783 -0.158 1
1 464 . 47 1 1 A 51 51 LEU CA C 50 55.994 57.212 -1.218 1
1 465 . 47 1 1 A 51 51 LEU CB C 50 40.743 41.587 -0.844 1
1 469 . 47 1 1 A 51 51 LEU N N 50 118.478 121.814 -3.336 1
1 470 . 47 1 1 A 52 52 GLU H H 51 8.042 7.913 0.129 1
1 471 . 47 1 1 A 52 52 GLU HA H 51 4.197 3.930 0.267 1
1 476 . 47 1 1 A 52 52 GLU C C 51 177.629 177.619 0.010 1
1 477 . 47 1 1 A 52 52 GLU CA C 51 56.141 59.465 -3.324 1
1 478 . 47 1 1 A 52 52 GLU CB C 51 29.162 29.181 -0.019 1
1 480 . 47 1 1 A 52 52 GLU N N 51 115.067 117.552 -2.485 1
1 481 . 47 1 1 A 53 53 PHE H H 52 7.465 8.121 -0.656 1
1 482 . 47 1 1 A 53 53 PHE HA H 52 4.431 4.622 -0.191 1
1 490 . 47 1 1 A 53 53 PHE C C 52 174.325 174.479 -0.154 1
1 491 . 47 1 1 A 53 53 PHE CA C 52 58.986 56.943 2.043 1
1 492 . 47 1 1 A 53 53 PHE CB C 52 40.183 37.304 2.879 1
1 498 . 47 1 1 A 53 53 PHE N N 52 116.768 118.617 -1.849 1
1 499 . 47 1 1 A 54 54 GLU H H 53 7.484 7.778 -0.294 1
1 500 . 47 1 1 A 54 54 GLU HA H 53 4.583 4.993 -0.410 1
1 505 . 47 1 1 A 54 54 GLU C C 53 175.722 175.141 0.581 1
1 506 . 47 1 1 A 54 54 GLU CA C 53 54.248 55.377 -1.129 1
1 507 . 47 1 1 A 54 54 GLU CB C 53 34.409 31.738 2.671 1
1 509 . 47 1 1 A 54 54 GLU N N 53 118.844 122.311 -3.467 1
1 510 . 47 1 1 A 55 55 ASP H H 54 9.008 8.773 0.235 1
1 511 . 47 1 1 A 55 55 ASP HA H 54 4.735 4.741 -0.006 1
1 514 . 47 1 1 A 55 55 ASP C C 54 175.421 175.596 -0.175 1
1 515 . 47 1 1 A 55 55 ASP CA C 54 52.888 54.014 -1.126 1
1 516 . 47 1 1 A 55 55 ASP CB C 54 38.894 40.575 -1.681 1
1 517 . 47 1 1 A 55 55 ASP N N 54 123.654 123.773 -0.119 1
1 518 . 47 1 1 A 56 56 THR H H 55 7.819 8.183 -0.364 1
1 519 . 47 1 1 A 56 56 THR HA H 55 4.574 4.986 -0.412 1
1 524 . 47 1 1 A 56 56 THR C C 55 174.096 173.904 0.192 1
1 525 . 47 1 1 A 56 56 THR CA C 55 59.172 60.160 -0.988 1
1 526 . 47 1 1 A 56 56 THR CB C 55 71.889 72.149 -0.260 1
1 528 . 47 1 1 A 56 56 THR N N 55 112.015 116.942 -4.927 1
1 529 . 47 1 1 A 57 57 GLU H H 56 8.527 8.586 -0.059 1
1 530 . 47 1 1 A 57 57 GLU HA H 56 4.217 4.670 -0.453 1
1 535 . 47 1 1 A 57 57 GLU C C 56 177.042 176.004 1.038 1
1 536 . 47 1 1 A 57 57 GLU CA C 56 56.869 56.260 0.609 1
1 537 . 47 1 1 A 57 57 GLU CB C 56 29.731 30.252 -0.521 1
1 539 . 47 1 1 A 57 57 GLU N N 56 117.531 117.753 -0.222 1
1 540 . 47 1 1 A 58 58 GLU H H 57 7.587 7.754 -0.167 1
1 541 . 47 1 1 A 58 58 GLU HA H 57 3.941 4.710 -0.769 1
1 546 . 47 1 1 A 58 58 GLU C C 57 176.849 175.207 1.642 1
1 547 . 47 1 1 A 58 58 GLU CA C 57 56.924 56.248 0.676 1
1 548 . 47 1 1 A 58 58 GLU CB C 57 30.251 31.258 -1.007 1
1 550 . 47 1 1 A 58 58 GLU N N 57 119.183 122.378 -3.195 1
1 551 . 47 1 1 A 59 59 ASN H H 58 9.120 8.926 0.194 1
1 552 . 47 1 1 A 59 59 ASN HA H 58 4.922 5.212 -0.290 1
1 557 . 47 1 1 A 59 59 ASN C C 58 174.254 174.232 0.022 1
1 558 . 47 1 1 A 59 59 ASN CA C 58 51.956 51.790 0.166 1
1 559 . 47 1 1 A 59 59 ASN CB C 58 37.404 40.387 -2.983 1
1 560 . 47 1 1 A 59 59 ASN N N 58 126.767 124.659 2.108 1
1 562 . 47 1 1 A 60 60 LYS H H 59 5.892 9.011 -3.119 1
1 563 . 47 1 1 A 60 60 LYS HA H 59 3.798 4.608 -0.810 1
1 572 . 47 1 1 A 60 60 LYS C C 59 177.908 177.913 -0.005 1
1 573 . 47 1 1 A 60 60 LYS CA C 59 56.623 54.811 1.812 1
1 574 . 47 1 1 A 60 60 LYS CB C 59 32.279 33.726 -1.447 1
1 578 . 47 1 1 A 60 60 LYS N N 59 121.527 126.639 -5.112 1
1 579 . 47 1 1 A 61 61 LEU H H 60 8.473 8.910 -0.437 1
1 580 . 47 1 1 A 61 61 LEU HA H 60 3.891 4.232 -0.341 1
1 590 . 47 1 1 A 61 61 LEU C C 60 179.843 178.592 1.251 1
1 591 . 47 1 1 A 61 61 LEU CA C 60 58.301 56.306 1.995 1
1 592 . 47 1 1 A 61 61 LEU CB C 60 41.305 41.639 -0.334 1
1 596 . 47 1 1 A 61 61 LEU N N 60 125.639 122.914 2.725 1
1 597 . 47 1 1 A 62 62 ILE H H 61 7.698 7.870 -0.172 1
1 598 . 47 1 1 A 62 62 ILE HA H 61 3.952 3.896 0.056 1
1 608 . 47 1 1 A 62 62 ILE C C 61 175.392 177.191 -1.799 1
1 609 . 47 1 1 A 62 62 ILE CA C 61 61.743 63.547 -1.804 1
1 610 . 47 1 1 A 62 62 ILE CB C 61 39.108 37.809 1.299 1
1 614 . 47 1 1 A 62 62 ILE N N 61 114.111 120.067 -5.956 1
1 615 . 47 1 1 A 63 63 TYR H H 62 7.273 8.030 -0.757 1
1 616 . 47 1 1 A 63 63 TYR HA H 62 4.343 4.390 -0.047 1
1 623 . 47 1 1 A 63 63 TYR C C 62 178.264 178.533 -0.269 1
1 624 . 47 1 1 A 63 63 TYR CA C 62 57.231 61.215 -3.984 1
1 625 . 47 1 1 A 63 63 TYR CB C 62 36.332 37.322 -0.990 1
1 630 . 47 1 1 A 63 63 TYR N N 62 117.689 121.316 -3.627 1
1 631 . 47 1 1 A 64 64 THR H H 63 7.747 8.132 -0.385 1
1 632 . 47 1 1 A 64 64 THR HA H 63 4.266 4.196 0.070 1
1 637 . 47 1 1 A 64 64 THR CA C 63 69.362 67.545 1.817 1
1 638 . 47 1 1 A 64 64 THR CB C 63 66.962 67.739 -0.777 1
1 640 . 47 1 1 A 64 64 THR N N 63 113.755 116.327 -2.572 1
1 641 . 47 1 1 A 65 65 PRO HA H 64 4.372 4.394 -0.022 1
1 648 . 47 1 1 A 65 65 PRO C C 64 179.913 179.470 0.443 1
1 649 . 47 1 1 A 65 65 PRO CA C 64 66.011 66.001 0.010 1
1 650 . 47 1 1 A 65 65 PRO CB C 64 30.642 30.640 0.002 1
1 653 . 47 1 1 A 66 66 ILE H H 65 7.377 7.215 0.162 1
1 654 . 47 1 1 A 66 66 ILE HA H 65 3.530 3.896 -0.366 1
1 664 . 47 1 1 A 66 66 ILE C C 65 177.543 178.474 -0.931 1
1 665 . 47 1 1 A 66 66 ILE CA C 65 66.647 64.130 2.517 1
1 666 . 47 1 1 A 66 66 ILE CB C 65 38.029 37.126 0.903 1
1 670 . 47 1 1 A 66 66 ILE N N 65 118.353 116.756 1.597 1
1 671 . 47 1 1 A 67 67 PHE H H 66 8.480 8.371 0.109 1
1 672 . 47 1 1 A 67 67 PHE HA H 66 4.115 4.335 -0.220 1
1 680 . 47 1 1 A 67 67 PHE C C 66 177.293 178.047 -0.754 1
1 681 . 47 1 1 A 67 67 PHE CA C 66 59.570 62.173 -2.603 1
1 682 . 47 1 1 A 67 67 PHE CB C 66 38.865 39.465 -0.600 1
1 688 . 47 1 1 A 67 67 PHE N N 66 122.420 121.686 0.734 1
1 689 . 47 1 1 A 68 68 ASN H H 67 8.595 8.250 0.345 1
1 690 . 47 1 1 A 68 68 ASN HA H 67 4.211 4.535 -0.324 1
1 695 . 47 1 1 A 68 68 ASN C C 67 178.697 178.150 0.547 1
1 696 . 47 1 1 A 68 68 ASN CA C 67 56.056 56.052 0.004 1
1 697 . 47 1 1 A 68 68 ASN CB C 67 37.704 38.104 -0.400 1
1 698 . 47 1 1 A 68 68 ASN N N 67 115.573 117.938 -2.365 1
1 700 . 47 1 1 A 69 69 GLU H H 68 8.414 8.206 0.208 1
1 701 . 47 1 1 A 69 69 GLU HA H 68 4.102 4.195 -0.093 1
1 706 . 47 1 1 A 69 69 GLU C C 68 177.880 178.820 -0.940 1
1 707 . 47 1 1 A 69 69 GLU CA C 68 59.399 59.430 -0.031 1
1 708 . 47 1 1 A 69 69 GLU CB C 68 29.855 29.594 0.261 1
1 710 . 47 1 1 A 69 69 GLU N N 68 123.510 120.136 3.374 1
1 711 . 47 1 1 A 70 70 TYR H H 69 8.659 8.111 0.548 1
1 712 . 47 1 1 A 70 70 TYR HA H 69 3.362 4.043 -0.681 1
1 719 . 47 1 1 A 70 70 TYR C C 69 178.143 176.992 1.151 1
1 720 . 47 1 1 A 70 70 TYR CA C 69 60.686 61.099 -0.413 1
1 721 . 47 1 1 A 70 70 TYR CB C 69 38.560 38.858 -0.298 1
1 726 . 47 1 1 A 70 70 TYR N N 69 122.130 120.800 1.330 1
1 727 . 47 1 1 A 71 71 ILE H H 70 8.031 7.792 0.239 1
1 728 . 47 1 1 A 71 71 ILE HA H 70 3.265 3.582 -0.317 1
1 738 . 47 1 1 A 71 71 ILE C C 70 178.056 177.730 0.326 1
1 739 . 47 1 1 A 71 71 ILE CA C 70 63.756 63.895 -0.139 1
1 740 . 47 1 1 A 71 71 ILE CB C 70 37.321 36.696 0.625 1
1 744 . 47 1 1 A 71 71 ILE N N 70 118.906 120.291 -1.385 1
1 745 . 47 1 1 A 72 72 SER H H 71 7.803 8.029 -0.226 1
1 746 . 47 1 1 A 72 72 SER HA H 71 4.029 4.386 -0.357 1
1 749 . 47 1 1 A 72 72 SER CA C 71 61.380 61.022 0.358 1
1 750 . 47 1 1 A 72 72 SER CB C 71 63.288 63.444 -0.156 1
1 751 . 47 1 1 A 72 72 SER N N 71 113.735 118.673 -4.938 1
1 752 . 47 1 1 A 73 73 LEU H H 72 7.952 8.045 -0.093 1
1 753 . 47 1 1 A 73 73 LEU HA H 72 4.418 4.198 0.220 1
1 763 . 47 1 1 A 73 73 LEU C C 72 177.767 178.374 -0.607 1
1 764 . 47 1 1 A 73 73 LEU CA C 72 56.543 57.526 -0.983 1
1 765 . 47 1 1 A 73 73 LEU CB C 72 44.517 41.938 2.579 1
1 769 . 47 1 1 A 73 73 LEU N N 72 119.411 122.601 -3.190 1
1 770 . 47 1 1 A 74 74 VAL H H 73 8.021 7.560 0.461 1
1 771 . 47 1 1 A 74 74 VAL HA H 73 3.532 3.338 0.194 1
1 779 . 47 1 1 A 74 74 VAL C C 73 177.126 177.940 -0.814 1
1 780 . 47 1 1 A 74 74 VAL CA C 73 66.250 66.309 -0.059 1
1 781 . 47 1 1 A 74 74 VAL CB C 73 31.212 31.158 0.054 1
1 784 . 47 1 1 A 74 74 VAL N N 73 118.747 119.257 -0.510 1
1 785 . 47 1 1 A 75 75 GLU H H 74 7.232 7.773 -0.541 1
1 786 . 47 1 1 A 75 75 GLU HA H 74 3.013 4.024 -1.011 1
1 791 . 47 1 1 A 75 75 GLU C C 74 178.804 179.115 -0.311 1
1 792 . 47 1 1 A 75 75 GLU CA C 74 60.536 59.934 0.602 1
1 793 . 47 1 1 A 75 75 GLU CB C 74 27.009 28.959 -1.950 1
1 795 . 47 1 1 A 75 75 GLU N N 74 118.660 119.682 -1.022 1
1 796 . 47 1 1 A 76 76 LYS H H 75 7.051 7.763 -0.712 1
1 797 . 47 1 1 A 76 76 LYS HA H 75 3.765 4.038 -0.273 1
1 806 . 47 1 1 A 76 76 LYS C C 75 177.765 178.087 -0.322 1
1 807 . 47 1 1 A 76 76 LYS CA C 75 58.357 58.343 0.014 1
1 808 . 47 1 1 A 76 76 LYS CB C 75 31.939 32.270 -0.331 1
1 812 . 47 1 1 A 76 76 LYS N N 75 116.112 119.169 -3.057 1
1 813 . 47 1 1 A 77 77 TYR H H 76 7.067 7.705 -0.638 1
1 814 . 47 1 1 A 77 77 TYR HA H 76 4.036 4.182 -0.146 1
1 821 . 47 1 1 A 77 77 TYR C C 76 177.752 177.146 0.606 1
1 822 . 47 1 1 A 77 77 TYR CA C 76 61.820 61.225 0.595 1
1 823 . 47 1 1 A 77 77 TYR CB C 76 38.480 38.659 -0.179 1
1 828 . 47 1 1 A 77 77 TYR N N 76 118.434 120.967 -2.533 1
1 829 . 47 1 1 A 78 78 ILE H H 77 7.554 8.303 -0.749 1
1 830 . 47 1 1 A 78 78 ILE HA H 77 3.159 3.648 -0.489 1
1 840 . 47 1 1 A 78 78 ILE C C 77 177.341 178.049 -0.708 1
1 841 . 47 1 1 A 78 78 ILE CA C 77 65.177 65.192 -0.015 1
1 842 . 47 1 1 A 78 78 ILE CB C 77 37.339 37.947 -0.608 1
1 846 . 47 1 1 A 78 78 ILE N N 77 117.672 121.547 -3.875 1
1 847 . 47 1 1 A 79 79 GLU H H 78 8.296 7.927 0.369 1
1 848 . 47 1 1 A 79 79 GLU HA H 78 3.557 3.805 -0.248 1
1 853 . 47 1 1 A 79 79 GLU C C 78 177.742 178.801 -1.059 1
1 854 . 47 1 1 A 79 79 GLU CA C 78 60.847 60.080 0.767 1
1 855 . 47 1 1 A 79 79 GLU CB C 78 29.594 29.225 0.369 1
1 857 . 47 1 1 A 79 79 GLU N N 78 118.701 120.511 -1.810 1
1 858 . 47 1 1 A 80 80 GLU H H 79 8.330 8.309 0.021 1
1 859 . 47 1 1 A 80 80 GLU HA H 79 3.774 4.026 -0.252 1
1 864 . 47 1 1 A 80 80 GLU C C 79 179.926 179.093 0.833 1
1 865 . 47 1 1 A 80 80 GLU CA C 79 59.581 58.934 0.647 1
1 866 . 47 1 1 A 80 80 GLU CB C 79 29.062 29.153 -0.091 1
1 868 . 47 1 1 A 80 80 GLU N N 79 116.767 118.450 -1.683 1
1 869 . 47 1 1 A 81 81 GLN H H 80 7.634 7.998 -0.364 1
1 870 . 47 1 1 A 81 81 GLN HA H 80 3.605 3.875 -0.270 1
1 877 . 47 1 1 A 81 81 GLN C C 80 179.681 177.579 2.102 1
1 878 . 47 1 1 A 81 81 GLN CA C 80 57.765 57.915 -0.150 1
1 879 . 47 1 1 A 81 81 GLN CB C 80 28.079 27.482 0.597 1
1 881 . 47 1 1 A 81 81 GLN N N 80 116.325 117.722 -1.397 1
1 883 . 47 1 1 A 82 82 LEU H H 81 8.156 7.674 0.482 1
1 884 . 47 1 1 A 82 82 LEU HA H 81 3.536 3.701 -0.165 1
1 894 . 47 1 1 A 82 82 LEU C C 81 178.945 179.125 -0.180 1
1 895 . 47 1 1 A 82 82 LEU CA C 81 57.761 57.492 0.269 1
1 896 . 47 1 1 A 82 82 LEU CB C 81 40.961 41.080 -0.119 1
1 900 . 47 1 1 A 82 82 LEU N N 81 121.546 121.481 0.065 1
1 901 . 47 1 1 A 83 83 LEU H H 82 8.326 8.106 0.220 1
1 902 . 47 1 1 A 83 83 LEU HA H 82 4.198 4.305 -0.107 1
1 912 . 47 1 1 A 83 83 LEU C C 82 178.631 179.274 -0.643 1
1 913 . 47 1 1 A 83 83 LEU CA C 82 57.016 57.080 -0.064 1
1 914 . 47 1 1 A 83 83 LEU CB C 82 42.182 40.662 1.520 1
1 918 . 47 1 1 A 83 83 LEU N N 82 120.426 118.479 1.947 1
1 919 . 47 1 1 A 84 84 GLN H H 83 6.992 7.653 -0.661 1
1 920 . 47 1 1 A 84 84 GLN HA H 83 3.877 4.013 -0.136 1
1 927 . 47 1 1 A 84 84 GLN C C 83 177.008 176.989 0.019 1
1 928 . 47 1 1 A 84 84 GLN CA C 83 57.543 58.491 -0.948 1
1 929 . 47 1 1 A 84 84 GLN CB C 83 28.688 28.410 0.278 1
1 931 . 47 1 1 A 84 84 GLN N N 83 114.001 117.247 -3.246 1
1 933 . 47 1 1 A 85 85 ARG H H 84 7.072 7.525 -0.453 1
1 934 . 47 1 1 A 85 85 ARG HA H 84 4.047 4.382 -0.335 1
1 942 . 47 1 1 A 85 85 ARG C C 84 175.999 175.500 0.499 1
1 943 . 47 1 1 A 85 85 ARG CA C 84 56.764 55.976 0.788 1
1 944 . 47 1 1 A 85 85 ARG CB C 84 32.044 32.533 -0.489 1
1 947 . 47 1 1 A 85 85 ARG N N 84 115.827 116.700 -0.873 1
1 949 . 47 1 1 A 86 86 ILE H H 85 8.238 7.670 0.568 1
1 950 . 47 1 1 A 86 86 ILE HA H 85 4.389 4.534 -0.145 1
1 960 . 47 1 1 A 86 86 ILE CA C 85 58.007 57.860 0.147 1
1 961 . 47 1 1 A 86 86 ILE CB C 85 39.604 38.889 0.715 1
1 965 . 47 1 1 A 86 86 ILE N N 85 119.285 119.915 -0.630 1
1 966 . 47 1 1 A 87 87 PRO HA H 86 4.392 4.522 -0.130 1
1 973 . 47 1 1 A 87 87 PRO C C 86 177.622 177.283 0.339 1
1 974 . 47 1 1 A 87 87 PRO CA C 86 64.665 64.243 0.422 1
1 975 . 47 1 1 A 87 87 PRO CB C 86 32.020 31.609 0.411 1
1 978 . 47 1 1 A 88 88 GLU H H 87 8.312 8.574 -0.262 1
1 979 . 47 1 1 A 88 88 GLU HA H 87 4.208 4.373 -0.165 1
1 984 . 47 1 1 A 88 88 GLU C C 87 175.554 176.441 -0.887 1
1 985 . 47 1 1 A 88 88 GLU CA C 87 56.045 55.846 0.199 1
1 986 . 47 1 1 A 88 88 GLU CB C 87 28.654 29.411 -0.757 1
1 988 . 47 1 1 A 88 88 GLU N N 87 114.256 115.569 -1.313 1
1 989 . 47 1 1 A 89 89 PHE H H 88 7.946 7.577 0.369 1
1 990 . 47 1 1 A 89 89 PHE HA H 88 3.993 4.442 -0.449 1
1 998 . 47 1 1 A 89 89 PHE C C 88 173.460 174.252 -0.792 1
1 999 . 47 1 1 A 89 89 PHE CA C 88 60.119 59.074 1.045 1
1 1000 . 47 1 1 A 89 89 PHE CB C 88 39.994 39.681 0.313 1
1 1006 . 47 1 1 A 89 89 PHE N N 88 121.550 122.150 -0.600 1
1 1007 . 47 1 1 A 90 90 ASN H H 89 7.266 7.928 -0.662 1
1 1008 . 47 1 1 A 90 90 ASN HA H 89 4.454 5.042 -0.588 1
1 1013 . 47 1 1 A 90 90 ASN C C 89 173.921 175.152 -1.231 1
1 1014 . 47 1 1 A 90 90 ASN CA C 89 51.839 51.492 0.347 1
1 1015 . 47 1 1 A 90 90 ASN CB C 89 40.674 39.317 1.357 1
1 1016 . 47 1 1 A 90 90 ASN N N 89 125.344 125.149 0.195 1
1 1018 . 47 1 1 A 91 91 MET H H 90 8.968 8.671 0.297 1
1 1019 . 47 1 1 A 91 91 MET HA H 90 4.049 4.296 -0.247 1
1 1027 . 47 1 1 A 91 91 MET C C 90 177.475 177.941 -0.466 1
1 1028 . 47 1 1 A 91 91 MET CA C 90 57.758 57.535 0.223 1
1 1029 . 47 1 1 A 91 91 MET CB C 90 32.250 32.547 -0.297 1
1 1032 . 47 1 1 A 91 91 MET N N 90 127.052 124.836 2.216 1
1 1033 . 47 1 1 A 92 92 ALA H H 91 8.292 8.026 0.266 1
1 1034 . 47 1 1 A 92 92 ALA HA H 91 4.059 4.141 -0.082 1
1 1038 . 47 1 1 A 92 92 ALA C C 91 180.412 179.709 0.703 1
1 1039 . 47 1 1 A 92 92 ALA CA C 91 55.368 54.927 0.441 1
1 1040 . 47 1 1 A 92 92 ALA CB C 91 17.527 18.724 -1.197 1
1 1041 . 47 1 1 A 92 92 ALA N N 91 123.752 120.990 2.762 1
1 1042 . 47 1 1 A 93 93 ALA H H 92 7.931 8.021 -0.090 1
1 1043 . 47 1 1 A 93 93 ALA HA H 92 4.054 4.397 -0.343 1
1 1047 . 47 1 1 A 93 93 ALA C C 92 180.482 179.708 0.774 1
1 1048 . 47 1 1 A 93 93 ALA CA C 92 54.614 54.833 -0.219 1
1 1049 . 47 1 1 A 93 93 ALA CB C 92 18.098 18.194 -0.096 1
1 1050 . 47 1 1 A 93 93 ALA N N 92 121.158 120.120 1.038 1
1 1051 . 47 1 1 A 94 94 PHE H H 93 8.110 7.768 0.342 1
1 1052 . 47 1 1 A 94 94 PHE HA H 93 4.304 4.108 0.196 1
1 1060 . 47 1 1 A 94 94 PHE C C 93 177.350 177.542 -0.192 1
1 1061 . 47 1 1 A 94 94 PHE CA C 93 61.641 61.447 0.194 1
1 1062 . 47 1 1 A 94 94 PHE CB C 93 40.014 39.251 0.763 1
1 1068 . 47 1 1 A 94 94 PHE N N 93 119.807 119.822 -0.015 1
1 1069 . 47 1 1 A 95 95 THR H H 94 8.726 8.189 0.537 1
1 1070 . 47 1 1 A 95 95 THR HA H 94 3.569 3.892 -0.323 1
1 1075 . 47 1 1 A 95 95 THR C C 94 176.932 176.522 0.410 1
1 1076 . 47 1 1 A 95 95 THR CA C 94 66.833 65.645 1.188 1
1 1077 . 47 1 1 A 95 95 THR CB C 94 68.445 68.111 0.334 1
1 1079 . 47 1 1 A 95 95 THR N N 94 113.074 112.343 0.731 1
1 1080 . 47 1 1 A 96 96 THR H H 95 7.657 7.781 -0.124 1
1 1081 . 47 1 1 A 96 96 THR HA H 95 3.945 4.049 -0.104 1
1 1086 . 47 1 1 A 96 96 THR C C 95 176.386 177.386 -1.000 1
1 1087 . 47 1 1 A 96 96 THR CA C 95 66.550 65.636 0.914 1
1 1088 . 47 1 1 A 96 96 THR CB C 95 68.583 67.939 0.644 1
1 1090 . 47 1 1 A 96 96 THR N N 95 117.927 113.756 4.171 1
1 1091 . 47 1 1 A 97 97 THR H H 96 7.699 7.630 0.069 1
1 1092 . 47 1 1 A 97 97 THR HA H 96 3.905 3.717 0.188 1
1 1097 . 47 1 1 A 97 97 THR C C 96 176.572 176.210 0.362 1
1 1098 . 47 1 1 A 97 97 THR CA C 96 65.979 66.059 -0.080 1
1 1099 . 47 1 1 A 97 97 THR CB C 96 68.553 68.358 0.195 1
1 1101 . 47 1 1 A 97 97 THR N N 96 118.518 117.095 1.423 1
1 1102 . 47 1 1 A 98 98 LEU H H 97 8.304 7.947 0.357 1
1 1103 . 47 1 1 A 98 98 LEU HA H 97 3.725 3.747 -0.022 1
1 1113 . 47 1 1 A 98 98 LEU C C 97 178.490 178.345 0.145 1
1 1114 . 47 1 1 A 98 98 LEU CA C 97 58.517 57.898 0.619 1
1 1115 . 47 1 1 A 98 98 LEU CB C 97 41.697 40.830 0.867 1
1 1119 . 47 1 1 A 98 98 LEU N N 97 122.882 121.782 1.100 1
1 1120 . 47 1 1 A 99 99 GLN H H 98 7.639 8.167 -0.528 1
1 1121 . 47 1 1 A 99 99 GLN HA H 98 3.927 4.182 -0.255 1
1 1128 . 47 1 1 A 99 99 GLN C C 98 178.068 177.004 1.064 1
1 1129 . 47 1 1 A 99 99 GLN CA C 98 58.735 58.131 0.604 1
1 1130 . 47 1 1 A 99 99 GLN CB C 98 27.986 28.238 -0.252 1
1 1132 . 47 1 1 A 99 99 GLN N N 98 114.302 116.013 -1.711 1
1 1134 . 47 1 1 A 100 100 HIS H H 99 7.575 7.513 0.062 1
1 1135 . 47 1 1 A 100 100 HIS HA H 99 4.524 4.609 -0.085 1
1 1139 . 47 1 1 A 100 100 HIS C C 99 174.789 177.312 -2.523 1
1 1140 . 47 1 1 A 100 100 HIS CA C 99 56.154 56.661 -0.507 1
1 1141 . 47 1 1 A 100 100 HIS CB C 99 28.946 30.797 -1.851 1
1 1143 . 47 1 1 A 100 100 HIS N N 99 114.778 116.238 -1.460 1
1 1144 . 47 1 1 A 101 101 HIS H H 100 7.773 7.803 -0.030 1
1 1145 . 47 1 1 A 101 101 HIS HA H 100 4.704 4.059 0.645 1
1 1149 . 47 1 1 A 101 101 HIS C C 100 174.818 176.907 -2.089 1
1 1150 . 47 1 1 A 101 101 HIS CA C 100 54.830 58.100 -3.270 1
1 1151 . 47 1 1 A 101 101 HIS CB C 100 29.749 30.183 -0.434 1
1 1153 . 47 1 1 A 101 101 HIS N N 100 117.397 120.320 -2.923 1
1 1154 . 47 1 1 A 102 102 LYS H H 101 7.324 8.411 -1.087 1
1 1155 . 47 1 1 A 102 102 LYS HA H 101 3.611 4.059 -0.448 1
1 1164 . 47 1 1 A 102 102 LYS C C 101 176.823 177.234 -0.411 1
1 1165 . 47 1 1 A 102 102 LYS CA C 101 59.915 58.799 1.116 1
1 1166 . 47 1 1 A 102 102 LYS CB C 101 32.825 31.396 1.429 1
1 1170 . 47 1 1 A 102 102 LYS N N 101 120.533 117.082 3.451 1
1 1171 . 47 1 1 A 103 103 ASP H H 102 8.361 7.691 0.670 1
1 1172 . 47 1 1 A 103 103 ASP HA H 102 4.421 4.555 -0.134 1
1 1175 . 47 1 1 A 103 103 ASP C C 102 176.793 176.682 0.111 1
1 1176 . 47 1 1 A 103 103 ASP CA C 102 55.500 56.385 -0.885 1
1 1177 . 47 1 1 A 103 103 ASP CB C 102 40.178 40.317 -0.139 1
1 1178 . 47 1 1 A 103 103 ASP N N 102 114.814 119.441 -4.627 1
1 1179 . 47 1 1 A 104 104 GLU H H 103 7.858 7.477 0.381 1
1 1180 . 47 1 1 A 104 104 GLU HA H 103 4.339 4.326 0.013 1
1 1183 . 47 1 1 A 104 104 GLU C C 103 175.777 176.510 -0.733 1
1 1184 . 47 1 1 A 104 104 GLU CA C 103 56.356 57.552 -1.196 1
1 1185 . 47 1 1 A 104 104 GLU CB C 103 31.293 30.716 0.577 1
1 1186 . 47 1 1 A 104 104 GLU N N 103 116.826 117.264 -0.438 1
1 1187 . 47 1 1 A 105 105 VAL H H 104 7.201 7.248 -0.047 1
1 1188 . 47 1 1 A 105 105 VAL HA H 104 4.296 4.269 0.027 1
1 1196 . 47 1 1 A 105 105 VAL C C 104 174.482 175.595 -1.113 1
1 1197 . 47 1 1 A 105 105 VAL CA C 104 60.370 61.491 -1.121 1
1 1198 . 47 1 1 A 105 105 VAL CB C 104 34.341 33.726 0.615 1
1 1201 . 47 1 1 A 105 105 VAL N N 104 116.422 117.014 -0.592 1
1 1202 . 47 1 1 A 106 106 ALA H H 105 8.487 8.624 -0.137 1
1 1203 . 47 1 1 A 106 106 ALA HA H 105 4.172 4.457 -0.285 1
1 1207 . 47 1 1 A 106 106 ALA C C 105 179.030 178.391 0.639 1
1 1208 . 47 1 1 A 106 106 ALA CA C 105 52.966 51.632 1.334 1
1 1209 . 47 1 1 A 106 106 ALA CB C 105 19.371 18.832 0.539 1
1 1210 . 47 1 1 A 106 106 ALA N N 105 128.313 124.842 3.471 1
1 1211 . 47 1 1 A 107 107 GLY H H 106 8.738 8.750 -0.012 1
1 1212 . 47 1 1 A 107 107 GLY HA2 H 106 3.773 3.887 -0.114 1
1 1213 . 47 1 1 A 107 107 GLY HA3 H 106 3.998 3.949 0.049 1
1 1214 . 47 1 1 A 107 107 GLY C C 106 174.958 175.341 -0.383 1
1 1215 . 47 1 1 A 107 107 GLY CA C 106 47.449 47.222 0.227 1
1 1216 . 47 1 1 A 107 107 GLY N N 106 110.612 110.494 0.118 1
1 1217 . 47 1 1 A 108 108 ASP H H 107 8.535 7.866 0.669 1
1 1218 . 47 1 1 A 108 108 ASP HA H 107 4.333 4.378 -0.045 1
1 1221 . 47 1 1 A 108 108 ASP C C 107 179.133 179.024 0.109 1
1 1222 . 47 1 1 A 108 108 ASP CA C 107 56.721 56.461 0.260 1
1 1223 . 47 1 1 A 108 108 ASP CB C 107 39.336 40.413 -1.077 1
1 1224 . 47 1 1 A 108 108 ASP N N 107 117.474 122.099 -4.625 1
1 1225 . 47 1 1 A 109 109 ILE H H 108 7.459 7.623 -0.164 1
1 1226 . 47 1 1 A 109 109 ILE HA H 108 3.688 3.817 -0.129 1
1 1236 . 47 1 1 A 109 109 ILE C C 108 176.735 178.477 -1.742 1
1 1237 . 47 1 1 A 109 109 ILE CA C 108 63.474 65.459 -1.985 1
1 1238 . 47 1 1 A 109 109 ILE CB C 108 37.340 37.693 -0.353 1
1 1242 . 47 1 1 A 109 109 ILE N N 108 119.609 119.754 -0.145 1
1 1243 . 47 1 1 A 110 110 PHE H H 109 7.920 8.299 -0.379 1
1 1244 . 47 1 1 A 110 110 PHE HA H 109 3.759 4.094 -0.335 1
1 1252 . 47 1 1 A 110 110 PHE C C 109 177.132 177.409 -0.277 1
1 1253 . 47 1 1 A 110 110 PHE CA C 109 62.766 61.262 1.504 1
1 1254 . 47 1 1 A 110 110 PHE CB C 109 39.752 39.347 0.405 1
1 1260 . 47 1 1 A 110 110 PHE N N 109 120.906 120.512 0.394 1
1 1261 . 47 1 1 A 111 111 ASP H H 110 8.639 8.283 0.356 1
1 1262 . 47 1 1 A 111 111 ASP HA H 110 4.216 4.222 -0.006 1
1 1265 . 47 1 1 A 111 111 ASP C C 110 178.900 178.435 0.465 1
1 1266 . 47 1 1 A 111 111 ASP CA C 110 57.105 57.240 -0.135 1
1 1267 . 47 1 1 A 111 111 ASP CB C 110 39.697 41.620 -1.923 1
1 1268 . 47 1 1 A 111 111 ASP N N 110 117.124 119.051 -1.927 1
1 1269 . 47 1 1 A 112 112 MET H H 111 7.331 7.548 -0.217 1
1 1270 . 47 1 1 A 112 112 MET HA H 111 4.081 4.154 -0.073 1
1 1278 . 47 1 1 A 112 112 MET C C 111 179.052 178.183 0.869 1
1 1279 . 47 1 1 A 112 112 MET CA C 111 58.202 58.119 0.083 1
1 1280 . 47 1 1 A 112 112 MET CB C 111 31.827 32.372 -0.545 1
1 1283 . 47 1 1 A 112 112 MET N N 111 118.061 119.515 -1.454 1
1 1284 . 47 1 1 A 113 113 LEU H H 112 8.001 8.058 -0.057 1
1 1285 . 47 1 1 A 113 113 LEU HA H 112 3.723 3.600 0.123 1
1 1295 . 47 1 1 A 113 113 LEU C C 112 179.747 178.685 1.062 1
1 1296 . 47 1 1 A 113 113 LEU CA C 112 57.371 57.451 -0.080 1
1 1297 . 47 1 1 A 113 113 LEU CB C 112 40.671 41.143 -0.472 1
1 1301 . 47 1 1 A 113 113 LEU N N 112 120.426 119.855 0.571 1
1 1302 . 47 1 1 A 114 114 LEU H H 113 7.744 7.665 0.079 1
1 1303 . 47 1 1 A 114 114 LEU HA H 113 4.007 3.563 0.444 1
1 1313 . 47 1 1 A 114 114 LEU C C 113 179.358 178.539 0.819 1
1 1314 . 47 1 1 A 114 114 LEU CA C 113 57.202 57.530 -0.328 1
1 1315 . 47 1 1 A 114 114 LEU CB C 113 41.727 41.598 0.129 1
1 1319 . 47 1 1 A 114 114 LEU N N 113 119.584 119.655 -0.071 1
1 1320 . 47 1 1 A 115 115 THR H H 114 7.353 7.599 -0.246 1
1 1321 . 47 1 1 A 115 115 THR HA H 114 4.071 4.082 -0.011 1
1 1327 . 47 1 1 A 115 115 THR C C 114 173.591 176.327 -2.736 1
1 1328 . 47 1 1 A 115 115 THR CA C 114 65.332 64.620 0.712 1
1 1329 . 47 1 1 A 115 115 THR CB C 114 70.319 68.590 1.729 1
1 1331 . 47 1 1 A 115 115 THR N N 114 107.535 112.331 -4.796 1
1 1332 . 47 1 1 A 116 116 PHE H H 115 6.979 7.888 -0.909 1
1 1333 . 47 1 1 A 116 116 PHE HA H 115 5.022 4.357 0.665 1
1 1341 . 47 1 1 A 116 116 PHE C C 115 176.488 176.366 0.122 1
1 1342 . 47 1 1 A 116 116 PHE CA C 115 55.911 61.006 -5.095 1
1 1343 . 47 1 1 A 116 116 PHE CB C 115 38.521 38.888 -0.367 1
1 1349 . 47 1 1 A 116 116 PHE N N 115 112.366 119.947 -7.581 1
1 1350 . 47 1 1 A 117 117 THR H H 116 7.564 8.119 -0.555 1
1 1351 . 47 1 1 A 117 117 THR HA H 116 4.626 4.899 -0.273 1
1 1356 . 47 1 1 A 117 117 THR C C 116 174.085 174.121 -0.036 1
1 1357 . 47 1 1 A 117 117 THR CA C 116 61.636 62.787 -1.151 1
1 1358 . 47 1 1 A 117 117 THR CB C 116 70.915 72.211 -1.296 1
1 1360 . 47 1 1 A 117 117 THR N N 116 105.498 113.098 -7.600 1
1 1361 . 47 1 1 A 118 118 ASP H H 117 8.270 7.755 0.515 1
1 1362 . 47 1 1 A 118 118 ASP HA H 117 4.955 4.723 0.232 1
1 1365 . 47 1 1 A 118 118 ASP C C 117 176.328 176.460 -0.132 1
1 1366 . 47 1 1 A 118 118 ASP CA C 117 53.417 53.086 0.331 1
1 1367 . 47 1 1 A 118 118 ASP CB C 117 43.388 39.930 3.458 1
1 1368 . 47 1 1 A 118 118 ASP N N 117 124.409 121.887 2.522 1
1 1369 . 47 1 1 A 119 119 PHE H H 118 8.973 8.873 0.100 1
1 1370 . 47 1 1 A 119 119 PHE HA H 118 3.506 4.330 -0.824 1
1 1378 . 47 1 1 A 119 119 PHE CA C 118 61.490 61.180 0.310 1
1 1379 . 47 1 1 A 119 119 PHE CB C 118 39.246 39.689 -0.443 1
1 1385 . 47 1 1 A 119 119 PHE N N 118 126.688 126.686 0.002 1
1 1386 . 47 1 1 A 120 120 LEU H H 119 8.099 8.391 -0.292 1
1 1387 . 47 1 1 A 120 120 LEU HA H 119 3.842 4.157 -0.315 1
1 1397 . 47 1 1 A 120 120 LEU C C 119 179.601 178.508 1.093 1
1 1398 . 47 1 1 A 120 120 LEU CA C 119 58.174 58.129 0.045 1
1 1399 . 47 1 1 A 120 120 LEU CB C 119 40.315 41.328 -1.013 1
1 1403 . 47 1 1 A 120 120 LEU N N 119 117.930 120.505 -2.575 1
1 1404 . 47 1 1 A 121 121 ALA H H 120 7.729 8.008 -0.279 1
1 1405 . 47 1 1 A 121 121 ALA HA H 120 3.996 4.156 -0.160 1
1 1409 . 47 1 1 A 121 121 ALA C C 120 180.995 179.762 1.233 1
1 1410 . 47 1 1 A 121 121 ALA CA C 120 54.832 54.656 0.176 1
1 1411 . 47 1 1 A 121 121 ALA CB C 120 17.706 18.302 -0.596 1
1 1412 . 47 1 1 A 121 121 ALA N N 120 123.195 120.843 2.352 1
1 1413 . 47 1 1 A 122 122 PHE H H 121 7.943 7.805 0.138 1
1 1414 . 47 1 1 A 122 122 PHE HA H 121 3.887 3.859 0.028 1
1 1419 . 47 1 1 A 122 122 PHE C C 121 175.410 176.904 -1.494 1
1 1420 . 47 1 1 A 122 122 PHE CA C 121 61.075 60.710 0.365 1
1 1421 . 47 1 1 A 122 122 PHE CB C 121 38.115 38.885 -0.770 1
1 1424 . 47 1 1 A 122 122 PHE N N 121 121.798 120.152 1.646 1
1 1425 . 47 1 1 A 123 123 LYS H H 122 8.468 8.011 0.457 1
1 1426 . 47 1 1 A 123 123 LYS HA H 122 3.077 3.809 -0.732 1
1 1435 . 47 1 1 A 123 123 LYS C C 122 178.453 178.980 -0.527 1
1 1436 . 47 1 1 A 123 123 LYS CA C 122 59.855 60.019 -0.164 1
1 1437 . 47 1 1 A 123 123 LYS CB C 122 32.374 32.453 -0.079 1
1 1441 . 47 1 1 A 123 123 LYS N N 122 120.614 118.495 2.119 1
1 1442 . 47 1 1 A 124 124 GLU H H 123 8.100 7.834 0.266 1
1 1443 . 47 1 1 A 124 124 GLU HA H 123 3.652 4.059 -0.407 1
1 1448 . 47 1 1 A 124 124 GLU C C 123 177.743 178.477 -0.734 1
1 1449 . 47 1 1 A 124 124 GLU CA C 123 59.406 59.482 -0.076 1
1 1450 . 47 1 1 A 124 124 GLU CB C 123 28.811 29.395 -0.584 1
1 1452 . 47 1 1 A 124 124 GLU N N 123 117.404 119.066 -1.662 1
1 1453 . 47 1 1 A 125 125 MET H H 124 7.537 7.462 0.075 1
1 1454 . 47 1 1 A 125 125 MET HA H 124 3.860 3.973 -0.113 1
1 1462 . 47 1 1 A 125 125 MET C C 124 179.522 178.260 1.262 1
1 1463 . 47 1 1 A 125 125 MET CA C 124 58.832 58.288 0.544 1
1 1464 . 47 1 1 A 125 125 MET CB C 124 31.765 31.523 0.242 1
1 1467 . 47 1 1 A 125 125 MET N N 124 119.413 119.141 0.272 1
1 1468 . 47 1 1 A 126 126 PHE H H 125 7.148 7.420 -0.272 1
1 1469 . 47 1 1 A 126 126 PHE HA H 125 3.633 4.194 -0.561 1
1 1476 . 47 1 1 A 126 126 PHE C C 125 178.994 178.251 0.743 1
