data_16012_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16012
_Entry.PDB_ID 2KA1
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 1 A 2 2 GLY H H 155 8.570 8.902 -0.332 1
1 6 . 1 1 1 A 2 2 GLY HA2 H 155 3.950 4.251 -0.301 1
1 7 . 1 1 1 A 2 2 GLY HA3 H 155 4.070 4.268 -0.198 1
1 8 . 1 1 1 A 2 2 GLY C C 155 173.690 174.768 -1.078 1
1 9 . 1 1 1 A 2 2 GLY CA C 155 44.560 44.152 0.408 1
1 10 . 1 1 1 A 2 2 GLY N N 155 108.940 109.467 -0.527 1
1 11 . 1 1 1 A 3 3 ILE H H 156 8.340 8.495 -0.155 1
1 12 . 1 1 1 A 3 3 ILE HA H 156 3.640 3.575 0.065 1
1 22 . 1 1 1 A 3 3 ILE C C 156 174.470 177.300 -2.830 1
1 23 . 1 1 1 A 3 3 ILE CA C 156 62.060 64.597 -2.537 1
1 24 . 1 1 1 A 3 3 ILE CB C 156 37.680 37.910 -0.230 1
1 28 . 1 1 1 A 3 3 ILE N N 156 119.870 121.434 -1.564 1
1 29 . 1 1 1 A 4 4 PHE H H 157 7.850 7.892 -0.042 1
1 30 . 1 1 1 A 4 4 PHE HA H 157 4.570 4.327 0.243 1
1 38 . 1 1 1 A 4 4 PHE C C 157 174.320 176.232 -1.912 1
1 39 . 1 1 1 A 4 4 PHE CA C 157 56.310 60.884 -4.574 1
1 40 . 1 1 1 A 4 4 PHE CB C 157 37.840 38.831 -0.991 1
1 47 . 1 1 1 A 4 4 PHE N N 157 117.790 119.520 -1.730 1
1 48 . 1 1 1 A 5 5 SER H H 158 7.970 8.396 -0.426 1
1 49 . 1 1 1 A 5 5 SER HA H 158 4.560 4.409 0.151 1
1 52 . 1 1 1 A 5 5 SER C C 158 174.160 175.306 -1.146 1
1 53 . 1 1 1 A 5 5 SER CA C 158 57.010 60.720 -3.710 1
1 54 . 1 1 1 A 5 5 SER CB C 158 64.870 62.767 2.103 1
1 55 . 1 1 1 A 5 5 SER N N 158 115.670 114.432 1.238 1
1 56 . 1 1 1 A 6 6 ALA H H 159 9.000 8.319 0.681 1
1 57 . 1 1 1 A 6 6 ALA HA H 159 4.080 4.140 -0.060 1
1 61 . 1 1 1 A 6 6 ALA C C 159 178.290 179.626 -1.336 1
1 62 . 1 1 1 A 6 6 ALA CA C 159 54.850 55.516 -0.666 1
1 63 . 1 1 1 A 6 6 ALA CB C 159 18.070 18.517 -0.447 1
1 64 . 1 1 1 A 6 6 ALA N N 159 125.390 123.605 1.785 1
1 65 . 1 1 1 A 7 7 GLU H H 160 8.590 7.931 0.659 1
1 66 . 1 1 1 A 7 7 GLU HA H 160 3.990 4.094 -0.104 1
1 71 . 1 1 1 A 7 7 GLU C C 160 177.440 178.709 -1.269 1
1 72 . 1 1 1 A 7 7 GLU CA C 160 59.010 59.297 -0.287 1
1 73 . 1 1 1 A 7 7 GLU CB C 160 28.220 29.657 -1.437 1
1 75 . 1 1 1 A 7 7 GLU N N 160 116.180 118.721 -2.541 1
1 76 . 1 1 1 A 8 8 PHE H H 161 7.860 8.387 -0.527 1
1 77 . 1 1 1 A 8 8 PHE HA H 161 4.330 4.134 0.196 1
1 85 . 1 1 1 A 8 8 PHE C C 161 177.130 177.362 -0.232 1
1 86 . 1 1 1 A 8 8 PHE CA C 161 60.330 61.425 -1.095 1
1 87 . 1 1 1 A 8 8 PHE CB C 161 39.160 39.520 -0.360 1
1 94 . 1 1 1 A 8 8 PHE N N 161 118.050 120.987 -2.937 1
1 95 . 1 1 1 A 9 9 LEU H H 162 8.240 9.577 -1.337 1
1 96 . 1 1 1 A 9 9 LEU HA H 162 3.990 3.876 0.114 1
1 106 . 1 1 1 A 9 9 LEU C C 162 177.130 179.271 -2.141 1
1 107 . 1 1 1 A 9 9 LEU CA C 162 57.990 57.920 0.070 1
1 108 . 1 1 1 A 9 9 LEU CB C 162 41.510 41.485 0.025 1
1 112 . 1 1 1 A 9 9 LEU N N 162 119.110 119.533 -0.423 1
1 113 . 1 1 1 A 10 10 LYS H H 163 7.950 8.399 -0.449 1
1 114 . 1 1 1 A 10 10 LYS HA H 163 3.920 4.108 -0.188 1
1 123 . 1 1 1 A 10 10 LYS C C 163 174.010 177.708 -3.698 1
1 124 . 1 1 1 A 10 10 LYS CA C 163 58.850 58.737 0.113 1
1 125 . 1 1 1 A 10 10 LYS CB C 163 32.290 32.715 -0.425 1
1 129 . 1 1 1 A 10 10 LYS N N 163 115.320 117.197 -1.877 1
1 130 . 1 1 1 A 11 11 VAL H H 164 6.940 7.040 -0.100 1
1 131 . 1 1 1 A 11 11 VAL HA H 164 4.180 4.546 -0.366 1
1 139 . 1 1 1 A 11 11 VAL C C 164 177.290 176.275 1.015 1
1 140 . 1 1 1 A 11 11 VAL CA C 164 62.680 60.662 2.018 1
1 141 . 1 1 1 A 11 11 VAL CB C 164 32.680 31.175 1.505 1
1 144 . 1 1 1 A 11 11 VAL N N 164 110.250 109.479 0.771 1
1 145 . 1 1 1 A 12 12 PHE H H 165 8.610 7.879 0.731 1
1 146 . 1 1 1 A 12 12 PHE HA H 165 4.180 4.499 -0.319 1
1 154 . 1 1 1 A 12 12 PHE C C 165 175.720 177.123 -1.403 1
1 155 . 1 1 1 A 12 12 PHE CA C 165 60.410 59.991 0.419 1
1 156 . 1 1 1 A 12 12 PHE CB C 165 40.330 39.814 0.516 1
1 163 . 1 1 1 A 12 12 PHE N N 165 121.290 120.889 0.401 1
1 164 . 1 1 1 A 13 13 LEU H H 166 8.420 8.230 0.190 1
1 165 . 1 1 1 A 13 13 LEU HA H 166 4.160 3.688 0.472 1
1 175 . 1 1 1 A 13 13 LEU CA C 166 59.090 60.109 -1.019 1
1 176 . 1 1 1 A 13 13 LEU CB C 166 38.380 40.648 -2.268 1
1 180 . 1 1 1 A 13 13 LEU N N 166 115.420 120.477 -5.057 1
1 181 . 1 1 1 A 14 14 PRO HA H 167 4.130 4.317 -0.187 1
1 188 . 1 1 1 A 14 14 PRO C C 167 177.150 178.910 -1.760 1
1 189 . 1 1 1 A 14 14 PRO CA C 167 65.800 65.644 0.156 1
1 190 . 1 1 1 A 14 14 PRO CB C 167 30.340 30.832 -0.492 1
1 193 . 1 1 1 A 15 15 SER H H 168 7.150 7.924 -0.774 1
1 194 . 1 1 1 A 15 15 SER HA H 168 4.040 4.126 -0.086 1
1 197 . 1 1 1 A 15 15 SER C C 168 174.160 175.972 -1.812 1
1 198 . 1 1 1 A 15 15 SER CA C 168 63.330 61.537 1.793 1
1 199 . 1 1 1 A 15 15 SER CB C 168 62.060 62.759 -0.699 1
1 200 . 1 1 1 A 15 15 SER N N 168 112.330 114.430 -2.100 1
1 201 . 1 1 1 A 16 16 LEU H H 169 7.770 7.770 0.000 1
1 202 . 1 1 1 A 16 16 LEU HA H 169 4.800 3.571 1.229 1
1 212 . 1 1 1 A 16 16 LEU C C 169 180.100 178.809 1.291 1
1 213 . 1 1 1 A 16 16 LEU CA C 169 55.340 57.904 -2.564 1
1 214 . 1 1 1 A 16 16 LEU CB C 169 41.980 41.256 0.724 1
1 218 . 1 1 1 A 16 16 LEU N N 169 120.480 120.323 0.157 1
1 219 . 1 1 1 A 17 17 LEU H H 170 8.050 7.556 0.494 1
1 220 . 1 1 1 A 17 17 LEU HA H 170 4.070 4.129 -0.059 1
1 230 . 1 1 1 A 17 17 LEU C C 170 176.970 179.072 -2.102 1
1 231 . 1 1 1 A 17 17 LEU CA C 170 57.910 57.975 -0.065 1
1 232 . 1 1 1 A 17 17 LEU CB C 170 40.800 41.629 -0.829 1
1 236 . 1 1 1 A 17 17 LEU N N 170 122.150 118.629 3.521 1
1 237 . 1 1 1 A 18 18 LEU H H 171 7.940 8.001 -0.061 1
1 238 . 1 1 1 A 18 18 LEU HA H 171 3.990 3.838 0.152 1
1 248 . 1 1 1 A 18 18 LEU C C 171 177.910 179.226 -1.316 1
1 249 . 1 1 1 A 18 18 LEU CA C 171 57.760 57.870 -0.110 1
1 250 . 1 1 1 A 18 18 LEU CB C 171 41.120 41.375 -0.255 1
1 254 . 1 1 1 A 18 18 LEU N N 171 117.490 118.029 -0.539 1
1 255 . 1 1 1 A 19 19 SER H H 172 8.970 8.232 0.738 1
1 256 . 1 1 1 A 19 19 SER HA H 172 3.840 4.029 -0.189 1
1 259 . 1 1 1 A 19 19 SER C C 172 176.820 176.730 0.090 1
1 260 . 1 1 1 A 19 19 SER CA C 172 63.190 62.238 0.952 1
1 261 . 1 1 1 A 19 19 SER CB C 172 59.730 62.848 -3.118 1
1 262 . 1 1 1 A 19 19 SER N N 172 115.970 114.001 1.969 1
1 263 . 1 1 1 A 20 20 HIS H H 173 7.600 7.751 -0.151 1
1 264 . 1 1 1 A 20 20 HIS HA H 173 4.080 4.332 -0.252 1
1 269 . 1 1 1 A 20 20 HIS C C 173 176.970 177.699 -0.729 1
1 270 . 1 1 1 A 20 20 HIS CA C 173 62.220 58.921 3.299 1
1 271 . 1 1 1 A 20 20 HIS CB C 173 27.440 30.110 -2.670 1
1 275 . 1 1 1 A 20 20 HIS N N 173 119.720 119.569 0.151 1
1 276 . 1 1 1 A 21 21 LEU H H 174 8.200 8.347 -0.147 1
1 277 . 1 1 1 A 21 21 LEU HA H 174 4.070 3.788 0.282 1
1 287 . 1 1 1 A 21 21 LEU C C 174 178.220 178.958 -0.738 1
1 288 . 1 1 1 A 21 21 LEU CA C 174 57.910 58.201 -0.291 1
1 289 . 1 1 1 A 21 21 LEU CB C 174 40.960 41.836 -0.876 1
1 293 . 1 1 1 A 21 21 LEU N N 174 120.780 119.821 0.959 1
1 294 . 1 1 1 A 22 22 LEU H H 175 8.510 8.175 0.335 1
1 295 . 1 1 1 A 22 22 LEU HA H 175 3.930 3.891 0.039 1
1 305 . 1 1 1 A 22 22 LEU C C 175 177.440 178.892 -1.452 1
1 306 . 1 1 1 A 22 22 LEU CA C 175 57.760 57.926 -0.166 1
1 307 . 1 1 1 A 22 22 LEU CB C 175 40.800 41.529 -0.729 1
1 311 . 1 1 1 A 22 22 LEU N N 175 118.600 117.885 0.715 1
1 312 . 1 1 1 A 23 23 ALA H H 176 7.830 8.707 -0.877 1
1 313 . 1 1 1 A 23 23 ALA HA H 176 3.970 4.102 -0.132 1
1 317 . 1 1 1 A 23 23 ALA C C 176 178.220 179.890 -1.670 1
1 318 . 1 1 1 A 23 23 ALA CA C 176 55.260 55.358 -0.098 1
1 319 . 1 1 1 A 23 23 ALA CB C 176 18.070 18.351 -0.281 1
1 320 . 1 1 1 A 23 23 ALA N N 176 121.030 121.734 -0.704 1
1 321 . 1 1 1 A 24 24 ILE H H 177 8.210 8.058 0.152 1
1 322 . 1 1 1 A 24 24 ILE HA H 177 3.900 3.750 0.150 1
1 332 . 1 1 1 A 24 24 ILE C C 177 178.380 177.904 0.476 1
1 333 . 1 1 1 A 24 24 ILE CA C 177 64.870 65.081 -0.211 1
1 334 . 1 1 1 A 24 24 ILE CB C 177 37.370 37.746 -0.376 1
1 338 . 1 1 1 A 24 24 ILE N N 177 118.330 118.388 -0.058 1
1 339 . 1 1 1 A 25 25 GLY H H 178 8.590 8.012 0.578 1
1 340 . 1 1 1 A 25 25 GLY HA2 H 178 3.600 3.798 -0.198 1
1 341 . 1 1 1 A 25 25 GLY HA3 H 178 3.630 3.813 -0.183 1
1 342 . 1 1 1 A 25 25 GLY C C 178 173.850 176.081 -2.231 1
1 343 . 1 1 1 A 25 25 GLY CA C 178 47.530 47.374 0.156 1
1 344 . 1 1 1 A 25 25 GLY N N 178 107.320 108.357 -1.037 1
1 345 . 1 1 1 A 26 26 LEU H H 179 8.830 8.324 0.506 1
1 346 . 1 1 1 A 26 26 LEU HA H 179 4.110 4.054 0.056 1
1 356 . 1 1 1 A 26 26 LEU C C 179 178.220 179.055 -0.835 1
1 357 . 1 1 1 A 26 26 LEU CA C 179 57.600 58.442 -0.842 1
1 358 . 1 1 1 A 26 26 LEU CB C 179 41.040 41.973 -0.933 1
1 362 . 1 1 1 A 26 26 LEU N N 179 122.350 122.697 -0.347 1
1 363 . 1 1 1 A 27 27 GLY H H 180 8.520 8.149 0.371 1
1 364 . 1 1 1 A 27 27 GLY HA2 H 180 3.760 3.767 -0.007 1
1 365 . 1 1 1 A 27 27 GLY HA3 H 180 4.520 3.776 0.744 1
1 366 . 1 1 1 A 27 27 GLY C C 180 174.160 175.990 -1.830 1
1 367 . 1 1 1 A 27 27 GLY CA C 180 47.920 47.497 0.423 1
1 368 . 1 1 1 A 27 27 GLY N N 180 106.260 105.357 0.903 1
1 369 . 1 1 1 A 28 28 ILE H H 181 8.780 8.011 0.769 1
1 370 . 1 1 1 A 28 28 ILE HA H 181 3.590 3.853 -0.263 1
1 380 . 1 1 1 A 28 28 ILE C C 181 177.130 177.514 -0.384 1
1 381 . 1 1 1 A 28 28 ILE CA C 181 65.340 64.497 0.843 1
1 382 . 1 1 1 A 28 28 ILE CB C 181 36.900 37.493 -0.593 1
1 386 . 1 1 1 A 28 28 ILE N N 181 123.970 122.631 1.339 1
1 387 . 1 1 1 A 29 29 TYR H H 182 8.110 8.473 -0.363 1
1 388 . 1 1 1 A 29 29 TYR HA H 182 3.880 4.077 -0.197 1
1 395 . 1 1 1 A 29 29 TYR C C 182 176.970 176.774 0.196 1
1 396 . 1 1 1 A 29 29 TYR CA C 182 61.900 61.586 0.314 1
1 397 . 1 1 1 A 29 29 TYR CB C 182 37.910 38.487 -0.577 1
1 403 . 1 1 1 A 29 29 TYR N N 182 119.570 120.249 -0.679 1
1 404 . 1 1 1 A 30 30 ILE H H 183 8.490 8.265 0.225 1
1 405 . 1 1 1 A 30 30 ILE HA H 183 3.400 3.628 -0.228 1
1 415 . 1 1 1 A 30 30 ILE C C 183 177.760 177.620 0.140 1
1 416 . 1 1 1 A 30 30 ILE CA C 183 65.020 64.966 0.054 1
1 417 . 1 1 1 A 30 30 ILE CB C 183 37.600 37.979 -0.379 1
1 421 . 1 1 1 A 30 30 ILE N N 183 118.000 119.299 -1.299 1
1 422 . 1 1 1 A 31 31 GLY H H 184 9.360 8.040 1.320 1
1 423 . 1 1 1 A 31 31 GLY HA2 H 184 3.650 3.744 -0.094 1
1 424 . 1 1 1 A 31 31 GLY HA3 H 184 3.940 3.754 0.186 1
1 425 . 1 1 1 A 31 31 GLY C C 184 174.320 175.974 -1.654 1
1 426 . 1 1 1 A 31 31 GLY CA C 184 47.380 47.038 0.342 1
1 427 . 1 1 1 A 31 31 GLY N N 184 106.260 107.237 -0.977 1
1 428 . 1 1 1 A 32 32 ARG H H 185 8.090 8.982 -0.892 1
1 429 . 1 1 1 A 32 32 ARG HA H 185 4.030 4.059 -0.029 1
1 441 . 1 1 1 A 32 32 ARG C C 185 177.290 177.040 0.250 1
1 442 . 1 1 1 A 32 32 ARG CA C 185 57.050 58.593 -1.543 1
1 443 . 1 1 1 A 32 32 ARG CB C 185 29.630 30.103 -0.473 1
1 447 . 1 1 1 A 32 32 ARG N N 185 118.050 120.796 -2.746 1
1 451 . 1 1 1 A 33 33 ARG H H 186 7.760 7.687 0.073 1
1 452 . 1 1 1 A 33 33 ARG HA H 186 4.260 4.580 -0.320 1
1 464 . 1 1 1 A 33 33 ARG C C 186 176.190 176.342 -0.152 1
1 465 . 1 1 1 A 33 33 ARG CA C 186 55.670 54.891 0.779 1
1 466 . 1 1 1 A 33 33 ARG CB C 186 29.710 29.938 -0.228 1
1 470 . 1 1 1 A 33 33 ARG N N 186 117.390 118.554 -1.164 1
1 474 . 1 1 1 A 34 34 LEU H H 187 7.530 7.586 -0.056 1
1 475 . 1 1 1 A 34 34 LEU HA H 187 4.390 4.265 0.125 1
1 485 . 1 1 1 A 34 34 LEU C C 187 175.410 177.013 -1.603 1
1 486 . 1 1 1 A 34 34 LEU CA C 187 54.440 56.159 -1.719 1
1 487 . 1 1 1 A 34 34 LEU CB C 187 41.590 42.811 -1.221 1
1 491 . 1 1 1 A 34 34 LEU N N 187 119.360 120.235 -0.875 1
1 5 . 2 1 1 A 2 2 GLY H H 155 8.570 7.668 0.902 1
1 6 . 2 1 1 A 2 2 GLY HA2 H 155 3.950 4.109 -0.159 1
1 7 . 2 1 1 A 2 2 GLY HA3 H 155 4.070 4.124 -0.054 1
1 8 . 2 1 1 A 2 2 GLY C C 155 173.690 174.274 -0.584 1
1 9 . 2 1 1 A 2 2 GLY CA C 155 44.560 45.348 -0.788 1
1 10 . 2 1 1 A 2 2 GLY N N 155 108.940 107.174 1.766 1
1 11 . 2 1 1 A 3 3 ILE H H 156 8.340 8.841 -0.501 1
1 12 . 2 1 1 A 3 3 ILE HA H 156 3.640 3.618 0.022 1
1 22 . 2 1 1 A 3 3 ILE C C 156 174.470 177.392 -2.922 1
1 23 . 2 1 1 A 3 3 ILE CA C 156 62.060 64.383 -2.323 1
1 24 . 2 1 1 A 3 3 ILE CB C 156 37.680 37.832 -0.152 1
1 28 . 2 1 1 A 3 3 ILE N N 156 119.870 119.825 0.045 1
1 29 . 2 1 1 A 4 4 PHE H H 157 7.850 8.145 -0.295 1
1 30 . 2 1 1 A 4 4 PHE HA H 157 4.570 4.317 0.253 1
1 38 . 2 1 1 A 4 4 PHE C C 157 174.320 176.983 -2.663 1
1 39 . 2 1 1 A 4 4 PHE CA C 157 56.310 60.561 -4.251 1
1 40 . 2 1 1 A 4 4 PHE CB C 157 37.840 39.237 -1.397 1
1 47 . 2 1 1 A 4 4 PHE N N 157 117.790 119.680 -1.890 1
1 48 . 2 1 1 A 5 5 SER H H 158 7.970 8.250 -0.280 1
1 49 . 2 1 1 A 5 5 SER HA H 158 4.560 4.386 0.174 1
1 52 . 2 1 1 A 5 5 SER C C 158 174.160 176.046 -1.886 1
1 53 . 2 1 1 A 5 5 SER CA C 158 57.010 61.287 -4.277 1
1 54 . 2 1 1 A 5 5 SER CB C 158 64.870 62.950 1.920 1
1 55 . 2 1 1 A 5 5 SER N N 158 115.670 114.259 1.411 1
1 56 . 2 1 1 A 6 6 ALA H H 159 9.000 8.459 0.541 1
1 57 . 2 1 1 A 6 6 ALA HA H 159 4.080 4.144 -0.064 1
1 61 . 2 1 1 A 6 6 ALA C C 159 178.290 179.621 -1.331 1
1 62 . 2 1 1 A 6 6 ALA CA C 159 54.850 55.416 -0.566 1
1 63 . 2 1 1 A 6 6 ALA CB C 159 18.070 18.409 -0.339 1
1 64 . 2 1 1 A 6 6 ALA N N 159 125.390 122.408 2.982 1
1 65 . 2 1 1 A 7 7 GLU H H 160 8.590 8.044 0.546 1
1 66 . 2 1 1 A 7 7 GLU HA H 160 3.990 4.140 -0.150 1
1 71 . 2 1 1 A 7 7 GLU C C 160 177.440 178.880 -1.440 1
1 72 . 2 1 1 A 7 7 GLU CA C 160 59.010 59.095 -0.085 1
1 73 . 2 1 1 A 7 7 GLU CB C 160 28.220 29.541 -1.321 1
1 75 . 2 1 1 A 7 7 GLU N N 160 116.180 119.210 -3.030 1
1 76 . 2 1 1 A 8 8 PHE H H 161 7.860 8.264 -0.404 1
1 77 . 2 1 1 A 8 8 PHE HA H 161 4.330 4.240 0.090 1
1 85 . 2 1 1 A 8 8 PHE C C 161 177.130 177.533 -0.403 1
1 86 . 2 1 1 A 8 8 PHE CA C 161 60.330 61.242 -0.912 1
1 87 . 2 1 1 A 8 8 PHE CB C 161 39.160 39.538 -0.378 1
1 94 . 2 1 1 A 8 8 PHE N N 161 118.050 121.184 -3.134 1
1 95 . 2 1 1 A 9 9 LEU H H 162 8.240 9.490 -1.250 1
1 96 . 2 1 1 A 9 9 LEU HA H 162 3.990 3.974 0.016 1
1 106 . 2 1 1 A 9 9 LEU C C 162 177.130 179.412 -2.282 1
1 107 . 2 1 1 A 9 9 LEU CA C 162 57.990 57.954 0.036 1
1 108 . 2 1 1 A 9 9 LEU CB C 162 41.510 41.430 0.080 1
1 112 . 2 1 1 A 9 9 LEU N N 162 119.110 119.882 -0.772 1
1 113 . 2 1 1 A 10 10 LYS H H 163 7.950 8.549 -0.599 1
1 114 . 2 1 1 A 10 10 LYS HA H 163 3.920 4.145 -0.225 1
1 123 . 2 1 1 A 10 10 LYS C C 163 174.010 177.794 -3.784 1
1 124 . 2 1 1 A 10 10 LYS CA C 163 58.850 58.623 0.227 1
1 125 . 2 1 1 A 10 10 LYS CB C 163 32.290 32.660 -0.370 1
1 129 . 2 1 1 A 10 10 LYS N N 163 115.320 116.904 -1.584 1
1 130 . 2 1 1 A 11 11 VAL H H 164 6.940 7.195 -0.255 1
1 131 . 2 1 1 A 11 11 VAL HA H 164 4.180 4.527 -0.347 1
1 139 . 2 1 1 A 11 11 VAL C C 164 177.290 176.085 1.205 1
1 140 . 2 1 1 A 11 11 VAL CA C 164 62.680 60.676 2.004 1
1 141 . 2 1 1 A 11 11 VAL CB C 164 32.680 31.489 1.191 1
1 144 . 2 1 1 A 11 11 VAL N N 164 110.250 110.353 -0.103 1
1 145 . 2 1 1 A 12 12 PHE H H 165 8.610 7.879 0.731 1
1 146 . 2 1 1 A 12 12 PHE HA H 165 4.180 4.578 -0.398 1
1 154 . 2 1 1 A 12 12 PHE C C 165 175.720 176.842 -1.122 1
1 155 . 2 1 1 A 12 12 PHE CA C 165 60.410 59.599 0.811 1
1 156 . 2 1 1 A 12 12 PHE CB C 165 40.330 40.324 0.006 1
1 163 . 2 1 1 A 12 12 PHE N N 165 121.290 120.318 0.972 1
1 164 . 2 1 1 A 13 13 LEU H H 166 8.420 7.662 0.758 1
1 165 . 2 1 1 A 13 13 LEU HA H 166 4.160 3.915 0.245 1
1 175 . 2 1 1 A 13 13 LEU CA C 166 59.090 60.070 -0.980 1
1 176 . 2 1 1 A 13 13 LEU CB C 166 38.380 39.799 -1.419 1
1 180 . 2 1 1 A 13 13 LEU N N 166 115.420 119.956 -4.536 1
1 181 . 2 1 1 A 14 14 PRO HA H 167 4.130 4.334 -0.204 1
1 188 . 2 1 1 A 14 14 PRO C C 167 177.150 178.966 -1.816 1
1 189 . 2 1 1 A 14 14 PRO CA C 167 65.800 65.253 0.547 1
1 190 . 2 1 1 A 14 14 PRO CB C 167 30.340 30.687 -0.347 1
1 193 . 2 1 1 A 15 15 SER H H 168 7.150 8.186 -1.036 1
1 194 . 2 1 1 A 15 15 SER HA H 168 4.040 4.122 -0.082 1
1 197 . 2 1 1 A 15 15 SER C C 168 174.160 176.050 -1.890 1
1 198 . 2 1 1 A 15 15 SER CA C 168 63.330 61.549 1.781 1
1 199 . 2 1 1 A 15 15 SER CB C 168 62.060 62.758 -0.698 1
1 200 . 2 1 1 A 15 15 SER N N 168 112.330 114.282 -1.952 1
1 201 . 2 1 1 A 16 16 LEU H H 169 7.770 7.860 -0.090 1
1 202 . 2 1 1 A 16 16 LEU HA H 169 4.800 3.583 1.217 1
1 212 . 2 1 1 A 16 16 LEU C C 169 180.100 178.908 1.192 1
1 213 . 2 1 1 A 16 16 LEU CA C 169 55.340 57.980 -2.640 1
1 214 . 2 1 1 A 16 16 LEU CB C 169 41.980 42.096 -0.116 1
1 218 . 2 1 1 A 16 16 LEU N N 169 120.480 120.280 0.200 1
1 219 . 2 1 1 A 17 17 LEU H H 170 8.050 8.111 -0.061 1
1 220 . 2 1 1 A 17 17 LEU HA H 170 4.070 4.178 -0.108 1
1 230 . 2 1 1 A 17 17 LEU C C 170 176.970 179.224 -2.254 1
1 231 . 2 1 1 A 17 17 LEU CA C 170 57.910 58.062 -0.152 1
1 232 . 2 1 1 A 17 17 LEU CB C 170 40.800 41.533 -0.733 1
1 236 . 2 1 1 A 17 17 LEU N N 170 122.150 117.080 5.070 1
1 237 . 2 1 1 A 18 18 LEU H H 171 7.940 8.297 -0.357 1
1 238 . 2 1 1 A 18 18 LEU HA H 171 3.990 3.820 0.170 1
1 248 . 2 1 1 A 18 18 LEU C C 171 177.910 179.148 -1.238 1
1 249 . 2 1 1 A 18 18 LEU CA C 171 57.760 58.038 -0.278 1
1 250 . 2 1 1 A 18 18 LEU CB C 171 41.120 41.167 -0.047 1
1 254 . 2 1 1 A 18 18 LEU N N 171 117.490 118.834 -1.344 1
1 255 . 2 1 1 A 19 19 SER H H 172 8.970 8.222 0.748 1
1 256 . 2 1 1 A 19 19 SER HA H 172 3.840 4.003 -0.163 1
1 259 . 2 1 1 A 19 19 SER C C 172 176.820 176.721 0.099 1
1 260 . 2 1 1 A 19 19 SER CA C 172 63.190 62.258 0.932 1
1 261 . 2 1 1 A 19 19 SER CB C 172 59.730 62.862 -3.132 1
1 262 . 2 1 1 A 19 19 SER N N 172 115.970 114.157 1.813 1
1 263 . 2 1 1 A 20 20 HIS H H 173 7.600 7.646 -0.046 1
1 264 . 2 1 1 A 20 20 HIS HA H 173 4.080 4.282 -0.202 1
1 269 . 2 1 1 A 20 20 HIS C C 173 176.970 177.771 -0.801 1
1 270 . 2 1 1 A 20 20 HIS CA C 173 62.220 59.154 3.066 1
1 271 . 2 1 1 A 20 20 HIS CB C 173 27.440 29.936 -2.496 1
1 275 . 2 1 1 A 20 20 HIS N N 173 119.720 119.291 0.429 1
1 276 . 2 1 1 A 21 21 LEU H H 174 8.200 8.642 -0.442 1
1 277 . 2 1 1 A 21 21 LEU HA H 174 4.070 3.785 0.285 1
1 287 . 2 1 1 A 21 21 LEU C C 174 178.220 179.171 -0.951 1
1 288 . 2 1 1 A 21 21 LEU CA C 174 57.910 58.110 -0.200 1
1 289 . 2 1 1 A 21 21 LEU CB C 174 40.960 41.440 -0.480 1
1 293 . 2 1 1 A 21 21 LEU N N 174 120.780 119.820 0.960 1
1 294 . 2 1 1 A 22 22 LEU H H 175 8.510 8.471 0.039 1
1 295 . 2 1 1 A 22 22 LEU HA H 175 3.930 3.856 0.074 1
1 305 . 2 1 1 A 22 22 LEU C C 175 177.440 178.951 -1.511 1
1 306 . 2 1 1 A 22 22 LEU CA C 175 57.760 57.779 -0.019 1
1 307 . 2 1 1 A 22 22 LEU CB C 175 40.800 41.977 -1.177 1
1 311 . 2 1 1 A 22 22 LEU N N 175 118.600 118.573 0.027 1
1 312 . 2 1 1 A 23 23 ALA H H 176 7.830 8.600 -0.770 1
1 313 . 2 1 1 A 23 23 ALA HA H 176 3.970 4.104 -0.134 1
1 317 . 2 1 1 A 23 23 ALA C C 176 178.220 179.765 -1.545 1
1 318 . 2 1 1 A 23 23 ALA CA C 176 55.260 55.344 -0.084 1
1 319 . 2 1 1 A 23 23 ALA CB C 176 18.070 18.436 -0.366 1
1 320 . 2 1 1 A 23 23 ALA N N 176 121.030 121.535 -0.505 1
1 321 . 2 1 1 A 24 24 ILE H H 177 8.210 8.134 0.076 1
1 322 . 2 1 1 A 24 24 ILE HA H 177 3.900 3.749 0.151 1
1 332 . 2 1 1 A 24 24 ILE C C 177 178.380 177.865 0.515 1
1 333 . 2 1 1 A 24 24 ILE CA C 177 64.870 65.115 -0.245 1
1 334 . 2 1 1 A 24 24 ILE CB C 177 37.370 37.748 -0.378 1
1 338 . 2 1 1 A 24 24 ILE N N 177 118.330 118.248 0.082 1
1 339 . 2 1 1 A 25 25 GLY H H 178 8.590 8.433 0.157 1
1 340 . 2 1 1 A 25 25 GLY HA2 H 178 3.600 3.763 -0.163 1
1 341 . 2 1 1 A 25 25 GLY HA3 H 178 3.630 3.779 -0.149 1
1 342 . 2 1 1 A 25 25 GLY C C 178 173.850 176.123 -2.273 1
1 343 . 2 1 1 A 25 25 GLY CA C 178 47.530 47.321 0.209 1
1 344 . 2 1 1 A 25 25 GLY N N 178 107.320 108.422 -1.102 1
1 345 . 2 1 1 A 26 26 LEU H H 179 8.830 8.363 0.467 1
1 346 . 2 1 1 A 26 26 LEU HA H 179 4.110 4.032 0.078 1
1 356 . 2 1 1 A 26 26 LEU C C 179 178.220 179.074 -0.854 1
1 357 . 2 1 1 A 26 26 LEU CA C 179 57.600 58.383 -0.783 1
1 358 . 2 1 1 A 26 26 LEU CB C 179 41.040 41.943 -0.903 1
1 362 . 2 1 1 A 26 26 LEU N N 179 122.350 122.526 -0.176 1
1 363 . 2 1 1 A 27 27 GLY H H 180 8.520 8.077 0.443 1
1 364 . 2 1 1 A 27 27 GLY HA2 H 180 3.760 3.802 -0.042 1
1 365 . 2 1 1 A 27 27 GLY HA3 H 180 4.520 3.811 0.709 1
1 366 . 2 1 1 A 27 27 GLY C C 180 174.160 176.119 -1.959 1
1 367 . 2 1 1 A 27 27 GLY CA C 180 47.920 47.532 0.388 1
1 368 . 2 1 1 A 27 27 GLY N N 180 106.260 105.528 0.732 1
1 369 . 2 1 1 A 28 28 ILE H H 181 8.780 8.364 0.416 1
1 370 . 2 1 1 A 28 28 ILE HA H 181 3.590 3.844 -0.254 1
1 380 . 2 1 1 A 28 28 ILE C C 181 177.130 177.443 -0.313 1
1 381 . 2 1 1 A 28 28 ILE CA C 181 65.340 64.585 0.755 1
1 382 . 2 1 1 A 28 28 ILE CB C 181 36.900 37.545 -0.645 1
1 386 . 2 1 1 A 28 28 ILE N N 181 123.970 122.428 1.542 1
1 387 . 2 1 1 A 29 29 TYR H H 182 8.110 8.624 -0.514 1
1 388 . 2 1 1 A 29 29 TYR HA H 182 3.880 4.105 -0.225 1
1 395 . 2 1 1 A 29 29 TYR C C 182 176.970 176.790 0.180 1
1 396 . 2 1 1 A 29 29 TYR CA C 182 61.900 61.706 0.194 1
1 397 . 2 1 1 A 29 29 TYR CB C 182 37.910 38.441 -0.531 1
1 403 . 2 1 1 A 29 29 TYR N N 182 119.570 120.316 -0.746 1
1 404 . 2 1 1 A 30 30 ILE H H 183 8.490 8.208 0.282 1
1 405 . 2 1 1 A 30 30 ILE HA H 183 3.400 3.697 -0.297 1
1 415 . 2 1 1 A 30 30 ILE C C 183 177.760 177.561 0.199 1
1 416 . 2 1 1 A 30 30 ILE CA C 183 65.020 64.940 0.080 1
1 417 . 2 1 1 A 30 30 ILE CB C 183 37.600 38.053 -0.453 1
1 421 . 2 1 1 A 30 30 ILE N N 183 118.000 119.176 -1.176 1
1 422 . 2 1 1 A 31 31 GLY H H 184 9.360 8.020 1.340 1
1 423 . 2 1 1 A 31 31 GLY HA2 H 184 3.650 3.756 -0.106 1
1 424 . 2 1 1 A 31 31 GLY HA3 H 184 3.940 3.763 0.177 1
1 425 . 2 1 1 A 31 31 GLY C C 184 174.320 175.877 -1.557 1
1 426 . 2 1 1 A 31 31 GLY CA C 184 47.380 47.077 0.303 1
1 427 . 2 1 1 A 31 31 GLY N N 184 106.260 107.121 -0.861 1
1 428 . 2 1 1 A 32 32 ARG H H 185 8.090 8.750 -0.660 1
1 429 . 2 1 1 A 32 32 ARG HA H 185 4.030 4.093 -0.063 1
1 441 . 2 1 1 A 32 32 ARG C C 185 177.290 176.762 0.528 1
1 442 . 2 1 1 A 32 32 ARG CA C 185 57.050 58.211 -1.161 1
1 443 . 2 1 1 A 32 32 ARG CB C 185 29.630 29.509 0.121 1
1 447 . 2 1 1 A 32 32 ARG N N 185 118.050 120.676 -2.626 1
1 451 . 2 1 1 A 33 33 ARG H H 186 7.760 7.540 0.220 1
1 452 . 2 1 1 A 33 33 ARG HA H 186 4.260 4.319 -0.059 1
1 464 . 2 1 1 A 33 33 ARG C C 186 176.190 176.743 -0.553 1
1 465 . 2 1 1 A 33 33 ARG CA C 186 55.670 55.499 0.171 1
1 466 . 2 1 1 A 33 33 ARG CB C 186 29.710 29.431 0.279 1
1 470 . 2 1 1 A 33 33 ARG N N 186 117.390 117.287 0.103 1
1 474 . 2 1 1 A 34 34 LEU H H 187 7.530 7.524 0.006 1
1 475 . 2 1 1 A 34 34 LEU HA H 187 4.390 4.026 0.364 1
1 485 . 2 1 1 A 34 34 LEU C C 187 175.410 177.168 -1.758 1
1 486 . 2 1 1 A 34 34 LEU CA C 187 54.440 57.797 -3.357 1
1 487 . 2 1 1 A 34 34 LEU CB C 187 41.590 41.873 -0.283 1
1 491 . 2 1 1 A 34 34 LEU N N 187 119.360 121.936 -2.576 1
1 5 . 3 1 1 A 2 2 GLY H H 155 8.570 8.020 0.550 1
1 6 . 3 1 1 A 2 2 GLY HA2 H 155 3.950 4.222 -0.272 1
1 7 . 3 1 1 A 2 2 GLY HA3 H 155 4.070 4.236 -0.166 1
1 8 . 3 1 1 A 2 2 GLY C C 155 173.690 174.244 -0.554 1
1 9 . 3 1 1 A 2 2 GLY CA C 155 44.560 45.494 -0.934 1
1 10 . 3 1 1 A 2 2 GLY N N 155 108.940 110.314 -1.374 1
1 11 . 3 1 1 A 3 3 ILE H H 156 8.340 8.890 -0.550 1
1 12 . 3 1 1 A 3 3 ILE HA H 156 3.640 3.651 -0.011 1
1 22 . 3 1 1 A 3 3 ILE C C 156 174.470 177.483 -3.013 1
1 23 . 3 1 1 A 3 3 ILE CA C 156 62.060 64.529 -2.469 1
1 24 . 3 1 1 A 3 3 ILE CB C 156 37.680 37.904 -0.224 1
1 28 . 3 1 1 A 3 3 ILE N N 156 119.870 119.844 0.026 1
1 29 . 3 1 1 A 4 4 PHE H H 157 7.850 8.198 -0.348 1
1 30 . 3 1 1 A 4 4 PHE HA H 157 4.570 4.336 0.234 1
1 38 . 3 1 1 A 4 4 PHE C C 157 174.320 176.602 -2.282 1
1 39 . 3 1 1 A 4 4 PHE CA C 157 56.310 60.685 -4.375 1
1 40 . 3 1 1 A 4 4 PHE CB C 157 37.840 39.273 -1.433 1
1 47 . 3 1 1 A 4 4 PHE N N 157 117.790 119.630 -1.840 1
1 48 . 3 1 1 A 5 5 SER H H 158 7.970 8.302 -0.332 1
1 49 . 3 1 1 A 5 5 SER HA H 158 4.560 4.371 0.189 1
1 52 . 3 1 1 A 5 5 SER C C 158 174.160 175.480 -1.320 1
1 53 . 3 1 1 A 5 5 SER CA C 158 57.010 60.842 -3.832 1
1 54 . 3 1 1 A 5 5 SER CB C 158 64.870 62.907 1.963 1
1 55 . 3 1 1 A 5 5 SER N N 158 115.670 114.180 1.490 1
1 56 . 3 1 1 A 6 6 ALA H H 159 9.000 8.281 0.719 1
1 57 . 3 1 1 A 6 6 ALA HA H 159 4.080 4.147 -0.067 1
1 61 . 3 1 1 A 6 6 ALA C C 159 178.290 179.616 -1.326 1
1 62 . 3 1 1 A 6 6 ALA CA C 159 54.850 55.452 -0.602 1
1 63 . 3 1 1 A 6 6 ALA CB C 159 18.070 18.323 -0.253 1
1 64 . 3 1 1 A 6 6 ALA N N 159 125.390 122.635 2.755 1
1 65 . 3 1 1 A 7 7 GLU H H 160 8.590 7.891 0.699 1
1 66 . 3 1 1 A 7 7 GLU HA H 160 3.990 4.106 -0.116 1
1 71 . 3 1 1 A 7 7 GLU C C 160 177.440 178.919 -1.479 1
1 72 . 3 1 1 A 7 7 GLU CA C 160 59.010 59.338 -0.328 1
1 73 . 3 1 1 A 7 7 GLU CB C 160 28.220 29.578 -1.358 1
1 75 . 3 1 1 A 7 7 GLU N N 160 116.180 118.988 -2.808 1
1 76 . 3 1 1 A 8 8 PHE H H 161 7.860 8.472 -0.612 1
1 77 . 3 1 1 A 8 8 PHE HA H 161 4.330 4.254 0.076 1
1 85 . 3 1 1 A 8 8 PHE C C 161 177.130 176.980 0.150 1
1 86 . 3 1 1 A 8 8 PHE CA C 161 60.330 61.526 -1.196 1
1 87 . 3 1 1 A 8 8 PHE CB C 161 39.160 39.009 0.151 1
1 94 . 3 1 1 A 8 8 PHE N N 161 118.050 120.916 -2.866 1
1 95 . 3 1 1 A 9 9 LEU H H 162 8.240 9.445 -1.205 1
1 96 . 3 1 1 A 9 9 LEU HA H 162 3.990 3.881 0.109 1
1 106 . 3 1 1 A 9 9 LEU C C 162 177.130 179.723 -2.593 1
1 107 . 3 1 1 A 9 9 LEU CA C 162 57.990 58.030 -0.040 1
1 108 . 3 1 1 A 9 9 LEU CB C 162 41.510 41.453 0.057 1
1 112 . 3 1 1 A 9 9 LEU N N 162 119.110 119.519 -0.409 1
1 113 . 3 1 1 A 10 10 LYS H H 163 7.950 8.911 -0.961 1
1 114 . 3 1 1 A 10 10 LYS HA H 163 3.920 4.144 -0.224 1
1 123 . 3 1 1 A 10 10 LYS C C 163 174.010 176.874 -2.864 1
1 124 . 3 1 1 A 10 10 LYS CA C 163 58.850 58.811 0.039 1
1 125 . 3 1 1 A 10 10 LYS CB C 163 32.290 31.872 0.418 1
1 129 . 3 1 1 A 10 10 LYS N N 163 115.320 117.890 -2.570 1
1 130 . 3 1 1 A 11 11 VAL H H 164 6.940 7.106 -0.166 1
1 131 . 3 1 1 A 11 11 VAL HA H 164 4.180 4.536 -0.356 1
1 139 . 3 1 1 A 11 11 VAL C C 164 177.290 176.044 1.246 1
1 140 . 3 1 1 A 11 11 VAL CA C 164 62.680 60.681 1.999 1
1 141 . 3 1 1 A 11 11 VAL CB C 164 32.680 31.442 1.238 1
1 144 . 3 1 1 A 11 11 VAL N N 164 110.250 115.007 -4.757 1
1 145 . 3 1 1 A 12 12 PHE H H 165 8.610 8.095 0.515 1
1 146 . 3 1 1 A 12 12 PHE HA H 165 4.180 4.624 -0.444 1
1 154 . 3 1 1 A 12 12 PHE C C 165 175.720 176.951 -1.231 1
1 155 . 3 1 1 A 12 12 PHE CA C 165 60.410 59.353 1.057 1
1 156 . 3 1 1 A 12 12 PHE CB C 165 40.330 40.345 -0.015 1
1 163 . 3 1 1 A 12 12 PHE N N 165 121.290 120.589 0.701 1
1 164 . 3 1 1 A 13 13 LEU H H 166 8.420 7.810 0.610 1
1 165 . 3 1 1 A 13 13 LEU HA H 166 4.160 3.954 0.206 1
1 175 . 3 1 1 A 13 13 LEU CA C 166 59.090 60.190 -1.100 1
1 176 . 3 1 1 A 13 13 LEU CB C 166 38.380 40.120 -1.740 1
1 180 . 3 1 1 A 13 13 LEU N N 166 115.420 120.429 -5.009 1
1 181 . 3 1 1 A 14 14 PRO HA H 167 4.130 4.339 -0.209 1
1 188 . 3 1 1 A 14 14 PRO C C 167 177.150 178.615 -1.465 1
1 189 . 3 1 1 A 14 14 PRO CA C 167 65.800 65.696 0.104 1
1 190 . 3 1 1 A 14 14 PRO CB C 167 30.340 31.078 -0.738 1
1 193 . 3 1 1 A 15 15 SER H H 168 7.150 8.061 -0.911 1
1 194 . 3 1 1 A 15 15 SER HA H 168 4.040 4.149 -0.109 1
1 197 . 3 1 1 A 15 15 SER C C 168 174.160 177.371 -3.211 1
1 198 . 3 1 1 A 15 15 SER CA C 168 63.330 60.829 2.501 1
1 199 . 3 1 1 A 15 15 SER CB C 168 62.060 62.580 -0.520 1
1 200 . 3 1 1 A 15 15 SER N N 168 112.330 112.338 -0.008 1
1 201 . 3 1 1 A 16 16 LEU H H 169 7.770 7.937 -0.167 1
1 202 . 3 1 1 A 16 16 LEU HA H 169 4.800 3.563 1.237 1
1 212 . 3 1 1 A 16 16 LEU C C 169 180.100 178.937 1.163 1
1 213 . 3 1 1 A 16 16 LEU CA C 169 55.340 57.915 -2.575 1
1 214 . 3 1 1 A 16 16 LEU CB C 169 41.980 41.223 0.757 1