1 1477 . 47 1 1 A 126 126 PHE CA C 125 63.148 61.145 2.003 1
1 1478 . 47 1 1 A 126 126 PHE CB C 125 39.830 38.336 1.494 1
1 1483 . 47 1 1 A 126 126 PHE N N 125 120.013 118.804 1.209 1
1 1484 . 47 1 1 A 127 127 LEU H H 126 8.369 8.551 -0.182 1
1 1485 . 47 1 1 A 127 127 LEU HA H 126 3.972 3.990 -0.018 1
1 1495 . 47 1 1 A 127 127 LEU C C 126 180.621 179.096 1.525 1
1 1496 . 47 1 1 A 127 127 LEU CA C 126 57.944 57.885 0.059 1
1 1497 . 47 1 1 A 127 127 LEU CB C 126 40.543 41.234 -0.691 1
1 1501 . 47 1 1 A 127 127 LEU N N 126 119.692 119.622 0.070 1
1 1502 . 47 1 1 A 128 128 ASP H H 127 8.578 8.061 0.517 1
1 1503 . 47 1 1 A 128 128 ASP HA H 127 4.308 4.350 -0.042 1
1 1506 . 47 1 1 A 128 128 ASP C C 127 178.254 178.119 0.135 1
1 1507 . 47 1 1 A 128 128 ASP CA C 127 56.964 57.159 -0.195 1
1 1508 . 47 1 1 A 128 128 ASP CB C 127 39.735 40.700 -0.965 1
1 1509 . 47 1 1 A 128 128 ASP N N 127 121.926 119.572 2.354 1
1 1510 . 47 1 1 A 129 129 TYR H H 128 7.710 8.184 -0.474 1
1 1511 . 47 1 1 A 129 129 TYR HA H 128 3.908 3.973 -0.065 1
1 1518 . 47 1 1 A 129 129 TYR C C 128 177.633 177.493 0.140 1
1 1519 . 47 1 1 A 129 129 TYR CA C 128 61.796 61.391 0.405 1
1 1520 . 47 1 1 A 129 129 TYR CB C 128 39.372 38.411 0.961 1
1 1525 . 47 1 1 A 129 129 TYR N N 128 122.548 120.081 2.467 1
1 1526 . 47 1 1 A 130 130 ARG H H 129 8.622 8.462 0.160 1
1 1527 . 47 1 1 A 130 130 ARG HA H 129 3.722 3.920 -0.198 1
1 1535 . 47 1 1 A 130 130 ARG CA C 129 60.084 59.633 0.451 1
1 1536 . 47 1 1 A 130 130 ARG CB C 129 29.902 29.847 0.055 1
1 1539 . 47 1 1 A 130 130 ARG N N 129 118.302 119.135 -0.833 1
1 1541 . 47 1 1 A 131 131 ALA H H 130 7.936 7.766 0.170 1
1 1542 . 47 1 1 A 131 131 ALA HA H 130 3.997 4.059 -0.062 1
1 1546 . 47 1 1 A 131 131 ALA C C 130 180.456 180.435 0.021 1
1 1547 . 47 1 1 A 131 131 ALA CA C 130 55.133 54.965 0.168 1
1 1548 . 47 1 1 A 131 131 ALA CB C 130 17.750 18.327 -0.577 1
1 1549 . 47 1 1 A 131 131 ALA N N 130 119.788 121.385 -1.597 1
1 1550 . 47 1 1 A 132 132 GLU H H 131 7.622 7.521 0.101 1
1 1551 . 47 1 1 A 132 132 GLU HA H 131 3.862 4.019 -0.157 1
1 1556 . 47 1 1 A 132 132 GLU C C 131 179.528 178.064 1.464 1
1 1557 . 47 1 1 A 132 132 GLU CA C 131 58.849 58.366 0.483 1
1 1558 . 47 1 1 A 132 132 GLU CB C 131 28.930 29.515 -0.585 1
1 1560 . 47 1 1 A 132 132 GLU N N 131 118.428 118.327 0.101 1
1 1561 . 47 1 1 A 133 133 LYS H H 132 7.853 7.388 0.465 1
1 1562 . 47 1 1 A 133 133 LYS HA H 132 3.722 4.038 -0.316 1
1 1571 . 47 1 1 A 133 133 LYS C C 132 175.725 177.199 -1.474 1
1 1572 . 47 1 1 A 133 133 LYS CA C 132 57.544 58.008 -0.464 1
1 1573 . 47 1 1 A 133 133 LYS CB C 132 31.770 31.828 -0.058 1
1 1577 . 47 1 1 A 133 133 LYS N N 132 119.473 117.784 1.689 1
1 1578 . 47 1 1 A 134 134 GLU H H 133 8.151 7.814 0.337 1
1 1579 . 47 1 1 A 134 134 GLU HA H 133 4.161 4.261 -0.100 1
1 1584 . 47 1 1 A 134 134 GLU C C 133 177.453 178.598 -1.145 1
1 1585 . 47 1 1 A 134 134 GLU CA C 133 57.222 57.221 0.001 1
1 1586 . 47 1 1 A 134 134 GLU CB C 133 30.091 30.354 -0.263 1
1 1588 . 47 1 1 A 134 134 GLU N N 133 116.525 118.329 -1.804 1
1 1589 . 47 1 1 A 135 135 GLY H H 134 7.702 8.037 -0.335 1
1 1590 . 47 1 1 A 135 135 GLY HA2 H 134 3.896 3.696 0.200 1
1 1591 . 47 1 1 A 135 135 GLY HA3 H 134 3.897 3.708 0.189 1
1 1592 . 47 1 1 A 135 135 GLY C C 134 174.538 174.770 -0.232 1
1 1593 . 47 1 1 A 135 135 GLY CA C 134 45.975 47.244 -1.269 1
1 1594 . 47 1 1 A 135 135 GLY N N 134 107.924 109.433 -1.509 1
1 1595 . 47 1 1 A 136 136 ARG H H 135 8.045 7.844 0.201 1
1 1596 . 47 1 1 A 136 136 ARG HA H 135 4.323 4.536 -0.213 1
1 1604 . 47 1 1 A 136 136 ARG C C 135 175.864 176.595 -0.731 1
1 1605 . 47 1 1 A 136 136 ARG CA C 135 56.016 55.245 0.771 1
1 1606 . 47 1 1 A 136 136 ARG CB C 135 30.987 31.549 -0.562 1
1 1609 . 47 1 1 A 136 136 ARG N N 135 119.708 115.081 4.627 1
1 1 . 48 1 1 A 14 14 PHE CA C 13 58.199 57.888 0.311 1
1 2 . 48 1 1 A 14 14 PHE CB C 13 39.717 39.592 0.125 1
1 3 . 48 1 1 A 15 15 SER H H 14 8.299 9.076 -0.777 1
1 4 . 48 1 1 A 15 15 SER HA H 14 4.359 4.608 -0.249 1
1 7 . 48 1 1 A 15 15 SER CA C 14 58.249 59.014 -0.765 1
1 8 . 48 1 1 A 15 15 SER CB C 14 63.936 63.075 0.861 1
1 9 . 48 1 1 A 15 15 SER N N 14 117.379 117.762 -0.383 1
1 10 . 48 1 1 A 16 16 SER H H 15 8.255 8.963 -0.708 1
1 11 . 48 1 1 A 16 16 SER HA H 15 3.729 4.748 -1.019 1
1 14 . 48 1 1 A 16 16 SER CA C 15 58.224 59.201 -0.977 1
1 15 . 48 1 1 A 16 16 SER CB C 15 63.886 66.489 -2.603 1
1 16 . 48 1 1 A 16 16 SER N N 15 117.694 120.820 -3.126 1
1 17 . 48 1 1 A 17 17 ALA H H 16 8.333 8.282 0.051 1
1 18 . 48 1 1 A 17 17 ALA HA H 16 4.252 4.211 0.041 1
1 22 . 48 1 1 A 17 17 ALA CA C 16 53.377 54.253 -0.876 1
1 23 . 48 1 1 A 17 17 ALA CB C 16 18.896 18.591 0.305 1
1 24 . 48 1 1 A 17 17 ALA N N 16 125.462 124.045 1.417 1
1 25 . 48 1 1 A 18 18 SER H H 17 8.219 8.316 -0.097 1
1 26 . 48 1 1 A 18 18 SER HA H 17 4.332 4.579 -0.247 1
1 29 . 48 1 1 A 18 18 SER CA C 17 59.105 57.092 2.013 1
1 30 . 48 1 1 A 18 18 SER CB C 17 63.592 63.723 -0.131 1
1 31 . 48 1 1 A 18 18 SER N N 17 114.821 112.290 2.531 1
1 32 . 48 1 1 A 19 19 ASP H H 18 8.309 8.444 -0.135 1
1 33 . 48 1 1 A 19 19 ASP HA H 18 4.554 5.022 -0.468 1
1 36 . 48 1 1 A 19 19 ASP C C 18 176.528 176.749 -0.221 1
1 37 . 48 1 1 A 19 19 ASP CA C 18 55.272 54.418 0.854 1
1 38 . 48 1 1 A 19 19 ASP CB C 18 40.883 42.639 -1.756 1
1 39 . 48 1 1 A 19 19 ASP N N 18 123.367 121.267 2.100 1
1 40 . 48 1 1 A 20 20 ALA H H 19 8.133 8.633 -0.500 1
1 41 . 48 1 1 A 20 20 ALA HA H 19 4.170 4.117 0.053 1
1 45 . 48 1 1 A 20 20 ALA C C 19 179.857 179.047 0.810 1
1 46 . 48 1 1 A 20 20 ALA CA C 19 54.341 55.549 -1.208 1
1 47 . 48 1 1 A 20 20 ALA CB C 19 18.660 18.632 0.028 1
1 48 . 48 1 1 A 20 20 ALA N N 19 123.350 123.248 0.102 1
1 49 . 48 1 1 A 21 21 GLU H H 20 8.140 8.106 0.034 1
1 50 . 48 1 1 A 21 21 GLU HA H 20 4.128 4.091 0.037 1
1 55 . 48 1 1 A 21 21 GLU C C 20 177.675 178.635 -0.960 1
1 56 . 48 1 1 A 21 21 GLU CA C 20 58.520 59.328 -0.808 1
1 57 . 48 1 1 A 21 21 GLU CB C 20 29.765 29.449 0.316 1
1 59 . 48 1 1 A 21 21 GLU N N 20 119.063 119.234 -0.171 1
1 60 . 48 1 1 A 22 22 PHE H H 21 8.009 8.169 -0.160 1
1 61 . 48 1 1 A 22 22 PHE HA H 21 4.123 4.289 -0.166 1
1 68 . 48 1 1 A 22 22 PHE C C 21 176.410 177.657 -1.247 1
1 69 . 48 1 1 A 22 22 PHE CA C 21 62.202 61.121 1.081 1
1 70 . 48 1 1 A 22 22 PHE CB C 21 39.223 39.254 -0.031 1
1 75 . 48 1 1 A 22 22 PHE N N 21 121.211 120.910 0.301 1
1 76 . 48 1 1 A 23 23 ASP H H 22 8.261 8.330 -0.069 1
1 77 . 48 1 1 A 23 23 ASP HA H 22 4.041 4.389 -0.348 1
1 80 . 48 1 1 A 23 23 ASP C C 22 179.078 178.343 0.735 1
1 81 . 48 1 1 A 23 23 ASP CA C 22 57.048 57.660 -0.612 1
1 82 . 48 1 1 A 23 23 ASP CB C 22 40.154 41.301 -1.147 1
1 83 . 48 1 1 A 23 23 ASP N N 22 116.876 118.797 -1.921 1
1 84 . 48 1 1 A 24 24 ALA H H 23 7.651 7.534 0.117 1
1 85 . 48 1 1 A 24 24 ALA HA H 23 3.785 3.838 -0.053 1
1 89 . 48 1 1 A 24 24 ALA C C 23 179.577 179.437 0.140 1
1 90 . 48 1 1 A 24 24 ALA CA C 23 54.341 54.952 -0.611 1
1 91 . 48 1 1 A 24 24 ALA CB C 23 17.762 18.363 -0.601 1
1 92 . 48 1 1 A 24 24 ALA N N 23 121.873 121.295 0.578 1
1 93 . 48 1 1 A 25 25 VAL H H 24 7.718 8.027 -0.309 1
1 94 . 48 1 1 A 25 25 VAL HA H 24 3.216 3.837 -0.621 1
1 102 . 48 1 1 A 25 25 VAL C C 24 177.805 177.831 -0.026 1
1 103 . 48 1 1 A 25 25 VAL CA C 24 66.789 65.453 1.336 1
1 104 . 48 1 1 A 25 25 VAL CB C 24 31.277 31.288 -0.011 1
1 107 . 48 1 1 A 25 25 VAL N N 24 117.890 117.017 0.873 1
1 108 . 48 1 1 A 26 26 VAL H H 25 7.867 7.651 0.216 1
1 109 . 48 1 1 A 26 26 VAL HA H 25 3.274 3.464 -0.190 1
1 117 . 48 1 1 A 26 26 VAL C C 25 177.788 177.656 0.132 1
1 118 . 48 1 1 A 26 26 VAL CA C 25 67.282 66.322 0.960 1
1 119 . 48 1 1 A 26 26 VAL CB C 25 31.266 31.271 -0.005 1
1 122 . 48 1 1 A 26 26 VAL N N 25 118.170 121.425 -3.255 1
1 123 . 48 1 1 A 27 27 GLY H H 26 7.544 7.547 -0.003 1
1 124 . 48 1 1 A 27 27 GLY HA2 H 26 3.592 3.494 0.098 1
1 125 . 48 1 1 A 27 27 GLY HA3 H 26 3.721 3.616 0.105 1
1 126 . 48 1 1 A 27 27 GLY C C 26 176.717 176.526 0.191 1
1 127 . 48 1 1 A 27 27 GLY CA C 26 47.085 47.166 -0.081 1
1 128 . 48 1 1 A 27 27 GLY N N 26 105.795 107.462 -1.667 1
1 129 . 48 1 1 A 28 28 TYR H H 27 7.625 7.297 0.328 1
1 130 . 48 1 1 A 28 28 TYR HA H 27 4.546 4.582 -0.036 1
1 137 . 48 1 1 A 28 28 TYR C C 27 178.991 178.141 0.850 1
1 138 . 48 1 1 A 28 28 TYR CA C 27 58.845 59.668 -0.823 1
1 139 . 48 1 1 A 28 28 TYR CB C 27 37.602 37.617 -0.015 1
1 144 . 48 1 1 A 28 28 TYR N N 27 119.933 121.747 -1.814 1
1 145 . 48 1 1 A 29 29 LEU H H 28 8.517 8.497 0.020 1
1 146 . 48 1 1 A 29 29 LEU HA H 28 3.728 3.841 -0.113 1
1 156 . 48 1 1 A 29 29 LEU CA C 28 58.281 57.947 0.334 1
1 157 . 48 1 1 A 29 29 LEU CB C 28 41.948 41.312 0.636 1
1 161 . 48 1 1 A 29 29 LEU N N 28 119.669 120.108 -0.439 1
1 162 . 48 1 1 A 30 30 GLU H H 29 8.072 7.996 0.076 1
1 163 . 48 1 1 A 30 30 GLU HA H 29 3.722 3.873 -0.151 1
1 168 . 48 1 1 A 30 30 GLU C C 29 177.731 178.847 -1.116 1
1 169 . 48 1 1 A 30 30 GLU CA C 29 59.763 59.952 -0.189 1
1 170 . 48 1 1 A 30 30 GLU CB C 29 28.844 29.299 -0.455 1
1 172 . 48 1 1 A 30 30 GLU N N 29 117.666 117.923 -0.257 1
1 173 . 48 1 1 A 31 31 ASP H H 30 7.243 7.725 -0.482 1
1 174 . 48 1 1 A 31 31 ASP HA H 30 4.297 4.415 -0.118 1
1 177 . 48 1 1 A 31 31 ASP CA C 30 56.953 57.014 -0.061 1
1 178 . 48 1 1 A 31 31 ASP CB C 30 40.730 40.979 -0.249 1
1 179 . 48 1 1 A 31 31 ASP N N 30 116.720 118.971 -2.251 1
1 180 . 48 1 1 A 32 32 ILE H H 31 7.940 7.770 0.170 1
1 181 . 48 1 1 A 32 32 ILE HA H 31 3.640 3.727 -0.087 1
1 191 . 48 1 1 A 32 32 ILE C C 31 177.980 178.319 -0.339 1
1 192 . 48 1 1 A 32 32 ILE CA C 31 64.692 64.307 0.385 1
1 193 . 48 1 1 A 32 32 ILE CB C 31 38.938 37.116 1.822 1
1 197 . 48 1 1 A 32 32 ILE N N 31 119.728 119.183 0.545 1
1 198 . 48 1 1 A 33 33 ILE H H 32 7.984 8.000 -0.016 1
1 199 . 48 1 1 A 33 33 ILE HA H 32 3.598 2.790 0.808 1
1 209 . 48 1 1 A 33 33 ILE C C 32 176.723 176.805 -0.082 1
1 210 . 48 1 1 A 33 33 ILE CA C 32 63.241 64.453 -1.212 1
1 211 . 48 1 1 A 33 33 ILE CB C 32 37.580 37.412 0.168 1
1 215 . 48 1 1 A 33 33 ILE N N 32 113.919 120.822 -6.903 1
1 216 . 48 1 1 A 34 34 MET H H 33 7.288 7.745 -0.457 1
1 217 . 48 1 1 A 34 34 MET HA H 33 4.496 4.642 -0.146 1
1 225 . 48 1 1 A 34 34 MET C C 33 176.423 175.806 0.617 1
1 226 . 48 1 1 A 34 34 MET CA C 33 54.634 54.437 0.197 1
1 227 . 48 1 1 A 34 34 MET CB C 33 31.934 30.998 0.936 1
1 230 . 48 1 1 A 34 34 MET N N 33 115.130 117.042 -1.912 1
1 231 . 48 1 1 A 35 35 ASP H H 34 7.405 7.628 -0.223 1
1 232 . 48 1 1 A 35 35 ASP HA H 34 4.484 4.618 -0.134 1
1 235 . 48 1 1 A 35 35 ASP C C 34 177.139 176.543 0.596 1
1 236 . 48 1 1 A 35 35 ASP CA C 34 54.625 54.657 -0.032 1
1 237 . 48 1 1 A 35 35 ASP CB C 34 43.554 42.879 0.675 1
1 238 . 48 1 1 A 35 35 ASP N N 34 121.814 122.497 -0.683 1
1 239 . 48 1 1 A 36 36 ASP H H 35 8.765 8.832 -0.067 1
1 240 . 48 1 1 A 36 36 ASP HA H 35 4.235 4.321 -0.086 1
1 243 . 48 1 1 A 36 36 ASP C C 35 178.320 178.432 -0.112 1
1 244 . 48 1 1 A 36 36 ASP CA C 35 57.832 57.921 -0.089 1
1 245 . 48 1 1 A 36 36 ASP CB C 35 40.914 40.545 0.369 1
1 246 . 48 1 1 A 36 36 ASP N N 35 125.883 125.286 0.597 1
1 247 . 48 1 1 A 37 37 GLU H H 36 8.905 8.086 0.819 1
1 248 . 48 1 1 A 37 37 GLU HA H 36 3.933 4.133 -0.200 1
1 253 . 48 1 1 A 37 37 GLU C C 36 179.304 179.055 0.249 1
1 254 . 48 1 1 A 37 37 GLU CA C 36 59.828 59.257 0.571 1
1 255 . 48 1 1 A 37 37 GLU CB C 36 29.380 29.299 0.081 1
1 257 . 48 1 1 A 37 37 GLU N N 36 119.077 119.947 -0.870 1
1 258 . 48 1 1 A 38 38 PHE H H 37 7.460 8.219 -0.759 1
1 259 . 48 1 1 A 38 38 PHE HA H 37 3.642 4.005 -0.363 1
1 267 . 48 1 1 A 38 38 PHE C C 37 176.483 177.867 -1.384 1
1 268 . 48 1 1 A 38 38 PHE CA C 37 61.411 61.270 0.141 1
1 269 . 48 1 1 A 38 38 PHE CB C 37 39.355 39.038 0.317 1
1 275 . 48 1 1 A 38 38 PHE N N 37 119.968 120.765 -0.797 1
1 276 . 48 1 1 A 39 39 GLN H H 38 7.968 8.117 -0.149 1
1 277 . 48 1 1 A 39 39 GLN HA H 38 3.712 3.932 -0.220 1
1 284 . 48 1 1 A 39 39 GLN CA C 38 59.153 58.774 0.379 1
1 285 . 48 1 1 A 39 39 GLN CB C 38 28.213 28.482 -0.269 1
1 287 . 48 1 1 A 39 39 GLN N N 38 116.433 118.513 -2.080 1
1 289 . 48 1 1 A 40 40 LEU H H 39 7.930 7.692 0.238 1
1 290 . 48 1 1 A 40 40 LEU HA H 39 3.916 4.005 -0.089 1
1 300 . 48 1 1 A 40 40 LEU C C 39 177.731 178.004 -0.273 1
1 301 . 48 1 1 A 40 40 LEU CA C 39 57.915 57.980 -0.065 1
1 302 . 48 1 1 A 40 40 LEU CB C 39 41.989 41.681 0.308 1
1 306 . 48 1 1 A 40 40 LEU N N 39 119.505 121.769 -2.264 1
1 307 . 48 1 1 A 41 41 LEU H H 40 7.174 7.877 -0.703 1
1 308 . 48 1 1 A 41 41 LEU HA H 40 3.835 3.993 -0.158 1
1 318 . 48 1 1 A 41 41 LEU C C 40 179.738 178.376 1.362 1
1 319 . 48 1 1 A 41 41 LEU CA C 40 58.266 58.225 0.041 1
1 320 . 48 1 1 A 41 41 LEU CB C 40 42.050 41.765 0.285 1
1 324 . 48 1 1 A 41 41 LEU N N 40 120.971 119.680 1.291 1
1 325 . 48 1 1 A 42 42 GLN H H 41 8.058 7.903 0.155 1
1 326 . 48 1 1 A 42 42 GLN HA H 41 3.556 3.754 -0.198 1
1 333 . 48 1 1 A 42 42 GLN C C 41 177.642 178.182 -0.540 1
1 334 . 48 1 1 A 42 42 GLN CA C 41 59.826 59.194 0.632 1
1 335 . 48 1 1 A 42 42 GLN CB C 41 28.762 28.316 0.446 1
1 337 . 48 1 1 A 42 42 GLN N N 41 117.899 118.026 -0.127 1
1 339 . 48 1 1 A 43 43 ARG H H 42 8.179 7.607 0.572 1
1 340 . 48 1 1 A 43 43 ARG HA H 42 3.655 3.927 -0.272 1
1 347 . 48 1 1 A 43 43 ARG C C 42 178.051 178.174 -0.123 1
1 348 . 48 1 1 A 43 43 ARG CA C 42 59.766 59.065 0.701 1
1 349 . 48 1 1 A 43 43 ARG CB C 42 29.941 29.889 0.052 1
1 352 . 48 1 1 A 43 43 ARG N N 42 119.392 119.318 0.074 1
1 353 . 48 1 1 A 44 44 ASN H H 43 8.525 8.100 0.425 1
1 354 . 48 1 1 A 44 44 ASN HA H 43 4.332 4.295 0.037 1
1 359 . 48 1 1 A 44 44 ASN C C 43 178.150 177.480 0.670 1
1 360 . 48 1 1 A 44 44 ASN CA C 43 55.841 56.046 -0.205 1
1 361 . 48 1 1 A 44 44 ASN CB C 43 37.632 39.236 -1.604 1
1 362 . 48 1 1 A 44 44 ASN N N 43 116.214 117.260 -1.046 1
1 364 . 48 1 1 A 45 45 PHE H H 44 7.586 7.767 -0.181 1
1 365 . 48 1 1 A 45 45 PHE HA H 44 4.132 4.320 -0.188 1
1 372 . 48 1 1 A 45 45 PHE C C 44 176.691 178.407 -1.716 1
1 373 . 48 1 1 A 45 45 PHE CA C 44 62.333 60.944 1.389 1
1 374 . 48 1 1 A 45 45 PHE CB C 44 39.449 38.382 1.067 1
1 379 . 48 1 1 A 45 45 PHE N N 44 121.501 117.804 3.697 1
1 380 . 48 1 1 A 46 46 MET H H 45 8.190 8.253 -0.063 1
1 381 . 48 1 1 A 46 46 MET HA H 45 4.060 4.162 -0.102 1
1 389 . 48 1 1 A 46 46 MET C C 45 179.754 178.369 1.385 1
1 390 . 48 1 1 A 46 46 MET CA C 45 57.742 58.468 -0.726 1
1 391 . 48 1 1 A 46 46 MET CB C 45 29.912 31.789 -1.877 1
1 394 . 48 1 1 A 46 46 MET N N 45 116.727 117.473 -0.746 1
1 395 . 48 1 1 A 47 47 ASP H H 46 8.579 8.004 0.575 1
1 396 . 48 1 1 A 47 47 ASP HA H 46 4.804 4.459 0.345 1
1 399 . 48 1 1 A 47 47 ASP C C 46 177.854 178.070 -0.216 1
1 400 . 48 1 1 A 47 47 ASP CA C 46 57.277 57.328 -0.051 1
1 401 . 48 1 1 A 47 47 ASP CB C 46 40.776 40.269 0.507 1
1 402 . 48 1 1 A 47 47 ASP N N 46 117.798 119.477 -1.679 1
1 403 . 48 1 1 A 48 48 LYS H H 47 7.339 7.860 -0.521 1
1 404 . 48 1 1 A 48 48 LYS HA H 47 3.828 4.303 -0.475 1
1 413 . 48 1 1 A 48 48 LYS C C 47 178.812 178.768 0.044 1
1 414 . 48 1 1 A 48 48 LYS CA C 47 58.953 57.950 1.003 1
1 415 . 48 1 1 A 48 48 LYS CB C 47 32.796 33.530 -0.734 1
1 419 . 48 1 1 A 48 48 LYS N N 47 117.852 118.918 -1.066 1
1 420 . 48 1 1 A 49 49 TYR H H 48 6.841 8.842 -2.001 1
1 421 . 48 1 1 A 49 49 TYR HA H 48 4.995 4.210 0.785 1
1 428 . 48 1 1 A 49 49 TYR C C 48 178.138 178.529 -0.391 1
1 429 . 48 1 1 A 49 49 TYR CA C 48 58.620 59.752 -1.132 1
1 430 . 48 1 1 A 49 49 TYR CB C 48 42.939 38.250 4.689 1
1 435 . 48 1 1 A 49 49 TYR N N 48 112.109 119.336 -7.227 1
1 436 . 48 1 1 A 50 50 TYR H H 49 8.491 7.906 0.585 1
1 437 . 48 1 1 A 50 50 TYR HA H 49 4.598 4.195 0.403 1
1 444 . 48 1 1 A 50 50 TYR C C 49 176.015 177.558 -1.543 1
1 445 . 48 1 1 A 50 50 TYR CA C 49 62.442 59.494 2.948 1
1 446 . 48 1 1 A 50 50 TYR CB C 49 36.588 36.791 -0.203 1
1 451 . 48 1 1 A 50 50 TYR N N 49 118.294 119.258 -0.964 1
1 452 . 48 1 1 A 51 51 LEU H H 50 7.512 7.507 0.005 1
1 453 . 48 1 1 A 51 51 LEU HA H 50 3.878 3.499 0.379 1
1 463 . 48 1 1 A 51 51 LEU C C 50 178.625 178.549 0.076 1
1 464 . 48 1 1 A 51 51 LEU CA C 50 55.994 57.276 -1.282 1
1 465 . 48 1 1 A 51 51 LEU CB C 50 40.743 41.384 -0.641 1
1 469 . 48 1 1 A 51 51 LEU N N 50 118.478 121.969 -3.491 1
1 470 . 48 1 1 A 52 52 GLU H H 51 8.042 7.685 0.357 1
1 471 . 48 1 1 A 52 52 GLU HA H 51 4.197 3.885 0.312 1
1 476 . 48 1 1 A 52 52 GLU C C 51 177.629 177.718 -0.089 1
1 477 . 48 1 1 A 52 52 GLU CA C 51 56.141 59.600 -3.459 1
1 478 . 48 1 1 A 52 52 GLU CB C 51 29.162 29.094 0.068 1
1 480 . 48 1 1 A 52 52 GLU N N 51 115.067 117.576 -2.509 1
1 481 . 48 1 1 A 53 53 PHE H H 52 7.465 7.806 -0.341 1
1 482 . 48 1 1 A 53 53 PHE HA H 52 4.431 4.479 -0.048 1
1 490 . 48 1 1 A 53 53 PHE C C 52 174.325 174.872 -0.547 1
1 491 . 48 1 1 A 53 53 PHE CA C 52 58.986 57.292 1.694 1
1 492 . 48 1 1 A 53 53 PHE CB C 52 40.183 37.675 2.508 1
1 498 . 48 1 1 A 53 53 PHE N N 52 116.768 118.960 -2.192 1
1 499 . 48 1 1 A 54 54 GLU H H 53 7.484 8.559 -1.075 1
1 500 . 48 1 1 A 54 54 GLU HA H 53 4.583 4.800 -0.217 1
1 505 . 48 1 1 A 54 54 GLU C C 53 175.722 175.679 0.043 1
1 506 . 48 1 1 A 54 54 GLU CA C 53 54.248 54.783 -0.535 1
1 507 . 48 1 1 A 54 54 GLU CB C 53 34.409 32.013 2.396 1
1 509 . 48 1 1 A 54 54 GLU N N 53 118.844 124.051 -5.207 1
1 510 . 48 1 1 A 55 55 ASP H H 54 9.008 8.709 0.299 1
1 511 . 48 1 1 A 55 55 ASP HA H 54 4.735 4.720 0.015 1
1 514 . 48 1 1 A 55 55 ASP C C 54 175.421 175.510 -0.089 1
1 515 . 48 1 1 A 55 55 ASP CA C 54 52.888 54.243 -1.355 1
1 516 . 48 1 1 A 55 55 ASP CB C 54 38.894 40.684 -1.790 1
1 517 . 48 1 1 A 55 55 ASP N N 54 123.654 124.484 -0.830 1
1 518 . 48 1 1 A 56 56 THR H H 55 7.819 7.973 -0.154 1
1 519 . 48 1 1 A 56 56 THR HA H 55 4.574 5.013 -0.439 1
1 524 . 48 1 1 A 56 56 THR C C 55 174.096 174.084 0.012 1
1 525 . 48 1 1 A 56 56 THR CA C 55 59.172 59.480 -0.308 1
1 526 . 48 1 1 A 56 56 THR CB C 55 71.889 72.258 -0.369 1
1 528 . 48 1 1 A 56 56 THR N N 55 112.015 117.199 -5.184 1
1 529 . 48 1 1 A 57 57 GLU H H 56 8.527 8.883 -0.356 1
1 530 . 48 1 1 A 57 57 GLU HA H 56 4.217 4.460 -0.243 1
1 535 . 48 1 1 A 57 57 GLU C C 56 177.042 176.809 0.233 1
1 536 . 48 1 1 A 57 57 GLU CA C 56 56.869 56.873 -0.004 1
1 537 . 48 1 1 A 57 57 GLU CB C 56 29.731 30.555 -0.824 1
1 539 . 48 1 1 A 57 57 GLU N N 56 117.531 120.400 -2.869 1
1 540 . 48 1 1 A 58 58 GLU H H 57 7.587 7.944 -0.357 1
1 541 . 48 1 1 A 58 58 GLU HA H 57 3.941 4.368 -0.427 1
1 546 . 48 1 1 A 58 58 GLU C C 57 176.849 175.726 1.123 1
1 547 . 48 1 1 A 58 58 GLU CA C 57 56.924 56.584 0.340 1
1 548 . 48 1 1 A 58 58 GLU CB C 57 30.251 30.063 0.188 1
1 550 . 48 1 1 A 58 58 GLU N N 57 119.183 118.825 0.358 1
1 551 . 48 1 1 A 59 59 ASN H H 58 9.120 8.559 0.561 1
1 552 . 48 1 1 A 59 59 ASN HA H 58 4.922 5.052 -0.130 1
1 557 . 48 1 1 A 59 59 ASN C C 58 174.254 175.015 -0.761 1
1 558 . 48 1 1 A 59 59 ASN CA C 58 51.956 53.115 -1.159 1
1 559 . 48 1 1 A 59 59 ASN CB C 58 37.404 39.897 -2.493 1
1 560 . 48 1 1 A 59 59 ASN N N 58 126.767 120.607 6.160 1
1 562 . 48 1 1 A 60 60 LYS H H 59 5.892 8.850 -2.958 1
1 563 . 48 1 1 A 60 60 LYS HA H 59 3.798 4.860 -1.062 1
1 572 . 48 1 1 A 60 60 LYS C C 59 177.908 177.074 0.834 1
1 573 . 48 1 1 A 60 60 LYS CA C 59 56.623 54.784 1.839 1
1 574 . 48 1 1 A 60 60 LYS CB C 59 32.279 35.016 -2.737 1
1 578 . 48 1 1 A 60 60 LYS N N 59 121.527 122.628 -1.101 1
1 579 . 48 1 1 A 61 61 LEU H H 60 8.473 8.812 -0.339 1
1 580 . 48 1 1 A 61 61 LEU HA H 60 3.891 4.246 -0.355 1
1 590 . 48 1 1 A 61 61 LEU C C 60 179.843 178.517 1.326 1
1 591 . 48 1 1 A 61 61 LEU CA C 60 58.301 56.275 2.026 1
1 592 . 48 1 1 A 61 61 LEU CB C 60 41.305 41.546 -0.241 1
1 596 . 48 1 1 A 61 61 LEU N N 60 125.639 123.690 1.949 1
1 597 . 48 1 1 A 62 62 ILE H H 61 7.698 7.913 -0.215 1
1 598 . 48 1 1 A 62 62 ILE HA H 61 3.952 3.863 0.089 1
1 608 . 48 1 1 A 62 62 ILE C C 61 175.392 177.280 -1.888 1
1 609 . 48 1 1 A 62 62 ILE CA C 61 61.743 63.246 -1.503 1
1 610 . 48 1 1 A 62 62 ILE CB C 61 39.108 37.743 1.365 1
1 614 . 48 1 1 A 62 62 ILE N N 61 114.111 119.749 -5.638 1
1 615 . 48 1 1 A 63 63 TYR H H 62 7.273 7.935 -0.662 1
1 616 . 48 1 1 A 63 63 TYR HA H 62 4.343 4.281 0.062 1
1 623 . 48 1 1 A 63 63 TYR C C 62 178.264 178.607 -0.343 1
1 624 . 48 1 1 A 63 63 TYR CA C 62 57.231 60.992 -3.761 1
1 625 . 48 1 1 A 63 63 TYR CB C 62 36.332 37.442 -1.110 1
1 630 . 48 1 1 A 63 63 TYR N N 62 117.689 121.313 -3.624 1
1 631 . 48 1 1 A 64 64 THR H H 63 7.747 7.894 -0.147 1
1 632 . 48 1 1 A 64 64 THR HA H 63 4.266 4.233 0.033 1
1 637 . 48 1 1 A 64 64 THR CA C 63 69.362 67.558 1.804 1
1 638 . 48 1 1 A 64 64 THR CB C 63 66.962 67.576 -0.614 1
1 640 . 48 1 1 A 64 64 THR N N 63 113.755 116.274 -2.519 1
1 641 . 48 1 1 A 65 65 PRO HA H 64 4.372 4.364 0.008 1
1 648 . 48 1 1 A 65 65 PRO C C 64 179.913 179.357 0.556 1
1 649 . 48 1 1 A 65 65 PRO CA C 64 66.011 65.995 0.016 1
1 650 . 48 1 1 A 65 65 PRO CB C 64 30.642 30.675 -0.033 1
1 653 . 48 1 1 A 66 66 ILE H H 65 7.377 7.294 0.083 1
1 654 . 48 1 1 A 66 66 ILE HA H 65 3.530 3.873 -0.343 1
1 664 . 48 1 1 A 66 66 ILE C C 65 177.543 178.287 -0.744 1
1 665 . 48 1 1 A 66 66 ILE CA C 65 66.647 64.198 2.449 1
1 666 . 48 1 1 A 66 66 ILE CB C 65 38.029 37.651 0.378 1
1 670 . 48 1 1 A 66 66 ILE N N 65 118.353 116.676 1.677 1
1 671 . 48 1 1 A 67 67 PHE H H 66 8.480 8.312 0.168 1
1 672 . 48 1 1 A 67 67 PHE HA H 66 4.115 4.298 -0.183 1
1 680 . 48 1 1 A 67 67 PHE C C 66 177.293 178.057 -0.764 1
1 681 . 48 1 1 A 67 67 PHE CA C 66 59.570 62.277 -2.707 1
1 682 . 48 1 1 A 67 67 PHE CB C 66 38.865 39.512 -0.647 1
1 688 . 48 1 1 A 67 67 PHE N N 66 122.420 120.475 1.945 1
1 689 . 48 1 1 A 68 68 ASN H H 67 8.595 8.150 0.445 1
1 690 . 48 1 1 A 68 68 ASN HA H 67 4.211 4.415 -0.204 1
1 695 . 48 1 1 A 68 68 ASN C C 67 178.697 178.186 0.511 1
1 696 . 48 1 1 A 68 68 ASN CA C 67 56.056 56.158 -0.102 1
1 697 . 48 1 1 A 68 68 ASN CB C 67 37.704 37.952 -0.248 1
1 698 . 48 1 1 A 68 68 ASN N N 67 115.573 117.531 -1.958 1
1 700 . 48 1 1 A 69 69 GLU H H 68 8.414 8.113 0.301 1
1 701 . 48 1 1 A 69 69 GLU HA H 68 4.102 4.168 -0.066 1
1 706 . 48 1 1 A 69 69 GLU C C 68 177.880 178.812 -0.932 1
1 707 . 48 1 1 A 69 69 GLU CA C 68 59.399 59.339 0.060 1
1 708 . 48 1 1 A 69 69 GLU CB C 68 29.855 29.328 0.527 1
1 710 . 48 1 1 A 69 69 GLU N N 68 123.510 119.938 3.572 1
1 711 . 48 1 1 A 70 70 TYR H H 69 8.659 8.073 0.586 1
1 712 . 48 1 1 A 70 70 TYR HA H 69 3.362 4.126 -0.764 1
1 719 . 48 1 1 A 70 70 TYR C C 69 178.143 176.950 1.193 1
1 720 . 48 1 1 A 70 70 TYR CA C 69 60.686 61.467 -0.781 1
1 721 . 48 1 1 A 70 70 TYR CB C 69 38.560 38.729 -0.169 1
1 726 . 48 1 1 A 70 70 TYR N N 69 122.130 120.888 1.242 1
1 727 . 48 1 1 A 71 71 ILE H H 70 8.031 7.794 0.237 1
1 728 . 48 1 1 A 71 71 ILE HA H 70 3.265 3.697 -0.432 1
1 738 . 48 1 1 A 71 71 ILE C C 70 178.056 177.932 0.124 1
1 739 . 48 1 1 A 71 71 ILE CA C 70 63.756 64.001 -0.245 1
1 740 . 48 1 1 A 71 71 ILE CB C 70 37.321 36.563 0.758 1
1 744 . 48 1 1 A 71 71 ILE N N 70 118.906 120.388 -1.482 1
1 745 . 48 1 1 A 72 72 SER H H 71 7.803 7.758 0.045 1
1 746 . 48 1 1 A 72 72 SER HA H 71 4.029 4.304 -0.275 1
1 749 . 48 1 1 A 72 72 SER CA C 71 61.380 61.102 0.278 1
1 750 . 48 1 1 A 72 72 SER CB C 71 63.288 63.123 0.165 1
1 751 . 48 1 1 A 72 72 SER N N 71 113.735 117.019 -3.284 1
1 752 . 48 1 1 A 73 73 LEU H H 72 7.952 7.906 0.046 1
1 753 . 48 1 1 A 73 73 LEU HA H 72 4.418 4.152 0.266 1
1 763 . 48 1 1 A 73 73 LEU C C 72 177.767 178.334 -0.567 1
1 764 . 48 1 1 A 73 73 LEU CA C 72 56.543 57.452 -0.909 1
1 765 . 48 1 1 A 73 73 LEU CB C 72 44.517 41.727 2.790 1
1 769 . 48 1 1 A 73 73 LEU N N 72 119.411 122.445 -3.034 1
1 770 . 48 1 1 A 74 74 VAL H H 73 8.021 7.700 0.321 1
1 771 . 48 1 1 A 74 74 VAL HA H 73 3.532 3.343 0.189 1
1 779 . 48 1 1 A 74 74 VAL C C 73 177.126 177.975 -0.849 1
1 780 . 48 1 1 A 74 74 VAL CA C 73 66.250 66.321 -0.071 1
1 781 . 48 1 1 A 74 74 VAL CB C 73 31.212 31.129 0.083 1
1 784 . 48 1 1 A 74 74 VAL N N 73 118.747 119.096 -0.349 1
1 785 . 48 1 1 A 75 75 GLU H H 74 7.232 7.893 -0.661 1
1 786 . 48 1 1 A 75 75 GLU HA H 74 3.013 4.243 -1.230 1
1 791 . 48 1 1 A 75 75 GLU C C 74 178.804 179.151 -0.347 1
1 792 . 48 1 1 A 75 75 GLU CA C 74 60.536 59.958 0.578 1
1 793 . 48 1 1 A 75 75 GLU CB C 74 27.009 29.078 -2.069 1
1 795 . 48 1 1 A 75 75 GLU N N 74 118.660 119.746 -1.086 1
1 796 . 48 1 1 A 76 76 LYS H H 75 7.051 7.422 -0.371 1
1 797 . 48 1 1 A 76 76 LYS HA H 75 3.765 4.009 -0.244 1
1 806 . 48 1 1 A 76 76 LYS C C 75 177.765 178.289 -0.524 1
1 807 . 48 1 1 A 76 76 LYS CA C 75 58.357 58.962 -0.605 1
1 808 . 48 1 1 A 76 76 LYS CB C 75 31.939 31.971 -0.032 1
1 812 . 48 1 1 A 76 76 LYS N N 75 116.112 119.671 -3.559 1
1 813 . 48 1 1 A 77 77 TYR H H 76 7.067 7.604 -0.537 1
1 814 . 48 1 1 A 77 77 TYR HA H 76 4.036 4.217 -0.181 1
1 821 . 48 1 1 A 77 77 TYR C C 76 177.752 177.285 0.467 1
1 822 . 48 1 1 A 77 77 TYR CA C 76 61.820 61.242 0.578 1
1 823 . 48 1 1 A 77 77 TYR CB C 76 38.480 38.622 -0.142 1
1 828 . 48 1 1 A 77 77 TYR N N 76 118.434 120.672 -2.238 1
1 829 . 48 1 1 A 78 78 ILE H H 77 7.554 8.427 -0.873 1
1 830 . 48 1 1 A 78 78 ILE HA H 77 3.159 3.736 -0.577 1
1 840 . 48 1 1 A 78 78 ILE C C 77 177.341 178.038 -0.697 1
1 841 . 48 1 1 A 78 78 ILE CA C 77 65.177 65.402 -0.225 1
1 842 . 48 1 1 A 78 78 ILE CB C 77 37.339 38.185 -0.846 1
1 846 . 48 1 1 A 78 78 ILE N N 77 117.672 121.177 -3.505 1
1 847 . 48 1 1 A 79 79 GLU H H 78 8.296 7.975 0.321 1
1 848 . 48 1 1 A 79 79 GLU HA H 78 3.557 3.763 -0.206 1
1 853 . 48 1 1 A 79 79 GLU C C 78 177.742 178.935 -1.193 1
1 854 . 48 1 1 A 79 79 GLU CA C 78 60.847 60.069 0.778 1
1 855 . 48 1 1 A 79 79 GLU CB C 78 29.594 29.191 0.403 1
1 857 . 48 1 1 A 79 79 GLU N N 78 118.701 120.874 -2.173 1
1 858 . 48 1 1 A 80 80 GLU H H 79 8.330 8.202 0.128 1
1 859 . 48 1 1 A 80 80 GLU HA H 79 3.774 4.002 -0.228 1
1 864 . 48 1 1 A 80 80 GLU C C 79 179.926 179.152 0.774 1
1 865 . 48 1 1 A 80 80 GLU CA C 79 59.581 59.032 0.549 1
1 866 . 48 1 1 A 80 80 GLU CB C 79 29.062 29.373 -0.311 1
1 868 . 48 1 1 A 80 80 GLU N N 79 116.767 117.936 -1.169 1
1 869 . 48 1 1 A 81 81 GLN H H 80 7.634 7.709 -0.075 1
1 870 . 48 1 1 A 81 81 GLN HA H 80 3.605 3.834 -0.229 1
1 877 . 48 1 1 A 81 81 GLN C C 80 179.681 178.579 1.102 1