1 218 . 3 1 1 A 16 16 LEU N N 169 120.480 121.992 -1.512 1
1 219 . 3 1 1 A 17 17 LEU H H 170 8.050 7.650 0.400 1
1 220 . 3 1 1 A 17 17 LEU HA H 170 4.070 4.117 -0.047 1
1 230 . 3 1 1 A 17 17 LEU C C 170 176.970 179.264 -2.294 1
1 231 . 3 1 1 A 17 17 LEU CA C 170 57.910 58.023 -0.113 1
1 232 . 3 1 1 A 17 17 LEU CB C 170 40.800 41.581 -0.781 1
1 236 . 3 1 1 A 17 17 LEU N N 170 122.150 119.110 3.040 1
1 237 . 3 1 1 A 18 18 LEU H H 171 7.940 7.823 0.117 1
1 238 . 3 1 1 A 18 18 LEU HA H 171 3.990 3.805 0.185 1
1 248 . 3 1 1 A 18 18 LEU C C 171 177.910 179.154 -1.244 1
1 249 . 3 1 1 A 18 18 LEU CA C 171 57.760 58.005 -0.245 1
1 250 . 3 1 1 A 18 18 LEU CB C 171 41.120 41.362 -0.242 1
1 254 . 3 1 1 A 18 18 LEU N N 171 117.490 118.707 -1.217 1
1 255 . 3 1 1 A 19 19 SER H H 172 8.970 7.877 1.093 1
1 256 . 3 1 1 A 19 19 SER HA H 172 3.840 4.030 -0.190 1
1 259 . 3 1 1 A 19 19 SER C C 172 176.820 176.787 0.033 1
1 260 . 3 1 1 A 19 19 SER CA C 172 63.190 62.245 0.945 1
1 261 . 3 1 1 A 19 19 SER CB C 172 59.730 62.896 -3.166 1
1 262 . 3 1 1 A 19 19 SER N N 172 115.970 114.208 1.762 1
1 263 . 3 1 1 A 20 20 HIS H H 173 7.600 7.792 -0.192 1
1 264 . 3 1 1 A 20 20 HIS HA H 173 4.080 4.298 -0.218 1
1 269 . 3 1 1 A 20 20 HIS C C 173 176.970 177.758 -0.788 1
1 270 . 3 1 1 A 20 20 HIS CA C 173 62.220 59.081 3.139 1
1 271 . 3 1 1 A 20 20 HIS CB C 173 27.440 29.995 -2.555 1
1 275 . 3 1 1 A 20 20 HIS N N 173 119.720 119.656 0.064 1
1 276 . 3 1 1 A 21 21 LEU H H 174 8.200 8.754 -0.554 1
1 277 . 3 1 1 A 21 21 LEU HA H 174 4.070 3.792 0.278 1
1 287 . 3 1 1 A 21 21 LEU C C 174 178.220 179.101 -0.881 1
1 288 . 3 1 1 A 21 21 LEU CA C 174 57.910 58.232 -0.322 1
1 289 . 3 1 1 A 21 21 LEU CB C 174 40.960 41.715 -0.755 1
1 293 . 3 1 1 A 21 21 LEU N N 174 120.780 119.891 0.889 1
1 294 . 3 1 1 A 22 22 LEU H H 175 8.510 8.479 0.031 1
1 295 . 3 1 1 A 22 22 LEU HA H 175 3.930 3.906 0.024 1
1 305 . 3 1 1 A 22 22 LEU C C 175 177.440 178.935 -1.495 1
1 306 . 3 1 1 A 22 22 LEU CA C 175 57.760 57.985 -0.225 1
1 307 . 3 1 1 A 22 22 LEU CB C 175 40.800 41.406 -0.606 1
1 311 . 3 1 1 A 22 22 LEU N N 175 118.600 118.053 0.547 1
1 312 . 3 1 1 A 23 23 ALA H H 176 7.830 8.354 -0.524 1
1 313 . 3 1 1 A 23 23 ALA HA H 176 3.970 4.114 -0.144 1
1 317 . 3 1 1 A 23 23 ALA C C 176 178.220 179.893 -1.673 1
1 318 . 3 1 1 A 23 23 ALA CA C 176 55.260 55.310 -0.050 1
1 319 . 3 1 1 A 23 23 ALA CB C 176 18.070 18.429 -0.359 1
1 320 . 3 1 1 A 23 23 ALA N N 176 121.030 121.659 -0.629 1
1 321 . 3 1 1 A 24 24 ILE H H 177 8.210 8.008 0.202 1
1 322 . 3 1 1 A 24 24 ILE HA H 177 3.900 3.744 0.156 1
1 332 . 3 1 1 A 24 24 ILE C C 177 178.380 177.914 0.466 1
1 333 . 3 1 1 A 24 24 ILE CA C 177 64.870 65.087 -0.217 1
1 334 . 3 1 1 A 24 24 ILE CB C 177 37.370 37.828 -0.458 1
1 338 . 3 1 1 A 24 24 ILE N N 177 118.330 118.576 -0.246 1
1 339 . 3 1 1 A 25 25 GLY H H 178 8.590 8.061 0.529 1
1 340 . 3 1 1 A 25 25 GLY HA2 H 178 3.600 3.777 -0.177 1
1 341 . 3 1 1 A 25 25 GLY HA3 H 178 3.630 3.789 -0.159 1
1 342 . 3 1 1 A 25 25 GLY C C 178 173.850 176.095 -2.245 1
1 343 . 3 1 1 A 25 25 GLY CA C 178 47.530 47.342 0.188 1
1 344 . 3 1 1 A 25 25 GLY N N 178 107.320 108.209 -0.889 1
1 345 . 3 1 1 A 26 26 LEU H H 179 8.830 8.267 0.563 1
1 346 . 3 1 1 A 26 26 LEU HA H 179 4.110 4.041 0.069 1
1 356 . 3 1 1 A 26 26 LEU C C 179 178.220 179.083 -0.863 1
1 357 . 3 1 1 A 26 26 LEU CA C 179 57.600 58.480 -0.880 1
1 358 . 3 1 1 A 26 26 LEU CB C 179 41.040 41.965 -0.925 1
1 362 . 3 1 1 A 26 26 LEU N N 179 122.350 122.445 -0.095 1
1 363 . 3 1 1 A 27 27 GLY H H 180 8.520 8.093 0.427 1
1 364 . 3 1 1 A 27 27 GLY HA2 H 180 3.760 3.794 -0.034 1
1 365 . 3 1 1 A 27 27 GLY HA3 H 180 4.520 3.804 0.716 1
1 366 . 3 1 1 A 27 27 GLY C C 180 174.160 176.103 -1.943 1
1 367 . 3 1 1 A 27 27 GLY CA C 180 47.920 47.461 0.459 1
1 368 . 3 1 1 A 27 27 GLY N N 180 106.260 105.345 0.915 1
1 369 . 3 1 1 A 28 28 ILE H H 181 8.780 7.969 0.811 1
1 370 . 3 1 1 A 28 28 ILE HA H 181 3.590 3.848 -0.258 1
1 380 . 3 1 1 A 28 28 ILE C C 181 177.130 177.368 -0.238 1
1 381 . 3 1 1 A 28 28 ILE CA C 181 65.340 64.604 0.736 1
1 382 . 3 1 1 A 28 28 ILE CB C 181 36.900 37.602 -0.702 1
1 386 . 3 1 1 A 28 28 ILE N N 181 123.970 122.540 1.430 1
1 387 . 3 1 1 A 29 29 TYR H H 182 8.110 8.356 -0.246 1
1 388 . 3 1 1 A 29 29 TYR HA H 182 3.880 4.105 -0.225 1
1 395 . 3 1 1 A 29 29 TYR C C 182 176.970 176.921 0.049 1
1 396 . 3 1 1 A 29 29 TYR CA C 182 61.900 61.763 0.137 1
1 397 . 3 1 1 A 29 29 TYR CB C 182 37.910 38.510 -0.600 1
1 403 . 3 1 1 A 29 29 TYR N N 182 119.570 120.388 -0.818 1
1 404 . 3 1 1 A 30 30 ILE H H 183 8.490 8.115 0.375 1
1 405 . 3 1 1 A 30 30 ILE HA H 183 3.400 3.702 -0.302 1
1 415 . 3 1 1 A 30 30 ILE C C 183 177.760 177.726 0.034 1
1 416 . 3 1 1 A 30 30 ILE CA C 183 65.020 65.168 -0.148 1
1 417 . 3 1 1 A 30 30 ILE CB C 183 37.600 38.111 -0.511 1
1 421 . 3 1 1 A 30 30 ILE N N 183 118.000 119.656 -1.656 1
1 422 . 3 1 1 A 31 31 GLY H H 184 9.360 8.099 1.261 1
1 423 . 3 1 1 A 31 31 GLY HA2 H 184 3.650 3.754 -0.104 1
1 424 . 3 1 1 A 31 31 GLY HA3 H 184 3.940 3.763 0.177 1
1 425 . 3 1 1 A 31 31 GLY C C 184 174.320 175.905 -1.585 1
1 426 . 3 1 1 A 31 31 GLY CA C 184 47.380 47.041 0.339 1
1 427 . 3 1 1 A 31 31 GLY N N 184 106.260 107.549 -1.289 1
1 428 . 3 1 1 A 32 32 ARG H H 185 8.090 8.957 -0.867 1
1 429 . 3 1 1 A 32 32 ARG HA H 185 4.030 4.138 -0.108 1
1 441 . 3 1 1 A 32 32 ARG C C 185 177.290 176.885 0.405 1
1 442 . 3 1 1 A 32 32 ARG CA C 185 57.050 57.914 -0.864 1
1 443 . 3 1 1 A 32 32 ARG CB C 185 29.630 29.599 0.031 1
1 447 . 3 1 1 A 32 32 ARG N N 185 118.050 120.426 -2.376 1
1 451 . 3 1 1 A 33 33 ARG H H 186 7.760 7.762 -0.002 1
1 452 . 3 1 1 A 33 33 ARG HA H 186 4.260 4.539 -0.279 1
1 464 . 3 1 1 A 33 33 ARG C C 186 176.190 176.370 -0.180 1
1 465 . 3 1 1 A 33 33 ARG CA C 186 55.670 55.102 0.568 1
1 466 . 3 1 1 A 33 33 ARG CB C 186 29.710 29.791 -0.081 1
1 470 . 3 1 1 A 33 33 ARG N N 186 117.390 119.042 -1.652 1
1 474 . 3 1 1 A 34 34 LEU H H 187 7.530 7.679 -0.149 1
1 475 . 3 1 1 A 34 34 LEU HA H 187 4.390 4.273 0.117 1
1 485 . 3 1 1 A 34 34 LEU C C 187 175.410 177.900 -2.490 1
1 486 . 3 1 1 A 34 34 LEU CA C 187 54.440 56.064 -1.624 1
1 487 . 3 1 1 A 34 34 LEU CB C 187 41.590 43.266 -1.676 1
1 491 . 3 1 1 A 34 34 LEU N N 187 119.360 123.284 -3.924 1
1 5 . 4 1 1 A 2 2 GLY H H 155 8.570 8.079 0.491 1
1 6 . 4 1 1 A 2 2 GLY HA2 H 155 3.950 4.191 -0.241 1
1 7 . 4 1 1 A 2 2 GLY HA3 H 155 4.070 4.197 -0.127 1
1 8 . 4 1 1 A 2 2 GLY C C 155 173.690 174.102 -0.412 1
1 9 . 4 1 1 A 2 2 GLY CA C 155 44.560 45.478 -0.918 1
1 10 . 4 1 1 A 2 2 GLY N N 155 108.940 109.734 -0.794 1
1 11 . 4 1 1 A 3 3 ILE H H 156 8.340 8.895 -0.555 1
1 12 . 4 1 1 A 3 3 ILE HA H 156 3.640 3.672 -0.032 1
1 22 . 4 1 1 A 3 3 ILE C C 156 174.470 177.347 -2.877 1
1 23 . 4 1 1 A 3 3 ILE CA C 156 62.060 64.602 -2.542 1
1 24 . 4 1 1 A 3 3 ILE CB C 156 37.680 38.022 -0.342 1
1 28 . 4 1 1 A 3 3 ILE N N 156 119.870 119.800 0.070 1
1 29 . 4 1 1 A 4 4 PHE H H 157 7.850 8.140 -0.290 1
1 30 . 4 1 1 A 4 4 PHE HA H 157 4.570 4.337 0.233 1
1 38 . 4 1 1 A 4 4 PHE C C 157 174.320 176.149 -1.829 1
1 39 . 4 1 1 A 4 4 PHE CA C 157 56.310 60.564 -4.254 1
1 40 . 4 1 1 A 4 4 PHE CB C 157 37.840 38.918 -1.078 1
1 47 . 4 1 1 A 4 4 PHE N N 157 117.790 119.335 -1.545 1
1 48 . 4 1 1 A 5 5 SER H H 158 7.970 7.924 0.046 1
1 49 . 4 1 1 A 5 5 SER HA H 158 4.560 4.168 0.392 1
1 52 . 4 1 1 A 5 5 SER C C 158 174.160 175.823 -1.663 1
1 53 . 4 1 1 A 5 5 SER CA C 158 57.010 60.820 -3.810 1
1 54 . 4 1 1 A 5 5 SER CB C 158 64.870 61.932 2.938 1
1 55 . 4 1 1 A 5 5 SER N N 158 115.670 112.937 2.733 1
1 56 . 4 1 1 A 6 6 ALA H H 159 9.000 8.479 0.521 1
1 57 . 4 1 1 A 6 6 ALA HA H 159 4.080 4.160 -0.080 1
1 61 . 4 1 1 A 6 6 ALA C C 159 178.290 180.270 -1.980 1
1 62 . 4 1 1 A 6 6 ALA CA C 159 54.850 55.462 -0.612 1
1 63 . 4 1 1 A 6 6 ALA CB C 159 18.070 18.306 -0.236 1
1 64 . 4 1 1 A 6 6 ALA N N 159 125.390 124.989 0.401 1
1 65 . 4 1 1 A 7 7 GLU H H 160 8.590 8.139 0.451 1
1 66 . 4 1 1 A 7 7 GLU HA H 160 3.990 4.172 -0.182 1
1 71 . 4 1 1 A 7 7 GLU C C 160 177.440 179.044 -1.604 1
1 72 . 4 1 1 A 7 7 GLU CA C 160 59.010 58.929 0.081 1
1 73 . 4 1 1 A 7 7 GLU CB C 160 28.220 29.517 -1.297 1
1 75 . 4 1 1 A 7 7 GLU N N 160 116.180 118.339 -2.159 1
1 76 . 4 1 1 A 8 8 PHE H H 161 7.860 8.397 -0.537 1
1 77 . 4 1 1 A 8 8 PHE HA H 161 4.330 4.172 0.158 1
1 85 . 4 1 1 A 8 8 PHE C C 161 177.130 177.392 -0.262 1
1 86 . 4 1 1 A 8 8 PHE CA C 161 60.330 61.352 -1.022 1
1 87 . 4 1 1 A 8 8 PHE CB C 161 39.160 39.325 -0.165 1
1 94 . 4 1 1 A 8 8 PHE N N 161 118.050 123.203 -5.153 1
1 95 . 4 1 1 A 9 9 LEU H H 162 8.240 9.430 -1.190 1
1 96 . 4 1 1 A 9 9 LEU HA H 162 3.990 3.983 0.007 1
1 106 . 4 1 1 A 9 9 LEU C C 162 177.130 179.755 -2.625 1
1 107 . 4 1 1 A 9 9 LEU CA C 162 57.990 58.092 -0.102 1
1 108 . 4 1 1 A 9 9 LEU CB C 162 41.510 41.539 -0.029 1
1 112 . 4 1 1 A 9 9 LEU N N 162 119.110 119.670 -0.560 1
1 113 . 4 1 1 A 10 10 LYS H H 163 7.950 9.218 -1.268 1
1 114 . 4 1 1 A 10 10 LYS HA H 163 3.920 4.157 -0.237 1
1 123 . 4 1 1 A 10 10 LYS C C 163 174.010 176.923 -2.913 1
1 124 . 4 1 1 A 10 10 LYS CA C 163 58.850 58.803 0.047 1
1 125 . 4 1 1 A 10 10 LYS CB C 163 32.290 31.743 0.547 1
1 129 . 4 1 1 A 10 10 LYS N N 163 115.320 117.955 -2.635 1
1 130 . 4 1 1 A 11 11 VAL H H 164 6.940 7.059 -0.119 1
1 131 . 4 1 1 A 11 11 VAL HA H 164 4.180 4.597 -0.417 1
1 139 . 4 1 1 A 11 11 VAL C C 164 177.290 176.439 0.851 1
1 140 . 4 1 1 A 11 11 VAL CA C 164 62.680 60.928 1.752 1
1 141 . 4 1 1 A 11 11 VAL CB C 164 32.680 31.734 0.946 1
1 144 . 4 1 1 A 11 11 VAL N N 164 110.250 114.863 -4.613 1
1 145 . 4 1 1 A 12 12 PHE H H 165 8.610 8.125 0.485 1
1 146 . 4 1 1 A 12 12 PHE HA H 165 4.180 4.030 0.150 1
1 154 . 4 1 1 A 12 12 PHE C C 165 175.720 177.384 -1.664 1
1 155 . 4 1 1 A 12 12 PHE CA C 165 60.410 60.885 -0.475 1
1 156 . 4 1 1 A 12 12 PHE CB C 165 40.330 39.549 0.781 1
1 163 . 4 1 1 A 12 12 PHE N N 165 121.290 121.903 -0.613 1
1 164 . 4 1 1 A 13 13 LEU H H 166 8.420 7.928 0.492 1
1 165 . 4 1 1 A 13 13 LEU HA H 166 4.160 3.796 0.364 1
1 175 . 4 1 1 A 13 13 LEU CA C 166 59.090 59.993 -0.903 1
1 176 . 4 1 1 A 13 13 LEU CB C 166 38.380 39.865 -1.485 1
1 180 . 4 1 1 A 13 13 LEU N N 166 115.420 120.106 -4.686 1
1 181 . 4 1 1 A 14 14 PRO HA H 167 4.130 4.306 -0.176 1
1 188 . 4 1 1 A 14 14 PRO C C 167 177.150 178.779 -1.629 1
1 189 . 4 1 1 A 14 14 PRO CA C 167 65.800 66.213 -0.413 1
1 190 . 4 1 1 A 14 14 PRO CB C 167 30.340 30.571 -0.231 1
1 193 . 4 1 1 A 15 15 SER H H 168 7.150 8.120 -0.970 1
1 194 . 4 1 1 A 15 15 SER HA H 168 4.040 4.102 -0.062 1
1 197 . 4 1 1 A 15 15 SER C C 168 174.160 177.416 -3.256 1
1 198 . 4 1 1 A 15 15 SER CA C 168 63.330 61.029 2.301 1
1 199 . 4 1 1 A 15 15 SER CB C 168 62.060 62.700 -0.640 1
1 200 . 4 1 1 A 15 15 SER N N 168 112.330 112.273 0.057 1
1 201 . 4 1 1 A 16 16 LEU H H 169 7.770 7.812 -0.042 1
1 202 . 4 1 1 A 16 16 LEU HA H 169 4.800 3.619 1.181 1
1 212 . 4 1 1 A 16 16 LEU C C 169 180.100 178.704 1.396 1
1 213 . 4 1 1 A 16 16 LEU CA C 169 55.340 57.914 -2.574 1
1 214 . 4 1 1 A 16 16 LEU CB C 169 41.980 41.581 0.399 1
1 218 . 4 1 1 A 16 16 LEU N N 169 120.480 121.841 -1.361 1
1 219 . 4 1 1 A 17 17 LEU H H 170 8.050 7.636 0.414 1
1 220 . 4 1 1 A 17 17 LEU HA H 170 4.070 4.146 -0.076 1
1 230 . 4 1 1 A 17 17 LEU C C 170 176.970 179.127 -2.157 1
1 231 . 4 1 1 A 17 17 LEU CA C 170 57.910 58.172 -0.262 1
1 232 . 4 1 1 A 17 17 LEU CB C 170 40.800 41.474 -0.674 1
1 236 . 4 1 1 A 17 17 LEU N N 170 122.150 118.272 3.878 1
1 237 . 4 1 1 A 18 18 LEU H H 171 7.940 7.820 0.120 1
1 238 . 4 1 1 A 18 18 LEU HA H 171 3.990 3.846 0.144 1
1 248 . 4 1 1 A 18 18 LEU C C 171 177.910 178.832 -0.922 1
1 249 . 4 1 1 A 18 18 LEU CA C 171 57.760 58.018 -0.258 1
1 250 . 4 1 1 A 18 18 LEU CB C 171 41.120 41.269 -0.149 1
1 254 . 4 1 1 A 18 18 LEU N N 171 117.490 118.622 -1.132 1
1 255 . 4 1 1 A 19 19 SER H H 172 8.970 8.279 0.691 1
1 256 . 4 1 1 A 19 19 SER HA H 172 3.840 3.982 -0.142 1
1 259 . 4 1 1 A 19 19 SER C C 172 176.820 176.546 0.274 1
1 260 . 4 1 1 A 19 19 SER CA C 172 63.190 62.364 0.826 1
1 261 . 4 1 1 A 19 19 SER CB C 172 59.730 62.913 -3.183 1
1 262 . 4 1 1 A 19 19 SER N N 172 115.970 114.218 1.752 1
1 263 . 4 1 1 A 20 20 HIS H H 173 7.600 7.871 -0.271 1
1 264 . 4 1 1 A 20 20 HIS HA H 173 4.080 4.280 -0.200 1
1 269 . 4 1 1 A 20 20 HIS C C 173 176.970 177.694 -0.724 1
1 270 . 4 1 1 A 20 20 HIS CA C 173 62.220 58.941 3.279 1
1 271 . 4 1 1 A 20 20 HIS CB C 173 27.440 30.090 -2.650 1
1 275 . 4 1 1 A 20 20 HIS N N 173 119.720 119.680 0.040 1
1 276 . 4 1 1 A 21 21 LEU H H 174 8.200 8.366 -0.166 1
1 277 . 4 1 1 A 21 21 LEU HA H 174 4.070 3.780 0.290 1
1 287 . 4 1 1 A 21 21 LEU C C 174 178.220 179.092 -0.872 1
1 288 . 4 1 1 A 21 21 LEU CA C 174 57.910 58.199 -0.289 1
1 289 . 4 1 1 A 21 21 LEU CB C 174 40.960 41.685 -0.725 1
1 293 . 4 1 1 A 21 21 LEU N N 174 120.780 119.865 0.915 1
1 294 . 4 1 1 A 22 22 LEU H H 175 8.510 8.703 -0.193 1
1 295 . 4 1 1 A 22 22 LEU HA H 175 3.930 3.883 0.047 1
1 305 . 4 1 1 A 22 22 LEU C C 175 177.440 179.154 -1.714 1
1 306 . 4 1 1 A 22 22 LEU CA C 175 57.760 58.045 -0.285 1
1 307 . 4 1 1 A 22 22 LEU CB C 175 40.800 41.267 -0.467 1
1 311 . 4 1 1 A 22 22 LEU N N 175 118.600 118.361 0.239 1
1 312 . 4 1 1 A 23 23 ALA H H 176 7.830 8.351 -0.521 1
1 313 . 4 1 1 A 23 23 ALA HA H 176 3.970 4.100 -0.130 1
1 317 . 4 1 1 A 23 23 ALA C C 176 178.220 179.955 -1.735 1
1 318 . 4 1 1 A 23 23 ALA CA C 176 55.260 55.334 -0.074 1
1 319 . 4 1 1 A 23 23 ALA CB C 176 18.070 18.242 -0.172 1
1 320 . 4 1 1 A 23 23 ALA N N 176 121.030 121.513 -0.483 1
1 321 . 4 1 1 A 24 24 ILE H H 177 8.210 8.015 0.195 1
1 322 . 4 1 1 A 24 24 ILE HA H 177 3.900 3.751 0.149 1
1 332 . 4 1 1 A 24 24 ILE C C 177 178.380 177.963 0.417 1
1 333 . 4 1 1 A 24 24 ILE CA C 177 64.870 65.098 -0.228 1
1 334 . 4 1 1 A 24 24 ILE CB C 177 37.370 37.788 -0.418 1
1 338 . 4 1 1 A 24 24 ILE N N 177 118.330 118.520 -0.190 1
1 339 . 4 1 1 A 25 25 GLY H H 178 8.590 8.098 0.492 1
1 340 . 4 1 1 A 25 25 GLY HA2 H 178 3.600 3.786 -0.186 1
1 341 . 4 1 1 A 25 25 GLY HA3 H 178 3.630 3.798 -0.168 1
1 342 . 4 1 1 A 25 25 GLY C C 178 173.850 176.179 -2.329 1
1 343 . 4 1 1 A 25 25 GLY CA C 178 47.530 47.307 0.223 1
1 344 . 4 1 1 A 25 25 GLY N N 178 107.320 107.899 -0.579 1
1 345 . 4 1 1 A 26 26 LEU H H 179 8.830 8.106 0.724 1
1 346 . 4 1 1 A 26 26 LEU HA H 179 4.110 4.035 0.075 1
1 356 . 4 1 1 A 26 26 LEU C C 179 178.220 179.042 -0.822 1
1 357 . 4 1 1 A 26 26 LEU CA C 179 57.600 58.531 -0.931 1
1 358 . 4 1 1 A 26 26 LEU CB C 179 41.040 41.992 -0.952 1
1 362 . 4 1 1 A 26 26 LEU N N 179 122.350 122.775 -0.425 1
1 363 . 4 1 1 A 27 27 GLY H H 180 8.520 8.119 0.401 1
1 364 . 4 1 1 A 27 27 GLY HA2 H 180 3.760 3.777 -0.017 1
1 365 . 4 1 1 A 27 27 GLY HA3 H 180 4.520 3.785 0.735 1
1 366 . 4 1 1 A 27 27 GLY C C 180 174.160 176.220 -2.060 1
1 367 . 4 1 1 A 27 27 GLY CA C 180 47.920 47.478 0.442 1
1 368 . 4 1 1 A 27 27 GLY N N 180 106.260 105.067 1.193 1
1 369 . 4 1 1 A 28 28 ILE H H 181 8.780 7.961 0.819 1
1 370 . 4 1 1 A 28 28 ILE HA H 181 3.590 3.857 -0.267 1
1 380 . 4 1 1 A 28 28 ILE C C 181 177.130 177.575 -0.445 1
1 381 . 4 1 1 A 28 28 ILE CA C 181 65.340 64.413 0.927 1
1 382 . 4 1 1 A 28 28 ILE CB C 181 36.900 37.494 -0.594 1
1 386 . 4 1 1 A 28 28 ILE N N 181 123.970 122.365 1.605 1
1 387 . 4 1 1 A 29 29 TYR H H 182 8.110 8.540 -0.430 1
1 388 . 4 1 1 A 29 29 TYR HA H 182 3.880 4.140 -0.260 1
1 395 . 4 1 1 A 29 29 TYR C C 182 176.970 177.267 -0.297 1
1 396 . 4 1 1 A 29 29 TYR CA C 182 61.900 61.626 0.274 1
1 397 . 4 1 1 A 29 29 TYR CB C 182 37.910 38.712 -0.802 1
1 403 . 4 1 1 A 29 29 TYR N N 182 119.570 120.506 -0.936 1
1 404 . 4 1 1 A 30 30 ILE H H 183 8.490 8.313 0.177 1
1 405 . 4 1 1 A 30 30 ILE HA H 183 3.400 3.808 -0.408 1
1 415 . 4 1 1 A 30 30 ILE C C 183 177.760 177.586 0.174 1
1 416 . 4 1 1 A 30 30 ILE CA C 183 65.020 65.001 0.019 1
1 417 . 4 1 1 A 30 30 ILE CB C 183 37.600 38.139 -0.539 1
1 421 . 4 1 1 A 30 30 ILE N N 183 118.000 119.201 -1.201 1
1 422 . 4 1 1 A 31 31 GLY H H 184 9.360 8.135 1.225 1
1 423 . 4 1 1 A 31 31 GLY HA2 H 184 3.650 3.763 -0.113 1
1 424 . 4 1 1 A 31 31 GLY HA3 H 184 3.940 3.765 0.175 1
1 425 . 4 1 1 A 31 31 GLY C C 184 174.320 175.901 -1.581 1
1 426 . 4 1 1 A 31 31 GLY CA C 184 47.380 47.093 0.287 1
1 427 . 4 1 1 A 31 31 GLY N N 184 106.260 107.437 -1.177 1
1 428 . 4 1 1 A 32 32 ARG H H 185 8.090 8.508 -0.418 1
1 429 . 4 1 1 A 32 32 ARG HA H 185 4.030 4.131 -0.101 1
1 441 . 4 1 1 A 32 32 ARG C C 185 177.290 176.600 0.690 1
1 442 . 4 1 1 A 32 32 ARG CA C 185 57.050 57.910 -0.860 1
1 443 . 4 1 1 A 32 32 ARG CB C 185 29.630 29.232 0.398 1
1 447 . 4 1 1 A 32 32 ARG N N 185 118.050 120.307 -2.257 1
1 451 . 4 1 1 A 33 33 ARG H H 186 7.760 7.609 0.151 1
1 452 . 4 1 1 A 33 33 ARG HA H 186 4.260 4.442 -0.182 1
1 464 . 4 1 1 A 33 33 ARG C C 186 176.190 176.305 -0.115 1
1 465 . 4 1 1 A 33 33 ARG CA C 186 55.670 55.555 0.115 1
1 466 . 4 1 1 A 33 33 ARG CB C 186 29.710 29.758 -0.048 1
1 470 . 4 1 1 A 33 33 ARG N N 186 117.390 117.358 0.032 1
1 474 . 4 1 1 A 34 34 LEU H H 187 7.530 7.318 0.212 1
1 475 . 4 1 1 A 34 34 LEU HA H 187 4.390 4.243 0.147 1
1 485 . 4 1 1 A 34 34 LEU C C 187 175.410 178.510 -3.100 1
1 486 . 4 1 1 A 34 34 LEU CA C 187 54.440 56.507 -2.067 1
1 487 . 4 1 1 A 34 34 LEU CB C 187 41.590 42.700 -1.110 1
1 491 . 4 1 1 A 34 34 LEU N N 187 119.360 121.715 -2.355 1
1 5 . 5 1 1 A 2 2 GLY H H 155 8.570 8.783 -0.213 1
1 6 . 5 1 1 A 2 2 GLY HA2 H 155 3.950 4.086 -0.136 1
1 7 . 5 1 1 A 2 2 GLY HA3 H 155 4.070 4.099 -0.029 1
1 8 . 5 1 1 A 2 2 GLY C C 155 173.690 174.628 -0.938 1
1 9 . 5 1 1 A 2 2 GLY CA C 155 44.560 44.491 0.069 1
1 10 . 5 1 1 A 2 2 GLY N N 155 108.940 111.067 -2.127 1
1 11 . 5 1 1 A 3 3 ILE H H 156 8.340 8.545 -0.205 1
1 12 . 5 1 1 A 3 3 ILE HA H 156 3.640 3.538 0.102 1
1 22 . 5 1 1 A 3 3 ILE C C 156 174.470 177.373 -2.903 1
1 23 . 5 1 1 A 3 3 ILE CA C 156 62.060 64.596 -2.536 1
1 24 . 5 1 1 A 3 3 ILE CB C 156 37.680 37.618 0.062 1
1 28 . 5 1 1 A 3 3 ILE N N 156 119.870 120.403 -0.533 1
1 29 . 5 1 1 A 4 4 PHE H H 157 7.850 7.883 -0.033 1
1 30 . 5 1 1 A 4 4 PHE HA H 157 4.570 4.306 0.264 1
1 38 . 5 1 1 A 4 4 PHE C C 157 174.320 176.273 -1.953 1
1 39 . 5 1 1 A 4 4 PHE CA C 157 56.310 60.718 -4.408 1
1 40 . 5 1 1 A 4 4 PHE CB C 157 37.840 39.320 -1.480 1
1 47 . 5 1 1 A 4 4 PHE N N 157 117.790 119.840 -2.050 1
1 48 . 5 1 1 A 5 5 SER H H 158 7.970 8.276 -0.306 1
1 49 . 5 1 1 A 5 5 SER HA H 158 4.560 4.366 0.194 1
1 52 . 5 1 1 A 5 5 SER C C 158 174.160 175.422 -1.262 1
1 53 . 5 1 1 A 5 5 SER CA C 158 57.010 60.724 -3.714 1
1 54 . 5 1 1 A 5 5 SER CB C 158 64.870 62.815 2.055 1
1 55 . 5 1 1 A 5 5 SER N N 158 115.670 114.000 1.670 1
1 56 . 5 1 1 A 6 6 ALA H H 159 9.000 8.449 0.551 1
1 57 . 5 1 1 A 6 6 ALA HA H 159 4.080 4.167 -0.087 1
1 61 . 5 1 1 A 6 6 ALA C C 159 178.290 179.403 -1.113 1
1 62 . 5 1 1 A 6 6 ALA CA C 159 54.850 55.461 -0.611 1
1 63 . 5 1 1 A 6 6 ALA CB C 159 18.070 18.440 -0.370 1
1 64 . 5 1 1 A 6 6 ALA N N 159 125.390 122.918 2.472 1
1 65 . 5 1 1 A 7 7 GLU H H 160 8.590 8.229 0.361 1
1 66 . 5 1 1 A 7 7 GLU HA H 160 3.990 4.106 -0.116 1
1 71 . 5 1 1 A 7 7 GLU C C 160 177.440 178.648 -1.208 1
1 72 . 5 1 1 A 7 7 GLU CA C 160 59.010 59.212 -0.202 1
1 73 . 5 1 1 A 7 7 GLU CB C 160 28.220 29.544 -1.324 1
1 75 . 5 1 1 A 7 7 GLU N N 160 116.180 118.641 -2.461 1
1 76 . 5 1 1 A 8 8 PHE H H 161 7.860 8.301 -0.441 1
1 77 . 5 1 1 A 8 8 PHE HA H 161 4.330 4.133 0.197 1
1 85 . 5 1 1 A 8 8 PHE C C 161 177.130 177.184 -0.054 1
1 86 . 5 1 1 A 8 8 PHE CA C 161 60.330 61.146 -0.816 1
1 87 . 5 1 1 A 8 8 PHE CB C 161 39.160 39.165 -0.005 1
1 94 . 5 1 1 A 8 8 PHE N N 161 118.050 120.996 -2.946 1
1 95 . 5 1 1 A 9 9 LEU H H 162 8.240 9.429 -1.189 1
1 96 . 5 1 1 A 9 9 LEU HA H 162 3.990 4.057 -0.067 1
1 106 . 5 1 1 A 9 9 LEU C C 162 177.130 179.693 -2.563 1
1 107 . 5 1 1 A 9 9 LEU CA C 162 57.990 57.913 0.077 1
1 108 . 5 1 1 A 9 9 LEU CB C 162 41.510 41.485 0.025 1
1 112 . 5 1 1 A 9 9 LEU N N 162 119.110 119.308 -0.198 1
1 113 . 5 1 1 A 10 10 LYS H H 163 7.950 9.037 -1.087 1
1 114 . 5 1 1 A 10 10 LYS HA H 163 3.920 4.162 -0.242 1
1 123 . 5 1 1 A 10 10 LYS C C 163 174.010 176.844 -2.834 1
1 124 . 5 1 1 A 10 10 LYS CA C 163 58.850 58.927 -0.077 1
1 125 . 5 1 1 A 10 10 LYS CB C 163 32.290 32.199 0.091 1
1 129 . 5 1 1 A 10 10 LYS N N 163 115.320 118.046 -2.726 1
1 130 . 5 1 1 A 11 11 VAL H H 164 6.940 7.133 -0.193 1
1 131 . 5 1 1 A 11 11 VAL HA H 164 4.180 4.544 -0.364 1
1 139 . 5 1 1 A 11 11 VAL C C 164 177.290 176.186 1.104 1
1 140 . 5 1 1 A 11 11 VAL CA C 164 62.680 60.637 2.043 1
1 141 . 5 1 1 A 11 11 VAL CB C 164 32.680 31.179 1.501 1
1 144 . 5 1 1 A 11 11 VAL N N 164 110.250 115.660 -5.410 1
1 145 . 5 1 1 A 12 12 PHE H H 165 8.610 8.099 0.511 1
1 146 . 5 1 1 A 12 12 PHE HA H 165 4.180 4.625 -0.445 1
1 154 . 5 1 1 A 12 12 PHE C C 165 175.720 177.064 -1.344 1
1 155 . 5 1 1 A 12 12 PHE CA C 165 60.410 59.692 0.718 1
1 156 . 5 1 1 A 12 12 PHE CB C 165 40.330 40.667 -0.337 1
1 163 . 5 1 1 A 12 12 PHE N N 165 121.290 120.530 0.760 1
1 164 . 5 1 1 A 13 13 LEU H H 166 8.420 7.499 0.921 1
1 165 . 5 1 1 A 13 13 LEU HA H 166 4.160 3.808 0.352 1
1 175 . 5 1 1 A 13 13 LEU CA C 166 59.090 59.961 -0.871 1
1 176 . 5 1 1 A 13 13 LEU CB C 166 38.380 39.818 -1.438 1
1 180 . 5 1 1 A 13 13 LEU N N 166 115.420 119.889 -4.469 1
1 181 . 5 1 1 A 14 14 PRO HA H 167 4.130 4.309 -0.179 1
1 188 . 5 1 1 A 14 14 PRO C C 167 177.150 178.862 -1.712 1
1 189 . 5 1 1 A 14 14 PRO CA C 167 65.800 66.098 -0.298 1
1 190 . 5 1 1 A 14 14 PRO CB C 167 30.340 30.525 -0.185 1
1 193 . 5 1 1 A 15 15 SER H H 168 7.150 8.182 -1.032 1
1 194 . 5 1 1 A 15 15 SER HA H 168 4.040 4.082 -0.042 1
1 197 . 5 1 1 A 15 15 SER C C 168 174.160 176.055 -1.895 1
1 198 . 5 1 1 A 15 15 SER CA C 168 63.330 61.523 1.807 1
1 199 . 5 1 1 A 15 15 SER CB C 168 62.060 62.803 -0.743 1
1 200 . 5 1 1 A 15 15 SER N N 168 112.330 114.086 -1.756 1
1 201 . 5 1 1 A 16 16 LEU H H 169 7.770 7.723 0.047 1
1 202 . 5 1 1 A 16 16 LEU HA H 169 4.800 3.656 1.144 1
1 212 . 5 1 1 A 16 16 LEU C C 169 180.100 179.018 1.082 1
1 213 . 5 1 1 A 16 16 LEU CA C 169 55.340 58.030 -2.690 1
1 214 . 5 1 1 A 16 16 LEU CB C 169 41.980 42.137 -0.157 1
1 218 . 5 1 1 A 16 16 LEU N N 169 120.480 120.332 0.148 1
1 219 . 5 1 1 A 17 17 LEU H H 170 8.050 8.122 -0.072 1
1 220 . 5 1 1 A 17 17 LEU HA H 170 4.070 4.149 -0.079 1
1 230 . 5 1 1 A 17 17 LEU C C 170 176.970 179.036 -2.066 1
1 231 . 5 1 1 A 17 17 LEU CA C 170 57.910 58.047 -0.137 1
1 232 . 5 1 1 A 17 17 LEU CB C 170 40.800 41.532 -0.732 1
1 236 . 5 1 1 A 17 17 LEU N N 170 122.150 117.169 4.981 1
1 237 . 5 1 1 A 18 18 LEU H H 171 7.940 8.265 -0.325 1
1 238 . 5 1 1 A 18 18 LEU HA H 171 3.990 3.834 0.156 1
1 248 . 5 1 1 A 18 18 LEU C C 171 177.910 179.274 -1.364 1
1 249 . 5 1 1 A 18 18 LEU CA C 171 57.760 57.933 -0.173 1
1 250 . 5 1 1 A 18 18 LEU CB C 171 41.120 41.361 -0.241 1
1 254 . 5 1 1 A 18 18 LEU N N 171 117.490 118.531 -1.041 1
1 255 . 5 1 1 A 19 19 SER H H 172 8.970 8.273 0.697 1
1 256 . 5 1 1 A 19 19 SER HA H 172 3.840 4.040 -0.200 1
1 259 . 5 1 1 A 19 19 SER C C 172 176.820 176.656 0.164 1
1 260 . 5 1 1 A 19 19 SER CA C 172 63.190 62.256 0.934 1
1 261 . 5 1 1 A 19 19 SER CB C 172 59.730 62.749 -3.019 1
1 262 . 5 1 1 A 19 19 SER N N 172 115.970 114.053 1.917 1
1 263 . 5 1 1 A 20 20 HIS H H 173 7.600 7.783 -0.183 1
1 264 . 5 1 1 A 20 20 HIS HA H 173 4.080 4.335 -0.255 1
1 269 . 5 1 1 A 20 20 HIS C C 173 176.970 177.688 -0.718 1
1 270 . 5 1 1 A 20 20 HIS CA C 173 62.220 58.936 3.284 1
1 271 . 5 1 1 A 20 20 HIS CB C 173 27.440 30.229 -2.789 1
1 275 . 5 1 1 A 20 20 HIS N N 173 119.720 119.572 0.148 1
1 276 . 5 1 1 A 21 21 LEU H H 174 8.200 8.526 -0.326 1
1 277 . 5 1 1 A 21 21 LEU HA H 174 4.070 3.818 0.252 1
1 287 . 5 1 1 A 21 21 LEU C C 174 178.220 179.066 -0.846 1
1 288 . 5 1 1 A 21 21 LEU CA C 174 57.910 58.175 -0.265 1
1 289 . 5 1 1 A 21 21 LEU CB C 174 40.960 41.993 -1.033 1
1 293 . 5 1 1 A 21 21 LEU N N 174 120.780 119.890 0.890 1
1 294 . 5 1 1 A 22 22 LEU H H 175 8.510 8.305 0.205 1
1 295 . 5 1 1 A 22 22 LEU HA H 175 3.930 3.877 0.053 1
1 305 . 5 1 1 A 22 22 LEU C C 175 177.440 178.880 -1.440 1
1 306 . 5 1 1 A 22 22 LEU CA C 175 57.760 57.982 -0.222 1
1 307 . 5 1 1 A 22 22 LEU CB C 175 40.800 41.414 -0.614 1
1 311 . 5 1 1 A 22 22 LEU N N 175 118.600 118.124 0.476 1
1 312 . 5 1 1 A 23 23 ALA H H 176 7.830 8.503 -0.673 1
1 313 . 5 1 1 A 23 23 ALA HA H 176 3.970 4.057 -0.087 1
1 317 . 5 1 1 A 23 23 ALA C C 176 178.220 179.968 -1.748 1
1 318 . 5 1 1 A 23 23 ALA CA C 176 55.260 55.336 -0.076 1
1 319 . 5 1 1 A 23 23 ALA CB C 176 18.070 18.334 -0.264 1
1 320 . 5 1 1 A 23 23 ALA N N 176 121.030 121.745 -0.715 1
1 321 . 5 1 1 A 24 24 ILE H H 177 8.210 7.985 0.225 1
1 322 . 5 1 1 A 24 24 ILE HA H 177 3.900 3.750 0.150 1
1 332 . 5 1 1 A 24 24 ILE C C 177 178.380 177.963 0.417 1
1 333 . 5 1 1 A 24 24 ILE CA C 177 64.870 65.076 -0.206 1
1 334 . 5 1 1 A 24 24 ILE CB C 177 37.370 37.699 -0.329 1
1 338 . 5 1 1 A 24 24 ILE N N 177 118.330 118.400 -0.070 1
1 339 . 5 1 1 A 25 25 GLY H H 178 8.590 8.039 0.551 1
1 340 . 5 1 1 A 25 25 GLY HA2 H 178 3.600 3.798 -0.198 1
1 341 . 5 1 1 A 25 25 GLY HA3 H 178 3.630 3.821 -0.191 1
1 342 . 5 1 1 A 25 25 GLY C C 178 173.850 176.095 -2.245 1
1 343 . 5 1 1 A 25 25 GLY CA C 178 47.530 47.390 0.140 1
1 344 . 5 1 1 A 25 25 GLY N N 178 107.320 108.139 -0.819 1
1 345 . 5 1 1 A 26 26 LEU H H 179 8.830 8.488 0.342 1
1 346 . 5 1 1 A 26 26 LEU HA H 179 4.110 4.042 0.068 1
1 356 . 5 1 1 A 26 26 LEU C C 179 178.220 179.055 -0.835 1
1 357 . 5 1 1 A 26 26 LEU CA C 179 57.600 58.519 -0.919 1
1 358 . 5 1 1 A 26 26 LEU CB C 179 41.040 42.016 -0.976 1
1 362 . 5 1 1 A 26 26 LEU N N 179 122.350 122.758 -0.408 1
1 363 . 5 1 1 A 27 27 GLY H H 180 8.520 8.097 0.423 1
1 364 . 5 1 1 A 27 27 GLY HA2 H 180 3.760 3.789 -0.029 1
1 365 . 5 1 1 A 27 27 GLY HA3 H 180 4.520 3.795 0.725 1
1 366 . 5 1 1 A 27 27 GLY C C 180 174.160 175.950 -1.790 1
1 367 . 5 1 1 A 27 27 GLY CA C 180 47.920 47.470 0.450 1
1 368 . 5 1 1 A 27 27 GLY N N 180 106.260 105.465 0.795 1
1 369 . 5 1 1 A 28 28 ILE H H 181 8.780 8.070 0.710 1
1 370 . 5 1 1 A 28 28 ILE HA H 181 3.590 3.860 -0.270 1
1 380 . 5 1 1 A 28 28 ILE C C 181 177.130 177.682 -0.552 1
1 381 . 5 1 1 A 28 28 ILE CA C 181 65.340 64.504 0.836 1
1 382 . 5 1 1 A 28 28 ILE CB C 181 36.900 37.402 -0.502 1
1 386 . 5 1 1 A 28 28 ILE N N 181 123.970 122.396 1.574 1
1 387 . 5 1 1 A 29 29 TYR H H 182 8.110 8.899 -0.789 1
1 388 . 5 1 1 A 29 29 TYR HA H 182 3.880 4.114 -0.234 1
1 395 . 5 1 1 A 29 29 TYR C C 182 176.970 176.822 0.148 1
1 396 . 5 1 1 A 29 29 TYR CA C 182 61.900 61.693 0.207 1
1 397 . 5 1 1 A 29 29 TYR CB C 182 37.910 38.392 -0.482 1
1 403 . 5 1 1 A 29 29 TYR N N 182 119.570 120.648 -1.078 1
1 404 . 5 1 1 A 30 30 ILE H H 183 8.490 8.376 0.114 1
1 405 . 5 1 1 A 30 30 ILE HA H 183 3.400 3.725 -0.325 1
1 415 . 5 1 1 A 30 30 ILE C C 183 177.760 177.689 0.071 1
1 416 . 5 1 1 A 30 30 ILE CA C 183 65.020 65.038 -0.018 1
1 417 . 5 1 1 A 30 30 ILE CB C 183 37.600 37.990 -0.390 1
1 421 . 5 1 1 A 30 30 ILE N N 183 118.000 119.334 -1.334 1
1 422 . 5 1 1 A 31 31 GLY H H 184 9.360 8.295 1.065 1