1 878 . 48 1 1 A 81 81 GLN CA C 80 57.765 58.567 -0.802 1
1 879 . 48 1 1 A 81 81 GLN CB C 80 28.079 27.824 0.255 1
1 881 . 48 1 1 A 81 81 GLN N N 80 116.325 118.718 -2.393 1
1 883 . 48 1 1 A 82 82 LEU H H 81 8.156 7.484 0.672 1
1 884 . 48 1 1 A 82 82 LEU HA H 81 3.536 3.834 -0.298 1
1 894 . 48 1 1 A 82 82 LEU C C 81 178.945 179.424 -0.479 1
1 895 . 48 1 1 A 82 82 LEU CA C 81 57.761 56.825 0.936 1
1 896 . 48 1 1 A 82 82 LEU CB C 81 40.961 40.902 0.059 1
1 900 . 48 1 1 A 82 82 LEU N N 81 121.546 119.884 1.662 1
1 901 . 48 1 1 A 83 83 LEU H H 82 8.326 7.968 0.358 1
1 902 . 48 1 1 A 83 83 LEU HA H 82 4.198 4.274 -0.076 1
1 912 . 48 1 1 A 83 83 LEU C C 82 178.631 179.108 -0.477 1
1 913 . 48 1 1 A 83 83 LEU CA C 82 57.016 57.040 -0.024 1
1 914 . 48 1 1 A 83 83 LEU CB C 82 42.182 40.725 1.457 1
1 918 . 48 1 1 A 83 83 LEU N N 82 120.426 119.140 1.286 1
1 919 . 48 1 1 A 84 84 GLN H H 83 6.992 7.665 -0.673 1
1 920 . 48 1 1 A 84 84 GLN HA H 83 3.877 4.006 -0.129 1
1 927 . 48 1 1 A 84 84 GLN C C 83 177.008 176.982 0.026 1
1 928 . 48 1 1 A 84 84 GLN CA C 83 57.543 58.647 -1.104 1
1 929 . 48 1 1 A 84 84 GLN CB C 83 28.688 28.498 0.190 1
1 931 . 48 1 1 A 84 84 GLN N N 83 114.001 117.259 -3.258 1
1 933 . 48 1 1 A 85 85 ARG H H 84 7.072 7.439 -0.367 1
1 934 . 48 1 1 A 85 85 ARG HA H 84 4.047 4.379 -0.332 1
1 942 . 48 1 1 A 85 85 ARG C C 84 175.999 175.212 0.787 1
1 943 . 48 1 1 A 85 85 ARG CA C 84 56.764 55.723 1.041 1
1 944 . 48 1 1 A 85 85 ARG CB C 84 32.044 32.291 -0.247 1
1 947 . 48 1 1 A 85 85 ARG N N 84 115.827 116.510 -0.683 1
1 949 . 48 1 1 A 86 86 ILE H H 85 8.238 7.460 0.778 1
1 950 . 48 1 1 A 86 86 ILE HA H 85 4.389 4.590 -0.201 1
1 960 . 48 1 1 A 86 86 ILE CA C 85 58.007 57.956 0.051 1
1 961 . 48 1 1 A 86 86 ILE CB C 85 39.604 38.981 0.623 1
1 965 . 48 1 1 A 86 86 ILE N N 85 119.285 119.266 0.019 1
1 966 . 48 1 1 A 87 87 PRO HA H 86 4.392 4.415 -0.023 1
1 973 . 48 1 1 A 87 87 PRO C C 86 177.622 177.566 0.056 1
1 974 . 48 1 1 A 87 87 PRO CA C 86 64.665 64.608 0.057 1
1 975 . 48 1 1 A 87 87 PRO CB C 86 32.020 32.061 -0.041 1
1 978 . 48 1 1 A 88 88 GLU H H 87 8.312 8.362 -0.050 1
1 979 . 48 1 1 A 88 88 GLU HA H 87 4.208 4.507 -0.299 1
1 984 . 48 1 1 A 88 88 GLU C C 87 175.554 176.019 -0.465 1
1 985 . 48 1 1 A 88 88 GLU CA C 87 56.045 56.202 -0.157 1
1 986 . 48 1 1 A 88 88 GLU CB C 87 28.654 30.028 -1.374 1
1 988 . 48 1 1 A 88 88 GLU N N 87 114.256 116.971 -2.715 1
1 989 . 48 1 1 A 89 89 PHE H H 88 7.946 7.392 0.554 1
1 990 . 48 1 1 A 89 89 PHE HA H 88 3.993 4.321 -0.328 1
1 998 . 48 1 1 A 89 89 PHE C C 88 173.460 174.674 -1.214 1
1 999 . 48 1 1 A 89 89 PHE CA C 88 60.119 59.650 0.469 1
1 1000 . 48 1 1 A 89 89 PHE CB C 88 39.994 39.718 0.276 1
1 1006 . 48 1 1 A 89 89 PHE N N 88 121.550 123.515 -1.965 1
1 1007 . 48 1 1 A 90 90 ASN H H 89 7.266 7.819 -0.553 1
1 1008 . 48 1 1 A 90 90 ASN HA H 89 4.454 5.272 -0.818 1
1 1013 . 48 1 1 A 90 90 ASN C C 89 173.921 174.889 -0.968 1
1 1014 . 48 1 1 A 90 90 ASN CA C 89 51.839 51.316 0.523 1
1 1015 . 48 1 1 A 90 90 ASN CB C 89 40.674 38.905 1.769 1
1 1016 . 48 1 1 A 90 90 ASN N N 89 125.344 123.033 2.311 1
1 1018 . 48 1 1 A 91 91 MET H H 90 8.968 8.503 0.465 1
1 1019 . 48 1 1 A 91 91 MET HA H 90 4.049 4.100 -0.051 1
1 1027 . 48 1 1 A 91 91 MET C C 90 177.475 178.077 -0.602 1
1 1028 . 48 1 1 A 91 91 MET CA C 90 57.758 57.956 -0.198 1
1 1029 . 48 1 1 A 91 91 MET CB C 90 32.250 32.385 -0.135 1
1 1032 . 48 1 1 A 91 91 MET N N 90 127.052 122.730 4.322 1
1 1033 . 48 1 1 A 92 92 ALA H H 91 8.292 8.067 0.225 1
1 1034 . 48 1 1 A 92 92 ALA HA H 91 4.059 4.131 -0.072 1
1 1038 . 48 1 1 A 92 92 ALA C C 91 180.412 179.707 0.705 1
1 1039 . 48 1 1 A 92 92 ALA CA C 91 55.368 54.984 0.384 1
1 1040 . 48 1 1 A 92 92 ALA CB C 91 17.527 18.645 -1.118 1
1 1041 . 48 1 1 A 92 92 ALA N N 91 123.752 121.437 2.315 1
1 1042 . 48 1 1 A 93 93 ALA H H 92 7.931 7.973 -0.042 1
1 1043 . 48 1 1 A 93 93 ALA HA H 92 4.054 4.087 -0.033 1
1 1047 . 48 1 1 A 93 93 ALA C C 92 180.482 179.940 0.542 1
1 1048 . 48 1 1 A 93 93 ALA CA C 92 54.614 54.868 -0.254 1
1 1049 . 48 1 1 A 93 93 ALA CB C 92 18.098 18.204 -0.106 1
1 1050 . 48 1 1 A 93 93 ALA N N 92 121.158 120.117 1.041 1
1 1051 . 48 1 1 A 94 94 PHE H H 93 8.110 7.872 0.238 1
1 1052 . 48 1 1 A 94 94 PHE HA H 93 4.304 4.163 0.141 1
1 1060 . 48 1 1 A 94 94 PHE C C 93 177.350 177.214 0.136 1
1 1061 . 48 1 1 A 94 94 PHE CA C 93 61.641 61.486 0.155 1
1 1062 . 48 1 1 A 94 94 PHE CB C 93 40.014 39.158 0.856 1
1 1068 . 48 1 1 A 94 94 PHE N N 93 119.807 119.966 -0.159 1
1 1069 . 48 1 1 A 95 95 THR H H 94 8.726 8.203 0.523 1
1 1070 . 48 1 1 A 95 95 THR HA H 94 3.569 3.938 -0.369 1
1 1075 . 48 1 1 A 95 95 THR C C 94 176.932 177.190 -0.258 1
1 1076 . 48 1 1 A 95 95 THR CA C 94 66.833 65.470 1.363 1
1 1077 . 48 1 1 A 95 95 THR CB C 94 68.445 68.230 0.215 1
1 1079 . 48 1 1 A 95 95 THR N N 94 113.074 111.977 1.097 1
1 1080 . 48 1 1 A 96 96 THR H H 95 7.657 7.796 -0.139 1
1 1081 . 48 1 1 A 96 96 THR HA H 95 3.945 3.955 -0.010 1
1 1086 . 48 1 1 A 96 96 THR C C 95 176.386 176.318 0.068 1
1 1087 . 48 1 1 A 96 96 THR CA C 95 66.550 66.002 0.548 1
1 1088 . 48 1 1 A 96 96 THR CB C 95 68.583 68.520 0.063 1
1 1090 . 48 1 1 A 96 96 THR N N 95 117.927 116.648 1.279 1
1 1091 . 48 1 1 A 97 97 THR H H 96 7.699 7.964 -0.265 1
1 1092 . 48 1 1 A 97 97 THR HA H 96 3.905 3.974 -0.069 1
1 1097 . 48 1 1 A 97 97 THR C C 96 176.572 176.439 0.133 1
1 1098 . 48 1 1 A 97 97 THR CA C 96 65.979 66.597 -0.618 1
1 1099 . 48 1 1 A 97 97 THR CB C 96 68.553 68.233 0.320 1
1 1101 . 48 1 1 A 97 97 THR N N 96 118.518 116.628 1.890 1
1 1102 . 48 1 1 A 98 98 LEU H H 97 8.304 8.087 0.217 1
1 1103 . 48 1 1 A 98 98 LEU HA H 97 3.725 3.807 -0.082 1
1 1113 . 48 1 1 A 98 98 LEU C C 97 178.490 178.566 -0.076 1
1 1114 . 48 1 1 A 98 98 LEU CA C 97 58.517 58.022 0.495 1
1 1115 . 48 1 1 A 98 98 LEU CB C 97 41.697 41.224 0.473 1
1 1119 . 48 1 1 A 98 98 LEU N N 97 122.882 121.900 0.982 1
1 1120 . 48 1 1 A 99 99 GLN H H 98 7.639 7.981 -0.342 1
1 1121 . 48 1 1 A 99 99 GLN HA H 98 3.927 3.980 -0.053 1
1 1128 . 48 1 1 A 99 99 GLN C C 98 178.068 178.464 -0.396 1
1 1129 . 48 1 1 A 99 99 GLN CA C 98 58.735 59.007 -0.272 1
1 1130 . 48 1 1 A 99 99 GLN CB C 98 27.986 28.184 -0.198 1
1 1132 . 48 1 1 A 99 99 GLN N N 98 114.302 117.407 -3.105 1
1 1134 . 48 1 1 A 100 100 HIS H H 99 7.575 8.160 -0.585 1
1 1135 . 48 1 1 A 100 100 HIS HA H 99 4.524 4.308 0.216 1
1 1139 . 48 1 1 A 100 100 HIS C C 99 174.789 177.305 -2.516 1
1 1140 . 48 1 1 A 100 100 HIS CA C 99 56.154 59.095 -2.941 1
1 1141 . 48 1 1 A 100 100 HIS CB C 99 28.946 29.792 -0.846 1
1 1143 . 48 1 1 A 100 100 HIS N N 99 114.778 121.153 -6.375 1
1 1144 . 48 1 1 A 101 101 HIS H H 100 7.773 8.247 -0.474 1
1 1145 . 48 1 1 A 101 101 HIS HA H 100 4.704 4.225 0.479 1
1 1149 . 48 1 1 A 101 101 HIS C C 100 174.818 177.098 -2.280 1
1 1150 . 48 1 1 A 101 101 HIS CA C 100 54.830 58.978 -4.148 1
1 1151 . 48 1 1 A 101 101 HIS CB C 100 29.749 28.500 1.249 1
1 1153 . 48 1 1 A 101 101 HIS N N 100 117.397 116.495 0.902 1
1 1154 . 48 1 1 A 102 102 LYS H H 101 7.324 8.005 -0.681 1
1 1155 . 48 1 1 A 102 102 LYS HA H 101 3.611 4.037 -0.426 1
1 1164 . 48 1 1 A 102 102 LYS C C 101 176.823 178.803 -1.980 1
1 1165 . 48 1 1 A 102 102 LYS CA C 101 59.915 58.792 1.123 1
1 1166 . 48 1 1 A 102 102 LYS CB C 101 32.825 32.225 0.600 1
1 1170 . 48 1 1 A 102 102 LYS N N 101 120.533 120.250 0.283 1
1 1171 . 48 1 1 A 103 103 ASP H H 102 8.361 8.655 -0.294 1
1 1172 . 48 1 1 A 103 103 ASP HA H 102 4.421 4.362 0.059 1
1 1175 . 48 1 1 A 103 103 ASP C C 102 176.793 176.624 0.169 1
1 1176 . 48 1 1 A 103 103 ASP CA C 102 55.500 55.526 -0.026 1
1 1177 . 48 1 1 A 103 103 ASP CB C 102 40.178 39.072 1.106 1
1 1178 . 48 1 1 A 103 103 ASP N N 102 114.814 118.664 -3.850 1
1 1179 . 48 1 1 A 104 104 GLU H H 103 7.858 8.278 -0.420 1
1 1180 . 48 1 1 A 104 104 GLU HA H 103 4.339 4.647 -0.308 1
1 1183 . 48 1 1 A 104 104 GLU C C 103 175.777 176.590 -0.813 1
1 1184 . 48 1 1 A 104 104 GLU CA C 103 56.356 57.573 -1.217 1
1 1185 . 48 1 1 A 104 104 GLU CB C 103 31.293 33.047 -1.754 1
1 1186 . 48 1 1 A 104 104 GLU N N 103 116.826 118.395 -1.569 1
1 1187 . 48 1 1 A 105 105 VAL H H 104 7.201 7.450 -0.249 1
1 1188 . 48 1 1 A 105 105 VAL HA H 104 4.296 4.081 0.215 1
1 1196 . 48 1 1 A 105 105 VAL C C 104 174.482 175.906 -1.424 1
1 1197 . 48 1 1 A 105 105 VAL CA C 104 60.370 63.129 -2.759 1
1 1198 . 48 1 1 A 105 105 VAL CB C 104 34.341 32.146 2.195 1
1 1201 . 48 1 1 A 105 105 VAL N N 104 116.422 120.759 -4.337 1
1 1202 . 48 1 1 A 106 106 ALA H H 105 8.487 8.558 -0.071 1
1 1203 . 48 1 1 A 106 106 ALA HA H 105 4.172 4.414 -0.242 1
1 1207 . 48 1 1 A 106 106 ALA C C 105 179.030 178.542 0.488 1
1 1208 . 48 1 1 A 106 106 ALA CA C 105 52.966 52.297 0.669 1
1 1209 . 48 1 1 A 106 106 ALA CB C 105 19.371 19.093 0.278 1
1 1210 . 48 1 1 A 106 106 ALA N N 105 128.313 128.347 -0.034 1
1 1211 . 48 1 1 A 107 107 GLY H H 106 8.738 8.766 -0.028 1
1 1212 . 48 1 1 A 107 107 GLY HA2 H 106 3.773 3.871 -0.098 1
1 1213 . 48 1 1 A 107 107 GLY HA3 H 106 3.998 3.934 0.064 1
1 1214 . 48 1 1 A 107 107 GLY C C 106 174.958 175.579 -0.621 1
1 1215 . 48 1 1 A 107 107 GLY CA C 106 47.449 47.143 0.306 1
1 1216 . 48 1 1 A 107 107 GLY N N 106 110.612 110.808 -0.196 1
1 1217 . 48 1 1 A 108 108 ASP H H 107 8.535 8.324 0.211 1
1 1218 . 48 1 1 A 108 108 ASP HA H 107 4.333 4.373 -0.040 1
1 1221 . 48 1 1 A 108 108 ASP C C 107 179.133 178.723 0.410 1
1 1222 . 48 1 1 A 108 108 ASP CA C 107 56.721 57.120 -0.399 1
1 1223 . 48 1 1 A 108 108 ASP CB C 107 39.336 41.633 -2.297 1
1 1224 . 48 1 1 A 108 108 ASP N N 107 117.474 121.612 -4.138 1
1 1225 . 48 1 1 A 109 109 ILE H H 108 7.459 7.936 -0.477 1
1 1226 . 48 1 1 A 109 109 ILE HA H 108 3.688 3.852 -0.164 1
1 1236 . 48 1 1 A 109 109 ILE C C 108 176.735 178.436 -1.701 1
1 1237 . 48 1 1 A 109 109 ILE CA C 108 63.474 65.319 -1.845 1
1 1238 . 48 1 1 A 109 109 ILE CB C 108 37.340 37.715 -0.375 1
1 1242 . 48 1 1 A 109 109 ILE N N 108 119.609 119.581 0.028 1
1 1243 . 48 1 1 A 110 110 PHE H H 109 7.920 8.299 -0.379 1
1 1244 . 48 1 1 A 110 110 PHE HA H 109 3.759 4.086 -0.327 1
1 1252 . 48 1 1 A 110 110 PHE C C 109 177.132 177.270 -0.138 1
1 1253 . 48 1 1 A 110 110 PHE CA C 109 62.766 61.219 1.547 1
1 1254 . 48 1 1 A 110 110 PHE CB C 109 39.752 39.299 0.453 1
1 1260 . 48 1 1 A 110 110 PHE N N 109 120.906 120.289 0.617 1
1 1261 . 48 1 1 A 111 111 ASP H H 110 8.639 8.263 0.376 1
1 1262 . 48 1 1 A 111 111 ASP HA H 110 4.216 4.204 0.012 1
1 1265 . 48 1 1 A 111 111 ASP C C 110 178.900 178.007 0.893 1
1 1266 . 48 1 1 A 111 111 ASP CA C 110 57.105 57.590 -0.485 1
1 1267 . 48 1 1 A 111 111 ASP CB C 110 39.697 41.958 -2.261 1
1 1268 . 48 1 1 A 111 111 ASP N N 110 117.124 118.805 -1.681 1
1 1269 . 48 1 1 A 112 112 MET H H 111 7.331 8.112 -0.781 1
1 1270 . 48 1 1 A 112 112 MET HA H 111 4.081 4.084 -0.003 1
1 1278 . 48 1 1 A 112 112 MET C C 111 179.052 178.815 0.237 1
1 1279 . 48 1 1 A 112 112 MET CA C 111 58.202 58.378 -0.176 1
1 1280 . 48 1 1 A 112 112 MET CB C 111 31.827 32.413 -0.586 1
1 1283 . 48 1 1 A 112 112 MET N N 111 118.061 117.610 0.451 1
1 1284 . 48 1 1 A 113 113 LEU H H 112 8.001 7.688 0.313 1
1 1285 . 48 1 1 A 113 113 LEU HA H 112 3.723 3.577 0.146 1
1 1295 . 48 1 1 A 113 113 LEU C C 112 179.747 178.714 1.033 1
1 1296 . 48 1 1 A 113 113 LEU CA C 112 57.371 57.397 -0.026 1
1 1297 . 48 1 1 A 113 113 LEU CB C 112 40.671 40.897 -0.226 1
1 1301 . 48 1 1 A 113 113 LEU N N 112 120.426 121.080 -0.654 1
1 1302 . 48 1 1 A 114 114 LEU H H 113 7.744 7.347 0.397 1
1 1303 . 48 1 1 A 114 114 LEU HA H 113 4.007 3.625 0.382 1
1 1313 . 48 1 1 A 114 114 LEU C C 113 179.358 178.887 0.471 1
1 1314 . 48 1 1 A 114 114 LEU CA C 113 57.202 57.441 -0.239 1
1 1315 . 48 1 1 A 114 114 LEU CB C 113 41.727 41.139 0.588 1
1 1319 . 48 1 1 A 114 114 LEU N N 113 119.584 118.341 1.243 1
1 1320 . 48 1 1 A 115 115 THR H H 114 7.353 7.634 -0.281 1
1 1321 . 48 1 1 A 115 115 THR HA H 114 4.071 4.057 0.014 1
1 1327 . 48 1 1 A 115 115 THR C C 114 173.591 176.763 -3.172 1
1 1328 . 48 1 1 A 115 115 THR CA C 114 65.332 64.773 0.559 1
1 1329 . 48 1 1 A 115 115 THR CB C 114 70.319 68.510 1.809 1
1 1331 . 48 1 1 A 115 115 THR N N 114 107.535 110.795 -3.260 1
1 1332 . 48 1 1 A 116 116 PHE H H 115 6.979 7.827 -0.848 1
1 1333 . 48 1 1 A 116 116 PHE HA H 115 5.022 4.266 0.756 1
1 1341 . 48 1 1 A 116 116 PHE C C 115 176.488 176.490 -0.002 1
1 1342 . 48 1 1 A 116 116 PHE CA C 115 55.911 60.837 -4.926 1
1 1343 . 48 1 1 A 116 116 PHE CB C 115 38.521 39.222 -0.701 1
1 1349 . 48 1 1 A 116 116 PHE N N 115 112.366 119.809 -7.443 1
1 1350 . 48 1 1 A 117 117 THR H H 116 7.564 7.594 -0.030 1
1 1351 . 48 1 1 A 117 117 THR HA H 116 4.626 4.807 -0.181 1
1 1356 . 48 1 1 A 117 117 THR C C 116 174.085 174.416 -0.331 1
1 1357 . 48 1 1 A 117 117 THR CA C 116 61.636 61.964 -0.328 1
1 1358 . 48 1 1 A 117 117 THR CB C 116 70.915 70.770 0.145 1
1 1360 . 48 1 1 A 117 117 THR N N 116 105.498 105.642 -0.144 1
1 1361 . 48 1 1 A 118 118 ASP H H 117 8.270 7.924 0.346 1
1 1362 . 48 1 1 A 118 118 ASP HA H 117 4.955 5.009 -0.054 1
1 1365 . 48 1 1 A 118 118 ASP C C 117 176.328 176.246 0.082 1
1 1366 . 48 1 1 A 118 118 ASP CA C 117 53.417 53.540 -0.123 1
1 1367 . 48 1 1 A 118 118 ASP CB C 117 43.388 38.960 4.428 1
1 1368 . 48 1 1 A 118 118 ASP N N 117 124.409 122.891 1.518 1
1 1369 . 48 1 1 A 119 119 PHE H H 118 8.973 8.891 0.082 1
1 1370 . 48 1 1 A 119 119 PHE HA H 118 3.506 4.267 -0.761 1
1 1378 . 48 1 1 A 119 119 PHE CA C 118 61.490 61.352 0.138 1
1 1379 . 48 1 1 A 119 119 PHE CB C 118 39.246 39.501 -0.255 1
1 1385 . 48 1 1 A 119 119 PHE N N 118 126.688 125.418 1.270 1
1 1386 . 48 1 1 A 120 120 LEU H H 119 8.099 8.310 -0.211 1
1 1387 . 48 1 1 A 120 120 LEU HA H 119 3.842 3.949 -0.107 1
1 1397 . 48 1 1 A 120 120 LEU C C 119 179.601 179.615 -0.014 1
1 1398 . 48 1 1 A 120 120 LEU CA C 119 58.174 57.744 0.430 1
1 1399 . 48 1 1 A 120 120 LEU CB C 119 40.315 40.856 -0.541 1
1 1403 . 48 1 1 A 120 120 LEU N N 119 117.930 119.917 -1.987 1
1 1404 . 48 1 1 A 121 121 ALA H H 120 7.729 7.610 0.119 1
1 1405 . 48 1 1 A 121 121 ALA HA H 120 3.996 4.124 -0.128 1
1 1409 . 48 1 1 A 121 121 ALA C C 120 180.995 179.564 1.431 1
1 1410 . 48 1 1 A 121 121 ALA CA C 120 54.832 54.620 0.212 1
1 1411 . 48 1 1 A 121 121 ALA CB C 120 17.706 18.193 -0.487 1
1 1412 . 48 1 1 A 121 121 ALA N N 120 123.195 121.501 1.694 1
1 1413 . 48 1 1 A 122 122 PHE H H 121 7.943 7.865 0.078 1
1 1414 . 48 1 1 A 122 122 PHE HA H 121 3.887 3.797 0.090 1
1 1419 . 48 1 1 A 122 122 PHE C C 121 175.410 176.794 -1.384 1
1 1420 . 48 1 1 A 122 122 PHE CA C 121 61.075 60.667 0.408 1
1 1421 . 48 1 1 A 122 122 PHE CB C 121 38.115 38.753 -0.638 1
1 1424 . 48 1 1 A 122 122 PHE N N 121 121.798 120.116 1.682 1
1 1425 . 48 1 1 A 123 123 LYS H H 122 8.468 7.759 0.709 1
1 1426 . 48 1 1 A 123 123 LYS HA H 122 3.077 3.755 -0.678 1
1 1435 . 48 1 1 A 123 123 LYS C C 122 178.453 178.741 -0.288 1
1 1436 . 48 1 1 A 123 123 LYS CA C 122 59.855 59.914 -0.059 1
1 1437 . 48 1 1 A 123 123 LYS CB C 122 32.374 32.419 -0.045 1
1 1441 . 48 1 1 A 123 123 LYS N N 122 120.614 118.402 2.212 1
1 1442 . 48 1 1 A 124 124 GLU H H 123 8.100 8.008 0.092 1
1 1443 . 48 1 1 A 124 124 GLU HA H 123 3.652 3.959 -0.307 1
1 1448 . 48 1 1 A 124 124 GLU C C 123 177.743 179.125 -1.382 1
1 1449 . 48 1 1 A 124 124 GLU CA C 123 59.406 59.510 -0.104 1
1 1450 . 48 1 1 A 124 124 GLU CB C 123 28.811 28.988 -0.177 1
1 1452 . 48 1 1 A 124 124 GLU N N 123 117.404 118.799 -1.395 1
1 1453 . 48 1 1 A 125 125 MET H H 124 7.537 7.559 -0.022 1
1 1454 . 48 1 1 A 125 125 MET HA H 124 3.860 3.920 -0.060 1
1 1462 . 48 1 1 A 125 125 MET C C 124 179.522 178.348 1.174 1
1 1463 . 48 1 1 A 125 125 MET CA C 124 58.832 58.487 0.345 1
1 1464 . 48 1 1 A 125 125 MET CB C 124 31.765 31.328 0.437 1
1 1467 . 48 1 1 A 125 125 MET N N 124 119.413 119.695 -0.282 1
1 1468 . 48 1 1 A 126 126 PHE H H 125 7.148 7.377 -0.229 1
1 1469 . 48 1 1 A 126 126 PHE HA H 125 3.633 4.193 -0.560 1
1 1476 . 48 1 1 A 126 126 PHE C C 125 178.994 178.293 0.701 1
1 1477 . 48 1 1 A 126 126 PHE CA C 125 63.148 61.006 2.142 1
1 1478 . 48 1 1 A 126 126 PHE CB C 125 39.830 38.218 1.612 1
1 1483 . 48 1 1 A 126 126 PHE N N 125 120.013 118.891 1.122 1
1 1484 . 48 1 1 A 127 127 LEU H H 126 8.369 8.568 -0.199 1
1 1485 . 48 1 1 A 127 127 LEU HA H 126 3.972 4.056 -0.084 1
1 1495 . 48 1 1 A 127 127 LEU C C 126 180.621 179.276 1.345 1
1 1496 . 48 1 1 A 127 127 LEU CA C 126 57.944 57.741 0.203 1
1 1497 . 48 1 1 A 127 127 LEU CB C 126 40.543 40.891 -0.348 1
1 1501 . 48 1 1 A 127 127 LEU N N 126 119.692 119.670 0.022 1
1 1502 . 48 1 1 A 128 128 ASP H H 127 8.578 8.053 0.525 1
1 1503 . 48 1 1 A 128 128 ASP HA H 127 4.308 4.351 -0.043 1
1 1506 . 48 1 1 A 128 128 ASP C C 127 178.254 178.087 0.167 1
1 1507 . 48 1 1 A 128 128 ASP CA C 127 56.964 57.222 -0.258 1
1 1508 . 48 1 1 A 128 128 ASP CB C 127 39.735 40.910 -1.175 1
1 1509 . 48 1 1 A 128 128 ASP N N 127 121.926 119.816 2.110 1
1 1510 . 48 1 1 A 129 129 TYR H H 128 7.710 8.044 -0.334 1
1 1511 . 48 1 1 A 129 129 TYR HA H 128 3.908 4.080 -0.172 1
1 1518 . 48 1 1 A 129 129 TYR C C 128 177.633 177.747 -0.114 1
1 1519 . 48 1 1 A 129 129 TYR CA C 128 61.796 61.654 0.142 1
1 1520 . 48 1 1 A 129 129 TYR CB C 128 39.372 38.630 0.742 1
1 1525 . 48 1 1 A 129 129 TYR N N 128 122.548 120.545 2.003 1
1 1526 . 48 1 1 A 130 130 ARG H H 129 8.622 8.089 0.533 1
1 1527 . 48 1 1 A 130 130 ARG HA H 129 3.722 4.144 -0.422 1
1 1535 . 48 1 1 A 130 130 ARG CA C 129 60.084 59.386 0.698 1
1 1536 . 48 1 1 A 130 130 ARG CB C 129 29.902 30.106 -0.204 1
1 1539 . 48 1 1 A 130 130 ARG N N 129 118.302 119.805 -1.503 1
1 1541 . 48 1 1 A 131 131 ALA H H 130 7.936 8.208 -0.272 1
1 1542 . 48 1 1 A 131 131 ALA HA H 130 3.997 4.063 -0.066 1
1 1546 . 48 1 1 A 131 131 ALA C C 130 180.456 179.790 0.666 1
1 1547 . 48 1 1 A 131 131 ALA CA C 130 55.133 54.812 0.321 1
1 1548 . 48 1 1 A 131 131 ALA CB C 130 17.750 18.645 -0.895 1
1 1549 . 48 1 1 A 131 131 ALA N N 130 119.788 122.233 -2.445 1
1 1550 . 48 1 1 A 132 132 GLU H H 131 7.622 7.776 -0.154 1
1 1551 . 48 1 1 A 132 132 GLU HA H 131 3.862 3.996 -0.134 1
1 1556 . 48 1 1 A 132 132 GLU C C 131 179.528 178.138 1.390 1
1 1557 . 48 1 1 A 132 132 GLU CA C 131 58.849 58.740 0.109 1
1 1558 . 48 1 1 A 132 132 GLU CB C 131 28.930 29.109 -0.179 1
1 1560 . 48 1 1 A 132 132 GLU N N 131 118.428 117.809 0.619 1
1 1561 . 48 1 1 A 133 133 LYS H H 132 7.853 7.768 0.085 1
1 1562 . 48 1 1 A 133 133 LYS HA H 132 3.722 4.191 -0.469 1
1 1571 . 48 1 1 A 133 133 LYS C C 132 175.725 178.390 -2.665 1
1 1572 . 48 1 1 A 133 133 LYS CA C 132 57.544 58.513 -0.969 1
1 1573 . 48 1 1 A 133 133 LYS CB C 132 31.770 32.299 -0.529 1
1 1577 . 48 1 1 A 133 133 LYS N N 132 119.473 118.986 0.487 1
1 1578 . 48 1 1 A 134 134 GLU H H 133 8.151 7.789 0.362 1
1 1579 . 48 1 1 A 134 134 GLU HA H 133 4.161 4.136 0.025 1
1 1584 . 48 1 1 A 134 134 GLU C C 133 177.453 178.069 -0.616 1
1 1585 . 48 1 1 A 134 134 GLU CA C 133 57.222 58.677 -1.455 1
1 1586 . 48 1 1 A 134 134 GLU CB C 133 30.091 29.452 0.639 1
1 1588 . 48 1 1 A 134 134 GLU N N 133 116.525 118.699 -2.174 1
1 1589 . 48 1 1 A 135 135 GLY H H 134 7.702 7.718 -0.016 1
1 1590 . 48 1 1 A 135 135 GLY HA2 H 134 3.896 3.953 -0.057 1
1 1591 . 48 1 1 A 135 135 GLY HA3 H 134 3.897 3.960 -0.063 1
1 1592 . 48 1 1 A 135 135 GLY C C 134 174.538 173.992 0.546 1
1 1593 . 48 1 1 A 135 135 GLY CA C 134 45.975 45.263 0.712 1
1 1594 . 48 1 1 A 135 135 GLY N N 134 107.924 107.862 0.062 1
1 1595 . 48 1 1 A 136 136 ARG H H 135 8.045 7.582 0.463 1
1 1596 . 48 1 1 A 136 136 ARG HA H 135 4.323 4.767 -0.444 1
1 1604 . 48 1 1 A 136 136 ARG C C 135 175.864 174.772 1.092 1
1 1605 . 48 1 1 A 136 136 ARG CA C 135 56.016 55.494 0.522 1
1 1606 . 48 1 1 A 136 136 ARG CB C 135 30.987 32.847 -1.860 1
1 1609 . 48 1 1 A 136 136 ARG N N 135 119.708 119.450 0.258 1
1 1 . 49 1 1 A 14 14 PHE CA C 13 58.199 57.870 0.329 1
1 2 . 49 1 1 A 14 14 PHE CB C 13 39.717 40.276 -0.559 1
1 3 . 49 1 1 A 15 15 SER H H 14 8.299 8.796 -0.497 1
1 4 . 49 1 1 A 15 15 SER HA H 14 4.359 4.564 -0.205 1
1 7 . 49 1 1 A 15 15 SER CA C 14 58.249 58.581 -0.332 1
1 8 . 49 1 1 A 15 15 SER CB C 14 63.936 64.064 -0.128 1
1 9 . 49 1 1 A 15 15 SER N N 14 117.379 115.752 1.627 1
1 10 . 49 1 1 A 16 16 SER H H 15 8.255 8.998 -0.743 1
1 11 . 49 1 1 A 16 16 SER HA H 15 3.729 4.816 -1.087 1
1 14 . 49 1 1 A 16 16 SER CA C 15 58.224 58.719 -0.495 1
1 15 . 49 1 1 A 16 16 SER CB C 15 63.886 65.630 -1.744 1
1 16 . 49 1 1 A 16 16 SER N N 15 117.694 116.713 0.981 1
1 17 . 49 1 1 A 17 17 ALA H H 16 8.333 8.206 0.127 1
1 18 . 49 1 1 A 17 17 ALA HA H 16 4.252 4.078 0.174 1
1 22 . 49 1 1 A 17 17 ALA CA C 16 53.377 55.171 -1.794 1
1 23 . 49 1 1 A 17 17 ALA CB C 16 18.896 18.456 0.440 1
1 24 . 49 1 1 A 17 17 ALA N N 16 125.462 124.651 0.811 1
1 25 . 49 1 1 A 18 18 SER H H 17 8.219 7.783 0.436 1
1 26 . 49 1 1 A 18 18 SER HA H 17 4.332 4.471 -0.139 1
1 29 . 49 1 1 A 18 18 SER CA C 17 59.105 58.930 0.175 1
1 30 . 49 1 1 A 18 18 SER CB C 17 63.592 63.858 -0.266 1
1 31 . 49 1 1 A 18 18 SER N N 17 114.821 110.338 4.483 1
1 32 . 49 1 1 A 19 19 ASP H H 18 8.309 7.694 0.615 1
1 33 . 49 1 1 A 19 19 ASP HA H 18 4.554 4.979 -0.425 1
1 36 . 49 1 1 A 19 19 ASP C C 18 176.528 176.913 -0.385 1
1 37 . 49 1 1 A 19 19 ASP CA C 18 55.272 52.864 2.408 1
1 38 . 49 1 1 A 19 19 ASP CB C 18 40.883 42.977 -2.094 1
1 39 . 49 1 1 A 19 19 ASP N N 18 123.367 121.604 1.763 1
1 40 . 49 1 1 A 20 20 ALA H H 19 8.133 8.844 -0.711 1
1 41 . 49 1 1 A 20 20 ALA HA H 19 4.170 4.086 0.084 1
1 45 . 49 1 1 A 20 20 ALA C C 19 179.857 179.553 0.304 1
1 46 . 49 1 1 A 20 20 ALA CA C 19 54.341 55.051 -0.710 1
1 47 . 49 1 1 A 20 20 ALA CB C 19 18.660 18.320 0.340 1
1 48 . 49 1 1 A 20 20 ALA N N 19 123.350 123.019 0.331 1
1 49 . 49 1 1 A 21 21 GLU H H 20 8.140 8.232 -0.092 1
1 50 . 49 1 1 A 21 21 GLU HA H 20 4.128 4.141 -0.013 1
1 55 . 49 1 1 A 21 21 GLU C C 20 177.675 178.657 -0.982 1
1 56 . 49 1 1 A 21 21 GLU CA C 20 58.520 59.498 -0.978 1
1 57 . 49 1 1 A 21 21 GLU CB C 20 29.765 29.611 0.154 1
1 59 . 49 1 1 A 21 21 GLU N N 20 119.063 119.531 -0.468 1
1 60 . 49 1 1 A 22 22 PHE H H 21 8.009 8.058 -0.049 1
1 61 . 49 1 1 A 22 22 PHE HA H 21 4.123 4.439 -0.316 1
1 68 . 49 1 1 A 22 22 PHE C C 21 176.410 177.223 -0.813 1
1 69 . 49 1 1 A 22 22 PHE CA C 21 62.202 61.516 0.686 1
1 70 . 49 1 1 A 22 22 PHE CB C 21 39.223 39.250 -0.027 1
1 75 . 49 1 1 A 22 22 PHE N N 21 121.211 121.010 0.201 1
1 76 . 49 1 1 A 23 23 ASP H H 22 8.261 8.590 -0.329 1
1 77 . 49 1 1 A 23 23 ASP HA H 22 4.041 4.382 -0.341 1
1 80 . 49 1 1 A 23 23 ASP C C 22 179.078 178.179 0.899 1
1 81 . 49 1 1 A 23 23 ASP CA C 22 57.048 57.913 -0.865 1
1 82 . 49 1 1 A 23 23 ASP CB C 22 40.154 42.167 -2.013 1
1 83 . 49 1 1 A 23 23 ASP N N 22 116.876 119.161 -2.285 1
1 84 . 49 1 1 A 24 24 ALA H H 23 7.651 7.628 0.023 1
1 85 . 49 1 1 A 24 24 ALA HA H 23 3.785 3.951 -0.166 1
1 89 . 49 1 1 A 24 24 ALA C C 23 179.577 179.794 -0.217 1
1 90 . 49 1 1 A 24 24 ALA CA C 23 54.341 55.189 -0.848 1
1 91 . 49 1 1 A 24 24 ALA CB C 23 17.762 18.293 -0.531 1
1 92 . 49 1 1 A 24 24 ALA N N 23 121.873 121.712 0.161 1
1 93 . 49 1 1 A 25 25 VAL H H 24 7.718 7.978 -0.260 1
1 94 . 49 1 1 A 25 25 VAL HA H 24 3.216 3.677 -0.461 1
1 102 . 49 1 1 A 25 25 VAL C C 24 177.805 178.398 -0.593 1
1 103 . 49 1 1 A 25 25 VAL CA C 24 66.789 66.811 -0.022 1
1 104 . 49 1 1 A 25 25 VAL CB C 24 31.277 31.367 -0.090 1
1 107 . 49 1 1 A 25 25 VAL N N 24 117.890 118.542 -0.652 1
1 108 . 49 1 1 A 26 26 VAL H H 25 7.867 7.771 0.096 1
1 109 . 49 1 1 A 26 26 VAL HA H 25 3.274 3.497 -0.223 1
1 117 . 49 1 1 A 26 26 VAL C C 25 177.788 178.033 -0.245 1
1 118 . 49 1 1 A 26 26 VAL CA C 25 67.282 66.442 0.840 1
1 119 . 49 1 1 A 26 26 VAL CB C 25 31.266 31.453 -0.187 1
1 122 . 49 1 1 A 26 26 VAL N N 25 118.170 120.102 -1.932 1
1 123 . 49 1 1 A 27 27 GLY H H 26 7.544 7.604 -0.060 1
1 124 . 49 1 1 A 27 27 GLY HA2 H 26 3.592 3.516 0.076 1
1 125 . 49 1 1 A 27 27 GLY HA3 H 26 3.721 3.628 0.093 1
1 126 . 49 1 1 A 27 27 GLY C C 26 176.717 176.539 0.178 1
1 127 . 49 1 1 A 27 27 GLY CA C 26 47.085 47.264 -0.179 1
1 128 . 49 1 1 A 27 27 GLY N N 26 105.795 107.440 -1.645 1
1 129 . 49 1 1 A 28 28 TYR H H 27 7.625 7.546 0.079 1
1 130 . 49 1 1 A 28 28 TYR HA H 27 4.546 4.584 -0.038 1
1 137 . 49 1 1 A 28 28 TYR C C 27 178.991 178.092 0.899 1
1 138 . 49 1 1 A 28 28 TYR CA C 27 58.845 59.596 -0.751 1
1 139 . 49 1 1 A 28 28 TYR CB C 27 37.602 37.619 -0.017 1
1 144 . 49 1 1 A 28 28 TYR N N 27 119.933 122.283 -2.350 1
1 145 . 49 1 1 A 29 29 LEU H H 28 8.517 8.397 0.120 1
1 146 . 49 1 1 A 29 29 LEU HA H 28 3.728 3.822 -0.094 1
1 156 . 49 1 1 A 29 29 LEU CA C 28 58.281 58.113 0.168 1
1 157 . 49 1 1 A 29 29 LEU CB C 28 41.948 41.453 0.495 1
1 161 . 49 1 1 A 29 29 LEU N N 28 119.669 120.301 -0.632 1
1 162 . 49 1 1 A 30 30 GLU H H 29 8.072 7.964 0.108 1
1 163 . 49 1 1 A 30 30 GLU HA H 29 3.722 3.859 -0.137 1
1 168 . 49 1 1 A 30 30 GLU C C 29 177.731 178.925 -1.194 1
1 169 . 49 1 1 A 30 30 GLU CA C 29 59.763 59.981 -0.218 1
1 170 . 49 1 1 A 30 30 GLU CB C 29 28.844 29.276 -0.432 1
1 172 . 49 1 1 A 30 30 GLU N N 29 117.666 117.618 0.048 1
1 173 . 49 1 1 A 31 31 ASP H H 30 7.243 8.003 -0.760 1
1 174 . 49 1 1 A 31 31 ASP HA H 30 4.297 4.388 -0.091 1
1 177 . 49 1 1 A 31 31 ASP CA C 30 56.953 57.255 -0.302 1
1 178 . 49 1 1 A 31 31 ASP CB C 30 40.730 42.215 -1.485 1
1 179 . 49 1 1 A 31 31 ASP N N 30 116.720 119.037 -2.317 1
1 180 . 49 1 1 A 32 32 ILE H H 31 7.940 7.504 0.436 1
1 181 . 49 1 1 A 32 32 ILE HA H 31 3.640 3.674 -0.034 1
1 191 . 49 1 1 A 32 32 ILE C C 31 177.980 178.140 -0.160 1
1 192 . 49 1 1 A 32 32 ILE CA C 31 64.692 64.278 0.414 1
1 193 . 49 1 1 A 32 32 ILE CB C 31 38.938 37.423 1.515 1
1 197 . 49 1 1 A 32 32 ILE N N 31 119.728 118.872 0.856 1
1 198 . 49 1 1 A 33 33 ILE H H 32 7.984 7.789 0.195 1
1 199 . 49 1 1 A 33 33 ILE HA H 32 3.598 3.449 0.149 1
1 209 . 49 1 1 A 33 33 ILE C C 32 176.723 177.058 -0.335 1
1 210 . 49 1 1 A 33 33 ILE CA C 32 63.241 64.660 -1.419 1
1 211 . 49 1 1 A 33 33 ILE CB C 32 37.580 37.919 -0.339 1
1 215 . 49 1 1 A 33 33 ILE N N 32 113.919 120.446 -6.527 1
1 216 . 49 1 1 A 34 34 MET H H 33 7.288 7.585 -0.297 1
1 217 . 49 1 1 A 34 34 MET HA H 33 4.496 4.692 -0.196 1