1 423 . 5 1 1 A 31 31 GLY HA2 H 184 3.650 3.781 -0.131 1
1 424 . 5 1 1 A 31 31 GLY HA3 H 184 3.940 3.789 0.151 1
1 425 . 5 1 1 A 31 31 GLY C C 184 174.320 175.875 -1.555 1
1 426 . 5 1 1 A 31 31 GLY CA C 184 47.380 47.057 0.323 1
1 427 . 5 1 1 A 31 31 GLY N N 184 106.260 107.462 -1.202 1
1 428 . 5 1 1 A 32 32 ARG H H 185 8.090 9.216 -1.126 1
1 429 . 5 1 1 A 32 32 ARG HA H 185 4.030 4.143 -0.113 1
1 441 . 5 1 1 A 32 32 ARG C C 185 177.290 177.004 0.286 1
1 442 . 5 1 1 A 32 32 ARG CA C 185 57.050 57.974 -0.924 1
1 443 . 5 1 1 A 32 32 ARG CB C 185 29.630 29.594 0.036 1
1 447 . 5 1 1 A 32 32 ARG N N 185 118.050 120.509 -2.459 1
1 451 . 5 1 1 A 33 33 ARG H H 186 7.760 7.233 0.527 1
1 452 . 5 1 1 A 33 33 ARG HA H 186 4.260 4.629 -0.369 1
1 464 . 5 1 1 A 33 33 ARG C C 186 176.190 176.515 -0.325 1
1 465 . 5 1 1 A 33 33 ARG CA C 186 55.670 54.818 0.852 1
1 466 . 5 1 1 A 33 33 ARG CB C 186 29.710 30.061 -0.351 1
1 470 . 5 1 1 A 33 33 ARG N N 186 117.390 118.825 -1.435 1
1 474 . 5 1 1 A 34 34 LEU H H 187 7.530 7.540 -0.010 1
1 475 . 5 1 1 A 34 34 LEU HA H 187 4.390 4.206 0.184 1
1 485 . 5 1 1 A 34 34 LEU C C 187 175.410 178.033 -2.623 1
1 486 . 5 1 1 A 34 34 LEU CA C 187 54.440 56.160 -1.720 1
1 487 . 5 1 1 A 34 34 LEU CB C 187 41.590 42.793 -1.203 1
1 491 . 5 1 1 A 34 34 LEU N N 187 119.360 120.215 -0.855 1
1 5 . 6 1 1 A 2 2 GLY H H 155 8.570 7.432 1.138 1
1 6 . 6 1 1 A 2 2 GLY HA2 H 155 3.950 4.042 -0.092 1
1 7 . 6 1 1 A 2 2 GLY HA3 H 155 4.070 4.048 0.022 1
1 8 . 6 1 1 A 2 2 GLY C C 155 173.690 174.411 -0.721 1
1 9 . 6 1 1 A 2 2 GLY CA C 155 44.560 45.659 -1.099 1
1 10 . 6 1 1 A 2 2 GLY N N 155 108.940 103.621 5.319 1
1 11 . 6 1 1 A 3 3 ILE H H 156 8.340 8.833 -0.493 1
1 12 . 6 1 1 A 3 3 ILE HA H 156 3.640 3.703 -0.063 1
1 22 . 6 1 1 A 3 3 ILE C C 156 174.470 177.694 -3.224 1
1 23 . 6 1 1 A 3 3 ILE CA C 156 62.060 63.849 -1.789 1
1 24 . 6 1 1 A 3 3 ILE CB C 156 37.680 37.096 0.584 1
1 28 . 6 1 1 A 3 3 ILE N N 156 119.870 119.602 0.268 1
1 29 . 6 1 1 A 4 4 PHE H H 157 7.850 7.660 0.190 1
1 30 . 6 1 1 A 4 4 PHE HA H 157 4.570 4.271 0.299 1
1 38 . 6 1 1 A 4 4 PHE C C 157 174.320 176.385 -2.065 1
1 39 . 6 1 1 A 4 4 PHE CA C 157 56.310 60.673 -4.363 1
1 40 . 6 1 1 A 4 4 PHE CB C 157 37.840 38.894 -1.054 1
1 47 . 6 1 1 A 4 4 PHE N N 157 117.790 120.988 -3.198 1
1 48 . 6 1 1 A 5 5 SER H H 158 7.970 8.228 -0.258 1
1 49 . 6 1 1 A 5 5 SER HA H 158 4.560 4.422 0.138 1
1 52 . 6 1 1 A 5 5 SER C C 158 174.160 175.373 -1.213 1
1 53 . 6 1 1 A 5 5 SER CA C 158 57.010 60.820 -3.810 1
1 54 . 6 1 1 A 5 5 SER CB C 158 64.870 62.862 2.008 1
1 55 . 6 1 1 A 5 5 SER N N 158 115.670 114.073 1.597 1
1 56 . 6 1 1 A 6 6 ALA H H 159 9.000 8.368 0.632 1
1 57 . 6 1 1 A 6 6 ALA HA H 159 4.080 4.117 -0.037 1
1 61 . 6 1 1 A 6 6 ALA C C 159 178.290 179.722 -1.432 1
1 62 . 6 1 1 A 6 6 ALA CA C 159 54.850 55.352 -0.502 1
1 63 . 6 1 1 A 6 6 ALA CB C 159 18.070 18.585 -0.515 1
1 64 . 6 1 1 A 6 6 ALA N N 159 125.390 122.658 2.732 1
1 65 . 6 1 1 A 7 7 GLU H H 160 8.590 7.832 0.758 1
1 66 . 6 1 1 A 7 7 GLU HA H 160 3.990 4.146 -0.156 1
1 71 . 6 1 1 A 7 7 GLU C C 160 177.440 178.762 -1.322 1
1 72 . 6 1 1 A 7 7 GLU CA C 160 59.010 59.060 -0.050 1
1 73 . 6 1 1 A 7 7 GLU CB C 160 28.220 29.718 -1.498 1
1 75 . 6 1 1 A 7 7 GLU N N 160 116.180 118.748 -2.568 1
1 76 . 6 1 1 A 8 8 PHE H H 161 7.860 8.467 -0.607 1
1 77 . 6 1 1 A 8 8 PHE HA H 161 4.330 4.158 0.172 1
1 85 . 6 1 1 A 8 8 PHE C C 161 177.130 177.148 -0.018 1
1 86 . 6 1 1 A 8 8 PHE CA C 161 60.330 61.447 -1.117 1
1 87 . 6 1 1 A 8 8 PHE CB C 161 39.160 38.987 0.173 1
1 94 . 6 1 1 A 8 8 PHE N N 161 118.050 121.070 -3.020 1
1 95 . 6 1 1 A 9 9 LEU H H 162 8.240 8.957 -0.717 1
1 96 . 6 1 1 A 9 9 LEU HA H 162 3.990 3.862 0.128 1
1 106 . 6 1 1 A 9 9 LEU C C 162 177.130 179.664 -2.534 1
1 107 . 6 1 1 A 9 9 LEU CA C 162 57.990 57.965 0.025 1
1 108 . 6 1 1 A 9 9 LEU CB C 162 41.510 41.379 0.131 1
1 112 . 6 1 1 A 9 9 LEU N N 162 119.110 119.435 -0.325 1
1 113 . 6 1 1 A 10 10 LYS H H 163 7.950 8.688 -0.738 1
1 114 . 6 1 1 A 10 10 LYS HA H 163 3.920 4.139 -0.219 1
1 123 . 6 1 1 A 10 10 LYS C C 163 174.010 176.930 -2.920 1
1 124 . 6 1 1 A 10 10 LYS CA C 163 58.850 58.864 -0.014 1
1 125 . 6 1 1 A 10 10 LYS CB C 163 32.290 31.918 0.372 1
1 129 . 6 1 1 A 10 10 LYS N N 163 115.320 118.039 -2.719 1
1 130 . 6 1 1 A 11 11 VAL H H 164 6.940 7.154 -0.214 1
1 131 . 6 1 1 A 11 11 VAL HA H 164 4.180 4.562 -0.382 1
1 139 . 6 1 1 A 11 11 VAL C C 164 177.290 176.025 1.265 1
1 140 . 6 1 1 A 11 11 VAL CA C 164 62.680 60.706 1.974 1
1 141 . 6 1 1 A 11 11 VAL CB C 164 32.680 31.427 1.253 1
1 144 . 6 1 1 A 11 11 VAL N N 164 110.250 115.114 -4.864 1
1 145 . 6 1 1 A 12 12 PHE H H 165 8.610 7.915 0.695 1
1 146 . 6 1 1 A 12 12 PHE HA H 165 4.180 4.788 -0.608 1
1 154 . 6 1 1 A 12 12 PHE C C 165 175.720 177.047 -1.327 1
1 155 . 6 1 1 A 12 12 PHE CA C 165 60.410 59.303 1.107 1
1 156 . 6 1 1 A 12 12 PHE CB C 165 40.330 40.867 -0.537 1
1 163 . 6 1 1 A 12 12 PHE N N 165 121.290 120.929 0.361 1
1 164 . 6 1 1 A 13 13 LEU H H 166 8.420 7.699 0.721 1
1 165 . 6 1 1 A 13 13 LEU HA H 166 4.160 3.835 0.325 1
1 175 . 6 1 1 A 13 13 LEU CA C 166 59.090 59.965 -0.875 1
1 176 . 6 1 1 A 13 13 LEU CB C 166 38.380 39.669 -1.289 1
1 180 . 6 1 1 A 13 13 LEU N N 166 115.420 119.926 -4.506 1
1 181 . 6 1 1 A 14 14 PRO HA H 167 4.130 4.371 -0.241 1
1 188 . 6 1 1 A 14 14 PRO C C 167 177.150 177.602 -0.452 1
1 189 . 6 1 1 A 14 14 PRO CA C 167 65.800 64.527 1.273 1
1 190 . 6 1 1 A 14 14 PRO CB C 167 30.340 31.431 -1.091 1
1 193 . 6 1 1 A 15 15 SER H H 168 7.150 8.144 -0.994 1
1 194 . 6 1 1 A 15 15 SER HA H 168 4.040 4.156 -0.116 1
1 197 . 6 1 1 A 15 15 SER C C 168 174.160 177.229 -3.069 1
1 198 . 6 1 1 A 15 15 SER CA C 168 63.330 61.128 2.202 1
1 199 . 6 1 1 A 15 15 SER CB C 168 62.060 62.624 -0.564 1
1 200 . 6 1 1 A 15 15 SER N N 168 112.330 113.662 -1.332 1
1 201 . 6 1 1 A 16 16 LEU H H 169 7.770 7.673 0.097 1
1 202 . 6 1 1 A 16 16 LEU HA H 169 4.800 3.692 1.108 1
1 212 . 6 1 1 A 16 16 LEU C C 169 180.100 179.097 1.003 1
1 213 . 6 1 1 A 16 16 LEU CA C 169 55.340 58.034 -2.694 1
1 214 . 6 1 1 A 16 16 LEU CB C 169 41.980 41.801 0.179 1
1 218 . 6 1 1 A 16 16 LEU N N 169 120.480 123.016 -2.536 1
1 219 . 6 1 1 A 17 17 LEU H H 170 8.050 8.130 -0.080 1
1 220 . 6 1 1 A 17 17 LEU HA H 170 4.070 4.143 -0.073 1
1 230 . 6 1 1 A 17 17 LEU C C 170 176.970 179.282 -2.312 1
1 231 . 6 1 1 A 17 17 LEU CA C 170 57.910 58.142 -0.232 1
1 232 . 6 1 1 A 17 17 LEU CB C 170 40.800 41.538 -0.738 1
1 236 . 6 1 1 A 17 17 LEU N N 170 122.150 117.847 4.303 1
1 237 . 6 1 1 A 18 18 LEU H H 171 7.940 7.829 0.111 1
1 238 . 6 1 1 A 18 18 LEU HA H 171 3.990 3.834 0.156 1
1 248 . 6 1 1 A 18 18 LEU C C 171 177.910 179.150 -1.240 1
1 249 . 6 1 1 A 18 18 LEU CA C 171 57.760 58.055 -0.295 1
1 250 . 6 1 1 A 18 18 LEU CB C 171 41.120 41.244 -0.124 1
1 254 . 6 1 1 A 18 18 LEU N N 171 117.490 118.885 -1.395 1
1 255 . 6 1 1 A 19 19 SER H H 172 8.970 8.019 0.951 1
1 256 . 6 1 1 A 19 19 SER HA H 172 3.840 3.988 -0.148 1
1 259 . 6 1 1 A 19 19 SER C C 172 176.820 176.660 0.160 1
1 260 . 6 1 1 A 19 19 SER CA C 172 63.190 62.277 0.913 1
1 261 . 6 1 1 A 19 19 SER CB C 172 59.730 62.687 -2.957 1
1 262 . 6 1 1 A 19 19 SER N N 172 115.970 114.288 1.682 1
1 263 . 6 1 1 A 20 20 HIS H H 173 7.600 7.779 -0.179 1
1 264 . 6 1 1 A 20 20 HIS HA H 173 4.080 4.304 -0.224 1
1 269 . 6 1 1 A 20 20 HIS C C 173 176.970 177.710 -0.740 1
1 270 . 6 1 1 A 20 20 HIS CA C 173 62.220 58.834 3.386 1
1 271 . 6 1 1 A 20 20 HIS CB C 173 27.440 30.075 -2.635 1
1 275 . 6 1 1 A 20 20 HIS N N 173 119.720 119.675 0.045 1
1 276 . 6 1 1 A 21 21 LEU H H 174 8.200 8.403 -0.203 1
1 277 . 6 1 1 A 21 21 LEU HA H 174 4.070 3.778 0.292 1
1 287 . 6 1 1 A 21 21 LEU C C 174 178.220 179.075 -0.855 1
1 288 . 6 1 1 A 21 21 LEU CA C 174 57.910 58.098 -0.188 1
1 289 . 6 1 1 A 21 21 LEU CB C 174 40.960 41.574 -0.614 1
1 293 . 6 1 1 A 21 21 LEU N N 174 120.780 119.874 0.906 1
1 294 . 6 1 1 A 22 22 LEU H H 175 8.510 8.633 -0.123 1
1 295 . 6 1 1 A 22 22 LEU HA H 175 3.930 3.894 0.036 1
1 305 . 6 1 1 A 22 22 LEU C C 175 177.440 178.920 -1.480 1
1 306 . 6 1 1 A 22 22 LEU CA C 175 57.760 57.977 -0.217 1
1 307 . 6 1 1 A 22 22 LEU CB C 175 40.800 41.368 -0.568 1
1 311 . 6 1 1 A 22 22 LEU N N 175 118.600 118.339 0.261 1
1 312 . 6 1 1 A 23 23 ALA H H 176 7.830 8.503 -0.673 1
1 313 . 6 1 1 A 23 23 ALA HA H 176 3.970 4.099 -0.129 1
1 317 . 6 1 1 A 23 23 ALA C C 176 178.220 179.857 -1.637 1
1 318 . 6 1 1 A 23 23 ALA CA C 176 55.260 55.325 -0.065 1
1 319 . 6 1 1 A 23 23 ALA CB C 176 18.070 18.391 -0.321 1
1 320 . 6 1 1 A 23 23 ALA N N 176 121.030 121.633 -0.603 1
1 321 . 6 1 1 A 24 24 ILE H H 177 8.210 7.958 0.252 1
1 322 . 6 1 1 A 24 24 ILE HA H 177 3.900 3.730 0.170 1
1 332 . 6 1 1 A 24 24 ILE C C 177 178.380 177.886 0.494 1
1 333 . 6 1 1 A 24 24 ILE CA C 177 64.870 65.078 -0.208 1
1 334 . 6 1 1 A 24 24 ILE CB C 177 37.370 37.747 -0.377 1
1 338 . 6 1 1 A 24 24 ILE N N 177 118.330 118.410 -0.080 1
1 339 . 6 1 1 A 25 25 GLY H H 178 8.590 8.264 0.326 1
1 340 . 6 1 1 A 25 25 GLY HA2 H 178 3.600 3.767 -0.167 1
1 341 . 6 1 1 A 25 25 GLY HA3 H 178 3.630 3.780 -0.150 1
1 342 . 6 1 1 A 25 25 GLY C C 178 173.850 176.139 -2.289 1
1 343 . 6 1 1 A 25 25 GLY CA C 178 47.530 47.323 0.207 1
1 344 . 6 1 1 A 25 25 GLY N N 178 107.320 108.434 -1.114 1
1 345 . 6 1 1 A 26 26 LEU H H 179 8.830 8.178 0.652 1
1 346 . 6 1 1 A 26 26 LEU HA H 179 4.110 4.034 0.076 1
1 356 . 6 1 1 A 26 26 LEU C C 179 178.220 179.032 -0.812 1
1 357 . 6 1 1 A 26 26 LEU CA C 179 57.600 58.550 -0.950 1
1 358 . 6 1 1 A 26 26 LEU CB C 179 41.040 42.006 -0.966 1
1 362 . 6 1 1 A 26 26 LEU N N 179 122.350 122.589 -0.239 1
1 363 . 6 1 1 A 27 27 GLY H H 180 8.520 8.086 0.434 1
1 364 . 6 1 1 A 27 27 GLY HA2 H 180 3.760 3.786 -0.026 1
1 365 . 6 1 1 A 27 27 GLY HA3 H 180 4.520 3.796 0.724 1
1 366 . 6 1 1 A 27 27 GLY C C 180 174.160 176.288 -2.128 1
1 367 . 6 1 1 A 27 27 GLY CA C 180 47.920 47.463 0.457 1
1 368 . 6 1 1 A 27 27 GLY N N 180 106.260 105.092 1.168 1
1 369 . 6 1 1 A 28 28 ILE H H 181 8.780 8.127 0.653 1
1 370 . 6 1 1 A 28 28 ILE HA H 181 3.590 3.860 -0.270 1
1 380 . 6 1 1 A 28 28 ILE C C 181 177.130 177.630 -0.500 1
1 381 . 6 1 1 A 28 28 ILE CA C 181 65.340 64.438 0.902 1
1 382 . 6 1 1 A 28 28 ILE CB C 181 36.900 37.480 -0.580 1
1 386 . 6 1 1 A 28 28 ILE N N 181 123.970 122.495 1.475 1
1 387 . 6 1 1 A 29 29 TYR H H 182 8.110 8.373 -0.263 1
1 388 . 6 1 1 A 29 29 TYR HA H 182 3.880 4.091 -0.211 1
1 395 . 6 1 1 A 29 29 TYR C C 182 176.970 176.816 0.154 1
1 396 . 6 1 1 A 29 29 TYR CA C 182 61.900 61.609 0.291 1
1 397 . 6 1 1 A 29 29 TYR CB C 182 37.910 38.448 -0.538 1
1 403 . 6 1 1 A 29 29 TYR N N 182 119.570 121.103 -1.533 1
1 404 . 6 1 1 A 30 30 ILE H H 183 8.490 8.097 0.393 1
1 405 . 6 1 1 A 30 30 ILE HA H 183 3.400 3.732 -0.332 1
1 415 . 6 1 1 A 30 30 ILE C C 183 177.760 177.626 0.134 1
1 416 . 6 1 1 A 30 30 ILE CA C 183 65.020 64.969 0.051 1
1 417 . 6 1 1 A 30 30 ILE CB C 183 37.600 38.092 -0.492 1
1 421 . 6 1 1 A 30 30 ILE N N 183 118.000 119.395 -1.395 1
1 422 . 6 1 1 A 31 31 GLY H H 184 9.360 7.983 1.377 1
1 423 . 6 1 1 A 31 31 GLY HA2 H 184 3.650 3.765 -0.115 1
1 424 . 6 1 1 A 31 31 GLY HA3 H 184 3.940 3.772 0.168 1
1 425 . 6 1 1 A 31 31 GLY C C 184 174.320 176.005 -1.685 1
1 426 . 6 1 1 A 31 31 GLY CA C 184 47.380 47.030 0.350 1
1 427 . 6 1 1 A 31 31 GLY N N 184 106.260 107.153 -0.893 1
1 428 . 6 1 1 A 32 32 ARG H H 185 8.090 8.944 -0.854 1
1 429 . 6 1 1 A 32 32 ARG HA H 185 4.030 4.061 -0.031 1
1 441 . 6 1 1 A 32 32 ARG C C 185 177.290 176.627 0.663 1
1 442 . 6 1 1 A 32 32 ARG CA C 185 57.050 58.712 -1.662 1
1 443 . 6 1 1 A 32 32 ARG CB C 185 29.630 30.096 -0.466 1
1 447 . 6 1 1 A 32 32 ARG N N 185 118.050 120.896 -2.846 1
1 451 . 6 1 1 A 33 33 ARG H H 186 7.760 7.569 0.191 1
1 452 . 6 1 1 A 33 33 ARG HA H 186 4.260 4.217 0.043 1
1 464 . 6 1 1 A 33 33 ARG C C 186 176.190 176.097 0.093 1
1 465 . 6 1 1 A 33 33 ARG CA C 186 55.670 55.904 -0.234 1
1 466 . 6 1 1 A 33 33 ARG CB C 186 29.710 29.968 -0.258 1
1 470 . 6 1 1 A 33 33 ARG N N 186 117.390 117.802 -0.412 1
1 474 . 6 1 1 A 34 34 LEU H H 187 7.530 7.626 -0.096 1
1 475 . 6 1 1 A 34 34 LEU HA H 187 4.390 4.229 0.161 1
1 485 . 6 1 1 A 34 34 LEU C C 187 175.410 177.537 -2.127 1
1 486 . 6 1 1 A 34 34 LEU CA C 187 54.440 56.307 -1.867 1
1 487 . 6 1 1 A 34 34 LEU CB C 187 41.590 43.471 -1.881 1
1 491 . 6 1 1 A 34 34 LEU N N 187 119.360 120.802 -1.442 1
1 5 . 7 1 1 A 2 2 GLY H H 155 8.570 8.672 -0.102 1
1 6 . 7 1 1 A 2 2 GLY HA2 H 155 3.950 4.098 -0.148 1
1 7 . 7 1 1 A 2 2 GLY HA3 H 155 4.070 4.106 -0.036 1
1 8 . 7 1 1 A 2 2 GLY C C 155 173.690 174.728 -1.038 1
1 9 . 7 1 1 A 2 2 GLY CA C 155 44.560 44.805 -0.245 1
1 10 . 7 1 1 A 2 2 GLY N N 155 108.940 107.836 1.104 1
1 11 . 7 1 1 A 3 3 ILE H H 156 8.340 8.600 -0.260 1
1 12 . 7 1 1 A 3 3 ILE HA H 156 3.640 3.566 0.074 1
1 22 . 7 1 1 A 3 3 ILE C C 156 174.470 177.384 -2.914 1
1 23 . 7 1 1 A 3 3 ILE CA C 156 62.060 64.644 -2.584 1
1 24 . 7 1 1 A 3 3 ILE CB C 156 37.680 37.992 -0.312 1
1 28 . 7 1 1 A 3 3 ILE N N 156 119.870 121.561 -1.691 1
1 29 . 7 1 1 A 4 4 PHE H H 157 7.850 8.101 -0.251 1
1 30 . 7 1 1 A 4 4 PHE HA H 157 4.570 4.298 0.272 1
1 38 . 7 1 1 A 4 4 PHE C C 157 174.320 176.263 -1.943 1
1 39 . 7 1 1 A 4 4 PHE CA C 157 56.310 60.701 -4.391 1
1 40 . 7 1 1 A 4 4 PHE CB C 157 37.840 38.929 -1.089 1
1 47 . 7 1 1 A 4 4 PHE N N 157 117.790 119.482 -1.692 1
1 48 . 7 1 1 A 5 5 SER H H 158 7.970 8.262 -0.292 1
1 49 . 7 1 1 A 5 5 SER HA H 158 4.560 4.402 0.158 1
1 52 . 7 1 1 A 5 5 SER C C 158 174.160 175.491 -1.331 1