1 225 . 49 1 1 A 34 34 MET C C 33 176.423 175.748 0.675 1
1 226 . 49 1 1 A 34 34 MET CA C 33 54.634 54.109 0.525 1
1 227 . 49 1 1 A 34 34 MET CB C 33 31.934 31.970 -0.036 1
1 230 . 49 1 1 A 34 34 MET N N 33 115.130 116.924 -1.794 1
1 231 . 49 1 1 A 35 35 ASP H H 34 7.405 7.837 -0.432 1
1 232 . 49 1 1 A 35 35 ASP HA H 34 4.484 4.602 -0.118 1
1 235 . 49 1 1 A 35 35 ASP C C 34 177.139 176.862 0.277 1
1 236 . 49 1 1 A 35 35 ASP CA C 34 54.625 54.552 0.073 1
1 237 . 49 1 1 A 35 35 ASP CB C 34 43.554 42.774 0.780 1
1 238 . 49 1 1 A 35 35 ASP N N 34 121.814 122.449 -0.635 1
1 239 . 49 1 1 A 36 36 ASP H H 35 8.765 8.822 -0.057 1
1 240 . 49 1 1 A 36 36 ASP HA H 35 4.235 4.317 -0.082 1
1 243 . 49 1 1 A 36 36 ASP C C 35 178.320 178.458 -0.138 1
1 244 . 49 1 1 A 36 36 ASP CA C 35 57.832 58.014 -0.182 1
1 245 . 49 1 1 A 36 36 ASP CB C 35 40.914 40.411 0.503 1
1 246 . 49 1 1 A 36 36 ASP N N 35 125.883 125.352 0.531 1
1 247 . 49 1 1 A 37 37 GLU H H 36 8.905 8.341 0.564 1
1 248 . 49 1 1 A 37 37 GLU HA H 36 3.933 4.048 -0.115 1
1 253 . 49 1 1 A 37 37 GLU C C 36 179.304 179.059 0.245 1
1 254 . 49 1 1 A 37 37 GLU CA C 36 59.828 59.161 0.667 1
1 255 . 49 1 1 A 37 37 GLU CB C 36 29.380 29.424 -0.044 1
1 257 . 49 1 1 A 37 37 GLU N N 36 119.077 120.507 -1.430 1
1 258 . 49 1 1 A 38 38 PHE H H 37 7.460 8.298 -0.838 1
1 259 . 49 1 1 A 38 38 PHE HA H 37 3.642 4.000 -0.358 1
1 267 . 49 1 1 A 38 38 PHE C C 37 176.483 178.102 -1.619 1
1 268 . 49 1 1 A 38 38 PHE CA C 37 61.411 61.066 0.345 1
1 269 . 49 1 1 A 38 38 PHE CB C 37 39.355 39.047 0.308 1
1 275 . 49 1 1 A 38 38 PHE N N 37 119.968 120.696 -0.728 1
1 276 . 49 1 1 A 39 39 GLN H H 38 7.968 7.903 0.065 1
1 277 . 49 1 1 A 39 39 GLN HA H 38 3.712 3.793 -0.081 1
1 284 . 49 1 1 A 39 39 GLN CA C 38 59.153 58.811 0.342 1
1 285 . 49 1 1 A 39 39 GLN CB C 38 28.213 28.483 -0.270 1
1 287 . 49 1 1 A 39 39 GLN N N 38 116.433 118.530 -2.097 1
1 289 . 49 1 1 A 40 40 LEU H H 39 7.930 7.625 0.305 1
1 290 . 49 1 1 A 40 40 LEU HA H 39 3.916 4.018 -0.102 1
1 300 . 49 1 1 A 40 40 LEU C C 39 177.731 178.046 -0.315 1
1 301 . 49 1 1 A 40 40 LEU CA C 39 57.915 57.930 -0.015 1
1 302 . 49 1 1 A 40 40 LEU CB C 39 41.989 41.525 0.464 1
1 306 . 49 1 1 A 40 40 LEU N N 39 119.505 121.032 -1.527 1
1 307 . 49 1 1 A 41 41 LEU H H 40 7.174 7.607 -0.433 1
1 308 . 49 1 1 A 41 41 LEU HA H 40 3.835 3.948 -0.113 1
1 318 . 49 1 1 A 41 41 LEU C C 40 179.738 178.305 1.433 1
1 319 . 49 1 1 A 41 41 LEU CA C 40 58.266 58.319 -0.053 1
1 320 . 49 1 1 A 41 41 LEU CB C 40 42.050 41.233 0.817 1
1 324 . 49 1 1 A 41 41 LEU N N 40 120.971 119.685 1.286 1
1 325 . 49 1 1 A 42 42 GLN H H 41 8.058 7.735 0.323 1
1 326 . 49 1 1 A 42 42 GLN HA H 41 3.556 3.720 -0.164 1
1 333 . 49 1 1 A 42 42 GLN C C 41 177.642 178.406 -0.764 1
1 334 . 49 1 1 A 42 42 GLN CA C 41 59.826 59.198 0.628 1
1 335 . 49 1 1 A 42 42 GLN CB C 41 28.762 27.958 0.804 1
1 337 . 49 1 1 A 42 42 GLN N N 41 117.899 117.793 0.106 1
1 339 . 49 1 1 A 43 43 ARG H H 42 8.179 7.723 0.456 1
1 340 . 49 1 1 A 43 43 ARG HA H 42 3.655 3.939 -0.284 1
1 347 . 49 1 1 A 43 43 ARG C C 42 178.051 178.618 -0.567 1
1 348 . 49 1 1 A 43 43 ARG CA C 42 59.766 58.712 1.054 1
1 349 . 49 1 1 A 43 43 ARG CB C 42 29.941 30.043 -0.102 1
1 352 . 49 1 1 A 43 43 ARG N N 42 119.392 119.651 -0.259 1
1 353 . 49 1 1 A 44 44 ASN H H 43 8.525 8.283 0.242 1
1 354 . 49 1 1 A 44 44 ASN HA H 43 4.332 4.426 -0.094 1
1 359 . 49 1 1 A 44 44 ASN C C 43 178.150 178.384 -0.234 1
1 360 . 49 1 1 A 44 44 ASN CA C 43 55.841 56.366 -0.525 1
1 361 . 49 1 1 A 44 44 ASN CB C 43 37.632 38.319 -0.687 1
1 362 . 49 1 1 A 44 44 ASN N N 43 116.214 117.819 -1.605 1
1 364 . 49 1 1 A 45 45 PHE H H 44 7.586 7.824 -0.238 1
1 365 . 49 1 1 A 45 45 PHE HA H 44 4.132 4.322 -0.190 1
1 372 . 49 1 1 A 45 45 PHE C C 44 176.691 178.331 -1.640 1
1 373 . 49 1 1 A 45 45 PHE CA C 44 62.333 60.643 1.690 1
1 374 . 49 1 1 A 45 45 PHE CB C 44 39.449 38.727 0.722 1
1 379 . 49 1 1 A 45 45 PHE N N 44 121.501 119.003 2.498 1
1 380 . 49 1 1 A 46 46 MET H H 45 8.190 8.491 -0.301 1
1 381 . 49 1 1 A 46 46 MET HA H 45 4.060 4.290 -0.230 1
1 389 . 49 1 1 A 46 46 MET C C 45 179.754 178.163 1.591 1
1 390 . 49 1 1 A 46 46 MET CA C 45 57.742 57.732 0.010 1
1 391 . 49 1 1 A 46 46 MET CB C 45 29.912 31.138 -1.226 1
1 394 . 49 1 1 A 46 46 MET N N 45 116.727 117.432 -0.705 1
1 395 . 49 1 1 A 47 47 ASP H H 46 8.579 8.195 0.384 1
1 396 . 49 1 1 A 47 47 ASP HA H 46 4.804 4.667 0.137 1
1 399 . 49 1 1 A 47 47 ASP C C 46 177.854 177.651 0.203 1
1 400 . 49 1 1 A 47 47 ASP CA C 46 57.277 57.258 0.019 1
1 401 . 49 1 1 A 47 47 ASP CB C 46 40.776 41.617 -0.841 1
1 402 . 49 1 1 A 47 47 ASP N N 46 117.798 120.714 -2.916 1
1 403 . 49 1 1 A 48 48 LYS H H 47 7.339 7.850 -0.511 1
1 404 . 49 1 1 A 48 48 LYS HA H 47 3.828 4.347 -0.519 1
1 413 . 49 1 1 A 48 48 LYS C C 47 178.812 178.485 0.327 1
1 414 . 49 1 1 A 48 48 LYS CA C 47 58.953 57.570 1.383 1
1 415 . 49 1 1 A 48 48 LYS CB C 47 32.796 33.467 -0.671 1
1 419 . 49 1 1 A 48 48 LYS N N 47 117.852 117.734 0.118 1
1 420 . 49 1 1 A 49 49 TYR H H 48 6.841 8.668 -1.827 1
1 421 . 49 1 1 A 49 49 TYR HA H 48 4.995 4.260 0.735 1
1 428 . 49 1 1 A 49 49 TYR C C 48 178.138 178.587 -0.449 1
1 429 . 49 1 1 A 49 49 TYR CA C 48 58.620 59.784 -1.164 1
1 430 . 49 1 1 A 49 49 TYR CB C 48 42.939 37.947 4.992 1
1 435 . 49 1 1 A 49 49 TYR N N 48 112.109 119.227 -7.118 1
1 436 . 49 1 1 A 50 50 TYR H H 49 8.491 8.140 0.351 1
1 437 . 49 1 1 A 50 50 TYR HA H 49 4.598 4.150 0.448 1
1 444 . 49 1 1 A 50 50 TYR C C 49 176.015 177.697 -1.682 1
1 445 . 49 1 1 A 50 50 TYR CA C 49 62.442 59.375 3.067 1
1 446 . 49 1 1 A 50 50 TYR CB C 49 36.588 36.884 -0.296 1
1 451 . 49 1 1 A 50 50 TYR N N 49 118.294 119.777 -1.483 1
1 452 . 49 1 1 A 51 51 LEU H H 50 7.512 7.564 -0.052 1
1 453 . 49 1 1 A 51 51 LEU HA H 50 3.878 3.565 0.313 1
1 463 . 49 1 1 A 51 51 LEU C C 50 178.625 178.563 0.062 1
1 464 . 49 1 1 A 51 51 LEU CA C 50 55.994 57.212 -1.218 1
1 465 . 49 1 1 A 51 51 LEU CB C 50 40.743 41.712 -0.969 1
1 469 . 49 1 1 A 51 51 LEU N N 50 118.478 121.854 -3.376 1
1 470 . 49 1 1 A 52 52 GLU H H 51 8.042 8.037 0.005 1
1 471 . 49 1 1 A 52 52 GLU HA H 51 4.197 3.956 0.241 1
1 476 . 49 1 1 A 52 52 GLU C C 51 177.629 177.763 -0.134 1
1 477 . 49 1 1 A 52 52 GLU CA C 51 56.141 59.501 -3.360 1
1 478 . 49 1 1 A 52 52 GLU CB C 51 29.162 29.405 -0.243 1
1 480 . 49 1 1 A 52 52 GLU N N 51 115.067 117.828 -2.761 1
1 481 . 49 1 1 A 53 53 PHE H H 52 7.465 7.884 -0.419 1
1 482 . 49 1 1 A 53 53 PHE HA H 52 4.431 4.753 -0.322 1
1 490 . 49 1 1 A 53 53 PHE C C 52 174.325 175.431 -1.106 1
1 491 . 49 1 1 A 53 53 PHE CA C 52 58.986 57.173 1.813 1
1 492 . 49 1 1 A 53 53 PHE CB C 52 40.183 37.639 2.544 1
1 498 . 49 1 1 A 53 53 PHE N N 52 116.768 118.878 -2.110 1
1 499 . 49 1 1 A 54 54 GLU H H 53 7.484 8.811 -1.327 1
1 500 . 49 1 1 A 54 54 GLU HA H 53 4.583 4.885 -0.302 1
1 505 . 49 1 1 A 54 54 GLU C C 53 175.722 174.906 0.816 1
1 506 . 49 1 1 A 54 54 GLU CA C 53 54.248 54.574 -0.326 1
1 507 . 49 1 1 A 54 54 GLU CB C 53 34.409 33.173 1.236 1
1 509 . 49 1 1 A 54 54 GLU N N 53 118.844 123.683 -4.839 1
1 510 . 49 1 1 A 55 55 ASP H H 54 9.008 8.782 0.226 1
1 511 . 49 1 1 A 55 55 ASP HA H 54 4.735 4.898 -0.163 1
1 514 . 49 1 1 A 55 55 ASP C C 54 175.421 175.906 -0.485 1
1 515 . 49 1 1 A 55 55 ASP CA C 54 52.888 53.693 -0.805 1
1 516 . 49 1 1 A 55 55 ASP CB C 54 38.894 40.737 -1.843 1
1 517 . 49 1 1 A 55 55 ASP N N 54 123.654 125.000 -1.346 1
1 518 . 49 1 1 A 56 56 THR H H 55 7.819 8.151 -0.332 1
1 519 . 49 1 1 A 56 56 THR HA H 55 4.574 4.937 -0.363 1
1 524 . 49 1 1 A 56 56 THR C C 55 174.096 174.034 0.062 1
1 525 . 49 1 1 A 56 56 THR CA C 55 59.172 60.109 -0.937 1
1 526 . 49 1 1 A 56 56 THR CB C 55 71.889 72.096 -0.207 1
1 528 . 49 1 1 A 56 56 THR N N 55 112.015 117.923 -5.908 1
1 529 . 49 1 1 A 57 57 GLU H H 56 8.527 8.736 -0.209 1
1 530 . 49 1 1 A 57 57 GLU HA H 56 4.217 4.569 -0.352 1
1 535 . 49 1 1 A 57 57 GLU C C 56 177.042 176.490 0.552 1
1 536 . 49 1 1 A 57 57 GLU CA C 56 56.869 56.292 0.577 1
1 537 . 49 1 1 A 57 57 GLU CB C 56 29.731 30.203 -0.472 1
1 539 . 49 1 1 A 57 57 GLU N N 56 117.531 117.899 -0.368 1
1 540 . 49 1 1 A 58 58 GLU H H 57 7.587 7.817 -0.230 1
1 541 . 49 1 1 A 58 58 GLU HA H 57 3.941 4.603 -0.662 1
1 546 . 49 1 1 A 58 58 GLU C C 57 176.849 175.840 1.009 1
1 547 . 49 1 1 A 58 58 GLU CA C 57 56.924 55.719 1.205 1
1 548 . 49 1 1 A 58 58 GLU CB C 57 30.251 30.831 -0.580 1
1 550 . 49 1 1 A 58 58 GLU N N 57 119.183 120.041 -0.858 1
1 551 . 49 1 1 A 59 59 ASN H H 58 9.120 8.793 0.327 1
1 552 . 49 1 1 A 59 59 ASN HA H 58 4.922 5.072 -0.150 1
1 557 . 49 1 1 A 59 59 ASN C C 58 174.254 174.513 -0.259 1
1 558 . 49 1 1 A 59 59 ASN CA C 58 51.956 52.912 -0.956 1
1 559 . 49 1 1 A 59 59 ASN CB C 58 37.404 39.502 -2.098 1
1 560 . 49 1 1 A 59 59 ASN N N 58 126.767 121.903 4.864 1
1 562 . 49 1 1 A 60 60 LYS H H 59 5.892 9.022 -3.130 1
1 563 . 49 1 1 A 60 60 LYS HA H 59 3.798 4.708 -0.910 1
1 572 . 49 1 1 A 60 60 LYS C C 59 177.908 176.795 1.113 1
1 573 . 49 1 1 A 60 60 LYS CA C 59 56.623 54.663 1.960 1
1 574 . 49 1 1 A 60 60 LYS CB C 59 32.279 34.390 -2.111 1
1 578 . 49 1 1 A 60 60 LYS N N 59 121.527 125.045 -3.518 1
1 579 . 49 1 1 A 61 61 LEU H H 60 8.473 8.755 -0.282 1
1 580 . 49 1 1 A 61 61 LEU HA H 60 3.891 4.214 -0.323 1
1 590 . 49 1 1 A 61 61 LEU C C 60 179.843 178.604 1.239 1
1 591 . 49 1 1 A 61 61 LEU CA C 60 58.301 56.118 2.183 1
1 592 . 49 1 1 A 61 61 LEU CB C 60 41.305 41.591 -0.286 1
1 596 . 49 1 1 A 61 61 LEU N N 60 125.639 123.534 2.105 1
1 597 . 49 1 1 A 62 62 ILE H H 61 7.698 7.577 0.121 1
1 598 . 49 1 1 A 62 62 ILE HA H 61 3.952 3.851 0.101 1
1 608 . 49 1 1 A 62 62 ILE C C 61 175.392 176.914 -1.522 1
1 609 . 49 1 1 A 62 62 ILE CA C 61 61.743 63.383 -1.640 1
1 610 . 49 1 1 A 62 62 ILE CB C 61 39.108 37.742 1.366 1
1 614 . 49 1 1 A 62 62 ILE N N 61 114.111 120.033 -5.922 1
1 615 . 49 1 1 A 63 63 TYR H H 62 7.273 7.566 -0.293 1
1 616 . 49 1 1 A 63 63 TYR HA H 62 4.343 4.135 0.208 1
1 623 . 49 1 1 A 63 63 TYR C C 62 178.264 178.385 -0.121 1
1 624 . 49 1 1 A 63 63 TYR CA C 62 57.231 61.049 -3.818 1
1 625 . 49 1 1 A 63 63 TYR CB C 62 36.332 37.941 -1.609 1
1 630 . 49 1 1 A 63 63 TYR N N 62 117.689 121.350 -3.661 1
1 631 . 49 1 1 A 64 64 THR H H 63 7.747 8.156 -0.409 1
1 632 . 49 1 1 A 64 64 THR HA H 63 4.266 4.239 0.027 1
1 637 . 49 1 1 A 64 64 THR CA C 63 69.362 67.580 1.782 1
1 638 . 49 1 1 A 64 64 THR CB C 63 66.962 67.371 -0.409 1
1 640 . 49 1 1 A 64 64 THR N N 63 113.755 116.271 -2.516 1
1 641 . 49 1 1 A 65 65 PRO HA H 64 4.372 4.374 -0.002 1
1 648 . 49 1 1 A 65 65 PRO C C 64 179.913 179.455 0.458 1
1 649 . 49 1 1 A 65 65 PRO CA C 64 66.011 66.377 -0.366 1
1 650 . 49 1 1 A 65 65 PRO CB C 64 30.642 30.752 -0.110 1
1 653 . 49 1 1 A 66 66 ILE H H 65 7.377 7.378 -0.001 1
1 654 . 49 1 1 A 66 66 ILE HA H 65 3.530 3.916 -0.386 1
1 664 . 49 1 1 A 66 66 ILE C C 65 177.543 178.222 -0.679 1
1 665 . 49 1 1 A 66 66 ILE CA C 65 66.647 64.289 2.358 1
1 666 . 49 1 1 A 66 66 ILE CB C 65 38.029 37.672 0.357 1
1 670 . 49 1 1 A 66 66 ILE N N 65 118.353 116.658 1.695 1
1 671 . 49 1 1 A 67 67 PHE H H 66 8.480 8.469 0.011 1
1 672 . 49 1 1 A 67 67 PHE HA H 66 4.115 4.382 -0.267 1
1 680 . 49 1 1 A 67 67 PHE C C 66 177.293 177.798 -0.505 1
1 681 . 49 1 1 A 67 67 PHE CA C 66 59.570 62.218 -2.648 1
1 682 . 49 1 1 A 67 67 PHE CB C 66 38.865 39.507 -0.642 1
1 688 . 49 1 1 A 67 67 PHE N N 66 122.420 120.492 1.928 1
1 689 . 49 1 1 A 68 68 ASN H H 67 8.595 8.151 0.444 1
1 690 . 49 1 1 A 68 68 ASN HA H 67 4.211 4.301 -0.090 1
1 695 . 49 1 1 A 68 68 ASN C C 67 178.697 178.243 0.454 1
1 696 . 49 1 1 A 68 68 ASN CA C 67 56.056 56.452 -0.396 1
1 697 . 49 1 1 A 68 68 ASN CB C 67 37.704 37.939 -0.235 1
1 698 . 49 1 1 A 68 68 ASN N N 67 115.573 116.938 -1.365 1
1 700 . 49 1 1 A 69 69 GLU H H 68 8.414 8.062 0.352 1
1 701 . 49 1 1 A 69 69 GLU HA H 68 4.102 4.201 -0.099 1
1 706 . 49 1 1 A 69 69 GLU C C 68 177.880 178.843 -0.963 1
1 707 . 49 1 1 A 69 69 GLU CA C 68 59.399 59.471 -0.072 1
1 708 . 49 1 1 A 69 69 GLU CB C 68 29.855 29.506 0.349 1
1 710 . 49 1 1 A 69 69 GLU N N 68 123.510 120.095 3.415 1
1 711 . 49 1 1 A 70 70 TYR H H 69 8.659 8.070 0.589 1
1 712 . 49 1 1 A 70 70 TYR HA H 69 3.362 4.139 -0.777 1
1 719 . 49 1 1 A 70 70 TYR C C 69 178.143 176.950 1.193 1
1 720 . 49 1 1 A 70 70 TYR CA C 69 60.686 61.195 -0.509 1
1 721 . 49 1 1 A 70 70 TYR CB C 69 38.560 38.785 -0.225 1
1 726 . 49 1 1 A 70 70 TYR N N 69 122.130 120.860 1.270 1
1 727 . 49 1 1 A 71 71 ILE H H 70 8.031 7.781 0.250 1
1 728 . 49 1 1 A 71 71 ILE HA H 70 3.265 3.693 -0.428 1
1 738 . 49 1 1 A 71 71 ILE C C 70 178.056 177.846 0.210 1
1 739 . 49 1 1 A 71 71 ILE CA C 70 63.756 63.949 -0.193 1
1 740 . 49 1 1 A 71 71 ILE CB C 70 37.321 36.666 0.655 1
1 744 . 49 1 1 A 71 71 ILE N N 70 118.906 120.414 -1.508 1
1 745 . 49 1 1 A 72 72 SER H H 71 7.803 8.005 -0.202 1
1 746 . 49 1 1 A 72 72 SER HA H 71 4.029 4.369 -0.340 1
1 749 . 49 1 1 A 72 72 SER CA C 71 61.380 61.363 0.017 1
1 750 . 49 1 1 A 72 72 SER CB C 71 63.288 63.338 -0.050 1
1 751 . 49 1 1 A 72 72 SER N N 71 113.735 118.664 -4.929 1
1 752 . 49 1 1 A 73 73 LEU H H 72 7.952 7.923 0.029 1
1 753 . 49 1 1 A 73 73 LEU HA H 72 4.418 4.097 0.321 1
1 763 . 49 1 1 A 73 73 LEU C C 72 177.767 178.228 -0.461 1
1 764 . 49 1 1 A 73 73 LEU CA C 72 56.543 57.402 -0.859 1
1 765 . 49 1 1 A 73 73 LEU CB C 72 44.517 41.746 2.771 1
1 769 . 49 1 1 A 73 73 LEU N N 72 119.411 122.323 -2.912 1
1 770 . 49 1 1 A 74 74 VAL H H 73 8.021 7.669 0.352 1
1 771 . 49 1 1 A 74 74 VAL HA H 73 3.532 3.345 0.187 1
1 779 . 49 1 1 A 74 74 VAL C C 73 177.126 177.948 -0.822 1
1 780 . 49 1 1 A 74 74 VAL CA C 73 66.250 66.322 -0.072 1
1 781 . 49 1 1 A 74 74 VAL CB C 73 31.212 31.169 0.043 1
1 784 . 49 1 1 A 74 74 VAL N N 73 118.747 119.254 -0.507 1
1 785 . 49 1 1 A 75 75 GLU H H 74 7.232 8.008 -0.776 1
1 786 . 49 1 1 A 75 75 GLU HA H 74 3.013 4.154 -1.141 1
1 791 . 49 1 1 A 75 75 GLU C C 74 178.804 178.989 -0.185 1
1 792 . 49 1 1 A 75 75 GLU CA C 74 60.536 59.719 0.817 1
1 793 . 49 1 1 A 75 75 GLU CB C 74 27.009 29.093 -2.084 1
1 795 . 49 1 1 A 75 75 GLU N N 74 118.660 119.906 -1.246 1
1 796 . 49 1 1 A 76 76 LYS H H 75 7.051 7.889 -0.838 1
1 797 . 49 1 1 A 76 76 LYS HA H 75 3.765 4.225 -0.460 1
1 806 . 49 1 1 A 76 76 LYS C C 75 177.765 178.947 -1.182 1
1 807 . 49 1 1 A 76 76 LYS CA C 75 58.357 58.875 -0.518 1
1 808 . 49 1 1 A 76 76 LYS CB C 75 31.939 31.887 0.052 1
1 812 . 49 1 1 A 76 76 LYS N N 75 116.112 119.446 -3.334 1
1 813 . 49 1 1 A 77 77 TYR H H 76 7.067 7.955 -0.888 1
1 814 . 49 1 1 A 77 77 TYR HA H 76 4.036 4.048 -0.012 1
1 821 . 49 1 1 A 77 77 TYR C C 76 177.752 176.993 0.759 1
1 822 . 49 1 1 A 77 77 TYR CA C 76 61.820 60.674 1.146 1
1 823 . 49 1 1 A 77 77 TYR CB C 76 38.480 38.708 -0.228 1
1 828 . 49 1 1 A 77 77 TYR N N 76 118.434 120.548 -2.114 1
1 829 . 49 1 1 A 78 78 ILE H H 77 7.554 7.685 -0.131 1
1 830 . 49 1 1 A 78 78 ILE HA H 77 3.159 3.601 -0.442 1
1 840 . 49 1 1 A 78 78 ILE C C 77 177.341 178.070 -0.729 1
1 841 . 49 1 1 A 78 78 ILE CA C 77 65.177 64.441 0.736 1
1 842 . 49 1 1 A 78 78 ILE CB C 77 37.339 37.468 -0.129 1
1 846 . 49 1 1 A 78 78 ILE N N 77 117.672 119.895 -2.223 1
1 847 . 49 1 1 A 79 79 GLU H H 78 8.296 8.164 0.132 1
1 848 . 49 1 1 A 79 79 GLU HA H 78 3.557 3.931 -0.374 1
1 853 . 49 1 1 A 79 79 GLU C C 78 177.742 178.548 -0.806 1
1 854 . 49 1 1 A 79 79 GLU CA C 78 60.847 59.133 1.714 1
1 855 . 49 1 1 A 79 79 GLU CB C 78 29.594 29.107 0.487 1
1 857 . 49 1 1 A 79 79 GLU N N 78 118.701 120.085 -1.384 1
1 858 . 49 1 1 A 80 80 GLU H H 79 8.330 8.024 0.306 1
1 859 . 49 1 1 A 80 80 GLU HA H 79 3.774 4.041 -0.267 1
1 864 . 49 1 1 A 80 80 GLU C C 79 179.926 179.144 0.782 1
1 865 . 49 1 1 A 80 80 GLU CA C 79 59.581 58.862 0.719 1
1 866 . 49 1 1 A 80 80 GLU CB C 79 29.062 29.370 -0.308 1
1 868 . 49 1 1 A 80 80 GLU N N 79 116.767 119.783 -3.016 1
1 869 . 49 1 1 A 81 81 GLN H H 80 7.634 7.623 0.011 1
1 870 . 49 1 1 A 81 81 GLN HA H 80 3.605 3.813 -0.208 1
1 877 . 49 1 1 A 81 81 GLN C C 80 179.681 178.581 1.100 1
1 878 . 49 1 1 A 81 81 GLN CA C 80 57.765 58.499 -0.734 1
1 879 . 49 1 1 A 81 81 GLN CB C 80 28.079 27.826 0.253 1
1 881 . 49 1 1 A 81 81 GLN N N 80 116.325 118.832 -2.507 1
1 883 . 49 1 1 A 82 82 LEU H H 81 8.156 7.430 0.726 1
1 884 . 49 1 1 A 82 82 LEU HA H 81 3.536 3.710 -0.174 1
1 894 . 49 1 1 A 82 82 LEU C C 81 178.945 179.317 -0.372 1
1 895 . 49 1 1 A 82 82 LEU CA C 81 57.761 56.801 0.960 1
1 896 . 49 1 1 A 82 82 LEU CB C 81 40.961 40.764 0.197 1
1 900 . 49 1 1 A 82 82 LEU N N 81 121.546 119.869 1.677 1
1 901 . 49 1 1 A 83 83 LEU H H 82 8.326 7.943 0.383 1
1 902 . 49 1 1 A 83 83 LEU HA H 82 4.198 4.012 0.186 1
1 912 . 49 1 1 A 83 83 LEU C C 82 178.631 179.281 -0.650 1
1 913 . 49 1 1 A 83 83 LEU CA C 82 57.016 57.642 -0.626 1
1 914 . 49 1 1 A 83 83 LEU CB C 82 42.182 40.750 1.432 1
1 918 . 49 1 1 A 83 83 LEU N N 82 120.426 119.579 0.847 1
1 919 . 49 1 1 A 84 84 GLN H H 83 6.992 7.631 -0.639 1
1 920 . 49 1 1 A 84 84 GLN HA H 83 3.877 4.043 -0.166 1
1 927 . 49 1 1 A 84 84 GLN C C 83 177.008 177.093 -0.085 1
1 928 . 49 1 1 A 84 84 GLN CA C 83 57.543 58.467 -0.924 1
1 929 . 49 1 1 A 84 84 GLN CB C 83 28.688 28.643 0.045 1
1 931 . 49 1 1 A 84 84 GLN N N 83 114.001 116.935 -2.934 1
1 933 . 49 1 1 A 85 85 ARG H H 84 7.072 7.367 -0.295 1
1 934 . 49 1 1 A 85 85 ARG HA H 84 4.047 4.338 -0.291 1
1 942 . 49 1 1 A 85 85 ARG C C 84 175.999 175.317 0.682 1
1 943 . 49 1 1 A 85 85 ARG CA C 84 56.764 56.173 0.591 1
1 944 . 49 1 1 A 85 85 ARG CB C 84 32.044 31.526 0.518 1
1 947 . 49 1 1 A 85 85 ARG N N 84 115.827 116.824 -0.997 1
1 949 . 49 1 1 A 86 86 ILE H H 85 8.238 7.727 0.511 1
1 950 . 49 1 1 A 86 86 ILE HA H 85 4.389 4.552 -0.163 1
1 960 . 49 1 1 A 86 86 ILE CA C 85 58.007 57.998 0.009 1
1 961 . 49 1 1 A 86 86 ILE CB C 85 39.604 39.285 0.319 1
1 965 . 49 1 1 A 86 86 ILE N N 85 119.285 119.770 -0.485 1
1 966 . 49 1 1 A 87 87 PRO HA H 86 4.392 4.516 -0.124 1
1 973 . 49 1 1 A 87 87 PRO C C 86 177.622 176.523 1.099 1
1 974 . 49 1 1 A 87 87 PRO CA C 86 64.665 64.323 0.342 1
1 975 . 49 1 1 A 87 87 PRO CB C 86 32.020 31.816 0.204 1
1 978 . 49 1 1 A 88 88 GLU H H 87 8.312 8.222 0.090 1
1 979 . 49 1 1 A 88 88 GLU HA H 87 4.208 4.578 -0.370 1
1 984 . 49 1 1 A 88 88 GLU C C 87 175.554 175.807 -0.253 1
1 985 . 49 1 1 A 88 88 GLU CA C 87 56.045 56.268 -0.223 1
1 986 . 49 1 1 A 88 88 GLU CB C 87 28.654 30.698 -2.044 1
1 988 . 49 1 1 A 88 88 GLU N N 87 114.256 116.760 -2.504 1
1 989 . 49 1 1 A 89 89 PHE H H 88 7.946 7.721 0.225 1
1 990 . 49 1 1 A 89 89 PHE HA H 88 3.993 4.593 -0.600 1
1 998 . 49 1 1 A 89 89 PHE C C 88 173.460 174.734 -1.274 1
1 999 . 49 1 1 A 89 89 PHE CA C 88 60.119 58.736 1.383 1
1 1000 . 49 1 1 A 89 89 PHE CB C 88 39.994 39.853 0.141 1
1 1006 . 49 1 1 A 89 89 PHE N N 88 121.550 123.137 -1.587 1
1 1007 . 49 1 1 A 90 90 ASN H H 89 7.266 7.974 -0.708 1
1 1008 . 49 1 1 A 90 90 ASN HA H 89 4.454 4.960 -0.506 1
1 1013 . 49 1 1 A 90 90 ASN C C 89 173.921 175.105 -1.184 1
1 1014 . 49 1 1 A 90 90 ASN CA C 89 51.839 51.280 0.559 1
1 1015 . 49 1 1 A 90 90 ASN CB C 89 40.674 39.623 1.051 1
1 1016 . 49 1 1 A 90 90 ASN N N 89 125.344 125.400 -0.056 1
1 1018 . 49 1 1 A 91 91 MET H H 90 8.968 8.745 0.223 1
1 1019 . 49 1 1 A 91 91 MET HA H 90 4.049 4.118 -0.069 1
1 1027 . 49 1 1 A 91 91 MET C C 90 177.475 177.845 -0.370 1
1 1028 . 49 1 1 A 91 91 MET CA C 90 57.758 58.153 -0.395 1
1 1029 . 49 1 1 A 91 91 MET CB C 90 32.250 32.389 -0.139 1
1 1032 . 49 1 1 A 91 91 MET N N 90 127.052 125.500 1.552 1
1 1033 . 49 1 1 A 92 92 ALA H H 91 8.292 8.031 0.261 1
1 1034 . 49 1 1 A 92 92 ALA HA H 91 4.059 4.125 -0.066 1
1 1038 . 49 1 1 A 92 92 ALA C C 91 180.412 179.734 0.678 1
1 1039 . 49 1 1 A 92 92 ALA CA C 91 55.368 54.860 0.508 1
1 1040 . 49 1 1 A 92 92 ALA CB C 91 17.527 18.833 -1.306 1
1 1041 . 49 1 1 A 92 92 ALA N N 91 123.752 121.051 2.701 1
1 1042 . 49 1 1 A 93 93 ALA H H 92 7.931 7.866 0.065 1
1 1043 . 49 1 1 A 93 93 ALA HA H 92 4.054 4.310 -0.256 1
1 1047 . 49 1 1 A 93 93 ALA C C 92 180.482 179.727 0.755 1
1 1048 . 49 1 1 A 93 93 ALA CA C 92 54.614 54.843 -0.229 1
1 1049 . 49 1 1 A 93 93 ALA CB C 92 18.098 18.126 -0.028 1
1 1050 . 49 1 1 A 93 93 ALA N N 92 121.158 120.155 1.003 1
1 1051 . 49 1 1 A 94 94 PHE H H 93 8.110 7.812 0.298 1
1 1052 . 49 1 1 A 94 94 PHE HA H 93 4.304 4.158 0.146 1
1 1060 . 49 1 1 A 94 94 PHE C C 93 177.350 177.299 0.051 1
1 1061 . 49 1 1 A 94 94 PHE CA C 93 61.641 61.469 0.172 1
1 1062 . 49 1 1 A 94 94 PHE CB C 93 40.014 39.512 0.502 1
1 1068 . 49 1 1 A 94 94 PHE N N 93 119.807 119.607 0.200 1
1 1069 . 49 1 1 A 95 95 THR H H 94 8.726 8.213 0.513 1
1 1070 . 49 1 1 A 95 95 THR HA H 94 3.569 4.119 -0.550 1
1 1075 . 49 1 1 A 95 95 THR C C 94 176.932 176.559 0.373 1
1 1076 . 49 1 1 A 95 95 THR CA C 94 66.833 65.572 1.261 1
1 1077 . 49 1 1 A 95 95 THR CB C 94 68.445 68.276 0.169 1
1 1079 . 49 1 1 A 95 95 THR N N 94 113.074 112.173 0.901 1
1 1080 . 49 1 1 A 96 96 THR H H 95 7.657 7.782 -0.125 1
1 1081 . 49 1 1 A 96 96 THR HA H 95 3.945 4.086 -0.141 1
1 1086 . 49 1 1 A 96 96 THR C C 95 176.386 177.473 -1.087 1
1 1087 . 49 1 1 A 96 96 THR CA C 95 66.550 65.737 0.813 1
1 1088 . 49 1 1 A 96 96 THR CB C 95 68.583 67.955 0.628 1
1 1090 . 49 1 1 A 96 96 THR N N 95 117.927 113.895 4.032 1
1 1091 . 49 1 1 A 97 97 THR H H 96 7.699 7.605 0.094 1
1 1092 . 49 1 1 A 97 97 THR HA H 96 3.905 3.982 -0.077 1
1 1097 . 49 1 1 A 97 97 THR C C 96 176.572 176.676 -0.104 1
1 1098 . 49 1 1 A 97 97 THR CA C 96 65.979 66.218 -0.239 1
1 1099 . 49 1 1 A 97 97 THR CB C 96 68.553 68.223 0.330 1
1 1101 . 49 1 1 A 97 97 THR N N 96 118.518 117.357 1.161 1
1 1102 . 49 1 1 A 98 98 LEU H H 97 8.304 8.234 0.070 1
1 1103 . 49 1 1 A 98 98 LEU HA H 97 3.725 3.794 -0.069 1
1 1113 . 49 1 1 A 98 98 LEU C C 97 178.490 178.371 0.119 1
1 1114 . 49 1 1 A 98 98 LEU CA C 97 58.517 57.997 0.520 1
1 1115 . 49 1 1 A 98 98 LEU CB C 97 41.697 41.217 0.480 1
1 1119 . 49 1 1 A 98 98 LEU N N 97 122.882 122.226 0.656 1
1 1120 . 49 1 1 A 99 99 GLN H H 98 7.639 8.343 -0.704 1
1 1121 . 49 1 1 A 99 99 GLN HA H 98 3.927 4.222 -0.295 1
1 1128 . 49 1 1 A 99 99 GLN C C 98 178.068 177.828 0.240 1
1 1129 . 49 1 1 A 99 99 GLN CA C 98 58.735 58.102 0.633 1
1 1130 . 49 1 1 A 99 99 GLN CB C 98 27.986 28.032 -0.046 1
1 1132 . 49 1 1 A 99 99 GLN N N 98 114.302 116.619 -2.317 1
1 1134 . 49 1 1 A 100 100 HIS H H 99 7.575 7.733 -0.158 1
1 1135 . 49 1 1 A 100 100 HIS HA H 99 4.524 4.393 0.131 1
1 1139 . 49 1 1 A 100 100 HIS C C 99 174.789 177.096 -2.307 1
1 1140 . 49 1 1 A 100 100 HIS CA C 99 56.154 58.870 -2.716 1
1 1141 . 49 1 1 A 100 100 HIS CB C 99 28.946 30.422 -1.476 1
1 1143 . 49 1 1 A 100 100 HIS N N 99 114.778 120.021 -5.243 1
1 1144 . 49 1 1 A 101 101 HIS H H 100 7.773 8.507 -0.734 1
1 1145 . 49 1 1 A 101 101 HIS HA H 100 4.704 4.135 0.569 1
1 1149 . 49 1 1 A 101 101 HIS C C 100 174.818 177.100 -2.282 1
1 1150 . 49 1 1 A 101 101 HIS CA C 100 54.830 58.433 -3.603 1
1 1151 . 49 1 1 A 101 101 HIS CB C 100 29.749 28.634 1.115 1
1 1153 . 49 1 1 A 101 101 HIS N N 100 117.397 115.828 1.569 1
1 1154 . 49 1 1 A 102 102 LYS H H 101 7.324 8.383 -1.059 1
1 1155 . 49 1 1 A 102 102 LYS HA H 101 3.611 4.052 -0.441 1
1 1164 . 49 1 1 A 102 102 LYS C C 101 176.823 177.062 -0.239 1
1 1165 . 49 1 1 A 102 102 LYS CA C 101 59.915 58.511 1.404 1
1 1166 . 49 1 1 A 102 102 LYS CB C 101 32.825 31.324 1.501 1
1 1170 . 49 1 1 A 102 102 LYS N N 101 120.533 118.229 2.304 1
1 1171 . 49 1 1 A 103 103 ASP H H 102 8.361 8.608 -0.247 1
1 1172 . 49 1 1 A 103 103 ASP HA H 102 4.421 4.391 0.030 1
1 1175 . 49 1 1 A 103 103 ASP C C 102 176.793 177.306 -0.513 1
1 1176 . 49 1 1 A 103 103 ASP CA C 102 55.500 55.211 0.289 1
1 1177 . 49 1 1 A 103 103 ASP CB C 102 40.178 38.867 1.311 1
1 1178 . 49 1 1 A 103 103 ASP N N 102 114.814 120.091 -5.277 1
1 1179 . 49 1 1 A 104 104 GLU H H 103 7.858 8.188 -0.330 1
1 1180 . 49 1 1 A 104 104 GLU HA H 103 4.339 4.512 -0.173 1
1 1183 . 49 1 1 A 104 104 GLU C C 103 175.777 176.496 -0.719 1
1 1184 . 49 1 1 A 104 104 GLU CA C 103 56.356 57.981 -1.625 1
1 1185 . 49 1 1 A 104 104 GLU CB C 103 31.293 31.697 -0.404 1
1 1186 . 49 1 1 A 104 104 GLU N N 103 116.826 118.536 -1.710 1
1 1187 . 49 1 1 A 105 105 VAL H H 104 7.201 7.493 -0.292 1
1 1188 . 49 1 1 A 105 105 VAL HA H 104 4.296 4.120 0.176 1
1 1196 . 49 1 1 A 105 105 VAL C C 104 174.482 175.665 -1.183 1
1 1197 . 49 1 1 A 105 105 VAL CA C 104 60.370 62.676 -2.306 1
1 1198 . 49 1 1 A 105 105 VAL CB C 104 34.341 33.197 1.144 1
1 1201 . 49 1 1 A 105 105 VAL N N 104 116.422 119.749 -3.327 1
1 1202 . 49 1 1 A 106 106 ALA H H 105 8.487 8.468 0.019 1
1 1203 . 49 1 1 A 106 106 ALA HA H 105 4.172 4.367 -0.195 1
1 1207 . 49 1 1 A 106 106 ALA C C 105 179.030 179.262 -0.232 1
1 1208 . 49 1 1 A 106 106 ALA CA C 105 52.966 52.707 0.259 1
1 1209 . 49 1 1 A 106 106 ALA CB C 105 19.371 19.682 -0.311 1
1 1210 . 49 1 1 A 106 106 ALA N N 105 128.313 128.721 -0.408 1
1 1211 . 49 1 1 A 107 107 GLY H H 106 8.738 8.805 -0.067 1
1 1212 . 49 1 1 A 107 107 GLY HA2 H 106 3.773 3.878 -0.105 1
1 1213 . 49 1 1 A 107 107 GLY HA3 H 106 3.998 3.940 0.058 1
1 1214 . 49 1 1 A 107 107 GLY C C 106 174.958 175.817 -0.859 1
1 1215 . 49 1 1 A 107 107 GLY CA C 106 47.449 47.190 0.259 1
1 1216 . 49 1 1 A 107 107 GLY N N 106 110.612 110.864 -0.252 1
1 1217 . 49 1 1 A 108 108 ASP H H 107 8.535 8.476 0.059 1
1 1218 . 49 1 1 A 108 108 ASP HA H 107 4.333 4.343 -0.010 1
1 1221 . 49 1 1 A 108 108 ASP C C 107 179.133 178.467 0.666 1
1 1222 . 49 1 1 A 108 108 ASP CA C 107 56.721 56.815 -0.094 1
1 1223 . 49 1 1 A 108 108 ASP CB C 107 39.336 39.667 -0.331 1
1 1224 . 49 1 1 A 108 108 ASP N N 107 117.474 120.921 -3.447 1
1 1225 . 49 1 1 A 109 109 ILE H H 108 7.459 7.641 -0.182 1
1 1226 . 49 1 1 A 109 109 ILE HA H 108 3.688 3.810 -0.122 1
1 1236 . 49 1 1 A 109 109 ILE C C 108 176.735 178.383 -1.648 1
1 1237 . 49 1 1 A 109 109 ILE CA C 108 63.474 65.466 -1.992 1
1 1238 . 49 1 1 A 109 109 ILE CB C 108 37.340 37.726 -0.386 1
1 1242 . 49 1 1 A 109 109 ILE N N 108 119.609 120.945 -1.336 1
1 1243 . 49 1 1 A 110 110 PHE H H 109 7.920 8.312 -0.392 1
1 1244 . 49 1 1 A 110 110 PHE HA H 109 3.759 4.110 -0.351 1
1 1252 . 49 1 1 A 110 110 PHE C C 109 177.132 177.410 -0.278 1
1 1253 . 49 1 1 A 110 110 PHE CA C 109 62.766 61.263 1.503 1
1 1254 . 49 1 1 A 110 110 PHE CB C 109 39.752 39.316 0.436 1
1 1260 . 49 1 1 A 110 110 PHE N N 109 120.906 120.508 0.398 1
1 1261 . 49 1 1 A 111 111 ASP H H 110 8.639 8.248 0.391 1
1 1262 . 49 1 1 A 111 111 ASP HA H 110 4.216 4.224 -0.008 1
1 1265 . 49 1 1 A 111 111 ASP C C 110 178.900 178.400 0.500 1
1 1266 . 49 1 1 A 111 111 ASP CA C 110 57.105 57.288 -0.183 1
1 1267 . 49 1 1 A 111 111 ASP CB C 110 39.697 41.731 -2.034 1
1 1268 . 49 1 1 A 111 111 ASP N N 110 117.124 119.055 -1.931 1
1 1269 . 49 1 1 A 112 112 MET H H 111 7.331 7.558 -0.227 1
1 1270 . 49 1 1 A 112 112 MET HA H 111 4.081 4.154 -0.073 1
1 1278 . 49 1 1 A 112 112 MET C C 111 179.052 178.188 0.864 1
1 1279 . 49 1 1 A 112 112 MET CA C 111 58.202 58.153 0.049 1
1 1280 . 49 1 1 A 112 112 MET CB C 111 31.827 32.422 -0.595 1
1 1283 . 49 1 1 A 112 112 MET N N 111 118.061 119.457 -1.396 1
1 1284 . 49 1 1 A 113 113 LEU H H 112 8.001 8.060 -0.059 1
1 1285 . 49 1 1 A 113 113 LEU HA H 112 3.723 3.658 0.065 1
1 1295 . 49 1 1 A 113 113 LEU C C 112 179.747 178.778 0.969 1
1 1296 . 49 1 1 A 113 113 LEU CA C 112 57.371 57.497 -0.126 1
1 1297 . 49 1 1 A 113 113 LEU CB C 112 40.671 41.192 -0.521 1
1 1301 . 49 1 1 A 113 113 LEU N N 112 120.426 119.702 0.724 1
1 1302 . 49 1 1 A 114 114 LEU H H 113 7.744 7.688 0.056 1
1 1303 . 49 1 1 A 114 114 LEU HA H 113 4.007 3.587 0.420 1
1 1313 . 49 1 1 A 114 114 LEU C C 113 179.358 178.559 0.799 1
1 1314 . 49 1 1 A 114 114 LEU CA C 113 57.202 57.560 -0.358 1
1 1315 . 49 1 1 A 114 114 LEU CB C 113 41.727 41.627 0.100 1
1 1319 . 49 1 1 A 114 114 LEU N N 113 119.584 119.701 -0.117 1
1 1320 . 49 1 1 A 115 115 THR H H 114 7.353 7.617 -0.264 1
1 1321 . 49 1 1 A 115 115 THR HA H 114 4.071 4.093 -0.022 1
1 1327 . 49 1 1 A 115 115 THR C C 114 173.591 176.656 -3.065 1
1 1328 . 49 1 1 A 115 115 THR CA C 114 65.332 64.469 0.863 1
1 1329 . 49 1 1 A 115 115 THR CB C 114 70.319 68.589 1.730 1
1 1331 . 49 1 1 A 115 115 THR N N 114 107.535 112.369 -4.834 1
1 1332 . 49 1 1 A 116 116 PHE H H 115 6.979 7.912 -0.933 1
1 1333 . 49 1 1 A 116 116 PHE HA H 115 5.022 4.300 0.722 1
1 1341 . 49 1 1 A 116 116 PHE C C 115 176.488 176.586 -0.098 1
1 1342 . 49 1 1 A 116 116 PHE CA C 115 55.911 60.898 -4.987 1
1 1343 . 49 1 1 A 116 116 PHE CB C 115 38.521 39.153 -0.632 1
1 1349 . 49 1 1 A 116 116 PHE N N 115 112.366 120.184 -7.818 1
1 1350 . 49 1 1 A 117 117 THR H H 116 7.564 7.423 0.141 1
1 1351 . 49 1 1 A 117 117 THR HA H 116 4.626 4.785 -0.159 1
1 1356 . 49 1 1 A 117 117 THR C C 116 174.085 174.322 -0.237 1
1 1357 . 49 1 1 A 117 117 THR CA C 116 61.636 61.818 -0.182 1
1 1358 . 49 1 1 A 117 117 THR CB C 116 70.915 70.857 0.058 1
1 1360 . 49 1 1 A 117 117 THR N N 116 105.498 105.976 -0.478 1
1 1361 . 49 1 1 A 118 118 ASP H H 117 8.270 7.751 0.519 1
1 1362 . 49 1 1 A 118 118 ASP HA H 117 4.955 4.688 0.267 1
1 1365 . 49 1 1 A 118 118 ASP C C 117 176.328 176.395 -0.067 1
1 1366 . 49 1 1 A 118 118 ASP CA C 117 53.417 53.318 0.099 1
1 1367 . 49 1 1 A 118 118 ASP CB C 117 43.388 40.317 3.071 1
1 1368 . 49 1 1 A 118 118 ASP N N 117 124.409 122.447 1.962 1
1 1369 . 49 1 1 A 119 119 PHE H H 118 8.973 8.717 0.256 1
1 1370 . 49 1 1 A 119 119 PHE HA H 118 3.506 4.184 -0.678 1
1 1378 . 49 1 1 A 119 119 PHE CA C 118 61.490 61.330 0.160 1
1 1379 . 49 1 1 A 119 119 PHE CB C 118 39.246 39.474 -0.228 1
1 1385 . 49 1 1 A 119 119 PHE N N 118 126.688 126.376 0.312 1
1 1386 . 49 1 1 A 120 120 LEU H H 119 8.099 8.382 -0.283 1
1 1387 . 49 1 1 A 120 120 LEU HA H 119 3.842 3.886 -0.044 1
1 1397 . 49 1 1 A 120 120 LEU C C 119 179.601 179.501 0.100 1
1 1398 . 49 1 1 A 120 120 LEU CA C 119 58.174 57.801 0.373 1
1 1399 . 49 1 1 A 120 120 LEU CB C 119 40.315 41.036 -0.721 1
1 1403 . 49 1 1 A 120 120 LEU N N 119 117.930 119.878 -1.948 1
1 1404 . 49 1 1 A 121 121 ALA H H 120 7.729 7.913 -0.184 1
1 1405 . 49 1 1 A 121 121 ALA HA H 120 3.996 4.114 -0.118 1
1 1409 . 49 1 1 A 121 121 ALA C C 120 180.995 179.680 1.315 1
1 1410 . 49 1 1 A 121 121 ALA CA C 120 54.832 54.632 0.200 1
1 1411 . 49 1 1 A 121 121 ALA CB C 120 17.706 18.343 -0.637 1
1 1412 . 49 1 1 A 121 121 ALA N N 120 123.195 121.434 1.761 1
1 1413 . 49 1 1 A 122 122 PHE H H 121 7.943 7.785 0.158 1
1 1414 . 49 1 1 A 122 122 PHE HA H 121 3.887 3.858 0.029 1
1 1419 . 49 1 1 A 122 122 PHE C C 121 175.410 176.957 -1.547 1
1 1420 . 49 1 1 A 122 122 PHE CA C 121 61.075 60.743 0.332 1
1 1421 . 49 1 1 A 122 122 PHE CB C 121 38.115 38.978 -0.863 1
1 1424 . 49 1 1 A 122 122 PHE N N 121 121.798 120.429 1.369 1
1 1425 . 49 1 1 A 123 123 LYS H H 122 8.468 7.977 0.491 1
1 1426 . 49 1 1 A 123 123 LYS HA H 122 3.077 3.891 -0.814 1
1 1435 . 49 1 1 A 123 123 LYS C C 122 178.453 178.954 -0.501 1
1 1436 . 49 1 1 A 123 123 LYS CA C 122 59.855 59.953 -0.098 1
1 1437 . 49 1 1 A 123 123 LYS CB C 122 32.374 32.312 0.062 1
1 1441 . 49 1 1 A 123 123 LYS N N 122 120.614 118.512 2.102 1
1 1442 . 49 1 1 A 124 124 GLU H H 123 8.100 7.936 0.164 1
1 1443 . 49 1 1 A 124 124 GLU HA H 123 3.652 4.020 -0.368 1
1 1448 . 49 1 1 A 124 124 GLU C C 123 177.743 178.480 -0.737 1
1 1449 . 49 1 1 A 124 124 GLU CA C 123 59.406 59.459 -0.053 1
1 1450 . 49 1 1 A 124 124 GLU CB C 123 28.811 29.358 -0.547 1
1 1452 . 49 1 1 A 124 124 GLU N N 123 117.404 118.705 -1.301 1
1 1453 . 49 1 1 A 125 125 MET H H 124 7.537 7.501 0.036 1
1 1454 . 49 1 1 A 125 125 MET HA H 124 3.860 3.960 -0.100 1
1 1462 . 49 1 1 A 125 125 MET C C 124 179.522 178.381 1.141 1
1 1463 . 49 1 1 A 125 125 MET CA C 124 58.832 58.496 0.336 1
1 1464 . 49 1 1 A 125 125 MET CB C 124 31.765 31.411 0.354 1
1 1467 . 49 1 1 A 125 125 MET N N 124 119.413 118.961 0.452 1
1 1468 . 49 1 1 A 126 126 PHE H H 125 7.148 7.490 -0.342 1
1 1469 . 49 1 1 A 126 126 PHE HA H 125 3.633 4.228 -0.595 1
1 1476 . 49 1 1 A 126 126 PHE C C 125 178.994 178.207 0.787 1
1 1477 . 49 1 1 A 126 126 PHE CA C 125 63.148 61.170 1.978 1
1 1478 . 49 1 1 A 126 126 PHE CB C 125 39.830 38.501 1.329 1
1 1483 . 49 1 1 A 126 126 PHE N N 125 120.013 118.692 1.321 1
1 1484 . 49 1 1 A 127 127 LEU H H 126 8.369 8.395 -0.026 1
1 1485 . 49 1 1 A 127 127 LEU HA H 126 3.972 4.010 -0.038 1
1 1495 . 49 1 1 A 127 127 LEU C C 126 180.621 178.901 1.720 1
1 1496 . 49 1 1 A 127 127 LEU CA C 126 57.944 58.390 -0.446 1
1 1497 . 49 1 1 A 127 127 LEU CB C 126 40.543 41.837 -1.294 1
1 1501 . 49 1 1 A 127 127 LEU N N 126 119.692 119.948 -0.256 1
1 1502 . 49 1 1 A 128 128 ASP H H 127 8.578 8.336 0.242 1
1 1503 . 49 1 1 A 128 128 ASP HA H 127 4.308 4.339 -0.031 1
1 1506 . 49 1 1 A 128 128 ASP C C 127 178.254 177.962 0.292 1
1 1507 . 49 1 1 A 128 128 ASP CA C 127 56.964 57.270 -0.306 1
1 1508 . 49 1 1 A 128 128 ASP CB C 127 39.735 40.837 -1.102 1
1 1509 . 49 1 1 A 128 128 ASP N N 127 121.926 119.332 2.594 1
1 1510 . 49 1 1 A 129 129 TYR H H 128 7.710 8.363 -0.653 1
1 1511 . 49 1 1 A 129 129 TYR HA H 128 3.908 4.027 -0.119 1
1 1518 . 49 1 1 A 129 129 TYR C C 128 177.633 177.440 0.193 1
1 1519 . 49 1 1 A 129 129 TYR CA C 128 61.796 61.626 0.170 1
1 1520 . 49 1 1 A 129 129 TYR CB C 128 39.372 38.918 0.454 1
1 1525 . 49 1 1 A 129 129 TYR N N 128 122.548 120.437 2.111 1
1 1526 . 49 1 1 A 130 130 ARG H H 129 8.622 8.473 0.149 1
1 1527 . 49 1 1 A 130 130 ARG HA H 129 3.722 3.942 -0.220 1
1 1535 . 49 1 1 A 130 130 ARG CA C 129 60.084 59.769 0.315 1
1 1536 . 49 1 1 A 130 130 ARG CB C 129 29.902 29.967 -0.065 1
1 1539 . 49 1 1 A 130 130 ARG N N 129 118.302 119.465 -1.163 1
1 1541 . 49 1 1 A 131 131 ALA H H 130 7.936 8.024 -0.088 1
1 1542 . 49 1 1 A 131 131 ALA HA H 130 3.997 4.090 -0.093 1
1 1546 . 49 1 1 A 131 131 ALA C C 130 180.456 179.585 0.871 1
1 1547 . 49 1 1 A 131 131 ALA CA C 130 55.133 54.754 0.379 1
1 1548 . 49 1 1 A 131 131 ALA CB C 130 17.750 18.730 -0.980 1
1 1549 . 49 1 1 A 131 131 ALA N N 130 119.788 121.428 -1.640 1
1 1550 . 49 1 1 A 132 132 GLU H H 131 7.622 7.529 0.093 1
1 1551 . 49 1 1 A 132 132 GLU HA H 131 3.862 3.985 -0.123 1
1 1556 . 49 1 1 A 132 132 GLU C C 131 179.528 179.047 0.481 1
1 1557 . 49 1 1 A 132 132 GLU CA C 131 58.849 58.503 0.346 1
1 1558 . 49 1 1 A 132 132 GLU CB C 131 28.930 29.176 -0.246 1
1 1560 . 49 1 1 A 132 132 GLU N N 131 118.428 119.009 -0.581 1
1 1561 . 49 1 1 A 133 133 LYS H H 132 7.853 7.602 0.251 1
1 1562 . 49 1 1 A 133 133 LYS HA H 132 3.722 4.076 -0.354 1
1 1571 . 49 1 1 A 133 133 LYS C C 132 175.725 178.356 -2.631 1
1 1572 . 49 1 1 A 133 133 LYS CA C 132 57.544 58.118 -0.574 1
1 1573 . 49 1 1 A 133 133 LYS CB C 132 31.770 32.064 -0.294 1
1 1577 . 49 1 1 A 133 133 LYS N N 132 119.473 118.626 0.847 1
1 1578 . 49 1 1 A 134 134 GLU H H 133 8.151 7.491 0.660 1
1 1579 . 49 1 1 A 134 134 GLU HA H 133 4.161 4.313 -0.152 1
1 1584 . 49 1 1 A 134 134 GLU C C 133 177.453 176.247 1.206 1
1 1585 . 49 1 1 A 134 134 GLU CA C 133 57.222 56.534 0.688 1
1 1586 . 49 1 1 A 134 134 GLU CB C 133 30.091 29.869 0.222 1
1 1588 . 49 1 1 A 134 134 GLU N N 133 116.525 118.093 -1.568 1
1 1589 . 49 1 1 A 135 135 GLY H H 134 7.702 7.433 0.269 1
1 1590 . 49 1 1 A 135 135 GLY HA2 H 134 3.896 3.975 -0.079 1
1 1591 . 49 1 1 A 135 135 GLY HA3 H 134 3.897 3.983 -0.086 1
1 1592 . 49 1 1 A 135 135 GLY C C 134 174.538 173.458 1.080 1
1 1593 . 49 1 1 A 135 135 GLY CA C 134 45.975 45.477 0.498 1
1 1594 . 49 1 1 A 135 135 GLY N N 134 107.924 107.249 0.675 1
1 1595 . 49 1 1 A 136 136 ARG H H 135 8.045 8.041 0.004 1
1 1596 . 49 1 1 A 136 136 ARG HA H 135 4.323 4.621 -0.298 1
1 1604 . 49 1 1 A 136 136 ARG C C 135 175.864 175.300 0.564 1
1 1605 . 49 1 1 A 136 136 ARG CA C 135 56.016 57.290 -1.274 1
1 1606 . 49 1 1 A 136 136 ARG CB C 135 30.987 32.763 -1.776 1
1 1609 . 49 1 1 A 136 136 ARG N N 135 119.708 120.576 -0.868 1
1 1 . 50 1 1 A 14 14 PHE CA C 13 58.199 58.942 -0.743 1
1 2 . 50 1 1 A 14 14 PHE CB C 13 39.717 40.563 -0.846 1
1 3 . 50 1 1 A 15 15 SER H H 14 8.299 8.009 0.290 1
1 4 . 50 1 1 A 15 15 SER HA H 14 4.359 4.728 -0.369 1
1 7 . 50 1 1 A 15 15 SER CA C 14 58.249 59.469 -1.220 1
1 8 . 50 1 1 A 15 15 SER CB C 14 63.936 64.668 -0.732 1
1 9 . 50 1 1 A 15 15 SER N N 14 117.379 113.287 4.092 1
1 10 . 50 1 1 A 16 16 SER H H 15 8.255 8.338 -0.083 1
1 11 . 50 1 1 A 16 16 SER HA H 15 3.729 4.778 -1.049 1
1 14 . 50 1 1 A 16 16 SER CA C 15 58.224 58.060 0.164 1
1 15 . 50 1 1 A 16 16 SER CB C 15 63.886 65.428 -1.542 1
1 16 . 50 1 1 A 16 16 SER N N 15 117.694 113.750 3.944 1
1 17 . 50 1 1 A 17 17 ALA H H 16 8.333 8.169 0.164 1
1 18 . 50 1 1 A 17 17 ALA HA H 16 4.252 4.372 -0.120 1
1 22 . 50 1 1 A 17 17 ALA CA C 16 53.377 53.629 -0.252 1
1 23 . 50 1 1 A 17 17 ALA CB C 16 18.896 18.328 0.568 1
1 24 . 50 1 1 A 17 17 ALA N N 16 125.462 125.119 0.343 1
1 25 . 50 1 1 A 18 18 SER H H 17 8.219 8.122 0.097 1
1 26 . 50 1 1 A 18 18 SER HA H 17 4.332 4.228 0.104 1
1 29 . 50 1 1 A 18 18 SER CA C 17 59.105 61.775 -2.670 1
1 30 . 50 1 1 A 18 18 SER CB C 17 63.592 63.597 -0.005 1
1 31 . 50 1 1 A 18 18 SER N N 17 114.821 114.776 0.045 1
1 32 . 50 1 1 A 19 19 ASP H H 18 8.309 7.915 0.394 1
1 33 . 50 1 1 A 19 19 ASP HA H 18 4.554 4.952 -0.398 1
1 36 . 50 1 1 A 19 19 ASP C C 18 176.528 176.545 -0.017 1
1 37 . 50 1 1 A 19 19 ASP CA C 18 55.272 55.680 -0.408 1
1 38 . 50 1 1 A 19 19 ASP CB C 18 40.883 41.455 -0.572 1
1 39 . 50 1 1 A 19 19 ASP N N 18 123.367 118.741 4.626 1
1 40 . 50 1 1 A 20 20 ALA H H 19 8.133 8.559 -0.426 1
1 41 . 50 1 1 A 20 20 ALA HA H 19 4.170 4.101 0.069 1
1 45 . 50 1 1 A 20 20 ALA C C 19 179.857 179.516 0.341 1
1 46 . 50 1 1 A 20 20 ALA CA C 19 54.341 55.143 -0.802 1
1 47 . 50 1 1 A 20 20 ALA CB C 19 18.660 18.204 0.456 1
1 48 . 50 1 1 A 20 20 ALA N N 19 123.350 123.652 -0.302 1
1 49 . 50 1 1 A 21 21 GLU H H 20 8.140 8.219 -0.079 1
1 50 . 50 1 1 A 21 21 GLU HA H 20 4.128 4.123 0.005 1
1 55 . 50 1 1 A 21 21 GLU C C 20 177.675 178.561 -0.886 1
1 56 . 50 1 1 A 21 21 GLU CA C 20 58.520 59.530 -1.010 1
1 57 . 50 1 1 A 21 21 GLU CB C 20 29.765 29.585 0.180 1
1 59 . 50 1 1 A 21 21 GLU N N 20 119.063 119.363 -0.300 1
1 60 . 50 1 1 A 22 22 PHE H H 21 8.009 7.952 0.057 1
1 61 . 50 1 1 A 22 22 PHE HA H 21 4.123 4.377 -0.254 1
1 68 . 50 1 1 A 22 22 PHE C C 21 176.410 176.921 -0.511 1
1 69 . 50 1 1 A 22 22 PHE CA C 21 62.202 61.628 0.574 1
1 70 . 50 1 1 A 22 22 PHE CB C 21 39.223 39.150 0.073 1
1 75 . 50 1 1 A 22 22 PHE N N 21 121.211 120.917 0.294 1
1 76 . 50 1 1 A 23 23 ASP H H 22 8.261 8.102 0.159 1
1 77 . 50 1 1 A 23 23 ASP HA H 22 4.041 4.455 -0.414 1
1 80 . 50 1 1 A 23 23 ASP C C 22 179.078 178.801 0.277 1
1 81 . 50 1 1 A 23 23 ASP CA C 22 57.048 57.406 -0.358 1
1 82 . 50 1 1 A 23 23 ASP CB C 22 40.154 40.081 0.073 1
1 83 . 50 1 1 A 23 23 ASP N N 22 116.876 118.365 -1.489 1
1 84 . 50 1 1 A 24 24 ALA H H 23 7.651 7.607 0.044 1
1 85 . 50 1 1 A 24 24 ALA HA H 23 3.785 3.809 -0.024 1
1 89 . 50 1 1 A 24 24 ALA C C 23 179.577 179.685 -0.108 1
1 90 . 50 1 1 A 24 24 ALA CA C 23 54.341 55.077 -0.736 1
1 91 . 50 1 1 A 24 24 ALA CB C 23 17.762 18.081 -0.319 1
1 92 . 50 1 1 A 24 24 ALA N N 23 121.873 121.293 0.580 1
1 93 . 50 1 1 A 25 25 VAL H H 24 7.718 7.880 -0.162 1
1 94 . 50 1 1 A 25 25 VAL HA H 24 3.216 3.519 -0.303 1
1 102 . 50 1 1 A 25 25 VAL C C 24 177.805 178.374 -0.569 1
1 103 . 50 1 1 A 25 25 VAL CA C 24 66.789 66.727 0.062 1
1 104 . 50 1 1 A 25 25 VAL CB C 24 31.277 31.244 0.033 1
1 107 . 50 1 1 A 25 25 VAL N N 24 117.890 118.552 -0.662 1
1 108 . 50 1 1 A 26 26 VAL H H 25 7.867 7.749 0.118 1
1 109 . 50 1 1 A 26 26 VAL HA H 25 3.274 3.556 -0.282 1
1 117 . 50 1 1 A 26 26 VAL C C 25 177.788 178.020 -0.232 1
1 118 . 50 1 1 A 26 26 VAL CA C 25 67.282 66.450 0.832 1
1 119 . 50 1 1 A 26 26 VAL CB C 25 31.266 31.541 -0.275 1
1 122 . 50 1 1 A 26 26 VAL N N 25 118.170 120.045 -1.875 1
1 123 . 50 1 1 A 27 27 GLY H H 26 7.544 7.604 -0.060 1
1 124 . 50 1 1 A 27 27 GLY HA2 H 26 3.592 3.532 0.060 1
1 125 . 50 1 1 A 27 27 GLY HA3 H 26 3.721 3.652 0.069 1
1 126 . 50 1 1 A 27 27 GLY C C 26 176.717 176.507 0.210 1
1 127 . 50 1 1 A 27 27 GLY CA C 26 47.085 47.235 -0.150 1
1 128 . 50 1 1 A 27 27 GLY N N 26 105.795 107.517 -1.722 1
1 129 . 50 1 1 A 28 28 TYR H H 27 7.625 7.372 0.253 1
1 130 . 50 1 1 A 28 28 TYR HA H 27 4.546 4.582 -0.036 1
1 137 . 50 1 1 A 28 28 TYR C C 27 178.991 178.214 0.777 1
1 138 . 50 1 1 A 28 28 TYR CA C 27 58.845 59.766 -0.921 1
1 139 . 50 1 1 A 28 28 TYR CB C 27 37.602 37.595 0.007 1
1 144 . 50 1 1 A 28 28 TYR N N 27 119.933 122.134 -2.201 1
1 145 . 50 1 1 A 29 29 LEU H H 28 8.517 8.226 0.291 1
1 146 . 50 1 1 A 29 29 LEU HA H 28 3.728 3.800 -0.072 1
1 156 . 50 1 1 A 29 29 LEU CA C 28 58.281 58.096 0.185 1
1 157 . 50 1 1 A 29 29 LEU CB C 28 41.948 41.253 0.695 1
1 161 . 50 1 1 A 29 29 LEU N N 28 119.669 120.601 -0.932 1
1 162 . 50 1 1 A 30 30 GLU H H 29 8.072 8.004 0.068 1
1 163 . 50 1 1 A 30 30 GLU HA H 29 3.722 3.952 -0.230 1
1 168 . 50 1 1 A 30 30 GLU C C 29 177.731 178.951 -1.220 1
1 169 . 50 1 1 A 30 30 GLU CA C 29 59.763 59.831 -0.068 1
1 170 . 50 1 1 A 30 30 GLU CB C 29 28.844 29.078 -0.234 1
1 172 . 50 1 1 A 30 30 GLU N N 29 117.666 117.604 0.062 1
1 173 . 50 1 1 A 31 31 ASP H H 30 7.243 7.821 -0.578 1
1 174 . 50 1 1 A 31 31 ASP HA H 30 4.297 4.410 -0.113 1
1 177 . 50 1 1 A 31 31 ASP CA C 30 56.953 56.942 0.011 1
1 178 . 50 1 1 A 31 31 ASP CB C 30 40.730 40.993 -0.263 1
1 179 . 50 1 1 A 31 31 ASP N N 30 116.720 119.264 -2.544 1
1 180 . 50 1 1 A 32 32 ILE H H 31 7.940 7.524 0.416 1
1 181 . 50 1 1 A 32 32 ILE HA H 31 3.640 3.727 -0.087 1
1 191 . 50 1 1 A 32 32 ILE C C 31 177.980 178.089 -0.109 1
1 192 . 50 1 1 A 32 32 ILE CA C 31 64.692 64.249 0.443 1
1 193 . 50 1 1 A 32 32 ILE CB C 31 38.938 37.604 1.334 1
1 197 . 50 1 1 A 32 32 ILE N N 31 119.728 119.082 0.646 1
1 198 . 50 1 1 A 33 33 ILE H H 32 7.984 7.900 0.084 1
1 199 . 50 1 1 A 33 33 ILE HA H 32 3.598 2.580 1.018 1
1 209 . 50 1 1 A 33 33 ILE C C 32 176.723 176.841 -0.118 1
1 210 . 50 1 1 A 33 33 ILE CA C 32 63.241 64.412 -1.171 1
1 211 . 50 1 1 A 33 33 ILE CB C 32 37.580 37.656 -0.076 1
1 215 . 50 1 1 A 33 33 ILE N N 32 113.919 120.176 -6.257 1
1 216 . 50 1 1 A 34 34 MET H H 33 7.288 7.701 -0.413 1
1 217 . 50 1 1 A 34 34 MET HA H 33 4.496 4.655 -0.159 1
1 225 . 50 1 1 A 34 34 MET C C 33 176.423 175.779 0.644 1
1 226 . 50 1 1 A 34 34 MET CA C 33 54.634 54.294 0.340 1
1 227 . 50 1 1 A 34 34 MET CB C 33 31.934 31.185 0.749 1
1 230 . 50 1 1 A 34 34 MET N N 33 115.130 116.950 -1.820 1
1 231 . 50 1 1 A 35 35 ASP H H 34 7.405 7.684 -0.279 1
1 232 . 50 1 1 A 35 35 ASP HA H 34 4.484 4.614 -0.130 1
1 235 . 50 1 1 A 35 35 ASP C C 34 177.139 176.539 0.600 1
1 236 . 50 1 1 A 35 35 ASP CA C 34 54.625 54.727 -0.102 1
1 237 . 50 1 1 A 35 35 ASP CB C 34 43.554 42.904 0.650 1
1 238 . 50 1 1 A 35 35 ASP N N 34 121.814 122.380 -0.566 1
1 239 . 50 1 1 A 36 36 ASP H H 35 8.765 8.823 -0.058 1
1 240 . 50 1 1 A 36 36 ASP HA H 35 4.235 4.322 -0.087 1
1 243 . 50 1 1 A 36 36 ASP C C 35 178.320 178.463 -0.143 1
1 244 . 50 1 1 A 36 36 ASP CA C 35 57.832 57.874 -0.042 1
1 245 . 50 1 1 A 36 36 ASP CB C 35 40.914 40.537 0.377 1
1 246 . 50 1 1 A 36 36 ASP N N 35 125.883 125.295 0.588 1
1 247 . 50 1 1 A 37 37 GLU H H 36 8.905 8.207 0.698 1
1 248 . 50 1 1 A 37 37 GLU HA H 36 3.933 4.124 -0.191 1
1 253 . 50 1 1 A 37 37 GLU C C 36 179.304 179.035 0.269 1
1 254 . 50 1 1 A 37 37 GLU CA C 36 59.828 59.126 0.702 1
1 255 . 50 1 1 A 37 37 GLU CB C 36 29.380 29.313 0.067 1
1 257 . 50 1 1 A 37 37 GLU N N 36 119.077 119.633 -0.556 1
1 258 . 50 1 1 A 38 38 PHE H H 37 7.460 8.236 -0.776 1
1 259 . 50 1 1 A 38 38 PHE HA H 37 3.642 4.102 -0.460 1
1 267 . 50 1 1 A 38 38 PHE C C 37 176.483 177.864 -1.381 1
1 268 . 50 1 1 A 38 38 PHE CA C 37 61.411 61.203 0.208 1
1 269 . 50 1 1 A 38 38 PHE CB C 37 39.355 39.052 0.303 1
1 275 . 50 1 1 A 38 38 PHE N N 37 119.968 120.842 -0.874 1
1 276 . 50 1 1 A 39 39 GLN H H 38 7.968 8.056 -0.088 1
1 277 . 50 1 1 A 39 39 GLN HA H 38 3.712 3.827 -0.115 1
1 284 . 50 1 1 A 39 39 GLN CA C 38 59.153 58.822 0.331 1
1 285 . 50 1 1 A 39 39 GLN CB C 38 28.213 28.206 0.007 1
1 287 . 50 1 1 A 39 39 GLN N N 38 116.433 118.506 -2.073 1
1 289 . 50 1 1 A 40 40 LEU H H 39 7.930 7.589 0.341 1
1 290 . 50 1 1 A 40 40 LEU HA H 39 3.916 4.013 -0.097 1
1 300 . 50 1 1 A 40 40 LEU C C 39 177.731 177.993 -0.262 1
1 301 . 50 1 1 A 40 40 LEU CA C 39 57.915 57.907 0.008 1
1 302 . 50 1 1 A 40 40 LEU CB C 39 41.989 41.487 0.502 1
1 306 . 50 1 1 A 40 40 LEU N N 39 119.505 121.050 -1.545 1
1 307 . 50 1 1 A 41 41 LEU H H 40 7.174 7.772 -0.598 1
1 308 . 50 1 1 A 41 41 LEU HA H 40 3.835 3.925 -0.090 1
1 318 . 50 1 1 A 41 41 LEU C C 40 179.738 178.277 1.461 1
1 319 . 50 1 1 A 41 41 LEU CA C 40 58.266 58.292 -0.026 1
1 320 . 50 1 1 A 41 41 LEU CB C 40 42.050 41.560 0.490 1
1 324 . 50 1 1 A 41 41 LEU N N 40 120.971 119.824 1.147 1
1 325 . 50 1 1 A 42 42 GLN H H 41 8.058 8.012 0.046 1
1 326 . 50 1 1 A 42 42 GLN HA H 41 3.556 3.816 -0.260 1
1 333 . 50 1 1 A 42 42 GLN C C 41 177.642 178.565 -0.923 1
1 334 . 50 1 1 A 42 42 GLN CA C 41 59.826 59.293 0.533 1
1 335 . 50 1 1 A 42 42 GLN CB C 41 28.762 27.948 0.814 1
1 337 . 50 1 1 A 42 42 GLN N N 41 117.899 117.796 0.103 1
1 339 . 50 1 1 A 43 43 ARG H H 42 8.179 7.880 0.299 1
1 340 . 50 1 1 A 43 43 ARG HA H 42 3.655 3.986 -0.331 1
1 347 . 50 1 1 A 43 43 ARG C C 42 178.051 178.311 -0.260 1
1 348 . 50 1 1 A 43 43 ARG CA C 42 59.766 58.708 1.058 1
1 349 . 50 1 1 A 43 43 ARG CB C 42 29.941 29.930 0.011 1
1 352 . 50 1 1 A 43 43 ARG N N 42 119.392 119.875 -0.483 1
1 353 . 50 1 1 A 44 44 ASN H H 43 8.525 8.127 0.398 1
1 354 . 50 1 1 A 44 44 ASN HA H 43 4.332 4.349 -0.017 1
1 359 . 50 1 1 A 44 44 ASN C C 43 178.150 177.774 0.376 1
1 360 . 50 1 1 A 44 44 ASN CA C 43 55.841 56.146 -0.305 1
1 361 . 50 1 1 A 44 44 ASN CB C 43 37.632 39.166 -1.534 1
1 362 . 50 1 1 A 44 44 ASN N N 43 116.214 117.659 -1.445 1
1 364 . 50 1 1 A 45 45 PHE H H 44 7.586 7.768 -0.182 1
1 365 . 50 1 1 A 45 45 PHE HA H 44 4.132 4.348 -0.216 1
1 372 . 50 1 1 A 45 45 PHE C C 44 176.691 178.712 -2.021 1
1 373 . 50 1 1 A 45 45 PHE CA C 44 62.333 60.962 1.371 1
1 374 . 50 1 1 A 45 45 PHE CB C 44 39.449 38.875 0.574 1
1 379 . 50 1 1 A 45 45 PHE N N 44 121.501 117.707 3.794 1
1 380 . 50 1 1 A 46 46 MET H H 45 8.190 8.354 -0.164 1
1 381 . 50 1 1 A 46 46 MET HA H 45 4.060 4.287 -0.227 1
1 389 . 50 1 1 A 46 46 MET C C 45 179.754 178.238 1.516 1
1 390 . 50 1 1 A 46 46 MET CA C 45 57.742 58.077 -0.335 1
1 391 . 50 1 1 A 46 46 MET CB C 45 29.912 31.429 -1.517 1
1 394 . 50 1 1 A 46 46 MET N N 45 116.727 117.996 -1.269 1
1 395 . 50 1 1 A 47 47 ASP H H 46 8.579 8.297 0.282 1
1 396 . 50 1 1 A 47 47 ASP HA H 46 4.804 4.738 0.066 1
1 399 . 50 1 1 A 47 47 ASP C C 46 177.854 177.612 0.242 1
1 400 . 50 1 1 A 47 47 ASP CA C 46 57.277 57.312 -0.035 1
1 401 . 50 1 1 A 47 47 ASP CB C 46 40.776 41.623 -0.847 1
1 402 . 50 1 1 A 47 47 ASP N N 46 117.798 120.820 -3.022 1
1 403 . 50 1 1 A 48 48 LYS H H 47 7.339 7.955 -0.616 1
1 404 . 50 1 1 A 48 48 LYS HA H 47 3.828 4.366 -0.538 1
1 413 . 50 1 1 A 48 48 LYS C C 47 178.812 178.375 0.437 1
1 414 . 50 1 1 A 48 48 LYS CA C 47 58.953 57.217 1.736 1
1 415 . 50 1 1 A 48 48 LYS CB C 47 32.796 33.176 -0.380 1
1 419 . 50 1 1 A 48 48 LYS N N 47 117.852 117.832 0.020 1
1 420 . 50 1 1 A 49 49 TYR H H 48 6.841 8.557 -1.716 1
1 421 . 50 1 1 A 49 49 TYR HA H 48 4.995 4.320 0.675 1
1 428 . 50 1 1 A 49 49 TYR C C 48 178.138 178.602 -0.464 1
1 429 . 50 1 1 A 49 49 TYR CA C 48 58.620 59.784 -1.164 1
1 430 . 50 1 1 A 49 49 TYR CB C 48 42.939 38.197 4.742 1
1 435 . 50 1 1 A 49 49 TYR N N 48 112.109 119.146 -7.037 1
1 436 . 50 1 1 A 50 50 TYR H H 49 8.491 8.262 0.229 1
1 437 . 50 1 1 A 50 50 TYR HA H 49 4.598 4.390 0.208 1
1 444 . 50 1 1 A 50 50 TYR C C 49 176.015 177.680 -1.665 1
1 445 . 50 1 1 A 50 50 TYR CA C 49 62.442 59.711 2.731 1
1 446 . 50 1 1 A 50 50 TYR CB C 49 36.588 37.019 -0.431 1
1 451 . 50 1 1 A 50 50 TYR N N 49 118.294 118.966 -0.672 1
1 452 . 50 1 1 A 51 51 LEU H H 50 7.512 7.435 0.077 1
1 453 . 50 1 1 A 51 51 LEU HA H 50 3.878 3.635 0.243 1
1 463 . 50 1 1 A 51 51 LEU C C 50 178.625 178.585 0.040 1
1 464 . 50 1 1 A 51 51 LEU CA C 50 55.994 57.178 -1.184 1
1 465 . 50 1 1 A 51 51 LEU CB C 50 40.743 41.505 -0.762 1
1 469 . 50 1 1 A 51 51 LEU N N 50 118.478 121.884 -3.406 1
1 470 . 50 1 1 A 52 52 GLU H H 51 8.042 7.890 0.152 1
1 471 . 50 1 1 A 52 52 GLU HA H 51 4.197 3.889 0.308 1
1 476 . 50 1 1 A 52 52 GLU C C 51 177.629 177.693 -0.064 1
1 477 . 50 1 1 A 52 52 GLU CA C 51 56.141 59.431 -3.290 1
1 478 . 50 1 1 A 52 52 GLU CB C 51 29.162 29.225 -0.063 1
1 480 . 50 1 1 A 52 52 GLU N N 51 115.067 117.977 -2.910 1
1 481 . 50 1 1 A 53 53 PHE H H 52 7.465 7.923 -0.458 1
1 482 . 50 1 1 A 53 53 PHE HA H 52 4.431 4.728 -0.297 1
1 490 . 50 1 1 A 53 53 PHE C C 52 174.325 174.955 -0.630 1
1 491 . 50 1 1 A 53 53 PHE CA C 52 58.986 57.185 1.801 1
1 492 . 50 1 1 A 53 53 PHE CB C 52 40.183 37.528 2.655 1
1 498 . 50 1 1 A 53 53 PHE N N 52 116.768 118.760 -1.992 1
1 499 . 50 1 1 A 54 54 GLU H H 53 7.484 8.532 -1.048 1
1 500 . 50 1 1 A 54 54 GLU HA H 53 4.583 4.947 -0.364 1
1 505 . 50 1 1 A 54 54 GLU C C 53 175.722 175.798 -0.076 1
1 506 . 50 1 1 A 54 54 GLU CA C 53 54.248 54.712 -0.464 1
1 507 . 50 1 1 A 54 54 GLU CB C 53 34.409 32.502 1.907 1
1 509 . 50 1 1 A 54 54 GLU N N 53 118.844 125.496 -6.652 1
1 510 . 50 1 1 A 55 55 ASP H H 54 9.008 8.755 0.253 1
1 511 . 50 1 1 A 55 55 ASP HA H 54 4.735 4.826 -0.091 1
1 514 . 50 1 1 A 55 55 ASP C C 54 175.421 176.135 -0.714 1
1 515 . 50 1 1 A 55 55 ASP CA C 54 52.888 54.239 -1.351 1
1 516 . 50 1 1 A 55 55 ASP CB C 54 38.894 40.801 -1.907 1
1 517 . 50 1 1 A 55 55 ASP N N 54 123.654 126.683 -3.029 1
1 518 . 50 1 1 A 56 56 THR H H 55 7.819 8.391 -0.572 1
1 519 . 50 1 1 A 56 56 THR HA H 55 4.574 5.017 -0.443 1
1 524 . 50 1 1 A 56 56 THR C C 55 174.096 174.270 -0.174 1
1 525 . 50 1 1 A 56 56 THR CA C 55 59.172 59.370 -0.198 1
1 526 . 50 1 1 A 56 56 THR CB C 55 71.889 71.856 0.033 1
1 528 . 50 1 1 A 56 56 THR N N 55 112.015 117.613 -5.598 1
1 529 . 50 1 1 A 57 57 GLU H H 56 8.527 8.851 -0.324 1
1 530 . 50 1 1 A 57 57 GLU HA H 56 4.217 4.561 -0.344 1
1 535 . 50 1 1 A 57 57 GLU C C 56 177.042 176.630 0.412 1
1 536 . 50 1 1 A 57 57 GLU CA C 56 56.869 57.629 -0.760 1
1 537 . 50 1 1 A 57 57 GLU CB C 56 29.731 31.317 -1.586 1
1 539 . 50 1 1 A 57 57 GLU N N 56 117.531 119.337 -1.806 1
1 540 . 50 1 1 A 58 58 GLU H H 57 7.587 7.889 -0.302 1
1 541 . 50 1 1 A 58 58 GLU HA H 57 3.941 4.524 -0.583 1
1 546 . 50 1 1 A 58 58 GLU C C 57 176.849 176.303 0.546 1
1 547 . 50 1 1 A 58 58 GLU CA C 57 56.924 56.449 0.475 1
1 548 . 50 1 1 A 58 58 GLU CB C 57 30.251 30.691 -0.440 1
1 550 . 50 1 1 A 58 58 GLU N N 57 119.183 120.115 -0.932 1
1 551 . 50 1 1 A 59 59 ASN H H 58 9.120 8.625 0.495 1
1 552 . 50 1 1 A 59 59 ASN HA H 58 4.922 4.860 0.062 1
1 557 . 50 1 1 A 59 59 ASN C C 58 174.254 175.211 -0.957 1
1 558 . 50 1 1 A 59 59 ASN CA C 58 51.956 53.738 -1.782 1
1 559 . 50 1 1 A 59 59 ASN CB C 58 37.404 39.056 -1.652 1
1 560 . 50 1 1 A 59 59 ASN N N 58 126.767 126.716 0.051 1
1 562 . 50 1 1 A 60 60 LYS H H 59 5.892 9.378 -3.486 1
1 563 . 50 1 1 A 60 60 LYS HA H 59 3.798 4.509 -0.711 1
1 572 . 50 1 1 A 60 60 LYS C C 59 177.908 177.774 0.134 1
1 573 . 50 1 1 A 60 60 LYS CA C 59 56.623 55.229 1.394 1
1 574 . 50 1 1 A 60 60 LYS CB C 59 32.279 33.598 -1.319 1
1 578 . 50 1 1 A 60 60 LYS N N 59 121.527 125.814 -4.287 1
1 579 . 50 1 1 A 61 61 LEU H H 60 8.473 8.750 -0.277 1
1 580 . 50 1 1 A 61 61 LEU HA H 60 3.891 4.149 -0.258 1
1 590 . 50 1 1 A 61 61 LEU C C 60 179.843 178.793 1.050 1
1 591 . 50 1 1 A 61 61 LEU CA C 60 58.301 56.748 1.553 1
1 592 . 50 1 1 A 61 61 LEU CB C 60 41.305 41.722 -0.417 1
1 596 . 50 1 1 A 61 61 LEU N N 60 125.639 122.853 2.786 1
1 597 . 50 1 1 A 62 62 ILE H H 61 7.698 7.850 -0.152 1
1 598 . 50 1 1 A 62 62 ILE HA H 61 3.952 3.826 0.126 1
1 608 . 50 1 1 A 62 62 ILE C C 61 175.392 177.160 -1.768 1
1 609 . 50 1 1 A 62 62 ILE CA C 61 61.743 63.276 -1.533 1
1 610 . 50 1 1 A 62 62 ILE CB C 61 39.108 37.630 1.478 1
1 614 . 50 1 1 A 62 62 ILE N N 61 114.111 119.224 -5.113 1
1 615 . 50 1 1 A 63 63 TYR H H 62 7.273 7.587 -0.314 1
1 616 . 50 1 1 A 63 63 TYR HA H 62 4.343 4.084 0.259 1
1 623 . 50 1 1 A 63 63 TYR C C 62 178.264 178.514 -0.250 1
1 624 . 50 1 1 A 63 63 TYR CA C 62 57.231 60.733 -3.502 1
1 625 . 50 1 1 A 63 63 TYR CB C 62 36.332 37.604 -1.272 1