1 53 . 7 1 1 A 5 5 SER CA C 158 57.010 60.842 -3.832 1
1 54 . 7 1 1 A 5 5 SER CB C 158 64.870 62.824 2.046 1
1 55 . 7 1 1 A 5 5 SER N N 158 115.670 113.992 1.678 1
1 56 . 7 1 1 A 6 6 ALA H H 159 9.000 8.379 0.621 1
1 57 . 7 1 1 A 6 6 ALA HA H 159 4.080 4.154 -0.074 1
1 61 . 7 1 1 A 6 6 ALA C C 159 178.290 179.433 -1.143 1
1 62 . 7 1 1 A 6 6 ALA CA C 159 54.850 55.493 -0.643 1
1 63 . 7 1 1 A 6 6 ALA CB C 159 18.070 18.440 -0.370 1
1 64 . 7 1 1 A 6 6 ALA N N 159 125.390 122.821 2.569 1
1 65 . 7 1 1 A 7 7 GLU H H 160 8.590 7.797 0.793 1
1 66 . 7 1 1 A 7 7 GLU HA H 160 3.990 4.162 -0.172 1
1 71 . 7 1 1 A 7 7 GLU C C 160 177.440 178.707 -1.267 1
1 72 . 7 1 1 A 7 7 GLU CA C 160 59.010 59.170 -0.160 1
1 73 . 7 1 1 A 7 7 GLU CB C 160 28.220 29.608 -1.388 1
1 75 . 7 1 1 A 7 7 GLU N N 160 116.180 119.061 -2.881 1
1 76 . 7 1 1 A 8 8 PHE H H 161 7.860 8.380 -0.520 1
1 77 . 7 1 1 A 8 8 PHE HA H 161 4.330 4.142 0.188 1
1 85 . 7 1 1 A 8 8 PHE C C 161 177.130 177.421 -0.291 1
1 86 . 7 1 1 A 8 8 PHE CA C 161 60.330 61.243 -0.913 1
1 87 . 7 1 1 A 8 8 PHE CB C 161 39.160 39.385 -0.225 1
1 94 . 7 1 1 A 8 8 PHE N N 161 118.050 121.095 -3.045 1
1 95 . 7 1 1 A 9 9 LEU H H 162 8.240 9.464 -1.224 1
1 96 . 7 1 1 A 9 9 LEU HA H 162 3.990 3.954 0.036 1
1 106 . 7 1 1 A 9 9 LEU C C 162 177.130 179.512 -2.382 1
1 107 . 7 1 1 A 9 9 LEU CA C 162 57.990 57.976 0.014 1
1 108 . 7 1 1 A 9 9 LEU CB C 162 41.510 41.591 -0.081 1
1 112 . 7 1 1 A 9 9 LEU N N 162 119.110 119.382 -0.272 1
1 113 . 7 1 1 A 10 10 LYS H H 163 7.950 8.941 -0.991 1
1 114 . 7 1 1 A 10 10 LYS HA H 163 3.920 4.156 -0.236 1
1 123 . 7 1 1 A 10 10 LYS C C 163 174.010 176.945 -2.935 1
1 124 . 7 1 1 A 10 10 LYS CA C 163 58.850 58.907 -0.057 1
1 125 . 7 1 1 A 10 10 LYS CB C 163 32.290 32.111 0.179 1
1 129 . 7 1 1 A 10 10 LYS N N 163 115.320 117.799 -2.479 1
1 130 . 7 1 1 A 11 11 VAL H H 164 6.940 7.045 -0.105 1
1 131 . 7 1 1 A 11 11 VAL HA H 164 4.180 4.554 -0.374 1
1 139 . 7 1 1 A 11 11 VAL C C 164 177.290 176.167 1.123 1
1 140 . 7 1 1 A 11 11 VAL CA C 164 62.680 60.877 1.803 1
1 141 . 7 1 1 A 11 11 VAL CB C 164 32.680 31.628 1.052 1
1 144 . 7 1 1 A 11 11 VAL N N 164 110.250 114.902 -4.652 1
1 145 . 7 1 1 A 12 12 PHE H H 165 8.610 8.283 0.327 1
1 146 . 7 1 1 A 12 12 PHE HA H 165 4.180 4.615 -0.435 1
1 154 . 7 1 1 A 12 12 PHE C C 165 175.720 177.121 -1.401 1
1 155 . 7 1 1 A 12 12 PHE CA C 165 60.410 59.595 0.815 1
1 156 . 7 1 1 A 12 12 PHE CB C 165 40.330 40.867 -0.537 1
1 163 . 7 1 1 A 12 12 PHE N N 165 121.290 121.236 0.054 1
1 164 . 7 1 1 A 13 13 LEU H H 166 8.420 8.248 0.172 1
1 165 . 7 1 1 A 13 13 LEU HA H 166 4.160 3.850 0.310 1
1 175 . 7 1 1 A 13 13 LEU CA C 166 59.090 60.029 -0.939 1
1 176 . 7 1 1 A 13 13 LEU CB C 166 38.380 39.726 -1.346 1
1 180 . 7 1 1 A 13 13 LEU N N 166 115.420 120.174 -4.754 1
1 181 . 7 1 1 A 14 14 PRO HA H 167 4.130 4.318 -0.188 1
1 188 . 7 1 1 A 14 14 PRO C C 167 177.150 178.950 -1.800 1
1 189 . 7 1 1 A 14 14 PRO CA C 167 65.800 65.714 0.086 1
1 190 . 7 1 1 A 14 14 PRO CB C 167 30.340 30.615 -0.275 1
1 193 . 7 1 1 A 15 15 SER H H 168 7.150 8.300 -1.150 1
1 194 . 7 1 1 A 15 15 SER HA H 168 4.040 4.100 -0.060 1
1 197 . 7 1 1 A 15 15 SER C C 168 174.160 176.289 -2.129 1
1 198 . 7 1 1 A 15 15 SER CA C 168 63.330 61.614 1.716 1
1 199 . 7 1 1 A 15 15 SER CB C 168 62.060 62.751 -0.691 1
1 200 . 7 1 1 A 15 15 SER N N 168 112.330 114.260 -1.930 1
1 201 . 7 1 1 A 16 16 LEU H H 169 7.770 7.639 0.131 1
1 202 . 7 1 1 A 16 16 LEU HA H 169 4.800 3.678 1.122 1
1 212 . 7 1 1 A 16 16 LEU C C 169 180.100 179.115 0.985 1
1 213 . 7 1 1 A 16 16 LEU CA C 169 55.340 57.900 -2.560 1
1 214 . 7 1 1 A 16 16 LEU CB C 169 41.980 41.599 0.381 1
1 218 . 7 1 1 A 16 16 LEU N N 169 120.480 120.638 -0.158 1
1 219 . 7 1 1 A 17 17 LEU H H 170 8.050 7.623 0.427 1
1 220 . 7 1 1 A 17 17 LEU HA H 170 4.070 4.157 -0.087 1
1 230 . 7 1 1 A 17 17 LEU C C 170 176.970 179.278 -2.308 1
1 231 . 7 1 1 A 17 17 LEU CA C 170 57.910 58.042 -0.132 1
1 232 . 7 1 1 A 17 17 LEU CB C 170 40.800 41.593 -0.793 1
1 236 . 7 1 1 A 17 17 LEU N N 170 122.150 118.404 3.746 1
1 237 . 7 1 1 A 18 18 LEU H H 171 7.940 8.352 -0.412 1
1 238 . 7 1 1 A 18 18 LEU HA H 171 3.990 3.844 0.146 1
1 248 . 7 1 1 A 18 18 LEU C C 171 177.910 179.262 -1.352 1
1 249 . 7 1 1 A 18 18 LEU CA C 171 57.760 57.909 -0.149 1
1 250 . 7 1 1 A 18 18 LEU CB C 171 41.120 41.231 -0.111 1
1 254 . 7 1 1 A 18 18 LEU N N 171 117.490 118.461 -0.971 1
1 255 . 7 1 1 A 19 19 SER H H 172 8.970 7.910 1.060 1
1 256 . 7 1 1 A 19 19 SER HA H 172 3.840 4.004 -0.164 1
1 259 . 7 1 1 A 19 19 SER C C 172 176.820 176.675 0.145 1
1 260 . 7 1 1 A 19 19 SER CA C 172 63.190 62.362 0.828 1
1 261 . 7 1 1 A 19 19 SER CB C 172 59.730 62.647 -2.917 1
1 262 . 7 1 1 A 19 19 SER N N 172 115.970 114.066 1.904 1
1 263 . 7 1 1 A 20 20 HIS H H 173 7.600 7.707 -0.107 1
1 264 . 7 1 1 A 20 20 HIS HA H 173 4.080 4.291 -0.211 1
1 269 . 7 1 1 A 20 20 HIS C C 173 176.970 177.716 -0.746 1
1 270 . 7 1 1 A 20 20 HIS CA C 173 62.220 58.954 3.266 1
1 271 . 7 1 1 A 20 20 HIS CB C 173 27.440 30.123 -2.683 1
1 275 . 7 1 1 A 20 20 HIS N N 173 119.720 119.555 0.165 1
1 276 . 7 1 1 A 21 21 LEU H H 174 8.200 8.510 -0.310 1
1 277 . 7 1 1 A 21 21 LEU HA H 174 4.070 3.783 0.287 1
1 287 . 7 1 1 A 21 21 LEU C C 174 178.220 179.035 -0.815 1
1 288 . 7 1 1 A 21 21 LEU CA C 174 57.910 58.214 -0.304 1
1 289 . 7 1 1 A 21 21 LEU CB C 174 40.960 41.477 -0.517 1
1 293 . 7 1 1 A 21 21 LEU N N 174 120.780 119.882 0.898 1
1 294 . 7 1 1 A 22 22 LEU H H 175 8.510 8.373 0.137 1
1 295 . 7 1 1 A 22 22 LEU HA H 175 3.930 3.853 0.077 1
1 305 . 7 1 1 A 22 22 LEU C C 175 177.440 178.906 -1.466 1
1 306 . 7 1 1 A 22 22 LEU CA C 175 57.760 57.812 -0.052 1
1 307 . 7 1 1 A 22 22 LEU CB C 175 40.800 41.914 -1.114 1
1 311 . 7 1 1 A 22 22 LEU N N 175 118.600 118.489 0.111 1
1 312 . 7 1 1 A 23 23 ALA H H 176 7.830 8.619 -0.789 1
1 313 . 7 1 1 A 23 23 ALA HA H 176 3.970 4.080 -0.110 1
1 317 . 7 1 1 A 23 23 ALA C C 176 178.220 179.910 -1.690 1
1 318 . 7 1 1 A 23 23 ALA CA C 176 55.260 55.352 -0.092 1
1 319 . 7 1 1 A 23 23 ALA CB C 176 18.070 18.408 -0.338 1
1 320 . 7 1 1 A 23 23 ALA N N 176 121.030 121.470 -0.440 1
1 321 . 7 1 1 A 24 24 ILE H H 177 8.210 8.144 0.066 1
1 322 . 7 1 1 A 24 24 ILE HA H 177 3.900 3.751 0.149 1
1 332 . 7 1 1 A 24 24 ILE C C 177 178.380 177.904 0.476 1
1 333 . 7 1 1 A 24 24 ILE CA C 177 64.870 65.096 -0.226 1
1 334 . 7 1 1 A 24 24 ILE CB C 177 37.370 37.831 -0.461 1
1 338 . 7 1 1 A 24 24 ILE N N 177 118.330 118.380 -0.050 1
1 339 . 7 1 1 A 25 25 GLY H H 178 8.590 8.173 0.417 1
1 340 . 7 1 1 A 25 25 GLY HA2 H 178 3.600 3.783 -0.183 1
1 341 . 7 1 1 A 25 25 GLY HA3 H 178 3.630 3.800 -0.170 1
1 342 . 7 1 1 A 25 25 GLY C C 178 173.850 176.142 -2.292 1
1 343 . 7 1 1 A 25 25 GLY CA C 178 47.530 47.339 0.191 1
1 344 . 7 1 1 A 25 25 GLY N N 178 107.320 108.158 -0.838 1
1 345 . 7 1 1 A 26 26 LEU H H 179 8.830 8.413 0.417 1
1 346 . 7 1 1 A 26 26 LEU HA H 179 4.110 4.056 0.054 1
1 356 . 7 1 1 A 26 26 LEU C C 179 178.220 179.091 -0.871 1
1 357 . 7 1 1 A 26 26 LEU CA C 179 57.600 58.446 -0.846 1
1 358 . 7 1 1 A 26 26 LEU CB C 179 41.040 41.998 -0.958 1
1 362 . 7 1 1 A 26 26 LEU N N 179 122.350 122.703 -0.353 1
1 363 . 7 1 1 A 27 27 GLY H H 180 8.520 8.092 0.428 1
1 364 . 7 1 1 A 27 27 GLY HA2 H 180 3.760 3.802 -0.042 1
1 365 . 7 1 1 A 27 27 GLY HA3 H 180 4.520 3.809 0.711 1
1 366 . 7 1 1 A 27 27 GLY C C 180 174.160 176.067 -1.907 1
1 367 . 7 1 1 A 27 27 GLY CA C 180 47.920 47.495 0.425 1
1 368 . 7 1 1 A 27 27 GLY N N 180 106.260 105.318 0.942 1
1 369 . 7 1 1 A 28 28 ILE H H 181 8.780 8.088 0.692 1
1 370 . 7 1 1 A 28 28 ILE HA H 181 3.590 3.845 -0.255 1
1 380 . 7 1 1 A 28 28 ILE C C 181 177.130 177.307 -0.177 1
1 381 . 7 1 1 A 28 28 ILE CA C 181 65.340 64.615 0.725 1
1 382 . 7 1 1 A 28 28 ILE CB C 181 36.900 37.558 -0.658 1
1 386 . 7 1 1 A 28 28 ILE N N 181 123.970 122.551 1.419 1
1 387 . 7 1 1 A 29 29 TYR H H 182 8.110 8.582 -0.472 1
1 388 . 7 1 1 A 29 29 TYR HA H 182 3.880 4.096 -0.216 1
1 395 . 7 1 1 A 29 29 TYR C C 182 176.970 176.851 0.119 1
1 396 . 7 1 1 A 29 29 TYR CA C 182 61.900 61.543 0.357 1
1 397 . 7 1 1 A 29 29 TYR CB C 182 37.910 38.498 -0.588 1
1 403 . 7 1 1 A 29 29 TYR N N 182 119.570 120.406 -0.836 1
1 404 . 7 1 1 A 30 30 ILE H H 183 8.490 8.226 0.264 1
1 405 . 7 1 1 A 30 30 ILE HA H 183 3.400 3.641 -0.241 1
1 415 . 7 1 1 A 30 30 ILE C C 183 177.760 177.626 0.134 1
1 416 . 7 1 1 A 30 30 ILE CA C 183 65.020 64.915 0.105 1
1 417 . 7 1 1 A 30 30 ILE CB C 183 37.600 38.053 -0.453 1
1 421 . 7 1 1 A 30 30 ILE N N 183 118.000 119.337 -1.337 1
1 422 . 7 1 1 A 31 31 GLY H H 184 9.360 8.064 1.296 1
1 423 . 7 1 1 A 31 31 GLY HA2 H 184 3.650 3.751 -0.101 1
1 424 . 7 1 1 A 31 31 GLY HA3 H 184 3.940 3.760 0.180 1
1 425 . 7 1 1 A 31 31 GLY C C 184 174.320 175.904 -1.584 1
1 426 . 7 1 1 A 31 31 GLY CA C 184 47.380 47.040 0.340 1
1 427 . 7 1 1 A 31 31 GLY N N 184 106.260 107.025 -0.765 1
1 428 . 7 1 1 A 32 32 ARG H H 185 8.090 8.543 -0.453 1
1 429 . 7 1 1 A 32 32 ARG HA H 185 4.030 4.039 -0.009 1
1 441 . 7 1 1 A 32 32 ARG C C 185 177.290 177.222 0.068 1
1 442 . 7 1 1 A 32 32 ARG CA C 185 57.050 58.660 -1.610 1
1 443 . 7 1 1 A 32 32 ARG CB C 185 29.630 30.265 -0.635 1
1 447 . 7 1 1 A 32 32 ARG N N 185 118.050 120.966 -2.916 1
1 451 . 7 1 1 A 33 33 ARG H H 186 7.760 7.341 0.419 1
1 452 . 7 1 1 A 33 33 ARG HA H 186 4.260 4.564 -0.304 1
1 464 . 7 1 1 A 33 33 ARG C C 186 176.190 176.442 -0.252 1
1 465 . 7 1 1 A 33 33 ARG CA C 186 55.670 54.968 0.702 1
1 466 . 7 1 1 A 33 33 ARG CB C 186 29.710 30.239 -0.529 1
1 470 . 7 1 1 A 33 33 ARG N N 186 117.390 118.603 -1.213 1
1 474 . 7 1 1 A 34 34 LEU H H 187 7.530 7.691 -0.161 1
1 475 . 7 1 1 A 34 34 LEU HA H 187 4.390 3.920 0.470 1
1 485 . 7 1 1 A 34 34 LEU C C 187 175.410 176.962 -1.552 1
1 486 . 7 1 1 A 34 34 LEU CA C 187 54.440 57.784 -3.344 1
1 487 . 7 1 1 A 34 34 LEU CB C 187 41.590 42.006 -0.416 1
1 491 . 7 1 1 A 34 34 LEU N N 187 119.360 120.659 -1.299 1
1 5 . 8 1 1 A 2 2 GLY H H 155 8.570 7.974 0.596 1
1 6 . 8 1 1 A 2 2 GLY HA2 H 155 3.950 4.157 -0.207 1
1 7 . 8 1 1 A 2 2 GLY HA3 H 155 4.070 4.179 -0.109 1
1 8 . 8 1 1 A 2 2 GLY C C 155 173.690 174.954 -1.264 1
1 9 . 8 1 1 A 2 2 GLY CA C 155 44.560 44.791 -0.231 1
1 10 . 8 1 1 A 2 2 GLY N N 155 108.940 106.053 2.887 1
1 11 . 8 1 1 A 3 3 ILE H H 156 8.340 8.861 -0.521 1
1 12 . 8 1 1 A 3 3 ILE HA H 156 3.640 3.642 -0.002 1
1 22 . 8 1 1 A 3 3 ILE C C 156 174.470 177.299 -2.829 1
1 23 . 8 1 1 A 3 3 ILE CA C 156 62.060 64.455 -2.395 1
1 24 . 8 1 1 A 3 3 ILE CB C 156 37.680 37.816 -0.136 1
1 28 . 8 1 1 A 3 3 ILE N N 156 119.870 119.743 0.127 1
1 29 . 8 1 1 A 4 4 PHE H H 157 7.850 8.017 -0.167 1
1 30 . 8 1 1 A 4 4 PHE HA H 157 4.570 4.306 0.264 1
1 38 . 8 1 1 A 4 4 PHE C C 157 174.320 175.987 -1.667 1
1 39 . 8 1 1 A 4 4 PHE CA C 157 56.310 60.557 -4.247 1
1 40 . 8 1 1 A 4 4 PHE CB C 157 37.840 39.494 -1.654 1
1 47 . 8 1 1 A 4 4 PHE N N 157 117.790 119.917 -2.127 1
1 48 . 8 1 1 A 5 5 SER H H 158 7.970 8.129 -0.159 1
1 49 . 8 1 1 A 5 5 SER HA H 158 4.560 4.542 0.018 1
1 52 . 8 1 1 A 5 5 SER C C 158 174.160 175.508 -1.348 1
1 53 . 8 1 1 A 5 5 SER CA C 158 57.010 59.406 -2.396 1
1 54 . 8 1 1 A 5 5 SER CB C 158 64.870 63.141 1.729 1
1 55 . 8 1 1 A 5 5 SER N N 158 115.670 114.078 1.592 1
1 56 . 8 1 1 A 6 6 ALA H H 159 9.000 8.788 0.212 1
1 57 . 8 1 1 A 6 6 ALA HA H 159 4.080 4.096 -0.016 1
1 61 . 8 1 1 A 6 6 ALA C C 159 178.290 180.095 -1.805 1
1 62 . 8 1 1 A 6 6 ALA CA C 159 54.850 55.154 -0.304 1
1 63 . 8 1 1 A 6 6 ALA CB C 159 18.070 18.425 -0.355 1
1 64 . 8 1 1 A 6 6 ALA N N 159 125.390 127.999 -2.609 1
1 65 . 8 1 1 A 7 7 GLU H H 160 8.590 8.361 0.229 1
1 66 . 8 1 1 A 7 7 GLU HA H 160 3.990 4.129 -0.139 1
1 71 . 8 1 1 A 7 7 GLU C C 160 177.440 178.668 -1.228 1
1 72 . 8 1 1 A 7 7 GLU CA C 160 59.010 58.856 0.154 1
1 73 . 8 1 1 A 7 7 GLU CB C 160 28.220 29.336 -1.116 1
1 75 . 8 1 1 A 7 7 GLU N N 160 116.180 118.493 -2.313 1
1 76 . 8 1 1 A 8 8 PHE H H 161 7.860 8.620 -0.760 1
1 77 . 8 1 1 A 8 8 PHE HA H 161 4.330 4.240 0.090 1
1 85 . 8 1 1 A 8 8 PHE C C 161 177.130 177.309 -0.179 1
1 86 . 8 1 1 A 8 8 PHE CA C 161 60.330 60.519 -0.189 1
1 87 . 8 1 1 A 8 8 PHE CB C 161 39.160 39.846 -0.686 1
1 94 . 8 1 1 A 8 8 PHE N N 161 118.050 122.926 -4.876 1
1 95 . 8 1 1 A 9 9 LEU H H 162 8.240 7.930 0.310 1
1 96 . 8 1 1 A 9 9 LEU HA H 162 3.990 3.739 0.251 1
1 106 . 8 1 1 A 9 9 LEU C C 162 177.130 179.412 -2.282 1
1 107 . 8 1 1 A 9 9 LEU CA C 162 57.990 57.980 0.010 1
1 108 . 8 1 1 A 9 9 LEU CB C 162 41.510 41.456 0.054 1
1 112 . 8 1 1 A 9 9 LEU N N 162 119.110 119.539 -0.429 1
1 113 . 8 1 1 A 10 10 LYS H H 163 7.950 8.711 -0.761 1
1 114 . 8 1 1 A 10 10 LYS HA H 163 3.920 4.151 -0.231 1
1 123 . 8 1 1 A 10 10 LYS C C 163 174.010 177.037 -3.027 1
1 124 . 8 1 1 A 10 10 LYS CA C 163 58.850 58.903 -0.053 1
1 125 . 8 1 1 A 10 10 LYS CB C 163 32.290 32.080 0.210 1
1 129 . 8 1 1 A 10 10 LYS N N 163 115.320 118.030 -2.710 1
1 130 . 8 1 1 A 11 11 VAL H H 164 6.940 6.992 -0.052 1
1 131 . 8 1 1 A 11 11 VAL HA H 164 4.180 4.473 -0.293 1
1 139 . 8 1 1 A 11 11 VAL C C 164 177.290 176.138 1.152 1
1 140 . 8 1 1 A 11 11 VAL CA C 164 62.680 60.739 1.941 1
1 141 . 8 1 1 A 11 11 VAL CB C 164 32.680 31.664 1.016 1
1 144 . 8 1 1 A 11 11 VAL N N 164 110.250 115.032 -4.782 1
1 145 . 8 1 1 A 12 12 PHE H H 165 8.610 8.203 0.407 1
1 146 . 8 1 1 A 12 12 PHE HA H 165 4.180 4.663 -0.483 1
1 154 . 8 1 1 A 12 12 PHE C C 165 175.720 176.925 -1.205 1
1 155 . 8 1 1 A 12 12 PHE CA C 165 60.410 59.260 1.150 1
1 156 . 8 1 1 A 12 12 PHE CB C 165 40.330 40.315 0.015 1