1 630 . 50 1 1 A 63 63 TYR N N 62 117.689 121.275 -3.586 1
1 631 . 50 1 1 A 64 64 THR H H 63 7.747 7.967 -0.220 1
1 632 . 50 1 1 A 64 64 THR HA H 63 4.266 4.200 0.066 1
1 637 . 50 1 1 A 64 64 THR CA C 63 69.362 67.530 1.832 1
1 638 . 50 1 1 A 64 64 THR CB C 63 66.962 67.810 -0.848 1
1 640 . 50 1 1 A 64 64 THR N N 63 113.755 116.105 -2.350 1
1 641 . 50 1 1 A 65 65 PRO HA H 64 4.372 4.359 0.013 1
1 648 . 50 1 1 A 65 65 PRO C C 64 179.913 179.378 0.535 1
1 649 . 50 1 1 A 65 65 PRO CA C 64 66.011 66.314 -0.303 1
1 650 . 50 1 1 A 65 65 PRO CB C 64 30.642 30.748 -0.106 1
1 653 . 50 1 1 A 66 66 ILE H H 65 7.377 7.307 0.070 1
1 654 . 50 1 1 A 66 66 ILE HA H 65 3.530 3.847 -0.317 1
1 664 . 50 1 1 A 66 66 ILE C C 65 177.543 178.451 -0.908 1
1 665 . 50 1 1 A 66 66 ILE CA C 65 66.647 64.294 2.353 1
1 666 . 50 1 1 A 66 66 ILE CB C 65 38.029 37.666 0.363 1
1 670 . 50 1 1 A 66 66 ILE N N 65 118.353 116.616 1.737 1
1 671 . 50 1 1 A 67 67 PHE H H 66 8.480 8.418 0.062 1
1 672 . 50 1 1 A 67 67 PHE HA H 66 4.115 4.466 -0.351 1
1 680 . 50 1 1 A 67 67 PHE C C 66 177.293 178.090 -0.797 1
1 681 . 50 1 1 A 67 67 PHE CA C 66 59.570 62.122 -2.552 1
1 682 . 50 1 1 A 67 67 PHE CB C 66 38.865 39.707 -0.842 1
1 688 . 50 1 1 A 67 67 PHE N N 66 122.420 120.337 2.083 1
1 689 . 50 1 1 A 68 68 ASN H H 67 8.595 8.189 0.406 1
1 690 . 50 1 1 A 68 68 ASN HA H 67 4.211 4.442 -0.231 1
1 695 . 50 1 1 A 68 68 ASN C C 67 178.697 178.227 0.470 1
1 696 . 50 1 1 A 68 68 ASN CA C 67 56.056 56.273 -0.217 1
1 697 . 50 1 1 A 68 68 ASN CB C 67 37.704 37.860 -0.156 1
1 698 . 50 1 1 A 68 68 ASN N N 67 115.573 117.114 -1.541 1
1 700 . 50 1 1 A 69 69 GLU H H 68 8.414 7.994 0.420 1
1 701 . 50 1 1 A 69 69 GLU HA H 68 4.102 4.172 -0.070 1
1 706 . 50 1 1 A 69 69 GLU C C 68 177.880 178.765 -0.885 1
1 707 . 50 1 1 A 69 69 GLU CA C 68 59.399 59.464 -0.065 1
1 708 . 50 1 1 A 69 69 GLU CB C 68 29.855 29.421 0.434 1
1 710 . 50 1 1 A 69 69 GLU N N 68 123.510 120.033 3.477 1
1 711 . 50 1 1 A 70 70 TYR H H 69 8.659 8.030 0.629 1
1 712 . 50 1 1 A 70 70 TYR HA H 69 3.362 4.141 -0.779 1
1 719 . 50 1 1 A 70 70 TYR C C 69 178.143 177.059 1.084 1
1 720 . 50 1 1 A 70 70 TYR CA C 69 60.686 61.045 -0.359 1
1 721 . 50 1 1 A 70 70 TYR CB C 69 38.560 38.963 -0.403 1
1 726 . 50 1 1 A 70 70 TYR N N 69 122.130 120.701 1.429 1
1 727 . 50 1 1 A 71 71 ILE H H 70 8.031 7.700 0.331 1
1 728 . 50 1 1 A 71 71 ILE HA H 70 3.265 3.729 -0.464 1
1 738 . 50 1 1 A 71 71 ILE C C 70 178.056 177.662 0.394 1
1 739 . 50 1 1 A 71 71 ILE CA C 70 63.756 64.001 -0.245 1
1 740 . 50 1 1 A 71 71 ILE CB C 70 37.321 36.581 0.740 1
1 744 . 50 1 1 A 71 71 ILE N N 70 118.906 120.149 -1.243 1
1 745 . 50 1 1 A 72 72 SER H H 71 7.803 7.966 -0.163 1
1 746 . 50 1 1 A 72 72 SER HA H 71 4.029 4.351 -0.322 1
1 749 . 50 1 1 A 72 72 SER CA C 71 61.380 61.124 0.256 1
1 750 . 50 1 1 A 72 72 SER CB C 71 63.288 63.461 -0.173 1
1 751 . 50 1 1 A 72 72 SER N N 71 113.735 118.660 -4.925 1
1 752 . 50 1 1 A 73 73 LEU H H 72 7.952 7.922 0.030 1
1 753 . 50 1 1 A 73 73 LEU HA H 72 4.418 4.125 0.293 1
1 763 . 50 1 1 A 73 73 LEU C C 72 177.767 178.342 -0.575 1
1 764 . 50 1 1 A 73 73 LEU CA C 72 56.543 57.433 -0.890 1
1 765 . 50 1 1 A 73 73 LEU CB C 72 44.517 41.800 2.717 1
1 769 . 50 1 1 A 73 73 LEU N N 72 119.411 122.446 -3.035 1
1 770 . 50 1 1 A 74 74 VAL H H 73 8.021 7.661 0.360 1
1 771 . 50 1 1 A 74 74 VAL HA H 73 3.532 3.443 0.089 1
1 779 . 50 1 1 A 74 74 VAL C C 73 177.126 178.017 -0.891 1
1 780 . 50 1 1 A 74 74 VAL CA C 73 66.250 66.397 -0.147 1
1 781 . 50 1 1 A 74 74 VAL CB C 73 31.212 31.217 -0.005 1
1 784 . 50 1 1 A 74 74 VAL N N 73 118.747 119.277 -0.530 1
1 785 . 50 1 1 A 75 75 GLU H H 74 7.232 8.076 -0.844 1
1 786 . 50 1 1 A 75 75 GLU HA H 74 3.013 3.956 -0.943 1
1 791 . 50 1 1 A 75 75 GLU C C 74 178.804 178.940 -0.136 1
1 792 . 50 1 1 A 75 75 GLU CA C 74 60.536 59.652 0.884 1
1 793 . 50 1 1 A 75 75 GLU CB C 74 27.009 28.985 -1.976 1
1 795 . 50 1 1 A 75 75 GLU N N 74 118.660 119.968 -1.308 1
1 796 . 50 1 1 A 76 76 LYS H H 75 7.051 7.817 -0.766 1
1 797 . 50 1 1 A 76 76 LYS HA H 75 3.765 4.019 -0.254 1
1 806 . 50 1 1 A 76 76 LYS C C 75 177.765 178.449 -0.684 1
1 807 . 50 1 1 A 76 76 LYS CA C 75 58.357 58.926 -0.569 1
1 808 . 50 1 1 A 76 76 LYS CB C 75 31.939 31.930 0.009 1
1 812 . 50 1 1 A 76 76 LYS N N 75 116.112 119.600 -3.488 1
1 813 . 50 1 1 A 77 77 TYR H H 76 7.067 7.796 -0.729 1
1 814 . 50 1 1 A 77 77 TYR HA H 76 4.036 4.214 -0.178 1
1 821 . 50 1 1 A 77 77 TYR C C 76 177.752 177.398 0.354 1
1 822 . 50 1 1 A 77 77 TYR CA C 76 61.820 61.319 0.501 1
1 823 . 50 1 1 A 77 77 TYR CB C 76 38.480 38.679 -0.199 1
1 828 . 50 1 1 A 77 77 TYR N N 76 118.434 120.768 -2.334 1
1 829 . 50 1 1 A 78 78 ILE H H 77 7.554 8.252 -0.698 1
1 830 . 50 1 1 A 78 78 ILE HA H 77 3.159 3.547 -0.388 1
1 840 . 50 1 1 A 78 78 ILE C C 77 177.341 178.000 -0.659 1
1 841 . 50 1 1 A 78 78 ILE CA C 77 65.177 65.413 -0.236 1
1 842 . 50 1 1 A 78 78 ILE CB C 77 37.339 37.835 -0.496 1
1 846 . 50 1 1 A 78 78 ILE N N 77 117.672 121.014 -3.342 1
1 847 . 50 1 1 A 79 79 GLU H H 78 8.296 7.966 0.330 1
1 848 . 50 1 1 A 79 79 GLU HA H 78 3.557 3.768 -0.211 1
1 853 . 50 1 1 A 79 79 GLU C C 78 177.742 179.141 -1.399 1
1 854 . 50 1 1 A 79 79 GLU CA C 78 60.847 60.070 0.777 1
1 855 . 50 1 1 A 79 79 GLU CB C 78 29.594 29.207 0.387 1
1 857 . 50 1 1 A 79 79 GLU N N 78 118.701 120.604 -1.903 1
1 858 . 50 1 1 A 80 80 GLU H H 79 8.330 8.174 0.156 1
1 859 . 50 1 1 A 80 80 GLU HA H 79 3.774 4.081 -0.307 1
1 864 . 50 1 1 A 80 80 GLU C C 79 179.926 179.057 0.869 1
1 865 . 50 1 1 A 80 80 GLU CA C 79 59.581 58.518 1.063 1
1 866 . 50 1 1 A 80 80 GLU CB C 79 29.062 29.492 -0.430 1
1 868 . 50 1 1 A 80 80 GLU N N 79 116.767 118.386 -1.619 1
1 869 . 50 1 1 A 81 81 GLN H H 80 7.634 7.932 -0.298 1
1 870 . 50 1 1 A 81 81 GLN HA H 80 3.605 3.851 -0.246 1
1 877 . 50 1 1 A 81 81 GLN C C 80 179.681 178.578 1.103 1
1 878 . 50 1 1 A 81 81 GLN CA C 80 57.765 58.526 -0.761 1
1 879 . 50 1 1 A 81 81 GLN CB C 80 28.079 27.954 0.125 1
1 881 . 50 1 1 A 81 81 GLN N N 80 116.325 118.753 -2.428 1
1 883 . 50 1 1 A 82 82 LEU H H 81 8.156 7.589 0.567 1
1 884 . 50 1 1 A 82 82 LEU HA H 81 3.536 3.792 -0.256 1
1 894 . 50 1 1 A 82 82 LEU C C 81 178.945 179.324 -0.379 1
1 895 . 50 1 1 A 82 82 LEU CA C 81 57.761 56.828 0.933 1
1 896 . 50 1 1 A 82 82 LEU CB C 81 40.961 40.816 0.145 1
1 900 . 50 1 1 A 82 82 LEU N N 81 121.546 120.055 1.491 1
1 901 . 50 1 1 A 83 83 LEU H H 82 8.326 7.940 0.386 1
1 902 . 50 1 1 A 83 83 LEU HA H 82 4.198 4.254 -0.056 1
1 912 . 50 1 1 A 83 83 LEU C C 82 178.631 179.199 -0.568 1
1 913 . 50 1 1 A 83 83 LEU CA C 82 57.016 57.061 -0.045 1
1 914 . 50 1 1 A 83 83 LEU CB C 82 42.182 40.670 1.512 1
1 918 . 50 1 1 A 83 83 LEU N N 82 120.426 119.059 1.367 1
1 919 . 50 1 1 A 84 84 GLN H H 83 6.992 7.799 -0.807 1
1 920 . 50 1 1 A 84 84 GLN HA H 83 3.877 3.981 -0.104 1
1 927 . 50 1 1 A 84 84 GLN C C 83 177.008 176.730 0.278 1
1 928 . 50 1 1 A 84 84 GLN CA C 83 57.543 58.726 -1.183 1
1 929 . 50 1 1 A 84 84 GLN CB C 83 28.688 28.308 0.380 1
1 931 . 50 1 1 A 84 84 GLN N N 83 114.001 117.701 -3.700 1
1 933 . 50 1 1 A 85 85 ARG H H 84 7.072 7.647 -0.575 1
1 934 . 50 1 1 A 85 85 ARG HA H 84 4.047 4.521 -0.474 1
1 942 . 50 1 1 A 85 85 ARG C C 84 175.999 175.497 0.502 1
1 943 . 50 1 1 A 85 85 ARG CA C 84 56.764 56.976 -0.212 1
1 944 . 50 1 1 A 85 85 ARG CB C 84 32.044 32.773 -0.729 1
1 947 . 50 1 1 A 85 85 ARG N N 84 115.827 119.038 -3.211 1
1 949 . 50 1 1 A 86 86 ILE H H 85 8.238 7.806 0.432 1
1 950 . 50 1 1 A 86 86 ILE HA H 85 4.389 4.450 -0.061 1
1 960 . 50 1 1 A 86 86 ILE CA C 85 58.007 57.949 0.058 1
1 961 . 50 1 1 A 86 86 ILE CB C 85 39.604 38.670 0.934 1
1 965 . 50 1 1 A 86 86 ILE N N 85 119.285 118.883 0.402 1
1 966 . 50 1 1 A 87 87 PRO HA H 86 4.392 4.544 -0.152 1
1 973 . 50 1 1 A 87 87 PRO C C 86 177.622 176.428 1.194 1
1 974 . 50 1 1 A 87 87 PRO CA C 86 64.665 64.241 0.424 1
1 975 . 50 1 1 A 87 87 PRO CB C 86 32.020 31.674 0.346 1
1 978 . 50 1 1 A 88 88 GLU H H 87 8.312 8.190 0.122 1
1 979 . 50 1 1 A 88 88 GLU HA H 87 4.208 4.493 -0.285 1
1 984 . 50 1 1 A 88 88 GLU C C 87 175.554 175.803 -0.249 1
1 985 . 50 1 1 A 88 88 GLU CA C 87 56.045 56.222 -0.177 1
1 986 . 50 1 1 A 88 88 GLU CB C 87 28.654 30.381 -1.727 1
1 988 . 50 1 1 A 88 88 GLU N N 87 114.256 116.922 -2.666 1
1 989 . 50 1 1 A 89 89 PHE H H 88 7.946 7.548 0.398 1
1 990 . 50 1 1 A 89 89 PHE HA H 88 3.993 4.445 -0.452 1
1 998 . 50 1 1 A 89 89 PHE C C 88 173.460 174.854 -1.394 1
1 999 . 50 1 1 A 89 89 PHE CA C 88 60.119 59.182 0.937 1
1 1000 . 50 1 1 A 89 89 PHE CB C 88 39.994 39.774 0.220 1
1 1006 . 50 1 1 A 89 89 PHE N N 88 121.550 123.084 -1.534 1
1 1007 . 50 1 1 A 90 90 ASN H H 89 7.266 7.859 -0.593 1
1 1008 . 50 1 1 A 90 90 ASN HA H 89 4.454 4.969 -0.515 1
1 1013 . 50 1 1 A 90 90 ASN C C 89 173.921 175.160 -1.239 1
1 1014 . 50 1 1 A 90 90 ASN CA C 89 51.839 51.584 0.255 1
1 1015 . 50 1 1 A 90 90 ASN CB C 89 40.674 39.803 0.871 1
1 1016 . 50 1 1 A 90 90 ASN N N 89 125.344 124.792 0.552 1
1 1018 . 50 1 1 A 91 91 MET H H 90 8.968 8.865 0.103 1
1 1019 . 50 1 1 A 91 91 MET HA H 90 4.049 4.235 -0.186 1
1 1027 . 50 1 1 A 91 91 MET C C 90 177.475 177.942 -0.467 1
1 1028 . 50 1 1 A 91 91 MET CA C 90 57.758 58.370 -0.612 1
1 1029 . 50 1 1 A 91 91 MET CB C 90 32.250 32.170 0.080 1
1 1032 . 50 1 1 A 91 91 MET N N 90 127.052 125.465 1.587 1
1 1033 . 50 1 1 A 92 92 ALA H H 91 8.292 8.023 0.269 1
1 1034 . 50 1 1 A 92 92 ALA HA H 91 4.059 4.161 -0.102 1
1 1038 . 50 1 1 A 92 92 ALA C C 91 180.412 179.795 0.617 1
1 1039 . 50 1 1 A 92 92 ALA CA C 91 55.368 54.976 0.392 1
1 1040 . 50 1 1 A 92 92 ALA CB C 91 17.527 18.770 -1.243 1
1 1041 . 50 1 1 A 92 92 ALA N N 91 123.752 121.373 2.379 1
1 1042 . 50 1 1 A 93 93 ALA H H 92 7.931 8.190 -0.259 1
1 1043 . 50 1 1 A 93 93 ALA HA H 92 4.054 4.152 -0.098 1
1 1047 . 50 1 1 A 93 93 ALA C C 92 180.482 179.991 0.491 1
1 1048 . 50 1 1 A 93 93 ALA CA C 92 54.614 55.039 -0.425 1
1 1049 . 50 1 1 A 93 93 ALA CB C 92 18.098 18.328 -0.230 1
1 1050 . 50 1 1 A 93 93 ALA N N 92 121.158 120.040 1.118 1
1 1051 . 50 1 1 A 94 94 PHE H H 93 8.110 7.999 0.111 1
1 1052 . 50 1 1 A 94 94 PHE HA H 93 4.304 4.174 0.130 1
1 1060 . 50 1 1 A 94 94 PHE C C 93 177.350 177.146 0.204 1
1 1061 . 50 1 1 A 94 94 PHE CA C 93 61.641 61.476 0.165 1
1 1062 . 50 1 1 A 94 94 PHE CB C 93 40.014 39.045 0.969 1
1 1068 . 50 1 1 A 94 94 PHE N N 93 119.807 119.829 -0.022 1
1 1069 . 50 1 1 A 95 95 THR H H 94 8.726 8.166 0.560 1
1 1070 . 50 1 1 A 95 95 THR HA H 94 3.569 4.026 -0.457 1
1 1075 . 50 1 1 A 95 95 THR C C 94 176.932 176.966 -0.034 1
1 1076 . 50 1 1 A 95 95 THR CA C 94 66.833 65.699 1.134 1
1 1077 . 50 1 1 A 95 95 THR CB C 94 68.445 68.440 0.005 1
1 1079 . 50 1 1 A 95 95 THR N N 94 113.074 112.167 0.907 1
1 1080 . 50 1 1 A 96 96 THR H H 95 7.657 7.857 -0.200 1
1 1081 . 50 1 1 A 96 96 THR HA H 95 3.945 4.062 -0.117 1
1 1086 . 50 1 1 A 96 96 THR C C 95 176.386 176.320 0.066 1
1 1087 . 50 1 1 A 96 96 THR CA C 95 66.550 66.016 0.534 1
1 1088 . 50 1 1 A 96 96 THR CB C 95 68.583 68.761 -0.178 1
1 1090 . 50 1 1 A 96 96 THR N N 95 117.927 116.659 1.268 1
1 1091 . 50 1 1 A 97 97 THR H H 96 7.699 7.774 -0.075 1
1 1092 . 50 1 1 A 97 97 THR HA H 96 3.905 4.062 -0.157 1
1 1097 . 50 1 1 A 97 97 THR C C 96 176.572 176.454 0.118 1
1 1098 . 50 1 1 A 97 97 THR CA C 96 65.979 66.310 -0.331 1
1 1099 . 50 1 1 A 97 97 THR CB C 96 68.553 68.372 0.181 1
1 1101 . 50 1 1 A 97 97 THR N N 96 118.518 116.509 2.009 1
1 1102 . 50 1 1 A 98 98 LEU H H 97 8.304 8.322 -0.018 1
1 1103 . 50 1 1 A 98 98 LEU HA H 97 3.725 3.921 -0.196 1
1 1113 . 50 1 1 A 98 98 LEU C C 97 178.490 178.696 -0.206 1
1 1114 . 50 1 1 A 98 98 LEU CA C 97 58.517 58.148 0.369 1
1 1115 . 50 1 1 A 98 98 LEU CB C 97 41.697 41.086 0.611 1
1 1119 . 50 1 1 A 98 98 LEU N N 97 122.882 122.148 0.734 1
1 1120 . 50 1 1 A 99 99 GLN H H 98 7.639 7.942 -0.303 1
1 1121 . 50 1 1 A 99 99 GLN HA H 98 3.927 4.046 -0.119 1
1 1128 . 50 1 1 A 99 99 GLN C C 98 178.068 178.579 -0.511 1
1 1129 . 50 1 1 A 99 99 GLN CA C 98 58.735 59.169 -0.434 1
1 1130 . 50 1 1 A 99 99 GLN CB C 98 27.986 28.283 -0.297 1
1 1132 . 50 1 1 A 99 99 GLN N N 98 114.302 118.191 -3.889 1
1 1134 . 50 1 1 A 100 100 HIS H H 99 7.575 7.398 0.177 1
1 1135 . 50 1 1 A 100 100 HIS HA H 99 4.524 4.402 0.122 1
1 1139 . 50 1 1 A 100 100 HIS C C 99 174.789 177.810 -3.021 1
1 1140 . 50 1 1 A 100 100 HIS CA C 99 56.154 59.982 -3.828 1
1 1141 . 50 1 1 A 100 100 HIS CB C 99 28.946 30.530 -1.584 1
1 1143 . 50 1 1 A 100 100 HIS N N 99 114.778 118.876 -4.098 1
1 1144 . 50 1 1 A 101 101 HIS H H 100 7.773 8.060 -0.287 1
1 1145 . 50 1 1 A 101 101 HIS HA H 100 4.704 4.305 0.399 1
1 1149 . 50 1 1 A 101 101 HIS C C 100 174.818 177.302 -2.484 1
1 1150 . 50 1 1 A 101 101 HIS CA C 100 54.830 58.760 -3.930 1
1 1151 . 50 1 1 A 101 101 HIS CB C 100 29.749 28.439 1.310 1
1 1153 . 50 1 1 A 101 101 HIS N N 100 117.397 117.476 -0.079 1
1 1154 . 50 1 1 A 102 102 LYS H H 101 7.324 8.107 -0.783 1
1 1155 . 50 1 1 A 102 102 LYS HA H 101 3.611 4.089 -0.478 1
1 1164 . 50 1 1 A 102 102 LYS C C 101 176.823 178.662 -1.839 1
1 1165 . 50 1 1 A 102 102 LYS CA C 101 59.915 58.997 0.918 1
1 1166 . 50 1 1 A 102 102 LYS CB C 101 32.825 32.182 0.643 1
1 1170 . 50 1 1 A 102 102 LYS N N 101 120.533 121.956 -1.423 1
1 1171 . 50 1 1 A 103 103 ASP H H 102 8.361 7.759 0.602 1
1 1172 . 50 1 1 A 103 103 ASP HA H 102 4.421 4.507 -0.086 1
1 1175 . 50 1 1 A 103 103 ASP C C 102 176.793 176.889 -0.096 1
1 1176 . 50 1 1 A 103 103 ASP CA C 102 55.500 56.517 -1.017 1
1 1177 . 50 1 1 A 103 103 ASP CB C 102 40.178 40.654 -0.476 1
1 1178 . 50 1 1 A 103 103 ASP N N 102 114.814 117.935 -3.121 1
1 1179 . 50 1 1 A 104 104 GLU H H 103 7.858 8.274 -0.416 1
1 1180 . 50 1 1 A 104 104 GLU HA H 103 4.339 4.636 -0.297 1
1 1183 . 50 1 1 A 104 104 GLU C C 103 175.777 176.891 -1.114 1
1 1184 . 50 1 1 A 104 104 GLU CA C 103 56.356 57.774 -1.418 1
1 1185 . 50 1 1 A 104 104 GLU CB C 103 31.293 32.361 -1.068 1
1 1186 . 50 1 1 A 104 104 GLU N N 103 116.826 118.882 -2.056 1
1 1187 . 50 1 1 A 105 105 VAL H H 104 7.201 7.657 -0.456 1
1 1188 . 50 1 1 A 105 105 VAL HA H 104 4.296 4.111 0.185 1
1 1196 . 50 1 1 A 105 105 VAL C C 104 174.482 175.705 -1.223 1
1 1197 . 50 1 1 A 105 105 VAL CA C 104 60.370 63.025 -2.655 1
1 1198 . 50 1 1 A 105 105 VAL CB C 104 34.341 32.536 1.805 1
1 1201 . 50 1 1 A 105 105 VAL N N 104 116.422 119.537 -3.115 1
1 1202 . 50 1 1 A 106 106 ALA H H 105 8.487 8.461 0.026 1
1 1203 . 50 1 1 A 106 106 ALA HA H 105 4.172 4.431 -0.259 1
1 1207 . 50 1 1 A 106 106 ALA C C 105 179.030 178.854 0.176 1
1 1208 . 50 1 1 A 106 106 ALA CA C 105 52.966 52.658 0.308 1
1 1209 . 50 1 1 A 106 106 ALA CB C 105 19.371 19.588 -0.217 1
1 1210 . 50 1 1 A 106 106 ALA N N 105 128.313 128.230 0.083 1
1 1211 . 50 1 1 A 107 107 GLY H H 106 8.738 8.792 -0.054 1
1 1212 . 50 1 1 A 107 107 GLY HA2 H 106 3.773 3.866 -0.093 1
1 1213 . 50 1 1 A 107 107 GLY HA3 H 106 3.998 3.935 0.063 1
1 1214 . 50 1 1 A 107 107 GLY C C 106 174.958 175.962 -1.004 1
1 1215 . 50 1 1 A 107 107 GLY CA C 106 47.449 47.092 0.357 1
1 1216 . 50 1 1 A 107 107 GLY N N 106 110.612 110.856 -0.244 1
1 1217 . 50 1 1 A 108 108 ASP H H 107 8.535 8.446 0.089 1
1 1218 . 50 1 1 A 108 108 ASP HA H 107 4.333 4.341 -0.008 1
1 1221 . 50 1 1 A 108 108 ASP C C 107 179.133 178.385 0.748 1
1 1222 . 50 1 1 A 108 108 ASP CA C 107 56.721 56.750 -0.029 1
1 1223 . 50 1 1 A 108 108 ASP CB C 107 39.336 39.752 -0.416 1
1 1224 . 50 1 1 A 108 108 ASP N N 107 117.474 121.038 -3.564 1
1 1225 . 50 1 1 A 109 109 ILE H H 108 7.459 7.895 -0.436 1
1 1226 . 50 1 1 A 109 109 ILE HA H 108 3.688 3.814 -0.126 1
1 1236 . 50 1 1 A 109 109 ILE C C 108 176.735 178.387 -1.652 1
1 1237 . 50 1 1 A 109 109 ILE CA C 108 63.474 65.394 -1.920 1
1 1238 . 50 1 1 A 109 109 ILE CB C 108 37.340 37.583 -0.243 1
1 1242 . 50 1 1 A 109 109 ILE N N 108 119.609 121.368 -1.759 1
1 1243 . 50 1 1 A 110 110 PHE H H 109 7.920 8.337 -0.417 1
1 1244 . 50 1 1 A 110 110 PHE HA H 109 3.759 4.093 -0.334 1
1 1252 . 50 1 1 A 110 110 PHE C C 109 177.132 177.340 -0.208 1
1 1253 . 50 1 1 A 110 110 PHE CA C 109 62.766 61.318 1.448 1
1 1254 . 50 1 1 A 110 110 PHE CB C 109 39.752 39.300 0.452 1
1 1260 . 50 1 1 A 110 110 PHE N N 109 120.906 120.289 0.617 1
1 1261 . 50 1 1 A 111 111 ASP H H 110 8.639 8.278 0.361 1
1 1262 . 50 1 1 A 111 111 ASP HA H 110 4.216 4.138 0.078 1
1 1265 . 50 1 1 A 111 111 ASP C C 110 178.900 178.281 0.619 1
1 1266 . 50 1 1 A 111 111 ASP CA C 110 57.105 57.513 -0.408 1
1 1267 . 50 1 1 A 111 111 ASP CB C 110 39.697 42.198 -2.501 1
1 1268 . 50 1 1 A 111 111 ASP N N 110 117.124 118.683 -1.559 1
1 1269 . 50 1 1 A 112 112 MET H H 111 7.331 7.619 -0.288 1
1 1270 . 50 1 1 A 112 112 MET HA H 111 4.081 4.162 -0.081 1
1 1278 . 50 1 1 A 112 112 MET C C 111 179.052 178.098 0.954 1
1 1279 . 50 1 1 A 112 112 MET CA C 111 58.202 58.144 0.058 1
1 1280 . 50 1 1 A 112 112 MET CB C 111 31.827 32.334 -0.507 1
1 1283 . 50 1 1 A 112 112 MET N N 111 118.061 119.248 -1.187 1
1 1284 . 50 1 1 A 113 113 LEU H H 112 8.001 7.717 0.284 1
1 1285 . 50 1 1 A 113 113 LEU HA H 112 3.723 3.856 -0.133 1
1 1295 . 50 1 1 A 113 113 LEU C C 112 179.747 178.419 1.328 1
1 1296 . 50 1 1 A 113 113 LEU CA C 112 57.371 57.240 0.131 1
1 1297 . 50 1 1 A 113 113 LEU CB C 112 40.671 41.382 -0.711 1
1 1301 . 50 1 1 A 113 113 LEU N N 112 120.426 117.872 2.554 1
1 1302 . 50 1 1 A 114 114 LEU H H 113 7.744 8.055 -0.311 1
1 1303 . 50 1 1 A 114 114 LEU HA H 113 4.007 3.667 0.340 1
1 1313 . 50 1 1 A 114 114 LEU C C 113 179.358 178.580 0.778 1
1 1314 . 50 1 1 A 114 114 LEU CA C 113 57.202 57.585 -0.383 1
1 1315 . 50 1 1 A 114 114 LEU CB C 113 41.727 41.511 0.216 1
1 1319 . 50 1 1 A 114 114 LEU N N 113 119.584 121.020 -1.436 1
1 1320 . 50 1 1 A 115 115 THR H H 114 7.353 7.835 -0.482 1
1 1321 . 50 1 1 A 115 115 THR HA H 114 4.071 4.143 -0.072 1
1 1327 . 50 1 1 A 115 115 THR C C 114 173.591 176.569 -2.978 1
1 1328 . 50 1 1 A 115 115 THR CA C 114 65.332 64.734 0.598 1
1 1329 . 50 1 1 A 115 115 THR CB C 114 70.319 68.527 1.792 1
1 1331 . 50 1 1 A 115 115 THR N N 114 107.535 112.592 -5.057 1
1 1332 . 50 1 1 A 116 116 PHE H H 115 6.979 7.510 -0.531 1
1 1333 . 50 1 1 A 116 116 PHE HA H 115 5.022 4.327 0.695 1
1 1341 . 50 1 1 A 116 116 PHE C C 115 176.488 176.491 -0.003 1
1 1342 . 50 1 1 A 116 116 PHE CA C 115 55.911 60.964 -5.053 1
1 1343 . 50 1 1 A 116 116 PHE CB C 115 38.521 39.050 -0.529 1
1 1349 . 50 1 1 A 116 116 PHE N N 115 112.366 119.838 -7.472 1
1 1350 . 50 1 1 A 117 117 THR H H 116 7.564 7.764 -0.200 1
1 1351 . 50 1 1 A 117 117 THR HA H 116 4.626 4.792 -0.166 1
1 1356 . 50 1 1 A 117 117 THR C C 116 174.085 174.350 -0.265 1
1 1357 . 50 1 1 A 117 117 THR CA C 116 61.636 62.006 -0.370 1
1 1358 . 50 1 1 A 117 117 THR CB C 116 70.915 70.827 0.088 1
1 1360 . 50 1 1 A 117 117 THR N N 116 105.498 105.861 -0.363 1
1 1361 . 50 1 1 A 118 118 ASP H H 117 8.270 7.400 0.870 1
1 1362 . 50 1 1 A 118 118 ASP HA H 117 4.955 4.978 -0.023 1
1 1365 . 50 1 1 A 118 118 ASP C C 117 176.328 176.090 0.238 1
1 1366 . 50 1 1 A 118 118 ASP CA C 117 53.417 53.000 0.417 1
1 1367 . 50 1 1 A 118 118 ASP CB C 117 43.388 38.799 4.589 1
1 1368 . 50 1 1 A 118 118 ASP N N 117 124.409 122.010 2.399 1
1 1369 . 50 1 1 A 119 119 PHE H H 118 8.973 8.551 0.422 1
1 1370 . 50 1 1 A 119 119 PHE HA H 118 3.506 4.216 -0.710 1
1 1378 . 50 1 1 A 119 119 PHE CA C 118 61.490 61.099 0.391 1
1 1379 . 50 1 1 A 119 119 PHE CB C 118 39.246 39.502 -0.256 1
1 1385 . 50 1 1 A 119 119 PHE N N 118 126.688 125.039 1.649 1
1 1386 . 50 1 1 A 120 120 LEU H H 119 8.099 8.220 -0.121 1
1 1387 . 50 1 1 A 120 120 LEU HA H 119 3.842 3.856 -0.014 1
1 1397 . 50 1 1 A 120 120 LEU C C 119 179.601 179.407 0.194 1
1 1398 . 50 1 1 A 120 120 LEU CA C 119 58.174 57.874 0.300 1
1 1399 . 50 1 1 A 120 120 LEU CB C 119 40.315 41.129 -0.814 1
1 1403 . 50 1 1 A 120 120 LEU N N 119 117.930 119.764 -1.834 1
1 1404 . 50 1 1 A 121 121 ALA H H 120 7.729 7.579 0.150 1
1 1405 . 50 1 1 A 121 121 ALA HA H 120 3.996 4.098 -0.102 1
1 1409 . 50 1 1 A 121 121 ALA C C 120 180.995 179.546 1.449 1
1 1410 . 50 1 1 A 121 121 ALA CA C 120 54.832 54.602 0.230 1
1 1411 . 50 1 1 A 121 121 ALA CB C 120 17.706 18.232 -0.526 1
1 1412 . 50 1 1 A 121 121 ALA N N 120 123.195 121.224 1.971 1
1 1413 . 50 1 1 A 122 122 PHE H H 121 7.943 7.750 0.193 1
1 1414 . 50 1 1 A 122 122 PHE HA H 121 3.887 3.845 0.042 1
1 1419 . 50 1 1 A 122 122 PHE C C 121 175.410 176.804 -1.394 1
1 1420 . 50 1 1 A 122 122 PHE CA C 121 61.075 60.684 0.391 1
1 1421 . 50 1 1 A 122 122 PHE CB C 121 38.115 38.713 -0.598 1
1 1424 . 50 1 1 A 122 122 PHE N N 121 121.798 120.119 1.679 1
1 1425 . 50 1 1 A 123 123 LYS H H 122 8.468 7.755 0.713 1
1 1426 . 50 1 1 A 123 123 LYS HA H 122 3.077 3.505 -0.428 1
1 1435 . 50 1 1 A 123 123 LYS C C 122 178.453 178.935 -0.482 1
1 1436 . 50 1 1 A 123 123 LYS CA C 122 59.855 59.757 0.098 1
1 1437 . 50 1 1 A 123 123 LYS CB C 122 32.374 32.200 0.174 1
1 1441 . 50 1 1 A 123 123 LYS N N 122 120.614 118.272 2.342 1
1 1442 . 50 1 1 A 124 124 GLU H H 123 8.100 8.047 0.053 1
1 1443 . 50 1 1 A 124 124 GLU HA H 123 3.652 3.920 -0.268 1
1 1448 . 50 1 1 A 124 124 GLU C C 123 177.743 179.009 -1.266 1
1 1449 . 50 1 1 A 124 124 GLU CA C 123 59.406 59.602 -0.196 1
1 1450 . 50 1 1 A 124 124 GLU CB C 123 28.811 29.031 -0.220 1
1 1452 . 50 1 1 A 124 124 GLU N N 123 117.404 118.521 -1.117 1
1 1453 . 50 1 1 A 125 125 MET H H 124 7.537 7.485 0.052 1
1 1454 . 50 1 1 A 125 125 MET HA H 124 3.860 3.921 -0.061 1
1 1462 . 50 1 1 A 125 125 MET C C 124 179.522 178.331 1.191 1
1 1463 . 50 1 1 A 125 125 MET CA C 124 58.832 58.471 0.361 1
1 1464 . 50 1 1 A 125 125 MET CB C 124 31.765 31.259 0.506 1
1 1467 . 50 1 1 A 125 125 MET N N 124 119.413 119.514 -0.101 1
1 1468 . 50 1 1 A 126 126 PHE H H 125 7.148 7.466 -0.318 1
1 1469 . 50 1 1 A 126 126 PHE HA H 125 3.633 4.248 -0.615 1
1 1476 . 50 1 1 A 126 126 PHE C C 125 178.994 178.239 0.755 1
1 1477 . 50 1 1 A 126 126 PHE CA C 125 63.148 60.911 2.237 1
1 1478 . 50 1 1 A 126 126 PHE CB C 125 39.830 38.473 1.357 1
1 1483 . 50 1 1 A 126 126 PHE N N 125 120.013 118.731 1.282 1
1 1484 . 50 1 1 A 127 127 LEU H H 126 8.369 8.381 -0.012 1
1 1485 . 50 1 1 A 127 127 LEU HA H 126 3.972 4.007 -0.035 1
1 1495 . 50 1 1 A 127 127 LEU C C 126 180.621 179.259 1.362 1
1 1496 . 50 1 1 A 127 127 LEU CA C 126 57.944 57.867 0.077 1
1 1497 . 50 1 1 A 127 127 LEU CB C 126 40.543 40.965 -0.422 1
1 1501 . 50 1 1 A 127 127 LEU N N 126 119.692 119.572 0.120 1
1 1502 . 50 1 1 A 128 128 ASP H H 127 8.578 8.051 0.527 1
1 1503 . 50 1 1 A 128 128 ASP HA H 127 4.308 4.349 -0.041 1
1 1506 . 50 1 1 A 128 128 ASP C C 127 178.254 178.102 0.152 1
1 1507 . 50 1 1 A 128 128 ASP CA C 127 56.964 57.247 -0.283 1
1 1508 . 50 1 1 A 128 128 ASP CB C 127 39.735 40.951 -1.216 1
1 1509 . 50 1 1 A 128 128 ASP N N 127 121.926 119.831 2.095 1
1 1510 . 50 1 1 A 129 129 TYR H H 128 7.710 8.091 -0.381 1
1 1511 . 50 1 1 A 129 129 TYR HA H 128 3.908 4.025 -0.117 1
1 1518 . 50 1 1 A 129 129 TYR C C 128 177.633 177.570 0.063 1
1 1519 . 50 1 1 A 129 129 TYR CA C 128 61.796 61.448 0.348 1
1 1520 . 50 1 1 A 129 129 TYR CB C 128 39.372 38.523 0.849 1
1 1525 . 50 1 1 A 129 129 TYR N N 128 122.548 120.115 2.433 1
1 1526 . 50 1 1 A 130 130 ARG H H 129 8.622 8.479 0.143 1
1 1527 . 50 1 1 A 130 130 ARG HA H 129 3.722 3.840 -0.118 1
1 1535 . 50 1 1 A 130 130 ARG CA C 129 60.084 59.708 0.376 1
1 1536 . 50 1 1 A 130 130 ARG CB C 129 29.902 29.946 -0.044 1
1 1539 . 50 1 1 A 130 130 ARG N N 129 118.302 118.963 -0.661 1
1 1541 . 50 1 1 A 131 131 ALA H H 130 7.936 7.929 0.007 1
1 1542 . 50 1 1 A 131 131 ALA HA H 130 3.997 4.034 -0.037 1
1 1546 . 50 1 1 A 131 131 ALA C C 130 180.456 179.873 0.583 1
1 1547 . 50 1 1 A 131 131 ALA CA C 130 55.133 55.108 0.025 1
1 1548 . 50 1 1 A 131 131 ALA CB C 130 17.750 18.279 -0.529 1
1 1549 . 50 1 1 A 131 131 ALA N N 130 119.788 120.640 -0.852 1
1 1550 . 50 1 1 A 132 132 GLU H H 131 7.622 7.738 -0.116 1
1 1551 . 50 1 1 A 132 132 GLU HA H 131 3.862 3.953 -0.091 1
1 1556 . 50 1 1 A 132 132 GLU C C 131 179.528 178.799 0.729 1
1 1557 . 50 1 1 A 132 132 GLU CA C 131 58.849 59.031 -0.182 1
1 1558 . 50 1 1 A 132 132 GLU CB C 131 28.930 29.163 -0.233 1
1 1560 . 50 1 1 A 132 132 GLU N N 131 118.428 119.318 -0.890 1
1 1561 . 50 1 1 A 133 133 LYS H H 132 7.853 7.577 0.276 1
1 1562 . 50 1 1 A 133 133 LYS HA H 132 3.722 3.998 -0.276 1
1 1571 . 50 1 1 A 133 133 LYS C C 132 175.725 178.469 -2.744 1
1 1572 . 50 1 1 A 133 133 LYS CA C 132 57.544 59.613 -2.069 1
1 1573 . 50 1 1 A 133 133 LYS CB C 132 31.770 31.819 -0.049 1
1 1577 . 50 1 1 A 133 133 LYS N N 132 119.473 119.176 0.297 1
1 1578 . 50 1 1 A 134 134 GLU H H 133 8.151 8.249 -0.098 1
1 1579 . 50 1 1 A 134 134 GLU HA H 133 4.161 4.400 -0.239 1
1 1584 . 50 1 1 A 134 134 GLU C C 133 177.453 177.478 -0.025 1
1 1585 . 50 1 1 A 134 134 GLU CA C 133 57.222 56.871 0.351 1
1 1586 . 50 1 1 A 134 134 GLU CB C 133 30.091 30.302 -0.211 1
1 1588 . 50 1 1 A 134 134 GLU N N 133 116.525 117.442 -0.917 1
1 1589 . 50 1 1 A 135 135 GLY H H 134 7.702 8.334 -0.632 1
1 1590 . 50 1 1 A 135 135 GLY HA2 H 134 3.896 3.739 0.157 1
1 1591 . 50 1 1 A 135 135 GLY HA3 H 134 3.897 3.752 0.145 1
1 1592 . 50 1 1 A 135 135 GLY C C 134 174.538 174.899 -0.361 1
1 1593 . 50 1 1 A 135 135 GLY CA C 134 45.975 47.109 -1.134 1
1 1594 . 50 1 1 A 135 135 GLY N N 134 107.924 109.087 -1.163 1
1 1595 . 50 1 1 A 136 136 ARG H H 135 8.045 7.636 0.409 1
1 1596 . 50 1 1 A 136 136 ARG HA H 135 4.323 4.619 -0.296 1
1 1604 . 50 1 1 A 136 136 ARG C C 135 175.864 175.503 0.361 1
1 1605 . 50 1 1 A 136 136 ARG CA C 135 56.016 55.118 0.898 1
1 1606 . 50 1 1 A 136 136 ARG CB C 135 30.987 31.110 -0.123 1
1 1609 . 50 1 1 A 136 136 ARG N N 135 119.708 120.284 -0.576 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 110 0.963 1
2 1 1 1 "RMS(OBS, PRED)" CA 123 1.215 1
3 1 1 1 "RMS(OBS, PRED)" CB 120 1.136 1
4 1 1 1 "RMS(OBS, PRED)" H 120 0.516 1
5 1 1 1 "RMS(OBS, PRED)" HA 125 0.356 1
6 1 1 1 "RMS(OBS, PRED)" N 120 2.577 1
7 1 2 1 "RMS(OBS, PRED)" C 110 0.975 1
8 1 2 1 "RMS(OBS, PRED)" CA 123 1.217 1
9 1 2 1 "RMS(OBS, PRED)" CB 120 1.168 1
10 1 2 1 "RMS(OBS, PRED)" H 120 0.515 1
11 1 2 1 "RMS(OBS, PRED)" HA 125 0.330 1
12 1 2 1 "RMS(OBS, PRED)" N 120 2.612 1
13 1 3 1 "RMS(OBS, PRED)" C 110 0.948 1
14 1 3 1 "RMS(OBS, PRED)" CA 123 1.170 1
15 1 3 1 "RMS(OBS, PRED)" CB 120 1.187 1
16 1 3 1 "RMS(OBS, PRED)" H 120 0.500 1
17 1 3 1 "RMS(OBS, PRED)" HA 125 0.334 1
18 1 3 1 "RMS(OBS, PRED)" N 120 2.612 1
19 1 4 1 "RMS(OBS, PRED)" C 110 0.917 1
20 1 4 1 "RMS(OBS, PRED)" CA 123 1.279 1
21 1 4 1 "RMS(OBS, PRED)" CB 120 1.291 1
22 1 4 1 "RMS(OBS, PRED)" H 120 0.491 1
23 1 4 1 "RMS(OBS, PRED)" HA 125 0.320 1
24 1 4 1 "RMS(OBS, PRED)" N 120 2.552 1
25 1 5 1 "RMS(OBS, PRED)" C 110 0.974 1
26 1 5 1 "RMS(OBS, PRED)" CA 123 1.271 1
27 1 5 1 "RMS(OBS, PRED)" CB 120 1.119 1
28 1 5 1 "RMS(OBS, PRED)" H 120 0.522 1
29 1 5 1 "RMS(OBS, PRED)" HA 125 0.327 1
30 1 5 1 "RMS(OBS, PRED)" N 120 2.538 1
31 1 6 1 "RMS(OBS, PRED)" C 110 0.969 1
32 1 6 1 "RMS(OBS, PRED)" CA 123 1.284 1
33 1 6 1 "RMS(OBS, PRED)" CB 120 1.283 1
34 1 6 1 "RMS(OBS, PRED)" H 120 0.468 1
35 1 6 1 "RMS(OBS, PRED)" HA 125 0.329 1
36 1 6 1 "RMS(OBS, PRED)" N 120 2.783 1
37 1 7 1 "RMS(OBS, PRED)" C 110 0.983 1
38 1 7 1 "RMS(OBS, PRED)" CA 123 1.194 1
39 1 7 1 "RMS(OBS, PRED)" CB 120 1.093 1
40 1 7 1 "RMS(OBS, PRED)" H 120 0.512 1
41 1 7 1 "RMS(OBS, PRED)" HA 125 0.322 1
42 1 7 1 "RMS(OBS, PRED)" N 120 2.453 1
43 1 8 1 "RMS(OBS, PRED)" C 110 0.966 1
44 1 8 1 "RMS(OBS, PRED)" CA 123 1.250 1
45 1 8 1 "RMS(OBS, PRED)" CB 120 1.231 1
46 1 8 1 "RMS(OBS, PRED)" H 120 0.539 1
47 1 8 1 "RMS(OBS, PRED)" HA 125 0.318 1
48 1 8 1 "RMS(OBS, PRED)" N 120 2.577 1
49 1 9 1 "RMS(OBS, PRED)" C 110 0.978 1
50 1 9 1 "RMS(OBS, PRED)" CA 123 1.271 1
51 1 9 1 "RMS(OBS, PRED)" CB 120 1.243 1
52 1 9 1 "RMS(OBS, PRED)" H 120 0.486 1
53 1 9 1 "RMS(OBS, PRED)" HA 125 0.333 1
54 1 9 1 "RMS(OBS, PRED)" N 120 2.408 1
55 1 10 1 "RMS(OBS, PRED)" C 110 0.925 1
56 1 10 1 "RMS(OBS, PRED)" CA 123 1.164 1
57 1 10 1 "RMS(OBS, PRED)" CB 120 1.190 1
58 1 10 1 "RMS(OBS, PRED)" H 120 0.508 1
59 1 10 1 "RMS(OBS, PRED)" HA 125 0.343 1
60 1 10 1 "RMS(OBS, PRED)" N 120 2.569 1
61 1 11 1 "RMS(OBS, PRED)" C 110 0.938 1
62 1 11 1 "RMS(OBS, PRED)" CA 123 1.249 1
63 1 11 1 "RMS(OBS, PRED)" CB 120 1.103 1
64 1 11 1 "RMS(OBS, PRED)" H 120 0.548 1
65 1 11 1 "RMS(OBS, PRED)" HA 125 0.320 1
66 1 11 1 "RMS(OBS, PRED)" N 120 2.587 1
67 1 12 1 "RMS(OBS, PRED)" C 110 0.973 1
68 1 12 1 "RMS(OBS, PRED)" CA 123 1.242 1
69 1 12 1 "RMS(OBS, PRED)" CB 120 1.196 1
70 1 12 1 "RMS(OBS, PRED)" H 120 0.553 1
71 1 12 1 "RMS(OBS, PRED)" HA 125 0.335 1
72 1 12 1 "RMS(OBS, PRED)" N 120 2.638 1
73 1 13 1 "RMS(OBS, PRED)" C 110 0.950 1
74 1 13 1 "RMS(OBS, PRED)" CA 123 1.255 1
75 1 13 1 "RMS(OBS, PRED)" CB 120 1.194 1
76 1 13 1 "RMS(OBS, PRED)" H 120 0.508 1
77 1 13 1 "RMS(OBS, PRED)" HA 125 0.330 1
78 1 13 1 "RMS(OBS, PRED)" N 120 2.645 1
79 1 14 1 "RMS(OBS, PRED)" C 110 0.895 1
80 1 14 1 "RMS(OBS, PRED)" CA 123 1.174 1
81 1 14 1 "RMS(OBS, PRED)" CB 120 1.166 1
82 1 14 1 "RMS(OBS, PRED)" H 120 0.540 1
83 1 14 1 "RMS(OBS, PRED)" HA 125 0.327 1
84 1 14 1 "RMS(OBS, PRED)" N 120 2.596 1
85 1 15 1 "RMS(OBS, PRED)" C 110 0.939 1
86 1 15 1 "RMS(OBS, PRED)" CA 123 1.200 1
87 1 15 1 "RMS(OBS, PRED)" CB 120 1.153 1
88 1 15 1 "RMS(OBS, PRED)" H 120 0.503 1
89 1 15 1 "RMS(OBS, PRED)" HA 125 0.319 1
90 1 15 1 "RMS(OBS, PRED)" N 120 2.578 1
91 1 16 1 "RMS(OBS, PRED)" C 110 0.947 1
92 1 16 1 "RMS(OBS, PRED)" CA 123 1.194 1
93 1 16 1 "RMS(OBS, PRED)" CB 120 1.131 1
94 1 16 1 "RMS(OBS, PRED)" H 120 0.526 1
95 1 16 1 "RMS(OBS, PRED)" HA 125 0.310 1
96 1 16 1 "RMS(OBS, PRED)" N 120 2.715 1
97 1 17 1 "RMS(OBS, PRED)" C 110 0.987 1
98 1 17 1 "RMS(OBS, PRED)" CA 123 1.268 1
99 1 17 1 "RMS(OBS, PRED)" CB 120 1.158 1
100 1 17 1 "RMS(OBS, PRED)" H 120 0.503 1
101 1 17 1 "RMS(OBS, PRED)" HA 125 0.321 1
102 1 17 1 "RMS(OBS, PRED)" N 120 2.517 1
103 1 18 1 "RMS(OBS, PRED)" C 110 0.955 1
104 1 18 1 "RMS(OBS, PRED)" CA 123 1.238 1
105 1 18 1 "RMS(OBS, PRED)" CB 120 1.083 1
106 1 18 1 "RMS(OBS, PRED)" H 120 0.553 1
107 1 18 1 "RMS(OBS, PRED)" HA 125 0.327 1
108 1 18 1 "RMS(OBS, PRED)" N 120 2.574 1
109 1 19 1 "RMS(OBS, PRED)" C 110 1.008 1
110 1 19 1 "RMS(OBS, PRED)" CA 123 1.289 1
111 1 19 1 "RMS(OBS, PRED)" CB 120 1.145 1
112 1 19 1 "RMS(OBS, PRED)" H 120 0.530 1
113 1 19 1 "RMS(OBS, PRED)" HA 125 0.335 1
114 1 19 1 "RMS(OBS, PRED)" N 120 2.584 1
115 1 20 1 "RMS(OBS, PRED)" C 110 1.003 1
116 1 20 1 "RMS(OBS, PRED)" CA 123 1.242 1
117 1 20 1 "RMS(OBS, PRED)" CB 120 1.203 1
118 1 20 1 "RMS(OBS, PRED)" H 120 0.502 1
119 1 20 1 "RMS(OBS, PRED)" HA 125 0.359 1
120 1 20 1 "RMS(OBS, PRED)" N 120 2.466 1
121 1 21 1 "RMS(OBS, PRED)" C 110 0.959 1
122 1 21 1 "RMS(OBS, PRED)" CA 123 1.245 1
123 1 21 1 "RMS(OBS, PRED)" CB 120 1.237 1
124 1 21 1 "RMS(OBS, PRED)" H 120 0.516 1
125 1 21 1 "RMS(OBS, PRED)" HA 125 0.356 1
126 1 21 1 "RMS(OBS, PRED)" N 120 2.499 1
127 1 22 1 "RMS(OBS, PRED)" C 110 0.967 1
128 1 22 1 "RMS(OBS, PRED)" CA 123 1.251 1
129 1 22 1 "RMS(OBS, PRED)" CB 120 1.189 1
130 1 22 1 "RMS(OBS, PRED)" H 120 0.495 1
131 1 22 1 "RMS(OBS, PRED)" HA 125 0.325 1
132 1 22 1 "RMS(OBS, PRED)" N 120 2.490 1
133 1 23 1 "RMS(OBS, PRED)" C 110 0.947 1
134 1 23 1 "RMS(OBS, PRED)" CA 123 1.174 1
135 1 23 1 "RMS(OBS, PRED)" CB 120 1.180 1
136 1 23 1 "RMS(OBS, PRED)" H 120 0.492 1
137 1 23 1 "RMS(OBS, PRED)" HA 125 0.339 1
138 1 23 1 "RMS(OBS, PRED)" N 120 2.526 1
139 1 24 1 "RMS(OBS, PRED)" C 110 0.987 1
140 1 24 1 "RMS(OBS, PRED)" CA 123 1.285 1
141 1 24 1 "RMS(OBS, PRED)" CB 120 1.188 1
142 1 24 1 "RMS(OBS, PRED)" H 120 0.526 1
143 1 24 1 "RMS(OBS, PRED)" HA 125 0.312 1
144 1 24 1 "RMS(OBS, PRED)" N 120 2.501 1
145 1 25 1 "RMS(OBS, PRED)" C 110 0.983 1
146 1 25 1 "RMS(OBS, PRED)" CA 123 1.264 1
147 1 25 1 "RMS(OBS, PRED)" CB 120 1.179 1
148 1 25 1 "RMS(OBS, PRED)" H 120 0.528 1
149 1 25 1 "RMS(OBS, PRED)" HA 125 0.342 1
150 1 25 1 "RMS(OBS, PRED)" N 120 2.637 1
151 1 26 1 "RMS(OBS, PRED)" C 110 0.951 1
152 1 26 1 "RMS(OBS, PRED)" CA 123 1.227 1
153 1 26 1 "RMS(OBS, PRED)" CB 120 1.170 1
154 1 26 1 "RMS(OBS, PRED)" H 120 0.498 1
155 1 26 1 "RMS(OBS, PRED)" HA 125 0.330 1
156 1 26 1 "RMS(OBS, PRED)" N 120 2.450 1
157 1 27 1 "RMS(OBS, PRED)" C 110 1.001 1
158 1 27 1 "RMS(OBS, PRED)" CA 123 1.160 1
159 1 27 1 "RMS(OBS, PRED)" CB 120 1.126 1
160 1 27 1 "RMS(OBS, PRED)" H 120 0.491 1
161 1 27 1 "RMS(OBS, PRED)" HA 125 0.351 1
162 1 27 1 "RMS(OBS, PRED)" N 120 2.537 1
163 1 28 1 "RMS(OBS, PRED)" C 110 0.980 1
164 1 28 1 "RMS(OBS, PRED)" CA 123 1.202 1
165 1 28 1 "RMS(OBS, PRED)" CB 120 1.171 1
166 1 28 1 "RMS(OBS, PRED)" H 120 0.491 1
167 1 28 1 "RMS(OBS, PRED)" HA 125 0.331 1
168 1 28 1 "RMS(OBS, PRED)" N 120 2.691 1
169 1 29 1 "RMS(OBS, PRED)" C 110 0.951 1
170 1 29 1 "RMS(OBS, PRED)" CA 123 1.213 1
171 1 29 1 "RMS(OBS, PRED)" CB 120 1.095 1
172 1 29 1 "RMS(OBS, PRED)" H 120 0.502 1
173 1 29 1 "RMS(OBS, PRED)" HA 125 0.323 1
174 1 29 1 "RMS(OBS, PRED)" N 120 2.492 1
175 1 30 1 "RMS(OBS, PRED)" C 110 0.978 1
176 1 30 1 "RMS(OBS, PRED)" CA 123 1.268 1
177 1 30 1 "RMS(OBS, PRED)" CB 120 1.119 1
178 1 30 1 "RMS(OBS, PRED)" H 120 0.533 1
179 1 30 1 "RMS(OBS, PRED)" HA 125 0.327 1
180 1 30 1 "RMS(OBS, PRED)" N 120 2.564 1
181 1 31 1 "RMS(OBS, PRED)" C 110 0.958 1
182 1 31 1 "RMS(OBS, PRED)" CA 123 1.185 1
183 1 31 1 "RMS(OBS, PRED)" CB 120 1.148 1
184 1 31 1 "RMS(OBS, PRED)" H 120 0.532 1
185 1 31 1 "RMS(OBS, PRED)" HA 125 0.322 1
186 1 31 1 "RMS(OBS, PRED)" N 120 2.523 1
187 1 32 1 "RMS(OBS, PRED)" C 110 0.981 1
188 1 32 1 "RMS(OBS, PRED)" CA 123 1.163 1
189 1 32 1 "RMS(OBS, PRED)" CB 120 1.129 1
190 1 32 1 "RMS(OBS, PRED)" H 120 0.496 1
191 1 32 1 "RMS(OBS, PRED)" HA 125 0.344 1
192 1 32 1 "RMS(OBS, PRED)" N 120 2.389 1
193 1 33 1 "RMS(OBS, PRED)" C 110 0.945 1
194 1 33 1 "RMS(OBS, PRED)" CA 123 1.194 1
195 1 33 1 "RMS(OBS, PRED)" CB 120 1.069 1
196 1 33 1 "RMS(OBS, PRED)" H 120 0.524 1
197 1 33 1 "RMS(OBS, PRED)" HA 125 0.313 1
198 1 33 1 "RMS(OBS, PRED)" N 120 2.373 1
199 1 34 1 "RMS(OBS, PRED)" C 110 0.931 1
200 1 34 1 "RMS(OBS, PRED)" CA 123 1.212 1
201 1 34 1 "RMS(OBS, PRED)" CB 120 1.133 1
202 1 34 1 "RMS(OBS, PRED)" H 120 0.551 1
203 1 34 1 "RMS(OBS, PRED)" HA 125 0.329 1
204 1 34 1 "RMS(OBS, PRED)" N 120 2.531 1
205 1 35 1 "RMS(OBS, PRED)" C 110 1.011 1
206 1 35 1 "RMS(OBS, PRED)" CA 123 1.240 1
207 1 35 1 "RMS(OBS, PRED)" CB 120 1.112 1
208 1 35 1 "RMS(OBS, PRED)" H 120 0.523 1
209 1 35 1 "RMS(OBS, PRED)" HA 125 0.316 1
210 1 35 1 "RMS(OBS, PRED)" N 120 2.675 1
211 1 36 1 "RMS(OBS, PRED)" C 110 0.969 1
212 1 36 1 "RMS(OBS, PRED)" CA 123 1.266 1
213 1 36 1 "RMS(OBS, PRED)" CB 120 1.149 1
214 1 36 1 "RMS(OBS, PRED)" H 120 0.515 1
215 1 36 1 "RMS(OBS, PRED)" HA 125 0.319 1
216 1 36 1 "RMS(OBS, PRED)" N 120 2.392 1
217 1 37 1 "RMS(OBS, PRED)" C 110 0.970 1
218 1 37 1 "RMS(OBS, PRED)" CA 123 1.270 1
219 1 37 1 "RMS(OBS, PRED)" CB 120 1.095 1
220 1 37 1 "RMS(OBS, PRED)" H 120 0.508 1
221 1 37 1 "RMS(OBS, PRED)" HA 125 0.315 1
222 1 37 1 "RMS(OBS, PRED)" N 120 2.474 1
223 1 38 1 "RMS(OBS, PRED)" C 110 0.979 1
224 1 38 1 "RMS(OBS, PRED)" CA 123 1.232 1
225 1 38 1 "RMS(OBS, PRED)" CB 120 1.304 1
226 1 38 1 "RMS(OBS, PRED)" H 120 0.528 1
227 1 38 1 "RMS(OBS, PRED)" HA 125 0.344 1
228 1 38 1 "RMS(OBS, PRED)" N 120 2.520 1
229 1 39 1 "RMS(OBS, PRED)" C 110 0.893 1
230 1 39 1 "RMS(OBS, PRED)" CA 123 1.197 1
231 1 39 1 "RMS(OBS, PRED)" CB 120 1.196 1
232 1 39 1 "RMS(OBS, PRED)" H 120 0.520 1
233 1 39 1 "RMS(OBS, PRED)" HA 125 0.338 1
234 1 39 1 "RMS(OBS, PRED)" N 120 2.517 1
235 1 40 1 "RMS(OBS, PRED)" C 110 0.949 1
236 1 40 1 "RMS(OBS, PRED)" CA 123 1.234 1
237 1 40 1 "RMS(OBS, PRED)" CB 120 1.122 1
238 1 40 1 "RMS(OBS, PRED)" H 120 0.516 1
239 1 40 1 "RMS(OBS, PRED)" HA 125 0.333 1
240 1 40 1 "RMS(OBS, PRED)" N 120 2.578 1
241 1 41 1 "RMS(OBS, PRED)" C 110 0.946 1
242 1 41 1 "RMS(OBS, PRED)" CA 123 1.223 1
243 1 41 1 "RMS(OBS, PRED)" CB 120 1.122 1
244 1 41 1 "RMS(OBS, PRED)" H 120 0.517 1
245 1 41 1 "RMS(OBS, PRED)" HA 125 0.334 1
246 1 41 1 "RMS(OBS, PRED)" N 120 2.692 1
247 1 42 1 "RMS(OBS, PRED)" C 110 0.946 1
248 1 42 1 "RMS(OBS, PRED)" CA 123 1.214 1
249 1 42 1 "RMS(OBS, PRED)" CB 120 1.111 1
250 1 42 1 "RMS(OBS, PRED)" H 120 0.505 1
251 1 42 1 "RMS(OBS, PRED)" HA 125 0.318 1
252 1 42 1 "RMS(OBS, PRED)" N 120 2.414 1
253 1 43 1 "RMS(OBS, PRED)" C 110 0.941 1
254 1 43 1 "RMS(OBS, PRED)" CA 123 1.237 1
255 1 43 1 "RMS(OBS, PRED)" CB 120 1.154 1
256 1 43 1 "RMS(OBS, PRED)" H 120 0.500 1
257 1 43 1 "RMS(OBS, PRED)" HA 125 0.337 1
258 1 43 1 "RMS(OBS, PRED)" N 120 2.439 1
259 1 44 1 "RMS(OBS, PRED)" C 110 0.980 1
260 1 44 1 "RMS(OBS, PRED)" CA 123 1.273 1
261 1 44 1 "RMS(OBS, PRED)" CB 120 1.106 1
262 1 44 1 "RMS(OBS, PRED)" H 120 0.546 1
263 1 44 1 "RMS(OBS, PRED)" HA 125 0.337 1
264 1 44 1 "RMS(OBS, PRED)" N 120 2.501 1
265 1 45 1 "RMS(OBS, PRED)" C 110 0.956 1
266 1 45 1 "RMS(OBS, PRED)" CA 123 1.185 1
267 1 45 1 "RMS(OBS, PRED)" CB 120 1.219 1
268 1 45 1 "RMS(OBS, PRED)" H 120 0.489 1
269 1 45 1 "RMS(OBS, PRED)" HA 125 0.346 1
270 1 45 1 "RMS(OBS, PRED)" N 120 2.553 1
271 1 46 1 "RMS(OBS, PRED)" C 110 0.938 1
272 1 46 1 "RMS(OBS, PRED)" CA 123 1.280 1
273 1 46 1 "RMS(OBS, PRED)" CB 120 1.129 1
274 1 46 1 "RMS(OBS, PRED)" H 120 0.505 1
275 1 46 1 "RMS(OBS, PRED)" HA 125 0.320 1
276 1 46 1 "RMS(OBS, PRED)" N 120 2.636 1
277 1 47 1 "RMS(OBS, PRED)" C 110 0.918 1
278 1 47 1 "RMS(OBS, PRED)" CA 123 1.178 1
279 1 47 1 "RMS(OBS, PRED)" CB 120 1.095 1
280 1 47 1 "RMS(OBS, PRED)" H 120 0.507 1
281 1 47 1 "RMS(OBS, PRED)" HA 125 0.330 1
282 1 47 1 "RMS(OBS, PRED)" N 120 2.652 1
283 1 48 1 "RMS(OBS, PRED)" C 110 0.943 1
284 1 48 1 "RMS(OBS, PRED)" CA 123 1.216 1
285 1 48 1 "RMS(OBS, PRED)" CB 120 1.177 1
286 1 48 1 "RMS(OBS, PRED)" H 120 0.521 1
287 1 48 1 "RMS(OBS, PRED)" HA 125 0.343 1
288 1 48 1 "RMS(OBS, PRED)" N 120 2.497 1
289 1 49 1 "RMS(OBS, PRED)" C 110 0.938 1
290 1 49 1 "RMS(OBS, PRED)" CA 123 1.227 1
291 1 49 1 "RMS(OBS, PRED)" CB 120 1.077 1
292 1 49 1 "RMS(OBS, PRED)" H 120 0.524 1
293 1 49 1 "RMS(OBS, PRED)" HA 125 0.335 1
294 1 49 1 "RMS(OBS, PRED)" N 120 2.488 1
295 1 50 1 "RMS(OBS, PRED)" C 110 0.958 1
296 1 50 1 "RMS(OBS, PRED)" CA 123 1.230 1
297 1 50 1 "RMS(OBS, PRED)" CB 120 1.073 1
298 1 50 1 "RMS(OBS, PRED)" H 120 0.528 1
299 1 50 1 "RMS(OBS, PRED)" HA 125 0.321 1
300 1 50 1 "RMS(OBS, PRED)" N 120 2.519 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 14 14 PHE CA C 13 58.199 58.153 0.046 2
1 2 . 1 1 A 14 14 PHE CB C 13 39.717 40.053 -0.336 2
1 3 . 1 1 A 15 15 SER H H 14 8.299 8.383 -0.084 2
1 4 . 1 1 A 15 15 SER HA H 14 4.359 4.716 -0.357 2
1 7 . 1 1 A 15 15 SER CA C 14 58.249 58.053 0.196 2
1 8 . 1 1 A 15 15 SER CB C 14 63.936 64.702 -0.766 2
1 9 . 1 1 A 15 15 SER N N 14 117.379 116.649 0.730 2
1 10 . 1 1 A 16 16 SER H H 15 8.255 8.600 -0.345 2
1 11 . 1 1 A 16 16 SER HA H 15 3.729 4.613 -0.884 2
1 14 . 1 1 A 16 16 SER CA C 15 58.224 59.403 -1.179 2
1 15 . 1 1 A 16 16 SER CB C 15 63.886 64.349 -0.463 2
1 16 . 1 1 A 16 16 SER N N 15 117.694 117.524 0.170 2
1 17 . 1 1 A 17 17 ALA H H 16 8.333 8.240 0.093 2
1 18 . 1 1 A 17 17 ALA HA H 16 4.252 4.237 0.015 2
1 22 . 1 1 A 17 17 ALA CA C 16 53.377 54.441 -1.065 2
1 23 . 1 1 A 17 17 ALA CB C 16 18.896 18.489 0.407 2
1 24 . 1 1 A 17 17 ALA N N 16 125.462 124.468 0.994 2
1 25 . 1 1 A 18 18 SER H H 17 8.219 7.964 0.255 2
1 26 . 1 1 A 18 18 SER HA H 17 4.332 4.512 -0.180 2
1 29 . 1 1 A 18 18 SER CA C 17 59.105 58.683 0.422 2
1 30 . 1 1 A 18 18 SER CB C 17 63.592 63.802 -0.210 2
1 31 . 1 1 A 18 18 SER N N 17 114.821 111.882 2.939 2
1 32 . 1 1 A 19 19 ASP H H 18 8.309 8.035 0.274 2
1 33 . 1 1 A 19 19 ASP HA H 18 4.554 4.902 -0.348 2
1 36 . 1 1 A 19 19 ASP C C 18 176.528 176.833 -0.305 2
1 37 . 1 1 A 19 19 ASP CA C 18 55.272 54.155 1.117 2
1 38 . 1 1 A 19 19 ASP CB C 18 40.883 42.529 -1.646 2
1 39 . 1 1 A 19 19 ASP N N 18 123.367 120.941 2.426 2
1 40 . 1 1 A 20 20 ALA H H 19 8.133 8.618 -0.485 2
1 41 . 1 1 A 20 20 ALA HA H 19 4.170 4.087 0.083 2
1 45 . 1 1 A 20 20 ALA C C 19 179.857 179.318 0.539 2
1 46 . 1 1 A 20 20 ALA CA C 19 54.341 55.321 -0.980 2
1 47 . 1 1 A 20 20 ALA CB C 19 18.660 18.439 0.221 2
1 48 . 1 1 A 20 20 ALA N N 19 123.350 123.699 -0.349 2
1 49 . 1 1 A 21 21 GLU H H 20 8.140 8.103 0.037 2
1 50 . 1 1 A 21 21 GLU HA H 20 4.128 4.095 0.033 2
1 55 . 1 1 A 21 21 GLU C C 20 177.675 178.655 -0.980 2
1 56 . 1 1 A 21 21 GLU CA C 20 58.520 59.464 -0.944 2
1 57 . 1 1 A 21 21 GLU CB C 20 29.765 29.540 0.225 2
1 59 . 1 1 A 21 21 GLU N N 20 119.063 119.185 -0.122 2
1 60 . 1 1 A 22 22 PHE H H 21 8.009 8.028 -0.019 2
1 61 . 1 1 A 22 22 PHE HA H 21 4.123 4.330 -0.207 2
1 68 . 1 1 A 22 22 PHE C C 21 176.410 177.246 -0.836 2
1 69 . 1 1 A 22 22 PHE CA C 21 62.202 61.319 0.883 2
1 70 . 1 1 A 22 22 PHE CB C 21 39.223 39.202 0.021 2
1 75 . 1 1 A 22 22 PHE N N 21 121.211 121.001 0.210 2
1 76 . 1 1 A 23 23 ASP H H 22 8.261 8.425 -0.164 2
1 77 . 1 1 A 23 23 ASP HA H 22 4.041 4.391 -0.350 2
1 80 . 1 1 A 23 23 ASP C C 22 179.078 178.387 0.691 2
1 81 . 1 1 A 23 23 ASP CA C 22 57.048 57.586 -0.538 2
1 82 . 1 1 A 23 23 ASP CB C 22 40.154 41.079 -0.925 2
1 83 . 1 1 A 23 23 ASP N N 22 116.876 118.887 -2.011 2
1 84 . 1 1 A 24 24 ALA H H 23 7.651 7.648 0.003 2
1 85 . 1 1 A 24 24 ALA HA H 23 3.785 3.880 -0.095 2
1 89 . 1 1 A 24 24 ALA C C 23 179.577 179.675 -0.098 2
1 90 . 1 1 A 24 24 ALA CA C 23 54.341 55.111 -0.770 2
1 91 . 1 1 A 24 24 ALA CB C 23 17.762 18.244 -0.482 2
1 92 . 1 1 A 24 24 ALA N N 23 121.873 121.906 -0.033 2
1 93 . 1 1 A 25 25 VAL H H 24 7.718 7.879 -0.161 2
1 94 . 1 1 A 25 25 VAL HA H 24 3.216 3.581 -0.365 2
1 102 . 1 1 A 25 25 VAL C C 24 177.805 178.213 -0.408 2
1 103 . 1 1 A 25 25 VAL CA C 24 66.789 66.732 0.057 2
1 104 . 1 1 A 25 25 VAL CB C 24 31.277 31.253 0.024 2
1 107 . 1 1 A 25 25 VAL N N 24 117.890 118.328 -0.438 2
1 108 . 1 1 A 26 26 VAL H H 25 7.867 7.744 0.123 2
1 109 . 1 1 A 26 26 VAL HA H 25 3.274 3.548 -0.274 2
1 117 . 1 1 A 26 26 VAL C C 25 177.788 177.817 -0.029 2
1 118 . 1 1 A 26 26 VAL CA C 25 67.282 66.305 0.977 2
1 119 . 1 1 A 26 26 VAL CB C 25 31.266 31.376 -0.110 2
1 122 . 1 1 A 26 26 VAL N N 25 118.170 120.024 -1.854 2
1 123 . 1 1 A 27 27 GLY H H 26 7.544 7.659 -0.115 2
1 124 . 1 1 A 27 27 GLY HA2 H 26 3.592 3.498 0.094 2
1 125 . 1 1 A 27 27 GLY HA3 H 26 3.721 3.619 0.102 2
1 126 . 1 1 A 27 27 GLY C C 26 176.717 176.407 0.310 2
1 127 . 1 1 A 27 27 GLY CA C 26 47.085 47.196 -0.111 2
1 128 . 1 1 A 27 27 GLY N N 26 105.795 107.655 -1.860 2
1 129 . 1 1 A 28 28 TYR H H 27 7.625 7.387 0.238 2
1 130 . 1 1 A 28 28 TYR HA H 27 4.546 4.580 -0.034 2
1 137 . 1 1 A 28 28 TYR C C 27 178.991 178.205 0.786 2
1 138 . 1 1 A 28 28 TYR CA C 27 58.845 59.751 -0.906 2
1 139 . 1 1 A 28 28 TYR CB C 27 37.602 37.563 0.039 2
1 144 . 1 1 A 28 28 TYR N N 27 119.933 121.757 -1.824 2
1 145 . 1 1 A 29 29 LEU H H 28 8.517 8.271 0.246 2
1 146 . 1 1 A 29 29 LEU HA H 28 3.728 3.830 -0.102 2
1 156 . 1 1 A 29 29 LEU CA C 28 58.281 58.026 0.255 2
1 157 . 1 1 A 29 29 LEU CB C 28 41.948 41.396 0.552 2
1 161 . 1 1 A 29 29 LEU N N 28 119.669 120.390 -0.721 2
1 162 . 1 1 A 30 30 GLU H H 29 8.072 7.994 0.078 2
1 163 . 1 1 A 30 30 GLU HA H 29 3.722 3.881 -0.159 2
1 168 . 1 1 A 30 30 GLU C C 29 177.731 179.044 -1.313 2
1 169 . 1 1 A 30 30 GLU CA C 29 59.763 59.931 -0.168 2
1 170 . 1 1 A 30 30 GLU CB C 29 28.844 29.286 -0.442 2
1 172 . 1 1 A 30 30 GLU N N 29 117.666 117.755 -0.089 2
1 173 . 1 1 A 31 31 ASP H H 30 7.243 7.911 -0.668 2
1 174 . 1 1 A 31 31 ASP HA H 30 4.297 4.385 -0.088 2
1 177 . 1 1 A 31 31 ASP CA C 30 56.953 57.298 -0.345 2
1 178 . 1 1 A 31 31 ASP CB C 30 40.730 41.496 -0.766 2
1 179 . 1 1 A 31 31 ASP N N 30 116.720 119.257 -2.537 2
1 180 . 1 1 A 32 32 ILE H H 31 7.940 7.486 0.454 2
1 181 . 1 1 A 32 32 ILE HA H 31 3.640 3.706 -0.066 2
1 191 . 1 1 A 32 32 ILE C C 31 177.980 178.137 -0.157 2
1 192 . 1 1 A 32 32 ILE CA C 31 64.692 64.248 0.444 2
1 193 . 1 1 A 32 32 ILE CB C 31 38.938 37.185 1.753 2
1 197 . 1 1 A 32 32 ILE N N 31 119.728 119.134 0.594 2
1 198 . 1 1 A 33 33 ILE H H 32 7.984 7.808 0.176 2
1 199 . 1 1 A 33 33 ILE HA H 32 3.598 3.102 0.496 2
1 209 . 1 1 A 33 33 ILE C C 32 176.723 176.970 -0.247 2
1 210 . 1 1 A 33 33 ILE CA C 32 63.241 64.529 -1.288 2
1 211 . 1 1 A 33 33 ILE CB C 32 37.580 37.758 -0.178 2
1 215 . 1 1 A 33 33 ILE N N 32 113.919 120.773 -6.854 2
1 216 . 1 1 A 34 34 MET H H 33 7.288 7.668 -0.380 2
1 217 . 1 1 A 34 34 MET HA H 33 4.496 4.663 -0.167 2
1 225 . 1 1 A 34 34 MET C C 33 176.423 175.774 0.649 2
1 226 . 1 1 A 34 34 MET CA C 33 54.634 54.385 0.249 2
1 227 . 1 1 A 34 34 MET CB C 33 31.934 31.773 0.161 2
1 230 . 1 1 A 34 34 MET N N 33 115.130 116.892 -1.762 2
1 231 . 1 1 A 35 35 ASP H H 34 7.405 7.630 -0.225 2
1 232 . 1 1 A 35 35 ASP HA H 34 4.484 4.574 -0.090 2
1 235 . 1 1 A 35 35 ASP C C 34 177.139 176.675 0.464 2
1 236 . 1 1 A 35 35 ASP CA C 34 54.625 54.616 0.009 2
1 237 . 1 1 A 35 35 ASP CB C 34 43.554 42.764 0.790 2
1 238 . 1 1 A 35 35 ASP N N 34 121.814 122.252 -0.438 2
1 239 . 1 1 A 36 36 ASP H H 35 8.765 8.974 -0.209 2
1 240 . 1 1 A 36 36 ASP HA H 35 4.235 4.296 -0.061 2
1 243 . 1 1 A 36 36 ASP C C 35 178.320 178.262 0.058 2
1 244 . 1 1 A 36 36 ASP CA C 35 57.832 58.015 -0.183 2
1 245 . 1 1 A 36 36 ASP CB C 35 40.914 40.584 0.330 2
1 246 . 1 1 A 36 36 ASP N N 35 125.883 126.328 -0.445 2
1 247 . 1 1 A 37 37 GLU H H 36 8.905 8.196 0.709 2
1 248 . 1 1 A 37 37 GLU HA H 36 3.933 4.093 -0.160 2
1 253 . 1 1 A 37 37 GLU C C 36 179.304 179.063 0.241 2
1 254 . 1 1 A 37 37 GLU CA C 36 59.828 59.145 0.683 2
1 255 . 1 1 A 37 37 GLU CB C 36 29.380 29.353 0.027 2
1 257 . 1 1 A 37 37 GLU N N 36 119.077 119.697 -0.620 2
1 258 . 1 1 A 38 38 PHE H H 37 7.460 8.270 -0.810 2
1 259 . 1 1 A 38 38 PHE HA H 37 3.642 4.022 -0.380 2
1 267 . 1 1 A 38 38 PHE C C 37 176.483 177.947 -1.464 2
1 268 . 1 1 A 38 38 PHE CA C 37 61.411 61.147 0.264 2
1 269 . 1 1 A 38 38 PHE CB C 37 39.355 39.084 0.271 2
1 275 . 1 1 A 38 38 PHE N N 37 119.968 121.174 -1.206 2
1 276 . 1 1 A 39 39 GLN H H 38 7.968 8.061 -0.093 2
1 277 . 1 1 A 39 39 GLN HA H 38 3.712 3.820 -0.108 2
1 284 . 1 1 A 39 39 GLN CA C 38 59.153 58.783 0.370 2
1 285 . 1 1 A 39 39 GLN CB C 38 28.213 28.363 -0.150 2
1 287 . 1 1 A 39 39 GLN N N 38 116.433 118.400 -1.967 2
1 289 . 1 1 A 40 40 LEU H H 39 7.930 7.640 0.290 2
1 290 . 1 1 A 40 40 LEU HA H 39 3.916 4.016 -0.100 2
1 300 . 1 1 A 40 40 LEU C C 39 177.731 178.134 -0.403 2
1 301 . 1 1 A 40 40 LEU CA C 39 57.915 57.978 -0.063 2
1 302 . 1 1 A 40 40 LEU CB C 39 41.989 41.592 0.397 2
1 306 . 1 1 A 40 40 LEU N N 39 119.505 121.558 -2.053 2
1 307 . 1 1 A 41 41 LEU H H 40 7.174 7.832 -0.658 2
1 308 . 1 1 A 41 41 LEU HA H 40 3.835 3.998 -0.163 2
1 318 . 1 1 A 41 41 LEU C C 40 179.738 178.275 1.463 2
1 319 . 1 1 A 41 41 LEU CA C 40 58.266 58.203 0.063 2
1 320 . 1 1 A 41 41 LEU CB C 40 42.050 41.447 0.603 2
1 324 . 1 1 A 41 41 LEU N N 40 120.971 119.735 1.236 2
1 325 . 1 1 A 42 42 GLN H H 41 8.058 7.918 0.140 2
1 326 . 1 1 A 42 42 GLN HA H 41 3.556 3.740 -0.184 2
1 333 . 1 1 A 42 42 GLN C C 41 177.642 178.453 -0.811 2
1 334 . 1 1 A 42 42 GLN CA C 41 59.826 59.169 0.657 2
1 335 . 1 1 A 42 42 GLN CB C 41 28.762 28.011 0.751 2
1 337 . 1 1 A 42 42 GLN N N 41 117.899 118.010 -0.111 2
1 339 . 1 1 A 43 43 ARG H H 42 8.179 7.798 0.381 2
1 340 . 1 1 A 43 43 ARG HA H 42 3.655 3.970 -0.315 2
1 347 . 1 1 A 43 43 ARG C C 42 178.051 178.522 -0.471 2
1 348 . 1 1 A 43 43 ARG CA C 42 59.766 58.841 0.925 2
1 349 . 1 1 A 43 43 ARG CB C 42 29.941 29.848 0.093 2
1 352 . 1 1 A 43 43 ARG N N 42 119.392 119.387 0.005 2
1 353 . 1 1 A 44 44 ASN H H 43 8.525 8.087 0.438 2
1 354 . 1 1 A 44 44 ASN HA H 43 4.332 4.390 -0.058 2
1 359 . 1 1 A 44 44 ASN C C 43 178.150 177.862 0.288 2
1 360 . 1 1 A 44 44 ASN CA C 43 55.841 56.211 -0.370 2
1 361 . 1 1 A 44 44 ASN CB C 43 37.632 39.079 -1.447 2
1 362 . 1 1 A 44 44 ASN N N 43 116.214 117.721 -1.507 2
1 364 . 1 1 A 45 45 PHE H H 44 7.586 7.867 -0.281 2
1 365 . 1 1 A 45 45 PHE HA H 44 4.132 4.295 -0.163 2
1 372 . 1 1 A 45 45 PHE C C 44 176.691 178.494 -1.803 2
1 373 . 1 1 A 45 45 PHE CA C 44 62.333 60.710 1.623 2
1 374 . 1 1 A 45 45 PHE CB C 44 39.449 38.699 0.750 2
1 379 . 1 1 A 45 45 PHE N N 44 121.501 118.041 3.460 2
1 380 . 1 1 A 46 46 MET H H 45 8.190 8.268 -0.078 2
1 381 . 1 1 A 46 46 MET HA H 45 4.060 4.220 -0.160 2
1 389 . 1 1 A 46 46 MET C C 45 179.754 178.158 1.596 2
1 390 . 1 1 A 46 46 MET CA C 45 57.742 57.861 -0.119 2
1 391 . 1 1 A 46 46 MET CB C 45 29.912 31.424 -1.512 2
1 394 . 1 1 A 46 46 MET N N 45 116.727 117.931 -1.204 2
1 395 . 1 1 A 47 47 ASP H H 46 8.579 8.217 0.362 2
1 396 . 1 1 A 47 47 ASP HA H 46 4.804 4.632 0.172 2
1 399 . 1 1 A 47 47 ASP C C 46 177.854 178.075 -0.221 2
1 400 . 1 1 A 47 47 ASP CA C 46 57.277 57.285 -0.008 2
1 401 . 1 1 A 47 47 ASP CB C 46 40.776 41.546 -0.770 2
1 402 . 1 1 A 47 47 ASP N N 46 117.798 120.670 -2.872 2
1 403 . 1 1 A 48 48 LYS H H 47 7.339 7.846 -0.507 2
1 404 . 1 1 A 48 48 LYS HA H 47 3.828 4.266 -0.438 2
1 413 . 1 1 A 48 48 LYS C C 47 178.812 178.680 0.132 2
1 414 . 1 1 A 48 48 LYS CA C 47 58.953 58.083 0.870 2
1 415 . 1 1 A 48 48 LYS CB C 47 32.796 33.126 -0.330 2
1 419 . 1 1 A 48 48 LYS N N 47 117.852 118.914 -1.062 2
1 420 . 1 1 A 49 49 TYR H H 48 6.841 8.584 -1.742 2
1 421 . 1 1 A 49 49 TYR HA H 48 4.995 4.268 0.727 2
1 428 . 1 1 A 49 49 TYR C C 48 178.138 178.547 -0.409 2
1 429 . 1 1 A 49 49 TYR CA C 48 58.620 59.822 -1.202 2
1 430 . 1 1 A 49 49 TYR CB C 48 42.939 38.122 4.817 2
1 435 . 1 1 A 49 49 TYR N N 48 112.109 119.523 -7.414 2
1 436 . 1 1 A 50 50 TYR H H 49 8.491 8.102 0.389 2
1 437 . 1 1 A 50 50 TYR HA H 49 4.598 4.199 0.399 2
1 444 . 1 1 A 50 50 TYR C C 49 176.015 177.735 -1.720 2
1 445 . 1 1 A 50 50 TYR CA C 49 62.442 59.583 2.859 2
1 446 . 1 1 A 50 50 TYR CB C 49 36.588 37.016 -0.428 2
1 451 . 1 1 A 50 50 TYR N N 49 118.294 119.401 -1.107 2
1 452 . 1 1 A 51 51 LEU H H 50 7.512 7.568 -0.056 2
1 453 . 1 1 A 51 51 LEU HA H 50 3.878 3.525 0.353 2
1 463 . 1 1 A 51 51 LEU C C 50 178.625 178.649 -0.024 2
1 464 . 1 1 A 51 51 LEU CA C 50 55.994 57.281 -1.287 2
1 465 . 1 1 A 51 51 LEU CB C 50 40.743 41.417 -0.674 2
1 469 . 1 1 A 51 51 LEU N N 50 118.478 121.506 -3.028 2
1 470 . 1 1 A 52 52 GLU H H 51 8.042 7.910 0.132 2
1 471 . 1 1 A 52 52 GLU HA H 51 4.197 3.950 0.247 2
1 476 . 1 1 A 52 52 GLU C C 51 177.629 177.575 0.054 2
1 477 . 1 1 A 52 52 GLU CA C 51 56.141 59.373 -3.232 2
1 478 . 1 1 A 52 52 GLU CB C 51 29.162 29.235 -0.073 2
1 480 . 1 1 A 52 52 GLU N N 51 115.067 118.008 -2.941 2
1 481 . 1 1 A 53 53 PHE H H 52 7.465 7.942 -0.477 2
1 482 . 1 1 A 53 53 PHE HA H 52 4.431 4.621 -0.190 2
1 490 . 1 1 A 53 53 PHE C C 52 174.325 174.854 -0.529 2
1 491 . 1 1 A 53 53 PHE CA C 52 58.986 57.111 1.875 2
1 492 . 1 1 A 53 53 PHE CB C 52 40.183 37.468 2.715 2
1 498 . 1 1 A 53 53 PHE N N 52 116.768 118.624 -1.856 2
1 499 . 1 1 A 54 54 GLU H H 53 7.484 8.467 -0.983 2
1 500 . 1 1 A 54 54 GLU HA H 53 4.583 4.843 -0.260 2
1 505 . 1 1 A 54 54 GLU C C 53 175.722 175.698 0.024 2
1 506 . 1 1 A 54 54 GLU CA C 53 54.248 55.256 -1.008 2
1 507 . 1 1 A 54 54 GLU CB C 53 34.409 31.654 2.755 2
1 509 . 1 1 A 54 54 GLU N N 53 118.844 124.102 -5.258 2
1 510 . 1 1 A 55 55 ASP H H 54 9.008 8.693 0.315 2
1 511 . 1 1 A 55 55 ASP HA H 54 4.735 4.812 -0.077 2
1 514 . 1 1 A 55 55 ASP C C 54 175.421 175.893 -0.472 2
1 515 . 1 1 A 55 55 ASP CA C 54 52.888 53.956 -1.068 2
1 516 . 1 1 A 55 55 ASP CB C 54 38.894 40.549 -1.655 2
1 517 . 1 1 A 55 55 ASP N N 54 123.654 124.062 -0.408 2
1 518 . 1 1 A 56 56 THR H H 55 7.819 8.097 -0.278 2
1 519 . 1 1 A 56 56 THR HA H 55 4.574 4.896 -0.322 2
1 524 . 1 1 A 56 56 THR C C 55 174.096 174.312 -0.216 2
1 525 . 1 1 A 56 56 THR CA C 55 59.172 59.921 -0.749 2
1 526 . 1 1 A 56 56 THR CB C 55 71.889 72.052 -0.163 2
1 528 . 1 1 A 56 56 THR N N 55 112.015 116.222 -4.207 2
1 529 . 1 1 A 57 57 GLU H H 56 8.527 8.755 -0.228 2
1 530 . 1 1 A 57 57 GLU HA H 56 4.217 4.474 -0.257 2
1 535 . 1 1 A 57 57 GLU C C 56 177.042 176.313 0.729 2
1 536 . 1 1 A 57 57 GLU CA C 56 56.869 56.961 -0.092 2
1 537 . 1 1 A 57 57 GLU CB C 56 29.731 30.617 -0.886 2
1 539 . 1 1 A 57 57 GLU N N 56 117.531 119.405 -1.874 2
1 540 . 1 1 A 58 58 GLU H H 57 7.587 7.803 -0.216 2
1 541 . 1 1 A 58 58 GLU HA H 57 3.941 4.615 -0.674 2
1 546 . 1 1 A 58 58 GLU C C 57 176.849 175.742 1.107 2