1 163 . 8 1 1 A 12 12 PHE N N 165 121.290 120.594 0.696 1
1 164 . 8 1 1 A 13 13 LEU H H 166 8.420 7.771 0.649 1
1 165 . 8 1 1 A 13 13 LEU HA H 166 4.160 3.602 0.558 1
1 175 . 8 1 1 A 13 13 LEU CA C 166 59.090 60.031 -0.941 1
1 176 . 8 1 1 A 13 13 LEU CB C 166 38.380 40.389 -2.009 1
1 180 . 8 1 1 A 13 13 LEU N N 166 115.420 120.301 -4.881 1
1 181 . 8 1 1 A 14 14 PRO HA H 167 4.130 4.349 -0.219 1
1 188 . 8 1 1 A 14 14 PRO C C 167 177.150 178.780 -1.630 1
1 189 . 8 1 1 A 14 14 PRO CA C 167 65.800 65.181 0.619 1
1 190 . 8 1 1 A 14 14 PRO CB C 167 30.340 31.288 -0.948 1
1 193 . 8 1 1 A 15 15 SER H H 168 7.150 8.261 -1.111 1
1 194 . 8 1 1 A 15 15 SER HA H 168 4.040 4.155 -0.115 1
1 197 . 8 1 1 A 15 15 SER C C 168 174.160 176.449 -2.289 1
1 198 . 8 1 1 A 15 15 SER CA C 168 63.330 61.568 1.762 1
1 199 . 8 1 1 A 15 15 SER CB C 168 62.060 62.809 -0.749 1
1 200 . 8 1 1 A 15 15 SER N N 168 112.330 113.977 -1.647 1
1 201 . 8 1 1 A 16 16 LEU H H 169 7.770 7.835 -0.065 1
1 202 . 8 1 1 A 16 16 LEU HA H 169 4.800 3.718 1.082 1
1 212 . 8 1 1 A 16 16 LEU C C 169 180.100 179.208 0.892 1
1 213 . 8 1 1 A 16 16 LEU CA C 169 55.340 57.985 -2.645 1
1 214 . 8 1 1 A 16 16 LEU CB C 169 41.980 41.365 0.615 1
1 218 . 8 1 1 A 16 16 LEU N N 169 120.480 120.442 0.038 1
1 219 . 8 1 1 A 17 17 LEU H H 170 8.050 7.603 0.447 1
1 220 . 8 1 1 A 17 17 LEU HA H 170 4.070 4.031 0.039 1
1 230 . 8 1 1 A 17 17 LEU C C 170 176.970 179.206 -2.236 1
1 231 . 8 1 1 A 17 17 LEU CA C 170 57.910 57.976 -0.066 1
1 232 . 8 1 1 A 17 17 LEU CB C 170 40.800 41.618 -0.818 1
1 236 . 8 1 1 A 17 17 LEU N N 170 122.150 118.614 3.536 1
1 237 . 8 1 1 A 18 18 LEU H H 171 7.940 7.971 -0.031 1
1 238 . 8 1 1 A 18 18 LEU HA H 171 3.990 3.825 0.165 1
1 248 . 8 1 1 A 18 18 LEU C C 171 177.910 179.223 -1.313 1
1 249 . 8 1 1 A 18 18 LEU CA C 171 57.760 58.041 -0.281 1
1 250 . 8 1 1 A 18 18 LEU CB C 171 41.120 41.222 -0.102 1
1 254 . 8 1 1 A 18 18 LEU N N 171 117.490 118.353 -0.863 1
1 255 . 8 1 1 A 19 19 SER H H 172 8.970 7.987 0.983 1
1 256 . 8 1 1 A 19 19 SER HA H 172 3.840 4.028 -0.188 1
1 259 . 8 1 1 A 19 19 SER C C 172 176.820 176.757 0.063 1
1 260 . 8 1 1 A 19 19 SER CA C 172 63.190 62.380 0.810 1
1 261 . 8 1 1 A 19 19 SER CB C 172 59.730 62.778 -3.048 1
1 262 . 8 1 1 A 19 19 SER N N 172 115.970 114.242 1.728 1
1 263 . 8 1 1 A 20 20 HIS H H 173 7.600 7.946 -0.346 1
1 264 . 8 1 1 A 20 20 HIS HA H 173 4.080 4.276 -0.196 1
1 269 . 8 1 1 A 20 20 HIS C C 173 176.970 177.719 -0.749 1
1 270 . 8 1 1 A 20 20 HIS CA C 173 62.220 59.069 3.151 1
1 271 . 8 1 1 A 20 20 HIS CB C 173 27.440 30.003 -2.563 1
1 275 . 8 1 1 A 20 20 HIS N N 173 119.720 119.505 0.215 1
1 276 . 8 1 1 A 21 21 LEU H H 174 8.200 8.853 -0.653 1
1 277 . 8 1 1 A 21 21 LEU HA H 174 4.070 3.819 0.251 1
1 287 . 8 1 1 A 21 21 LEU C C 174 178.220 178.888 -0.668 1
1 288 . 8 1 1 A 21 21 LEU CA C 174 57.910 58.187 -0.277 1
1 289 . 8 1 1 A 21 21 LEU CB C 174 40.960 41.999 -1.039 1
1 293 . 8 1 1 A 21 21 LEU N N 174 120.780 119.911 0.869 1
1 294 . 8 1 1 A 22 22 LEU H H 175 8.510 8.402 0.108 1
1 295 . 8 1 1 A 22 22 LEU HA H 175 3.930 3.918 0.012 1
1 305 . 8 1 1 A 22 22 LEU C C 175 177.440 178.878 -1.438 1
1 306 . 8 1 1 A 22 22 LEU CA C 175 57.760 57.983 -0.223 1
1 307 . 8 1 1 A 22 22 LEU CB C 175 40.800 41.318 -0.518 1
1 311 . 8 1 1 A 22 22 LEU N N 175 118.600 117.850 0.750 1
1 312 . 8 1 1 A 23 23 ALA H H 176 7.830 8.382 -0.552 1
1 313 . 8 1 1 A 23 23 ALA HA H 176 3.970 4.057 -0.087 1
1 317 . 8 1 1 A 23 23 ALA C C 176 178.220 179.791 -1.571 1
1 318 . 8 1 1 A 23 23 ALA CA C 176 55.260 55.359 -0.099 1
1 319 . 8 1 1 A 23 23 ALA CB C 176 18.070 18.397 -0.327 1
1 320 . 8 1 1 A 23 23 ALA N N 176 121.030 121.830 -0.800 1
1 321 . 8 1 1 A 24 24 ILE H H 177 8.210 8.061 0.149 1
1 322 . 8 1 1 A 24 24 ILE HA H 177 3.900 3.753 0.147 1
1 332 . 8 1 1 A 24 24 ILE C C 177 178.380 177.925 0.455 1
1 333 . 8 1 1 A 24 24 ILE CA C 177 64.870 65.068 -0.198 1
1 334 . 8 1 1 A 24 24 ILE CB C 177 37.370 37.699 -0.329 1
1 338 . 8 1 1 A 24 24 ILE N N 177 118.330 118.238 0.092 1
1 339 . 8 1 1 A 25 25 GLY H H 178 8.590 8.056 0.534 1
1 340 . 8 1 1 A 25 25 GLY HA2 H 178 3.600 3.778 -0.178 1
1 341 . 8 1 1 A 25 25 GLY HA3 H 178 3.630 3.794 -0.164 1
1 342 . 8 1 1 A 25 25 GLY C C 178 173.850 176.173 -2.323 1
1 343 . 8 1 1 A 25 25 GLY CA C 178 47.530 47.355 0.175 1
1 344 . 8 1 1 A 25 25 GLY N N 178 107.320 108.373 -1.053 1
1 345 . 8 1 1 A 26 26 LEU H H 179 8.830 8.289 0.541 1
1 346 . 8 1 1 A 26 26 LEU HA H 179 4.110 4.044 0.066 1
1 356 . 8 1 1 A 26 26 LEU C C 179 178.220 179.004 -0.784 1
1 357 . 8 1 1 A 26 26 LEU CA C 179 57.600 58.554 -0.954 1
1 358 . 8 1 1 A 26 26 LEU CB C 179 41.040 42.110 -1.070 1
1 362 . 8 1 1 A 26 26 LEU N N 179 122.350 122.767 -0.417 1
1 363 . 8 1 1 A 27 27 GLY H H 180 8.520 8.155 0.365 1
1 364 . 8 1 1 A 27 27 GLY HA2 H 180 3.760 3.770 -0.010 1
1 365 . 8 1 1 A 27 27 GLY HA3 H 180 4.520 3.778 0.742 1
1 366 . 8 1 1 A 27 27 GLY C C 180 174.160 176.153 -1.993 1
1 367 . 8 1 1 A 27 27 GLY CA C 180 47.920 47.533 0.387 1
1 368 . 8 1 1 A 27 27 GLY N N 180 106.260 105.302 0.958 1
1 369 . 8 1 1 A 28 28 ILE H H 181 8.780 8.085 0.695 1
1 370 . 8 1 1 A 28 28 ILE HA H 181 3.590 3.857 -0.267 1
1 380 . 8 1 1 A 28 28 ILE C C 181 177.130 177.641 -0.511 1
1 381 . 8 1 1 A 28 28 ILE CA C 181 65.340 64.390 0.950 1
1 382 . 8 1 1 A 28 28 ILE CB C 181 36.900 37.566 -0.666 1
1 386 . 8 1 1 A 28 28 ILE N N 181 123.970 122.478 1.492 1
1 387 . 8 1 1 A 29 29 TYR H H 182 8.110 8.254 -0.144 1
1 388 . 8 1 1 A 29 29 TYR HA H 182 3.880 4.136 -0.256 1
1 395 . 8 1 1 A 29 29 TYR C C 182 176.970 176.951 0.019 1
1 396 . 8 1 1 A 29 29 TYR CA C 182 61.900 62.007 -0.107 1
1 397 . 8 1 1 A 29 29 TYR CB C 182 37.910 38.632 -0.722 1
1 403 . 8 1 1 A 29 29 TYR N N 182 119.570 120.571 -1.001 1
1 404 . 8 1 1 A 30 30 ILE H H 183 8.490 8.035 0.455 1
1 405 . 8 1 1 A 30 30 ILE HA H 183 3.400 3.608 -0.208 1
1 415 . 8 1 1 A 30 30 ILE C C 183 177.760 177.620 0.140 1
1 416 . 8 1 1 A 30 30 ILE CA C 183 65.020 64.949 0.071 1
1 417 . 8 1 1 A 30 30 ILE CB C 183 37.600 37.954 -0.354 1
1 421 . 8 1 1 A 30 30 ILE N N 183 118.000 119.536 -1.536 1
1 422 . 8 1 1 A 31 31 GLY H H 184 9.360 7.939 1.421 1
1 423 . 8 1 1 A 31 31 GLY HA2 H 184 3.650 3.741 -0.091 1
1 424 . 8 1 1 A 31 31 GLY HA3 H 184 3.940 3.753 0.187 1
1 425 . 8 1 1 A 31 31 GLY C C 184 174.320 175.979 -1.659 1
1 426 . 8 1 1 A 31 31 GLY CA C 184 47.380 47.034 0.346 1
1 427 . 8 1 1 A 31 31 GLY N N 184 106.260 107.292 -1.032 1
1 428 . 8 1 1 A 32 32 ARG H H 185 8.090 8.833 -0.743 1
1 429 . 8 1 1 A 32 32 ARG HA H 185 4.030 4.066 -0.036 1
1 441 . 8 1 1 A 32 32 ARG C C 185 177.290 177.041 0.249 1
1 442 . 8 1 1 A 32 32 ARG CA C 185 57.050 58.494 -1.444 1
1 443 . 8 1 1 A 32 32 ARG CB C 185 29.630 30.046 -0.416 1
1 447 . 8 1 1 A 32 32 ARG N N 185 118.050 120.838 -2.788 1
1 451 . 8 1 1 A 33 33 ARG H H 186 7.760 7.442 0.318 1
1 452 . 8 1 1 A 33 33 ARG HA H 186 4.260 4.604 -0.344 1
1 464 . 8 1 1 A 33 33 ARG C C 186 176.190 176.368 -0.178 1
1 465 . 8 1 1 A 33 33 ARG CA C 186 55.670 54.726 0.944 1
1 466 . 8 1 1 A 33 33 ARG CB C 186 29.710 30.109 -0.399 1
1 470 . 8 1 1 A 33 33 ARG N N 186 117.390 118.356 -0.966 1
1 474 . 8 1 1 A 34 34 LEU H H 187 7.530 7.710 -0.180 1
1 475 . 8 1 1 A 34 34 LEU HA H 187 4.390 4.117 0.273 1
1 485 . 8 1 1 A 34 34 LEU C C 187 175.410 176.918 -1.508 1
1 486 . 8 1 1 A 34 34 LEU CA C 187 54.440 56.390 -1.950 1
1 487 . 8 1 1 A 34 34 LEU CB C 187 41.590 42.983 -1.393 1
1 491 . 8 1 1 A 34 34 LEU N N 187 119.360 120.103 -0.743 1
1 5 . 9 1 1 A 2 2 GLY H H 155 8.570 7.897 0.673 1
1 6 . 9 1 1 A 2 2 GLY HA2 H 155 3.950 4.076 -0.126 1
1 7 . 9 1 1 A 2 2 GLY HA3 H 155 4.070 4.080 -0.010 1
1 8 . 9 1 1 A 2 2 GLY C C 155 173.690 174.692 -1.002 1
1 9 . 9 1 1 A 2 2 GLY CA C 155 44.560 44.507 0.053 1
1 10 . 9 1 1 A 2 2 GLY N N 155 108.940 107.720 1.220 1
1 11 . 9 1 1 A 3 3 ILE H H 156 8.340 8.592 -0.252 1
1 12 . 9 1 1 A 3 3 ILE HA H 156 3.640 3.521 0.119 1
1 22 . 9 1 1 A 3 3 ILE C C 156 174.470 177.564 -3.094 1
1 23 . 9 1 1 A 3 3 ILE CA C 156 62.060 64.438 -2.378 1
1 24 . 9 1 1 A 3 3 ILE CB C 156 37.680 37.785 -0.105 1
1 28 . 9 1 1 A 3 3 ILE N N 156 119.870 119.344 0.526 1
1 29 . 9 1 1 A 4 4 PHE H H 157 7.850 7.817 0.033 1
1 30 . 9 1 1 A 4 4 PHE HA H 157 4.570 4.319 0.251 1
1 38 . 9 1 1 A 4 4 PHE C C 157 174.320 176.106 -1.786 1
1 39 . 9 1 1 A 4 4 PHE CA C 157 56.310 60.889 -4.579 1
1 40 . 9 1 1 A 4 4 PHE CB C 157 37.840 39.309 -1.469 1
1 47 . 9 1 1 A 4 4 PHE N N 157 117.790 119.765 -1.975 1
1 48 . 9 1 1 A 5 5 SER H H 158 7.970 8.021 -0.051 1
1 49 . 9 1 1 A 5 5 SER HA H 158 4.560 4.149 0.411 1
1 52 . 9 1 1 A 5 5 SER C C 158 174.160 175.795 -1.635 1
1 53 . 9 1 1 A 5 5 SER CA C 158 57.010 60.918 -3.908 1
1 54 . 9 1 1 A 5 5 SER CB C 158 64.870 61.816 3.054 1
1 55 . 9 1 1 A 5 5 SER N N 158 115.670 112.254 3.416 1
1 56 . 9 1 1 A 6 6 ALA H H 159 9.000 8.492 0.508 1
1 57 . 9 1 1 A 6 6 ALA HA H 159 4.080 4.128 -0.048 1
1 61 . 9 1 1 A 6 6 ALA C C 159 178.290 180.271 -1.981 1
1 62 . 9 1 1 A 6 6 ALA CA C 159 54.850 55.374 -0.524 1
1 63 . 9 1 1 A 6 6 ALA CB C 159 18.070 18.547 -0.477 1
1 64 . 9 1 1 A 6 6 ALA N N 159 125.390 124.029 1.361 1
1 65 . 9 1 1 A 7 7 GLU H H 160 8.590 8.278 0.312 1
1 66 . 9 1 1 A 7 7 GLU HA H 160 3.990 4.068 -0.078 1
1 71 . 9 1 1 A 7 7 GLU C C 160 177.440 179.385 -1.945 1
1 72 . 9 1 1 A 7 7 GLU CA C 160 59.010 59.540 -0.530 1
1 73 . 9 1 1 A 7 7 GLU CB C 160 28.220 29.655 -1.435 1
1 75 . 9 1 1 A 7 7 GLU N N 160 116.180 117.793 -1.613 1
1 76 . 9 1 1 A 8 8 PHE H H 161 7.860 8.192 -0.332 1
1 77 . 9 1 1 A 8 8 PHE HA H 161 4.330 4.133 0.197 1
1 85 . 9 1 1 A 8 8 PHE C C 161 177.130 177.121 0.009 1
1 86 . 9 1 1 A 8 8 PHE CA C 161 60.330 61.542 -1.212 1
1 87 . 9 1 1 A 8 8 PHE CB C 161 39.160 39.203 -0.043 1
1 94 . 9 1 1 A 8 8 PHE N N 161 118.050 121.641 -3.591 1
1 95 . 9 1 1 A 9 9 LEU H H 162 8.240 9.516 -1.276 1
1 96 . 9 1 1 A 9 9 LEU HA H 162 3.990 4.169 -0.179 1
1 106 . 9 1 1 A 9 9 LEU C C 162 177.130 179.376 -2.246 1
1 107 . 9 1 1 A 9 9 LEU CA C 162 57.990 58.101 -0.111 1
1 108 . 9 1 1 A 9 9 LEU CB C 162 41.510 41.545 -0.035 1
1 112 . 9 1 1 A 9 9 LEU N N 162 119.110 119.386 -0.276 1
1 113 . 9 1 1 A 10 10 LYS H H 163 7.950 8.270 -0.320 1
1 114 . 9 1 1 A 10 10 LYS HA H 163 3.920 4.092 -0.172 1
1 123 . 9 1 1 A 10 10 LYS C C 163 174.010 177.851 -3.841 1
1 124 . 9 1 1 A 10 10 LYS CA C 163 58.850 59.375 -0.525 1
1 125 . 9 1 1 A 10 10 LYS CB C 163 32.290 32.473 -0.183 1
1 129 . 9 1 1 A 10 10 LYS N N 163 115.320 118.319 -2.999 1
1 130 . 9 1 1 A 11 11 VAL H H 164 6.940 7.077 -0.137 1
1 131 . 9 1 1 A 11 11 VAL HA H 164 4.180 4.388 -0.208 1
1 139 . 9 1 1 A 11 11 VAL C C 164 177.290 176.214 1.076 1
1 140 . 9 1 1 A 11 11 VAL CA C 164 62.680 60.788 1.892 1
1 141 . 9 1 1 A 11 11 VAL CB C 164 32.680 31.499 1.181 1
1 144 . 9 1 1 A 11 11 VAL N N 164 110.250 109.746 0.504 1
1 145 . 9 1 1 A 12 12 PHE H H 165 8.610 7.915 0.695 1
1 146 . 9 1 1 A 12 12 PHE HA H 165 4.180 4.668 -0.488 1
1 154 . 9 1 1 A 12 12 PHE C C 165 175.720 176.958 -1.238 1
1 155 . 9 1 1 A 12 12 PHE CA C 165 60.410 59.242 1.168 1
1 156 . 9 1 1 A 12 12 PHE CB C 165 40.330 40.524 -0.194 1
1 163 . 9 1 1 A 12 12 PHE N N 165 121.290 120.793 0.497 1
1 164 . 9 1 1 A 13 13 LEU H H 166 8.420 8.222 0.198 1
1 165 . 9 1 1 A 13 13 LEU HA H 166 4.160 3.703 0.457 1
1 175 . 9 1 1 A 13 13 LEU CA C 166 59.090 60.087 -0.997 1
1 176 . 9 1 1 A 13 13 LEU CB C 166 38.380 40.678 -2.298 1
1 180 . 9 1 1 A 13 13 LEU N N 166 115.420 120.161 -4.741 1
1 181 . 9 1 1 A 14 14 PRO HA H 167 4.130 4.328 -0.198 1
1 188 . 9 1 1 A 14 14 PRO C C 167 177.150 178.670 -1.520 1
1 189 . 9 1 1 A 14 14 PRO CA C 167 65.800 65.667 0.133 1
1 190 . 9 1 1 A 14 14 PRO CB C 167 30.340 30.879 -0.539 1
1 193 . 9 1 1 A 15 15 SER H H 168 7.150 8.069 -0.919 1
1 194 . 9 1 1 A 15 15 SER HA H 168 4.040 4.200 -0.160 1
1 197 . 9 1 1 A 15 15 SER C C 168 174.160 177.473 -3.313 1
1 198 . 9 1 1 A 15 15 SER CA C 168 63.330 60.865 2.465 1
1 199 . 9 1 1 A 15 15 SER CB C 168 62.060 62.734 -0.674 1
1 200 . 9 1 1 A 15 15 SER N N 168 112.330 112.336 -0.006 1
1 201 . 9 1 1 A 16 16 LEU H H 169 7.770 8.052 -0.282 1
1 202 . 9 1 1 A 16 16 LEU HA H 169 4.800 3.927 0.873 1
1 212 . 9 1 1 A 16 16 LEU C C 169 180.100 179.011 1.089 1
1 213 . 9 1 1 A 16 16 LEU CA C 169 55.340 58.093 -2.753 1
1 214 . 9 1 1 A 16 16 LEU CB C 169 41.980 41.391 0.589 1
1 218 . 9 1 1 A 16 16 LEU N N 169 120.480 122.060 -1.580 1
1 219 . 9 1 1 A 17 17 LEU H H 170 8.050 7.680 0.370 1
1 220 . 9 1 1 A 17 17 LEU HA H 170 4.070 3.904 0.166 1
1 230 . 9 1 1 A 17 17 LEU C C 170 176.970 179.127 -2.157 1
1 231 . 9 1 1 A 17 17 LEU CA C 170 57.910 58.145 -0.235 1
1 232 . 9 1 1 A 17 17 LEU CB C 170 40.800 41.367 -0.567 1
1 236 . 9 1 1 A 17 17 LEU N N 170 122.150 118.544 3.606 1
1 237 . 9 1 1 A 18 18 LEU H H 171 7.940 7.737 0.203 1
1 238 . 9 1 1 A 18 18 LEU HA H 171 3.990 3.867 0.123 1
1 248 . 9 1 1 A 18 18 LEU C C 171 177.910 179.312 -1.402 1
1 249 . 9 1 1 A 18 18 LEU CA C 171 57.760 57.988 -0.228 1
1 250 . 9 1 1 A 18 18 LEU CB C 171 41.120 41.121 -0.001 1
1 254 . 9 1 1 A 18 18 LEU N N 171 117.490 118.842 -1.352 1
1 255 . 9 1 1 A 19 19 SER H H 172 8.970 7.954 1.016 1
1 256 . 9 1 1 A 19 19 SER HA H 172 3.840 4.064 -0.224 1
1 259 . 9 1 1 A 19 19 SER C C 172 176.820 176.754 0.066 1
1 260 . 9 1 1 A 19 19 SER CA C 172 63.190 62.474 0.716 1
1 261 . 9 1 1 A 19 19 SER CB C 172 59.730 62.883 -3.153 1
1 262 . 9 1 1 A 19 19 SER N N 172 115.970 114.228 1.742 1
1 263 . 9 1 1 A 20 20 HIS H H 173 7.600 8.241 -0.641 1
1 264 . 9 1 1 A 20 20 HIS HA H 173 4.080 4.321 -0.241 1
1 269 . 9 1 1 A 20 20 HIS C C 173 176.970 177.727 -0.757 1