1 547 . 1 1 A 58 58 GLU CA C 57 56.924 55.839 1.085 2
1 548 . 1 1 A 58 58 GLU CB C 57 30.251 31.095 -0.844 2
1 550 . 1 1 A 58 58 GLU N N 57 119.183 120.290 -1.107 2
1 551 . 1 1 A 59 59 ASN H H 58 9.120 8.739 0.381 2
1 552 . 1 1 A 59 59 ASN HA H 58 4.922 5.175 -0.253 2
1 557 . 1 1 A 59 59 ASN C C 58 174.254 174.665 -0.411 2
1 558 . 1 1 A 59 59 ASN CA C 58 51.956 52.566 -0.610 2
1 559 . 1 1 A 59 59 ASN CB C 58 37.404 40.129 -2.725 2
1 560 . 1 1 A 59 59 ASN N N 58 126.767 122.982 3.785 2
1 562 . 1 1 A 60 60 LYS H H 59 5.892 8.899 -3.007 2
1 563 . 1 1 A 60 60 LYS HA H 59 3.798 4.704 -0.906 2
1 572 . 1 1 A 60 60 LYS C C 59 177.908 177.390 0.518 2
1 573 . 1 1 A 60 60 LYS CA C 59 56.623 54.791 1.832 2
1 574 . 1 1 A 60 60 LYS CB C 59 32.279 34.685 -2.406 2
1 578 . 1 1 A 60 60 LYS N N 59 121.527 122.997 -1.470 2
1 579 . 1 1 A 61 61 LEU H H 60 8.473 8.814 -0.341 2
1 580 . 1 1 A 61 61 LEU HA H 60 3.891 4.225 -0.334 2
1 590 . 1 1 A 61 61 LEU C C 60 179.843 178.383 1.460 2
1 591 . 1 1 A 61 61 LEU CA C 60 58.301 56.703 1.598 2
1 592 . 1 1 A 61 61 LEU CB C 60 41.305 41.787 -0.482 2
1 596 . 1 1 A 61 61 LEU N N 60 125.639 124.045 1.594 2
1 597 . 1 1 A 62 62 ILE H H 61 7.698 7.819 -0.121 2
1 598 . 1 1 A 62 62 ILE HA H 61 3.952 3.870 0.082 2
1 608 . 1 1 A 62 62 ILE C C 61 175.392 177.156 -1.764 2
1 609 . 1 1 A 62 62 ILE CA C 61 61.743 63.324 -1.581 2
1 610 . 1 1 A 62 62 ILE CB C 61 39.108 37.736 1.372 2
1 614 . 1 1 A 62 62 ILE N N 61 114.111 119.376 -5.265 2
1 615 . 1 1 A 63 63 TYR H H 62 7.273 7.729 -0.456 2
1 616 . 1 1 A 63 63 TYR HA H 62 4.343 4.212 0.131 2
1 623 . 1 1 A 63 63 TYR C C 62 178.264 178.552 -0.288 2
1 624 . 1 1 A 63 63 TYR CA C 62 57.231 60.983 -3.752 2
1 625 . 1 1 A 63 63 TYR CB C 62 36.332 37.531 -1.199 2
1 630 . 1 1 A 63 63 TYR N N 62 117.689 121.351 -3.662 2
1 631 . 1 1 A 64 64 THR H H 63 7.747 8.012 -0.265 2
1 632 . 1 1 A 64 64 THR HA H 63 4.266 4.226 0.040 2
1 637 . 1 1 A 64 64 THR CA C 63 69.362 67.564 1.798 2
1 638 . 1 1 A 64 64 THR CB C 63 66.962 67.614 -0.652 2
1 640 . 1 1 A 64 64 THR N N 63 113.755 116.208 -2.453 2
1 641 . 1 1 A 65 65 PRO HA H 64 4.372 4.381 -0.009 2
1 648 . 1 1 A 65 65 PRO C C 64 179.913 179.401 0.512 2
1 649 . 1 1 A 65 65 PRO CA C 64 66.011 66.161 -0.150 2
1 650 . 1 1 A 65 65 PRO CB C 64 30.642 30.701 -0.059 2
1 653 . 1 1 A 66 66 ILE H H 65 7.377 7.321 0.056 2
1 654 . 1 1 A 66 66 ILE HA H 65 3.530 3.886 -0.356 2
1 664 . 1 1 A 66 66 ILE C C 65 177.543 178.325 -0.782 2
1 665 . 1 1 A 66 66 ILE CA C 65 66.647 64.248 2.399 2
1 666 . 1 1 A 66 66 ILE CB C 65 38.029 37.672 0.357 2
1 670 . 1 1 A 66 66 ILE N N 65 118.353 116.678 1.675 2
1 671 . 1 1 A 67 67 PHE H H 66 8.480 8.424 0.056 2
1 672 . 1 1 A 67 67 PHE HA H 66 4.115 4.349 -0.234 2
1 680 . 1 1 A 67 67 PHE C C 66 177.293 178.021 -0.728 2
1 681 . 1 1 A 67 67 PHE CA C 66 59.570 62.103 -2.534 2
1 682 . 1 1 A 67 67 PHE CB C 66 38.865 39.487 -0.622 2
1 688 . 1 1 A 67 67 PHE N N 66 122.420 120.538 1.882 2
1 689 . 1 1 A 68 68 ASN H H 67 8.595 8.236 0.359 2
1 690 . 1 1 A 68 68 ASN HA H 67 4.211 4.379 -0.168 2
1 695 . 1 1 A 68 68 ASN C C 67 178.697 178.112 0.585 2
1 696 . 1 1 A 68 68 ASN CA C 67 56.056 56.267 -0.211 2
1 697 . 1 1 A 68 68 ASN CB C 67 37.704 37.977 -0.273 2
1 698 . 1 1 A 68 68 ASN N N 67 115.573 117.332 -1.759 2
1 700 . 1 1 A 69 69 GLU H H 68 8.414 8.029 0.385 2
1 701 . 1 1 A 69 69 GLU HA H 68 4.102 4.200 -0.098 2
1 706 . 1 1 A 69 69 GLU C C 68 177.880 178.814 -0.934 2
1 707 . 1 1 A 69 69 GLU CA C 68 59.399 59.395 0.004 2
1 708 . 1 1 A 69 69 GLU CB C 68 29.855 29.425 0.430 2
1 710 . 1 1 A 69 69 GLU N N 68 123.510 120.033 3.477 2
1 711 . 1 1 A 70 70 TYR H H 69 8.659 8.076 0.583 2
1 712 . 1 1 A 70 70 TYR HA H 69 3.362 4.109 -0.747 2
1 719 . 1 1 A 70 70 TYR C C 69 178.143 177.021 1.122 2
1 720 . 1 1 A 70 70 TYR CA C 69 60.686 61.137 -0.451 2
1 721 . 1 1 A 70 70 TYR CB C 69 38.560 38.859 -0.299 2
1 726 . 1 1 A 70 70 TYR N N 69 122.130 120.825 1.305 2
1 727 . 1 1 A 71 71 ILE H H 70 8.031 7.752 0.279 2
1 728 . 1 1 A 71 71 ILE HA H 70 3.265 3.686 -0.421 2
1 738 . 1 1 A 71 71 ILE C C 70 178.056 177.823 0.233 2
1 739 . 1 1 A 71 71 ILE CA C 70 63.756 64.020 -0.264 2
1 740 . 1 1 A 71 71 ILE CB C 70 37.321 36.808 0.513 2
1 744 . 1 1 A 71 71 ILE N N 70 118.906 120.412 -1.506 2
1 745 . 1 1 A 72 72 SER H H 71 7.803 7.858 -0.055 2
1 746 . 1 1 A 72 72 SER HA H 71 4.029 4.308 -0.279 2
1 749 . 1 1 A 72 72 SER CA C 71 61.380 61.242 0.138 2
1 750 . 1 1 A 72 72 SER CB C 71 63.288 63.165 0.123 2
1 751 . 1 1 A 72 72 SER N N 71 113.735 116.923 -3.188 2
1 752 . 1 1 A 73 73 LEU H H 72 7.952 7.943 0.009 2
1 753 . 1 1 A 73 73 LEU HA H 72 4.418 4.136 0.282 2
1 763 . 1 1 A 73 73 LEU C C 72 177.767 178.290 -0.523 2
1 764 . 1 1 A 73 73 LEU CA C 72 56.543 57.441 -0.898 2
1 765 . 1 1 A 73 73 LEU CB C 72 44.517 41.767 2.750 2
1 769 . 1 1 A 73 73 LEU N N 72 119.411 122.552 -3.141 2
1 770 . 1 1 A 74 74 VAL H H 73 8.021 7.601 0.420 2
1 771 . 1 1 A 74 74 VAL HA H 73 3.532 3.333 0.199 2
1 779 . 1 1 A 74 74 VAL C C 73 177.126 177.988 -0.862 2
1 780 . 1 1 A 74 74 VAL CA C 73 66.250 66.389 -0.139 2
1 781 . 1 1 A 74 74 VAL CB C 73 31.212 31.127 0.085 2
1 784 . 1 1 A 74 74 VAL N N 73 118.747 119.193 -0.446 2
1 785 . 1 1 A 75 75 GLU H H 74 7.232 7.959 -0.727 2
1 786 . 1 1 A 75 75 GLU HA H 74 3.013 4.160 -1.147 2
1 791 . 1 1 A 75 75 GLU C C 74 178.804 179.172 -0.368 2
1 792 . 1 1 A 75 75 GLU CA C 74 60.536 59.889 0.647 2
1 793 . 1 1 A 75 75 GLU CB C 74 27.009 29.084 -2.075 2
1 795 . 1 1 A 75 75 GLU N N 74 118.660 119.799 -1.139 2
1 796 . 1 1 A 76 76 LYS H H 75 7.051 7.799 -0.748 2
1 797 . 1 1 A 76 76 LYS HA H 75 3.765 4.064 -0.300 2
1 806 . 1 1 A 76 76 LYS C C 75 177.765 178.361 -0.596 2
1 807 . 1 1 A 76 76 LYS CA C 75 58.357 58.629 -0.272 2
1 808 . 1 1 A 76 76 LYS CB C 75 31.939 32.112 -0.173 2
1 812 . 1 1 A 76 76 LYS N N 75 116.112 119.526 -3.414 2
1 813 . 1 1 A 77 77 TYR H H 76 7.067 7.812 -0.745 2
1 814 . 1 1 A 77 77 TYR HA H 76 4.036 4.166 -0.130 2
1 821 . 1 1 A 77 77 TYR C C 76 177.752 177.129 0.623 2
1 822 . 1 1 A 77 77 TYR CA C 76 61.820 61.259 0.561 2
1 823 . 1 1 A 77 77 TYR CB C 76 38.480 38.681 -0.201 2
1 828 . 1 1 A 77 77 TYR N N 76 118.434 121.232 -2.798 2
1 829 . 1 1 A 78 78 ILE H H 77 7.554 8.270 -0.716 2
1 830 . 1 1 A 78 78 ILE HA H 77 3.159 3.595 -0.436 2
1 840 . 1 1 A 78 78 ILE C C 77 177.341 177.889 -0.548 2
1 841 . 1 1 A 78 78 ILE CA C 77 65.177 65.162 0.015 2
1 842 . 1 1 A 78 78 ILE CB C 77 37.339 37.730 -0.391 2
1 846 . 1 1 A 78 78 ILE N N 77 117.672 121.183 -3.511 2
1 847 . 1 1 A 79 79 GLU H H 78 8.296 8.025 0.271 2
1 848 . 1 1 A 79 79 GLU HA H 78 3.557 3.809 -0.252 2
1 853 . 1 1 A 79 79 GLU C C 78 177.742 178.831 -1.089 2
1 854 . 1 1 A 79 79 GLU CA C 78 60.847 60.008 0.839 2
1 855 . 1 1 A 79 79 GLU CB C 78 29.594 29.176 0.418 2
1 857 . 1 1 A 79 79 GLU N N 78 118.701 120.814 -2.113 2
1 858 . 1 1 A 80 80 GLU H H 79 8.330 8.246 0.084 2
1 859 . 1 1 A 80 80 GLU HA H 79 3.774 4.011 -0.237 2
1 864 . 1 1 A 80 80 GLU C C 79 179.926 179.192 0.734 2
1 865 . 1 1 A 80 80 GLU CA C 79 59.581 58.950 0.631 2
1 866 . 1 1 A 80 80 GLU CB C 79 29.062 29.222 -0.160 2
1 868 . 1 1 A 80 80 GLU N N 79 116.767 118.244 -1.477 2
1 869 . 1 1 A 81 81 GLN H H 80 7.634 7.709 -0.075 2
1 870 . 1 1 A 81 81 GLN HA H 80 3.605 3.861 -0.256 2
1 877 . 1 1 A 81 81 GLN C C 80 179.681 178.565 1.116 2
1 878 . 1 1 A 81 81 GLN CA C 80 57.765 58.454 -0.689 2
1 879 . 1 1 A 81 81 GLN CB C 80 28.079 27.929 0.150 2
1 881 . 1 1 A 81 81 GLN N N 80 116.325 118.661 -2.336 2
1 883 . 1 1 A 82 82 LEU H H 81 8.156 7.541 0.615 2
1 884 . 1 1 A 82 82 LEU HA H 81 3.536 3.775 -0.239 2
1 894 . 1 1 A 82 82 LEU C C 81 178.945 179.378 -0.433 2
1 895 . 1 1 A 82 82 LEU CA C 81 57.761 56.901 0.860 2
1 896 . 1 1 A 82 82 LEU CB C 81 40.961 40.915 0.046 2
1 900 . 1 1 A 82 82 LEU N N 81 121.546 120.244 1.302 2
1 901 . 1 1 A 83 83 LEU H H 82 8.326 8.016 0.310 2
1 902 . 1 1 A 83 83 LEU HA H 82 4.198 4.215 -0.017 2
1 912 . 1 1 A 83 83 LEU C C 82 178.631 179.234 -0.603 2
1 913 . 1 1 A 83 83 LEU CA C 82 57.016 57.124 -0.108 2
1 914 . 1 1 A 83 83 LEU CB C 82 42.182 40.783 1.399 2
1 918 . 1 1 A 83 83 LEU N N 82 120.426 119.202 1.224 2
1 919 . 1 1 A 84 84 GLN H H 83 6.992 7.644 -0.652 2
1 920 . 1 1 A 84 84 GLN HA H 83 3.877 4.001 -0.124 2
1 927 . 1 1 A 84 84 GLN C C 83 177.008 176.885 0.123 2
1 928 . 1 1 A 84 84 GLN CA C 83 57.543 58.479 -0.936 2
1 929 . 1 1 A 84 84 GLN CB C 83 28.688 28.510 0.178 2
1 931 . 1 1 A 84 84 GLN N N 83 114.001 117.355 -3.354 2
1 933 . 1 1 A 85 85 ARG H H 84 7.072 7.472 -0.400 2
1 934 . 1 1 A 85 85 ARG HA H 84 4.047 4.401 -0.354 2
1 942 . 1 1 A 85 85 ARG C C 84 175.999 175.448 0.551 2
1 943 . 1 1 A 85 85 ARG CA C 84 56.764 56.208 0.556 2
1 944 . 1 1 A 85 85 ARG CB C 84 32.044 32.264 -0.220 2
1 947 . 1 1 A 85 85 ARG N N 84 115.827 117.289 -1.462 2
1 949 . 1 1 A 86 86 ILE H H 85 8.238 7.615 0.623 2
1 950 . 1 1 A 86 86 ILE HA H 85 4.389 4.527 -0.138 2
1 960 . 1 1 A 86 86 ILE CA C 85 58.007 57.856 0.151 2
1 961 . 1 1 A 86 86 ILE CB C 85 39.604 38.895 0.709 2
1 965 . 1 1 A 86 86 ILE N N 85 119.285 119.237 0.048 2
1 966 . 1 1 A 87 87 PRO HA H 86 4.392 4.534 -0.142 2
1 973 . 1 1 A 87 87 PRO C C 86 177.622 176.702 0.920 2
1 974 . 1 1 A 87 87 PRO CA C 86 64.665 64.276 0.389 2
1 975 . 1 1 A 87 87 PRO CB C 86 32.020 31.720 0.300 2
1 978 . 1 1 A 88 88 GLU H H 87 8.312 8.278 0.034 2
1 979 . 1 1 A 88 88 GLU HA H 87 4.208 4.521 -0.313 2
1 984 . 1 1 A 88 88 GLU C C 87 175.554 175.934 -0.380 2
1 985 . 1 1 A 88 88 GLU CA C 87 56.045 56.159 -0.114 2
1 986 . 1 1 A 88 88 GLU CB C 87 28.654 30.293 -1.639 2
1 988 . 1 1 A 88 88 GLU N N 87 114.256 116.610 -2.354 2
1 989 . 1 1 A 89 89 PHE H H 88 7.946 7.551 0.395 2
1 990 . 1 1 A 89 89 PHE HA H 88 3.993 4.447 -0.454 2
1 998 . 1 1 A 89 89 PHE C C 88 173.460 174.670 -1.210 2
1 999 . 1 1 A 89 89 PHE CA C 88 60.119 59.244 0.875 2
1 1000 . 1 1 A 89 89 PHE CB C 88 39.994 39.751 0.243 2
1 1006 . 1 1 A 89 89 PHE N N 88 121.550 123.099 -1.549 2
1 1007 . 1 1 A 90 90 ASN H H 89 7.266 7.818 -0.552 2
1 1008 . 1 1 A 90 90 ASN HA H 89 4.454 5.039 -0.585 2
1 1013 . 1 1 A 90 90 ASN C C 89 173.921 175.091 -1.170 2
1 1014 . 1 1 A 90 90 ASN CA C 89 51.839 51.465 0.374 2
1 1015 . 1 1 A 90 90 ASN CB C 89 40.674 39.382 1.292 2
1 1016 . 1 1 A 90 90 ASN N N 89 125.344 124.563 0.781 2
1 1018 . 1 1 A 91 91 MET H H 90 8.968 8.699 0.269 2
1 1019 . 1 1 A 91 91 MET HA H 90 4.049 4.193 -0.144 2
1 1027 . 1 1 A 91 91 MET C C 90 177.475 178.007 -0.532 2
1 1028 . 1 1 A 91 91 MET CA C 90 57.758 58.127 -0.369 2
1 1029 . 1 1 A 91 91 MET CB C 90 32.250 32.356 -0.106 2
1 1032 . 1 1 A 91 91 MET N N 90 127.052 124.647 2.405 2
1 1033 . 1 1 A 92 92 ALA H H 91 8.292 8.025 0.267 2
1 1034 . 1 1 A 92 92 ALA HA H 91 4.059 4.125 -0.066 2
1 1038 . 1 1 A 92 92 ALA C C 91 180.412 179.762 0.650 2
1 1039 . 1 1 A 92 92 ALA CA C 91 55.368 54.959 0.409 2
1 1040 . 1 1 A 92 92 ALA CB C 91 17.527 18.547 -1.020 2
1 1041 . 1 1 A 92 92 ALA N N 91 123.752 121.301 2.451 2
1 1042 . 1 1 A 93 93 ALA H H 92 7.931 8.008 -0.077 2
1 1043 . 1 1 A 93 93 ALA HA H 92 4.054 4.134 -0.080 2
1 1047 . 1 1 A 93 93 ALA C C 92 180.482 179.876 0.606 2
1 1048 . 1 1 A 93 93 ALA CA C 92 54.614 54.893 -0.279 2
1 1049 . 1 1 A 93 93 ALA CB C 92 18.098 18.198 -0.100 2
1 1050 . 1 1 A 93 93 ALA N N 92 121.158 120.136 1.022 2
1 1051 . 1 1 A 94 94 PHE H H 93 8.110 7.828 0.282 2
1 1052 . 1 1 A 94 94 PHE HA H 93 4.304 4.153 0.151 2
1 1060 . 1 1 A 94 94 PHE C C 93 177.350 177.302 0.048 2
1 1061 . 1 1 A 94 94 PHE CA C 93 61.641 61.468 0.173 2
1 1062 . 1 1 A 94 94 PHE CB C 93 40.014 39.252 0.762 2
1 1068 . 1 1 A 94 94 PHE N N 93 119.807 119.874 -0.067 2
1 1069 . 1 1 A 95 95 THR H H 94 8.726 8.229 0.497 2
1 1070 . 1 1 A 95 95 THR HA H 94 3.569 3.976 -0.407 2
1 1075 . 1 1 A 95 95 THR C C 94 176.932 176.768 0.164 2
1 1076 . 1 1 A 95 95 THR CA C 94 66.833 65.524 1.309 2
1 1077 . 1 1 A 95 95 THR CB C 94 68.445 68.236 0.209 2
1 1079 . 1 1 A 95 95 THR N N 94 113.074 112.297 0.777 2
1 1080 . 1 1 A 96 96 THR H H 95 7.657 7.844 -0.187 2
1 1081 . 1 1 A 96 96 THR HA H 95 3.945 4.071 -0.126 2
1 1086 . 1 1 A 96 96 THR C C 95 176.386 176.704 -0.318 2
1 1087 . 1 1 A 96 96 THR CA C 95 66.550 65.926 0.624 2
1 1088 . 1 1 A 96 96 THR CB C 95 68.583 68.486 0.097 2
1 1090 . 1 1 A 96 96 THR N N 95 117.927 116.020 1.907 2
1 1091 . 1 1 A 97 97 THR H H 96 7.699 7.759 -0.060 2
1 1092 . 1 1 A 97 97 THR HA H 96 3.905 4.068 -0.163 2
1 1097 . 1 1 A 97 97 THR C C 96 176.572 176.410 0.162 2
1 1098 . 1 1 A 97 97 THR CA C 96 65.979 66.471 -0.492 2
1 1099 . 1 1 A 97 97 THR CB C 96 68.553 68.276 0.277 2
1 1101 . 1 1 A 97 97 THR N N 96 118.518 117.050 1.468 2
1 1102 . 1 1 A 98 98 LEU H H 97 8.304 8.130 0.175 2
1 1103 . 1 1 A 98 98 LEU HA H 97 3.725 3.837 -0.112 2
1 1113 . 1 1 A 98 98 LEU C C 97 178.490 178.588 -0.098 2
1 1114 . 1 1 A 98 98 LEU CA C 97 58.517 58.000 0.517 2
1 1115 . 1 1 A 98 98 LEU CB C 97 41.697 41.096 0.601 2
1 1119 . 1 1 A 98 98 LEU N N 97 122.882 122.001 0.881 2
1 1120 . 1 1 A 99 99 GLN H H 98 7.639 7.971 -0.332 2
1 1121 . 1 1 A 99 99 GLN HA H 98 3.927 4.088 -0.161 2
1 1128 . 1 1 A 99 99 GLN C C 98 178.068 178.058 0.010 2
1 1129 . 1 1 A 99 99 GLN CA C 98 58.735 58.864 -0.129 2
1 1130 . 1 1 A 99 99 GLN CB C 98 27.986 28.279 -0.293 2
1 1132 . 1 1 A 99 99 GLN N N 98 114.302 117.809 -3.507 2
1 1134 . 1 1 A 100 100 HIS H H 99 7.575 7.681 -0.106 2
1 1135 . 1 1 A 100 100 HIS HA H 99 4.524 4.433 0.091 2
1 1139 . 1 1 A 100 100 HIS C C 99 174.789 177.526 -2.737 2
1 1140 . 1 1 A 100 100 HIS CA C 99 56.154 58.847 -2.693 2
1 1141 . 1 1 A 100 100 HIS CB C 99 28.946 30.547 -1.601 2
1 1143 . 1 1 A 100 100 HIS N N 99 114.778 118.522 -3.744 2
1 1144 . 1 1 A 101 101 HIS H H 100 7.773 8.041 -0.268 2
1 1145 . 1 1 A 101 101 HIS HA H 100 4.704 4.169 0.535 2
1 1149 . 1 1 A 101 101 HIS C C 100 174.818 177.073 -2.255 2
1 1150 . 1 1 A 101 101 HIS CA C 100 54.830 58.478 -3.648 2
1 1151 . 1 1 A 101 101 HIS CB C 100 29.749 29.196 0.553 2
1 1153 . 1 1 A 101 101 HIS N N 100 117.397 118.096 -0.699 2
1 1154 . 1 1 A 102 102 LYS H H 101 7.324 8.155 -0.831 2
1 1155 . 1 1 A 102 102 LYS HA H 101 3.611 4.059 -0.448 2
1 1164 . 1 1 A 102 102 LYS C C 101 176.823 178.320 -1.497 2
1 1165 . 1 1 A 102 102 LYS CA C 101 59.915 58.900 1.015 2
1 1166 . 1 1 A 102 102 LYS CB C 101 32.825 31.986 0.839 2
1 1170 . 1 1 A 102 102 LYS N N 101 120.533 120.024 0.509 2
1 1171 . 1 1 A 103 103 ASP H H 102 8.361 7.893 0.468 2
1 1172 . 1 1 A 103 103 ASP HA H 102 4.421 4.439 -0.018 2
1 1175 . 1 1 A 103 103 ASP C C 102 176.793 177.297 -0.504 2
1 1176 . 1 1 A 103 103 ASP CA C 102 55.500 56.077 -0.577 2
1 1177 . 1 1 A 103 103 ASP CB C 102 40.178 40.371 -0.193 2
1 1178 . 1 1 A 103 103 ASP N N 102 114.814 118.798 -3.984 2
1 1179 . 1 1 A 104 104 GLU H H 103 7.858 8.007 -0.149 2
1 1180 . 1 1 A 104 104 GLU HA H 103 4.339 4.480 -0.141 2
1 1183 . 1 1 A 104 104 GLU C C 103 175.777 176.564 -0.787 2
1 1184 . 1 1 A 104 104 GLU CA C 103 56.356 57.807 -1.451 2
1 1185 . 1 1 A 104 104 GLU CB C 103 31.293 31.523 -0.230 2
1 1186 . 1 1 A 104 104 GLU N N 103 116.826 118.285 -1.459 2
1 1187 . 1 1 A 105 105 VAL H H 104 7.201 7.564 -0.363 2
1 1188 . 1 1 A 105 105 VAL HA H 104 4.296 4.148 0.148 2
1 1196 . 1 1 A 105 105 VAL C C 104 174.482 175.687 -1.205 2
1 1197 . 1 1 A 105 105 VAL CA C 104 60.370 62.517 -2.147 2
1 1198 . 1 1 A 105 105 VAL CB C 104 34.341 32.927 1.414 2
1 1201 . 1 1 A 105 105 VAL N N 104 116.422 119.142 -2.720 2
1 1202 . 1 1 A 106 106 ALA H H 105 8.487 8.503 -0.016 2
1 1203 . 1 1 A 106 106 ALA HA H 105 4.172 4.404 -0.232 2
1 1207 . 1 1 A 106 106 ALA C C 105 179.030 178.749 0.281 2
1 1208 . 1 1 A 106 106 ALA CA C 105 52.966 52.375 0.591 2
1 1209 . 1 1 A 106 106 ALA CB C 105 19.371 19.309 0.062 2
1 1210 . 1 1 A 106 106 ALA N N 105 128.313 127.897 0.416 2
1 1211 . 1 1 A 107 107 GLY H H 106 8.738 8.784 -0.046 2
1 1212 . 1 1 A 107 107 GLY HA2 H 106 3.773 3.872 -0.099 2
1 1213 . 1 1 A 107 107 GLY HA3 H 106 3.998 3.938 0.060 2
1 1214 . 1 1 A 107 107 GLY C C 106 174.958 175.574 -0.616 2
1 1215 . 1 1 A 107 107 GLY CA C 106 47.449 47.173 0.276 2
1 1216 . 1 1 A 107 107 GLY N N 106 110.612 110.807 -0.195 2
1 1217 . 1 1 A 108 108 ASP H H 107 8.535 8.159 0.376 2
1 1218 . 1 1 A 108 108 ASP HA H 107 4.333 4.381 -0.048 2
1 1221 . 1 1 A 108 108 ASP C C 107 179.133 178.790 0.343 2
1 1222 . 1 1 A 108 108 ASP CA C 107 56.721 56.714 0.007 2
1 1223 . 1 1 A 108 108 ASP CB C 107 39.336 40.736 -1.400 2
1 1224 . 1 1 A 108 108 ASP N N 107 117.474 121.744 -4.270 2
1 1225 . 1 1 A 109 109 ILE H H 108 7.459 7.868 -0.409 2
1 1226 . 1 1 A 109 109 ILE HA H 108 3.688 3.793 -0.105 2
1 1236 . 1 1 A 109 109 ILE C C 108 176.735 178.394 -1.659 2
1 1237 . 1 1 A 109 109 ILE CA C 108 63.474 65.450 -1.976 2
1 1238 . 1 1 A 109 109 ILE CB C 108 37.340 37.727 -0.387 2
1 1242 . 1 1 A 109 109 ILE N N 108 119.609 119.978 -0.369 2
1 1243 . 1 1 A 110 110 PHE H H 109 7.920 8.339 -0.419 2
1 1244 . 1 1 A 110 110 PHE HA H 109 3.759 4.088 -0.329 2
1 1252 . 1 1 A 110 110 PHE C C 109 177.132 177.358 -0.226 2
1 1253 . 1 1 A 110 110 PHE CA C 109 62.766 61.236 1.530 2
1 1254 . 1 1 A 110 110 PHE CB C 109 39.752 39.305 0.447 2
1 1260 . 1 1 A 110 110 PHE N N 109 120.906 120.403 0.503 2
1 1261 . 1 1 A 111 111 ASP H H 110 8.639 8.263 0.376 2
1 1262 . 1 1 A 111 111 ASP HA H 110 4.216 4.209 0.007 2
1 1265 . 1 1 A 111 111 ASP C C 110 178.900 178.380 0.520 2
1 1266 . 1 1 A 111 111 ASP CA C 110 57.105 57.301 -0.196 2
1 1267 . 1 1 A 111 111 ASP CB C 110 39.697 41.773 -2.076 2
1 1268 . 1 1 A 111 111 ASP N N 110 117.124 118.872 -1.748 2
1 1269 . 1 1 A 112 112 MET H H 111 7.331 7.587 -0.256 2
1 1270 . 1 1 A 112 112 MET HA H 111 4.081 4.138 -0.057 2
1 1278 . 1 1 A 112 112 MET C C 111 179.052 178.181 0.871 2
1 1279 . 1 1 A 112 112 MET CA C 111 58.202 58.099 0.103 2
1 1280 . 1 1 A 112 112 MET CB C 111 31.827 32.396 -0.569 2
1 1283 . 1 1 A 112 112 MET N N 111 118.061 119.352 -1.291 2
1 1284 . 1 1 A 113 113 LEU H H 112 8.001 8.018 -0.017 2
1 1285 . 1 1 A 113 113 LEU HA H 112 3.723 3.592 0.131 2
1 1295 . 1 1 A 113 113 LEU C C 112 179.747 178.663 1.084 2
1 1296 . 1 1 A 113 113 LEU CA C 112 57.371 57.418 -0.047 2
1 1297 . 1 1 A 113 113 LEU CB C 112 40.671 41.086 -0.415 2
1 1301 . 1 1 A 113 113 LEU N N 112 120.426 119.714 0.712 2
1 1302 . 1 1 A 114 114 LEU H H 113 7.744 7.606 0.138 2
1 1303 . 1 1 A 114 114 LEU HA H 113 4.007 3.552 0.455 2
1 1313 . 1 1 A 114 114 LEU C C 113 179.358 178.591 0.767 2
1 1314 . 1 1 A 114 114 LEU CA C 113 57.202 57.487 -0.285 2
1 1315 . 1 1 A 114 114 LEU CB C 113 41.727 41.442 0.285 2
1 1319 . 1 1 A 114 114 LEU N N 113 119.584 119.257 0.327 2
1 1320 . 1 1 A 115 115 THR H H 114 7.353 7.627 -0.274 2
1 1321 . 1 1 A 115 115 THR HA H 114 4.071 4.103 -0.032 2
1 1327 . 1 1 A 115 115 THR C C 114 173.591 176.474 -2.883 2
1 1328 . 1 1 A 115 115 THR CA C 114 65.332 64.557 0.775 2
1 1329 . 1 1 A 115 115 THR CB C 114 70.319 68.620 1.699 2
1 1331 . 1 1 A 115 115 THR N N 114 107.535 111.825 -4.290 2
1 1332 . 1 1 A 116 116 PHE H H 115 6.979 7.827 -0.848 2
1 1333 . 1 1 A 116 116 PHE HA H 115 5.022 4.325 0.697 2
1 1341 . 1 1 A 116 116 PHE C C 115 176.488 176.382 0.106 2
1 1342 . 1 1 A 116 116 PHE CA C 115 55.911 60.973 -5.062 2
1 1343 . 1 1 A 116 116 PHE CB C 115 38.521 39.091 -0.570 2
1 1349 . 1 1 A 116 116 PHE N N 115 112.366 120.022 -7.656 2
1 1350 . 1 1 A 117 117 THR H H 116 7.564 7.735 -0.171 2
1 1351 . 1 1 A 117 117 THR HA H 116 4.626 4.855 -0.229 2
1 1356 . 1 1 A 117 117 THR C C 116 174.085 174.227 -0.142 2
1 1357 . 1 1 A 117 117 THR CA C 116 61.636 62.256 -0.620 2
1 1358 . 1 1 A 117 117 THR CB C 116 70.915 71.429 -0.514 2
1 1360 . 1 1 A 117 117 THR N N 116 105.498 108.788 -3.290 2
1 1361 . 1 1 A 118 118 ASP H H 117 8.270 7.704 0.566 2
1 1362 . 1 1 A 118 118 ASP HA H 117 4.955 4.821 0.134 2
1 1365 . 1 1 A 118 118 ASP C C 117 176.328 176.306 0.022 2
1 1366 . 1 1 A 118 118 ASP CA C 117 53.417 53.427 -0.010 2
1 1367 . 1 1 A 118 118 ASP CB C 117 43.388 39.721 3.667 2
1 1368 . 1 1 A 118 118 ASP N N 117 124.409 122.188 2.221 2
1 1369 . 1 1 A 119 119 PHE H H 118 8.973 8.770 0.203 2
1 1370 . 1 1 A 119 119 PHE HA H 118 3.506 4.204 -0.698 2
1 1378 . 1 1 A 119 119 PHE CA C 118 61.490 61.235 0.255 2
1 1379 . 1 1 A 119 119 PHE CB C 118 39.246 39.523 -0.277 2
1 1385 . 1 1 A 119 119 PHE N N 118 126.688 126.017 0.671 2
1 1386 . 1 1 A 120 120 LEU H H 119 8.099 8.316 -0.217 2
1 1387 . 1 1 A 120 120 LEU HA H 119 3.842 3.972 -0.130 2
1 1397 . 1 1 A 120 120 LEU C C 119 179.601 179.242 0.359 2
1 1398 . 1 1 A 120 120 LEU CA C 119 58.174 57.906 0.268 2
1 1399 . 1 1 A 120 120 LEU CB C 119 40.315 41.227 -0.912 2
1 1403 . 1 1 A 120 120 LEU N N 119 117.930 120.035 -2.105 2
1 1404 . 1 1 A 121 121 ALA H H 120 7.729 7.782 -0.053 2
1 1405 . 1 1 A 121 121 ALA HA H 120 3.996 4.109 -0.113 2
1 1409 . 1 1 A 121 121 ALA C C 120 180.995 179.617 1.378 2
1 1410 . 1 1 A 121 121 ALA CA C 120 54.832 54.640 0.192 2
1 1411 . 1 1 A 121 121 ALA CB C 120 17.706 18.293 -0.587 2
1 1412 . 1 1 A 121 121 ALA N N 120 123.195 121.143 2.052 2
1 1413 . 1 1 A 122 122 PHE H H 121 7.943 7.838 0.105 2
1 1414 . 1 1 A 122 122 PHE HA H 121 3.887 3.841 0.046 2
1 1419 . 1 1 A 122 122 PHE C C 121 175.410 176.874 -1.464 2
1 1420 . 1 1 A 122 122 PHE CA C 121 61.075 60.712 0.363 2
1 1421 . 1 1 A 122 122 PHE CB C 121 38.115 38.842 -0.727 2
1 1424 . 1 1 A 122 122 PHE N N 121 121.798 120.243 1.555 2
1 1425 . 1 1 A 123 123 LYS H H 122 8.468 7.864 0.604 2
1 1426 . 1 1 A 123 123 LYS HA H 122 3.077 3.775 -0.698 2
1 1435 . 1 1 A 123 123 LYS C C 122 178.453 178.775 -0.322 2
1 1436 . 1 1 A 123 123 LYS CA C 122 59.855 59.874 -0.019 2
1 1437 . 1 1 A 123 123 LYS CB C 122 32.374 32.221 0.153 2
1 1441 . 1 1 A 123 123 LYS N N 122 120.614 118.432 2.182 2
1 1442 . 1 1 A 124 124 GLU H H 123 8.100 7.853 0.247 2
1 1443 . 1 1 A 124 124 GLU HA H 123 3.652 4.020 -0.368 2
1 1448 . 1 1 A 124 124 GLU C C 123 177.743 178.589 -0.846 2
1 1449 . 1 1 A 124 124 GLU CA C 123 59.406 59.473 -0.067 2
1 1450 . 1 1 A 124 124 GLU CB C 123 28.811 29.220 -0.409 2
1 1452 . 1 1 A 124 124 GLU N N 123 117.404 118.901 -1.497 2
1 1453 . 1 1 A 125 125 MET H H 124 7.537 7.554 -0.017 2
1 1454 . 1 1 A 125 125 MET HA H 124 3.860 3.951 -0.091 2
1 1462 . 1 1 A 125 125 MET C C 124 179.522 178.321 1.201 2
1 1463 . 1 1 A 125 125 MET CA C 124 58.832 58.412 0.420 2
1 1464 . 1 1 A 125 125 MET CB C 124 31.765 31.440 0.325 2
1 1467 . 1 1 A 125 125 MET N N 124 119.413 119.065 0.348 2
1 1468 . 1 1 A 126 126 PHE H H 125 7.148 7.464 -0.316 2
1 1469 . 1 1 A 126 126 PHE HA H 125 3.633 4.217 -0.584 2
1 1476 . 1 1 A 126 126 PHE C C 125 178.994 178.276 0.718 2
1 1477 . 1 1 A 126 126 PHE CA C 125 63.148 61.013 2.135 2
1 1478 . 1 1 A 126 126 PHE CB C 125 39.830 38.470 1.360 2
1 1483 . 1 1 A 126 126 PHE N N 125 120.013 118.840 1.173 2
1 1484 . 1 1 A 127 127 LEU H H 126 8.369 8.474 -0.105 2
1 1485 . 1 1 A 127 127 LEU HA H 126 3.972 4.027 -0.055 2
1 1495 . 1 1 A 127 127 LEU C C 126 180.621 179.097 1.524 2
1 1496 . 1 1 A 127 127 LEU CA C 126 57.944 57.910 0.034 2
1 1497 . 1 1 A 127 127 LEU CB C 126 40.543 41.198 -0.655 2
1 1501 . 1 1 A 127 127 LEU N N 126 119.692 119.749 -0.057 2
1 1502 . 1 1 A 128 128 ASP H H 127 8.578 8.089 0.489 2
1 1503 . 1 1 A 128 128 ASP HA H 127 4.308 4.340 -0.032 2
1 1506 . 1 1 A 128 128 ASP C C 127 178.254 178.080 0.174 2
1 1507 . 1 1 A 128 128 ASP CA C 127 56.964 57.234 -0.270 2
1 1508 . 1 1 A 128 128 ASP CB C 127 39.735 40.910 -1.175 2
1 1509 . 1 1 A 128 128 ASP N N 127 121.926 119.563 2.363 2
1 1510 . 1 1 A 129 129 TYR H H 128 7.710 8.157 -0.447 2
1 1511 . 1 1 A 129 129 TYR HA H 128 3.908 4.061 -0.153 2
1 1518 . 1 1 A 129 129 TYR C C 128 177.633 177.600 0.033 2
1 1519 . 1 1 A 129 129 TYR CA C 128 61.796 61.421 0.375 2
1 1520 . 1 1 A 129 129 TYR CB C 128 39.372 38.653 0.719 2
1 1525 . 1 1 A 129 129 TYR N N 128 122.548 120.357 2.191 2
1 1526 . 1 1 A 130 130 ARG H H 129 8.622 8.422 0.200 2
1 1527 . 1 1 A 130 130 ARG HA H 129 3.722 3.950 -0.228 2
1 1535 . 1 1 A 130 130 ARG CA C 129 60.084 59.660 0.424 2
1 1536 . 1 1 A 130 130 ARG CB C 129 29.902 29.941 -0.039 2
1 1539 . 1 1 A 130 130 ARG N N 129 118.302 119.370 -1.068 2
1 1541 . 1 1 A 131 131 ALA H H 130 7.936 8.000 -0.064 2
1 1542 . 1 1 A 131 131 ALA HA H 130 3.997 4.039 -0.042 2
1 1546 . 1 1 A 131 131 ALA C C 130 180.456 179.882 0.574 2
1 1547 . 1 1 A 131 131 ALA CA C 130 55.133 54.959 0.174 2
1 1548 . 1 1 A 131 131 ALA CB C 130 17.750 18.264 -0.514 2
1 1549 . 1 1 A 131 131 ALA N N 130 119.788 121.402 -1.614 2
1 1550 . 1 1 A 132 132 GLU H H 131 7.622 7.645 -0.023 2
1 1551 . 1 1 A 132 132 GLU HA H 131 3.862 3.991 -0.129 2
1 1556 . 1 1 A 132 132 GLU C C 131 179.528 178.853 0.675 2
1 1557 . 1 1 A 132 132 GLU CA C 131 58.849 58.820 0.029 2
1 1558 . 1 1 A 132 132 GLU CB C 131 28.930 29.152 -0.222 2
1 1560 . 1 1 A 132 132 GLU N N 131 118.428 118.291 0.137 2
1 1561 . 1 1 A 133 133 LYS H H 132 7.853 7.592 0.261 2
1 1562 . 1 1 A 133 133 LYS HA H 132 3.722 4.007 -0.285 2
1 1571 . 1 1 A 133 133 LYS C C 132 175.725 178.255 -2.530 2
1 1572 . 1 1 A 133 133 LYS CA C 132 57.544 58.822 -1.278 2
1 1573 . 1 1 A 133 133 LYS CB C 132 31.770 31.958 -0.188 2
1 1577 . 1 1 A 133 133 LYS N N 132 119.473 119.018 0.455 2
1 1578 . 1 1 A 134 134 GLU H H 133 8.151 7.774 0.377 2
1 1579 . 1 1 A 134 134 GLU HA H 133 4.161 4.309 -0.148 2
1 1584 . 1 1 A 134 134 GLU C C 133 177.453 177.651 -0.198 2
1 1585 . 1 1 A 134 134 GLU CA C 133 57.222 56.931 0.291 2
1 1586 . 1 1 A 134 134 GLU CB C 133 30.091 29.902 0.189 2
1 1588 . 1 1 A 134 134 GLU N N 133 116.525 117.619 -1.094 2
1 1589 . 1 1 A 135 135 GLY H H 134 7.702 7.884 -0.182 2
1 1590 . 1 1 A 135 135 GLY HA2 H 134 3.896 3.906 -0.010 2
1 1591 . 1 1 A 135 135 GLY HA3 H 134 3.897 3.915 -0.018 2
1 1592 . 1 1 A 135 135 GLY C C 134 174.538 174.209 0.329 2
1 1593 . 1 1 A 135 135 GLY CA C 134 45.975 46.108 -0.132 2
1 1594 . 1 1 A 135 135 GLY N N 134 107.924 108.435 -0.511 2
1 1595 . 1 1 A 136 136 ARG H H 135 8.045 7.864 0.181 2
1 1596 . 1 1 A 136 136 ARG HA H 135 4.323 4.413 -0.090 2
1 1604 . 1 1 A 136 136 ARG C C 135 175.864 175.970 -0.106 2
1 1605 . 1 1 A 136 136 ARG CA C 135 56.016 56.219 -0.203 2
1 1606 . 1 1 A 136 136 ARG CB C 135 30.987 31.303 -0.316 2
1 1609 . 1 1 A 136 136 ARG N N 135 119.708 119.189 0.519 2
stop_
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