1 270 . 9 1 1 A 20 20 HIS CA C 173 62.220 59.213 3.007 1
1 271 . 9 1 1 A 20 20 HIS CB C 173 27.440 29.890 -2.450 1
1 275 . 9 1 1 A 20 20 HIS N N 173 119.720 119.491 0.229 1
1 276 . 9 1 1 A 21 21 LEU H H 174 8.200 8.917 -0.717 1
1 277 . 9 1 1 A 21 21 LEU HA H 174 4.070 3.806 0.264 1
1 287 . 9 1 1 A 21 21 LEU C C 174 178.220 179.110 -0.890 1
1 288 . 9 1 1 A 21 21 LEU CA C 174 57.910 58.197 -0.287 1
1 289 . 9 1 1 A 21 21 LEU CB C 174 40.960 41.995 -1.035 1
1 293 . 9 1 1 A 21 21 LEU N N 174 120.780 119.904 0.876 1
1 294 . 9 1 1 A 22 22 LEU H H 175 8.510 8.346 0.164 1
1 295 . 9 1 1 A 22 22 LEU HA H 175 3.930 3.885 0.045 1
1 305 . 9 1 1 A 22 22 LEU C C 175 177.440 178.821 -1.381 1
1 306 . 9 1 1 A 22 22 LEU CA C 175 57.760 57.866 -0.106 1
1 307 . 9 1 1 A 22 22 LEU CB C 175 40.800 41.751 -0.951 1
1 311 . 9 1 1 A 22 22 LEU N N 175 118.600 117.558 1.042 1
1 312 . 9 1 1 A 23 23 ALA H H 176 7.830 8.535 -0.705 1
1 313 . 9 1 1 A 23 23 ALA HA H 176 3.970 4.044 -0.074 1
1 317 . 9 1 1 A 23 23 ALA C C 176 178.220 179.725 -1.505 1
1 318 . 9 1 1 A 23 23 ALA CA C 176 55.260 55.335 -0.075 1
1 319 . 9 1 1 A 23 23 ALA CB C 176 18.070 18.363 -0.293 1
1 320 . 9 1 1 A 23 23 ALA N N 176 121.030 121.270 -0.240 1
1 321 . 9 1 1 A 24 24 ILE H H 177 8.210 8.253 -0.043 1
1 322 . 9 1 1 A 24 24 ILE HA H 177 3.900 3.747 0.153 1
1 332 . 9 1 1 A 24 24 ILE C C 177 178.380 177.896 0.484 1
1 333 . 9 1 1 A 24 24 ILE CA C 177 64.870 65.087 -0.217 1
1 334 . 9 1 1 A 24 24 ILE CB C 177 37.370 37.710 -0.340 1
1 338 . 9 1 1 A 24 24 ILE N N 177 118.330 118.321 0.009 1
1 339 . 9 1 1 A 25 25 GLY H H 178 8.590 8.253 0.337 1
1 340 . 9 1 1 A 25 25 GLY HA2 H 178 3.600 3.785 -0.185 1
1 341 . 9 1 1 A 25 25 GLY HA3 H 178 3.630 3.800 -0.170 1
1 342 . 9 1 1 A 25 25 GLY C C 178 173.850 176.167 -2.317 1
1 343 . 9 1 1 A 25 25 GLY CA C 178 47.530 47.426 0.104 1
1 344 . 9 1 1 A 25 25 GLY N N 178 107.320 108.359 -1.039 1
1 345 . 9 1 1 A 26 26 LEU H H 179 8.830 8.373 0.457 1
1 346 . 9 1 1 A 26 26 LEU HA H 179 4.110 4.024 0.086 1
1 356 . 9 1 1 A 26 26 LEU C C 179 178.220 179.024 -0.804 1
1 357 . 9 1 1 A 26 26 LEU CA C 179 57.600 58.374 -0.774 1
1 358 . 9 1 1 A 26 26 LEU CB C 179 41.040 41.983 -0.943 1
1 362 . 9 1 1 A 26 26 LEU N N 179 122.350 122.652 -0.302 1
1 363 . 9 1 1 A 27 27 GLY H H 180 8.520 8.145 0.375 1
1 364 . 9 1 1 A 27 27 GLY HA2 H 180 3.760 3.762 -0.002 1
1 365 . 9 1 1 A 27 27 GLY HA3 H 180 4.520 3.771 0.749 1
1 366 . 9 1 1 A 27 27 GLY C C 180 174.160 176.045 -1.885 1
1 367 . 9 1 1 A 27 27 GLY CA C 180 47.920 47.503 0.417 1
1 368 . 9 1 1 A 27 27 GLY N N 180 106.260 105.215 1.045 1
1 369 . 9 1 1 A 28 28 ILE H H 181 8.780 8.039 0.741 1
1 370 . 9 1 1 A 28 28 ILE HA H 181 3.590 3.858 -0.268 1
1 380 . 9 1 1 A 28 28 ILE C C 181 177.130 177.458 -0.328 1
1 381 . 9 1 1 A 28 28 ILE CA C 181 65.340 64.389 0.951 1
1 382 . 9 1 1 A 28 28 ILE CB C 181 36.900 37.559 -0.659 1
1 386 . 9 1 1 A 28 28 ILE N N 181 123.970 122.578 1.392 1
1 387 . 9 1 1 A 29 29 TYR H H 182 8.110 8.263 -0.153 1
1 388 . 9 1 1 A 29 29 TYR HA H 182 3.880 4.108 -0.228 1
1 395 . 9 1 1 A 29 29 TYR C C 182 176.970 176.936 0.034 1
1 396 . 9 1 1 A 29 29 TYR CA C 182 61.900 61.927 -0.027 1
1 397 . 9 1 1 A 29 29 TYR CB C 182 37.910 38.609 -0.699 1
1 403 . 9 1 1 A 29 29 TYR N N 182 119.570 120.655 -1.085 1
1 404 . 9 1 1 A 30 30 ILE H H 183 8.490 8.068 0.422 1
1 405 . 9 1 1 A 30 30 ILE HA H 183 3.400 3.697 -0.297 1
1 415 . 9 1 1 A 30 30 ILE C C 183 177.760 177.632 0.128 1
1 416 . 9 1 1 A 30 30 ILE CA C 183 65.020 64.963 0.057 1
1 417 . 9 1 1 A 30 30 ILE CB C 183 37.600 37.979 -0.379 1
1 421 . 9 1 1 A 30 30 ILE N N 183 118.000 119.587 -1.587 1
1 422 . 9 1 1 A 31 31 GLY H H 184 9.360 7.962 1.398 1
1 423 . 9 1 1 A 31 31 GLY HA2 H 184 3.650 3.740 -0.090 1
1 424 . 9 1 1 A 31 31 GLY HA3 H 184 3.940 3.748 0.192 1
1 425 . 9 1 1 A 31 31 GLY C C 184 174.320 176.003 -1.683 1
1 426 . 9 1 1 A 31 31 GLY CA C 184 47.380 47.064 0.316 1
1 427 . 9 1 1 A 31 31 GLY N N 184 106.260 107.265 -1.005 1
1 428 . 9 1 1 A 32 32 ARG H H 185 8.090 8.610 -0.520 1
1 429 . 9 1 1 A 32 32 ARG HA H 185 4.030 4.039 -0.009 1
1 441 . 9 1 1 A 32 32 ARG C C 185 177.290 176.980 0.310 1
1 442 . 9 1 1 A 32 32 ARG CA C 185 57.050 58.728 -1.678 1
1 443 . 9 1 1 A 32 32 ARG CB C 185 29.630 30.139 -0.509 1
1 447 . 9 1 1 A 32 32 ARG N N 185 118.050 120.959 -2.909 1
1 451 . 9 1 1 A 33 33 ARG H H 186 7.760 7.761 -0.001 1
1 452 . 9 1 1 A 33 33 ARG HA H 186 4.260 4.572 -0.312 1
1 464 . 9 1 1 A 33 33 ARG C C 186 176.190 176.315 -0.125 1
1 465 . 9 1 1 A 33 33 ARG CA C 186 55.670 54.900 0.770 1
1 466 . 9 1 1 A 33 33 ARG CB C 186 29.710 29.949 -0.239 1
1 470 . 9 1 1 A 33 33 ARG N N 186 117.390 118.498 -1.108 1
1 474 . 9 1 1 A 34 34 LEU H H 187 7.530 7.340 0.190 1
1 475 . 9 1 1 A 34 34 LEU HA H 187 4.390 4.301 0.089 1
1 485 . 9 1 1 A 34 34 LEU C C 187 175.410 177.997 -2.587 1
1 486 . 9 1 1 A 34 34 LEU CA C 187 54.440 55.634 -1.194 1
1 487 . 9 1 1 A 34 34 LEU CB C 187 41.590 42.456 -0.866 1
1 491 . 9 1 1 A 34 34 LEU N N 187 119.360 119.734 -0.374 1
1 5 . 10 1 1 A 2 2 GLY H H 155 8.570 8.325 0.245 1
1 6 . 10 1 1 A 2 2 GLY HA2 H 155 3.950 4.185 -0.235 1
1 7 . 10 1 1 A 2 2 GLY HA3 H 155 4.070 4.208 -0.138 1
1 8 . 10 1 1 A 2 2 GLY C C 155 173.690 175.018 -1.328 1
1 9 . 10 1 1 A 2 2 GLY CA C 155 44.560 44.285 0.275 1
1 10 . 10 1 1 A 2 2 GLY N N 155 108.940 110.258 -1.318 1
1 11 . 10 1 1 A 3 3 ILE H H 156 8.340 8.681 -0.341 1
1 12 . 10 1 1 A 3 3 ILE HA H 156 3.640 3.690 -0.050 1
1 22 . 10 1 1 A 3 3 ILE C C 156 174.470 177.418 -2.948 1
1 23 . 10 1 1 A 3 3 ILE CA C 156 62.060 64.141 -2.081 1
1 24 . 10 1 1 A 3 3 ILE CB C 156 37.680 37.474 0.206 1
1 28 . 10 1 1 A 3 3 ILE N N 156 119.870 120.702 -0.832 1
1 29 . 10 1 1 A 4 4 PHE H H 157 7.850 8.005 -0.155 1
1 30 . 10 1 1 A 4 4 PHE HA H 157 4.570 4.285 0.285 1
1 38 . 10 1 1 A 4 4 PHE C C 157 174.320 176.722 -2.402 1
1 39 . 10 1 1 A 4 4 PHE CA C 157 56.310 60.695 -4.385 1
1 40 . 10 1 1 A 4 4 PHE CB C 157 37.840 39.171 -1.331 1
1 47 . 10 1 1 A 4 4 PHE N N 157 117.790 119.777 -1.987 1
1 48 . 10 1 1 A 5 5 SER H H 158 7.970 8.316 -0.346 1
1 49 . 10 1 1 A 5 5 SER HA H 158 4.560 4.402 0.158 1
1 52 . 10 1 1 A 5 5 SER C C 158 174.160 175.485 -1.325 1
1 53 . 10 1 1 A 5 5 SER CA C 158 57.010 60.831 -3.821 1
1 54 . 10 1 1 A 5 5 SER CB C 158 64.870 62.915 1.955 1
1 55 . 10 1 1 A 5 5 SER N N 158 115.670 114.200 1.470 1
1 56 . 10 1 1 A 6 6 ALA H H 159 9.000 8.484 0.516 1
1 57 . 10 1 1 A 6 6 ALA HA H 159 4.080 4.151 -0.071 1
1 61 . 10 1 1 A 6 6 ALA C C 159 178.290 179.512 -1.222 1
1 62 . 10 1 1 A 6 6 ALA CA C 159 54.850 55.437 -0.587 1
1 63 . 10 1 1 A 6 6 ALA CB C 159 18.070 18.263 -0.193 1
1 64 . 10 1 1 A 6 6 ALA N N 159 125.390 122.597 2.793 1
1 65 . 10 1 1 A 7 7 GLU H H 160 8.590 8.126 0.464 1
1 66 . 10 1 1 A 7 7 GLU HA H 160 3.990 4.152 -0.162 1
1 71 . 10 1 1 A 7 7 GLU C C 160 177.440 178.762 -1.322 1
1 72 . 10 1 1 A 7 7 GLU CA C 160 59.010 59.104 -0.094 1
1 73 . 10 1 1 A 7 7 GLU CB C 160 28.220 29.628 -1.408 1
1 75 . 10 1 1 A 7 7 GLU N N 160 116.180 118.565 -2.385 1
1 76 . 10 1 1 A 8 8 PHE H H 161 7.860 8.060 -0.200 1
1 77 . 10 1 1 A 8 8 PHE HA H 161 4.330 4.177 0.153 1
1 85 . 10 1 1 A 8 8 PHE C C 161 177.130 177.340 -0.210 1
1 86 . 10 1 1 A 8 8 PHE CA C 161 60.330 61.014 -0.684 1
1 87 . 10 1 1 A 8 8 PHE CB C 161 39.160 39.380 -0.220 1
1 94 . 10 1 1 A 8 8 PHE N N 161 118.050 121.143 -3.093 1
1 95 . 10 1 1 A 9 9 LEU H H 162 8.240 9.279 -1.039 1
1 96 . 10 1 1 A 9 9 LEU HA H 162 3.990 3.837 0.153 1
1 106 . 10 1 1 A 9 9 LEU C C 162 177.130 179.481 -2.351 1
1 107 . 10 1 1 A 9 9 LEU CA C 162 57.990 57.579 0.411 1
1 108 . 10 1 1 A 9 9 LEU CB C 162 41.510 40.819 0.691 1
1 112 . 10 1 1 A 9 9 LEU N N 162 119.110 119.213 -0.103 1
1 113 . 10 1 1 A 10 10 LYS H H 163 7.950 8.339 -0.389 1
1 114 . 10 1 1 A 10 10 LYS HA H 163 3.920 4.106 -0.186 1
1 123 . 10 1 1 A 10 10 LYS C C 163 174.010 177.748 -3.738 1
1 124 . 10 1 1 A 10 10 LYS CA C 163 58.850 59.383 -0.533 1
1 125 . 10 1 1 A 10 10 LYS CB C 163 32.290 32.471 -0.181 1
1 129 . 10 1 1 A 10 10 LYS N N 163 115.320 118.070 -2.750 1
1 130 . 10 1 1 A 11 11 VAL H H 164 6.940 7.303 -0.363 1
1 131 . 10 1 1 A 11 11 VAL HA H 164 4.180 4.442 -0.262 1
1 139 . 10 1 1 A 11 11 VAL C C 164 177.290 176.109 1.181 1
1 140 . 10 1 1 A 11 11 VAL CA C 164 62.680 60.592 2.088 1
1 141 . 10 1 1 A 11 11 VAL CB C 164 32.680 31.396 1.284 1
1 144 . 10 1 1 A 11 11 VAL N N 164 110.250 109.967 0.283 1
1 145 . 10 1 1 A 12 12 PHE H H 165 8.610 7.819 0.791 1
1 146 . 10 1 1 A 12 12 PHE HA H 165 4.180 4.640 -0.460 1
1 154 . 10 1 1 A 12 12 PHE C C 165 175.720 176.786 -1.066 1
1 155 . 10 1 1 A 12 12 PHE CA C 165 60.410 59.176 1.234 1
1 156 . 10 1 1 A 12 12 PHE CB C 165 40.330 40.694 -0.364 1
1 163 . 10 1 1 A 12 12 PHE N N 165 121.290 120.511 0.779 1
1 164 . 10 1 1 A 13 13 LEU H H 166 8.420 7.834 0.586 1
1 165 . 10 1 1 A 13 13 LEU HA H 166 4.160 3.850 0.310 1
1 175 . 10 1 1 A 13 13 LEU CA C 166 59.090 60.103 -1.013 1
1 176 . 10 1 1 A 13 13 LEU CB C 166 38.380 40.061 -1.681 1
1 180 . 10 1 1 A 13 13 LEU N N 166 115.420 119.912 -4.492 1
1 181 . 10 1 1 A 14 14 PRO HA H 167 4.130 4.269 -0.139 1
1 188 . 10 1 1 A 14 14 PRO C C 167 177.150 178.980 -1.830 1
1 189 . 10 1 1 A 14 14 PRO CA C 167 65.800 66.097 -0.297 1
1 190 . 10 1 1 A 14 14 PRO CB C 167 30.340 30.438 -0.098 1
1 193 . 10 1 1 A 15 15 SER H H 168 7.150 8.289 -1.139 1
1 194 . 10 1 1 A 15 15 SER HA H 168 4.040 4.102 -0.062 1
1 197 . 10 1 1 A 15 15 SER C C 168 174.160 176.250 -2.090 1
1 198 . 10 1 1 A 15 15 SER CA C 168 63.330 61.457 1.873 1
1 199 . 10 1 1 A 15 15 SER CB C 168 62.060 62.736 -0.676 1
1 200 . 10 1 1 A 15 15 SER N N 168 112.330 114.391 -2.061 1
1 201 . 10 1 1 A 16 16 LEU H H 169 7.770 7.694 0.076 1
1 202 . 10 1 1 A 16 16 LEU HA H 169 4.800 3.528 1.272 1
1 212 . 10 1 1 A 16 16 LEU C C 169 180.100 178.925 1.175 1
1 213 . 10 1 1 A 16 16 LEU CA C 169 55.340 57.712 -2.372 1
1 214 . 10 1 1 A 16 16 LEU CB C 169 41.980 41.378 0.602 1
1 218 . 10 1 1 A 16 16 LEU N N 169 120.480 120.558 -0.078 1
1 219 . 10 1 1 A 17 17 LEU H H 170 8.050 7.659 0.391 1
1 220 . 10 1 1 A 17 17 LEU HA H 170 4.070 4.027 0.043 1
1 230 . 10 1 1 A 17 17 LEU C C 170 176.970 179.290 -2.320 1
1 231 . 10 1 1 A 17 17 LEU CA C 170 57.910 57.968 -0.058 1
1 232 . 10 1 1 A 17 17 LEU CB C 170 40.800 41.562 -0.762 1
1 236 . 10 1 1 A 17 17 LEU N N 170 122.150 118.682 3.468 1
1 237 . 10 1 1 A 18 18 LEU H H 171 7.940 8.085 -0.145 1
1 238 . 10 1 1 A 18 18 LEU HA H 171 3.990 3.824 0.166 1
1 248 . 10 1 1 A 18 18 LEU C C 171 177.910 179.139 -1.229 1
1 249 . 10 1 1 A 18 18 LEU CA C 171 57.760 58.004 -0.244 1
1 250 . 10 1 1 A 18 18 LEU CB C 171 41.120 41.258 -0.138 1
1 254 . 10 1 1 A 18 18 LEU N N 171 117.490 118.353 -0.863 1
1 255 . 10 1 1 A 19 19 SER H H 172 8.970 7.854 1.116 1
1 256 . 10 1 1 A 19 19 SER HA H 172 3.840 4.043 -0.203 1
1 259 . 10 1 1 A 19 19 SER C C 172 176.820 176.798 0.022 1
1 260 . 10 1 1 A 19 19 SER CA C 172 63.190 62.242 0.948 1
1 261 . 10 1 1 A 19 19 SER CB C 172 59.730 62.896 -3.166 1
1 262 . 10 1 1 A 19 19 SER N N 172 115.970 114.191 1.779 1
1 263 . 10 1 1 A 20 20 HIS H H 173 7.600 7.770 -0.170 1
1 264 . 10 1 1 A 20 20 HIS HA H 173 4.080 4.267 -0.187 1
1 269 . 10 1 1 A 20 20 HIS C C 173 176.970 177.709 -0.739 1
1 270 . 10 1 1 A 20 20 HIS CA C 173 62.220 58.974 3.246 1
1 271 . 10 1 1 A 20 20 HIS CB C 173 27.440 30.073 -2.633 1
1 275 . 10 1 1 A 20 20 HIS N N 173 119.720 119.688 0.032 1
1 276 . 10 1 1 A 21 21 LEU H H 174 8.200 8.526 -0.326 1
1 277 . 10 1 1 A 21 21 LEU HA H 174 4.070 3.816 0.254 1
1 287 . 10 1 1 A 21 21 LEU C C 174 178.220 179.060 -0.840 1
1 288 . 10 1 1 A 21 21 LEU CA C 174 57.910 58.183 -0.273 1
1 289 . 10 1 1 A 21 21 LEU CB C 174 40.960 41.887 -0.927 1
1 293 . 10 1 1 A 21 21 LEU N N 174 120.780 119.882 0.898 1
1 294 . 10 1 1 A 22 22 LEU H H 175 8.510 8.292 0.218 1
1 295 . 10 1 1 A 22 22 LEU HA H 175 3.930 3.882 0.048 1
1 305 . 10 1 1 A 22 22 LEU C C 175 177.440 178.860 -1.420 1
1 306 . 10 1 1 A 22 22 LEU CA C 175 57.760 57.862 -0.102 1
1 307 . 10 1 1 A 22 22 LEU CB C 175 40.800 41.721 -0.921 1
1 311 . 10 1 1 A 22 22 LEU N N 175 118.600 117.965 0.635 1
1 312 . 10 1 1 A 23 23 ALA H H 176 7.830 8.681 -0.851 1
1 313 . 10 1 1 A 23 23 ALA HA H 176 3.970 4.068 -0.098 1
1 317 . 10 1 1 A 23 23 ALA C C 176 178.220 179.963 -1.743 1
1 318 . 10 1 1 A 23 23 ALA CA C 176 55.260 55.363 -0.103 1
1 319 . 10 1 1 A 23 23 ALA CB C 176 18.070 18.418 -0.348 1
1 320 . 10 1 1 A 23 23 ALA N N 176 121.030 121.550 -0.520 1
1 321 . 10 1 1 A 24 24 ILE H H 177 8.210 8.020 0.190 1
1 322 . 10 1 1 A 24 24 ILE HA H 177 3.900 3.749 0.151 1
1 332 . 10 1 1 A 24 24 ILE C C 177 178.380 178.012 0.368 1
1 333 . 10 1 1 A 24 24 ILE CA C 177 64.870 65.088 -0.218 1
1 334 . 10 1 1 A 24 24 ILE CB C 177 37.370 37.774 -0.404 1
1 338 . 10 1 1 A 24 24 ILE N N 177 118.330 118.383 -0.053 1
1 339 . 10 1 1 A 25 25 GLY H H 178 8.590 8.048 0.542 1
1 340 . 10 1 1 A 25 25 GLY HA2 H 178 3.600 3.797 -0.197 1
1 341 . 10 1 1 A 25 25 GLY HA3 H 178 3.630 3.816 -0.186 1
1 342 . 10 1 1 A 25 25 GLY C C 178 173.850 176.064 -2.214 1
1 343 . 10 1 1 A 25 25 GLY CA C 178 47.530 47.419 0.111 1
1 344 . 10 1 1 A 25 25 GLY N N 178 107.320 108.209 -0.889 1
1 345 . 10 1 1 A 26 26 LEU H H 179 8.830 8.539 0.291 1
1 346 . 10 1 1 A 26 26 LEU HA H 179 4.110 4.047 0.063 1
1 356 . 10 1 1 A 26 26 LEU C C 179 178.220 179.100 -0.880 1
1 357 . 10 1 1 A 26 26 LEU CA C 179 57.600 58.492 -0.892 1
1 358 . 10 1 1 A 26 26 LEU CB C 179 41.040 41.970 -0.930 1
1 362 . 10 1 1 A 26 26 LEU N N 179 122.350 122.813 -0.463 1
1 363 . 10 1 1 A 27 27 GLY H H 180 8.520 8.095 0.425 1
1 364 . 10 1 1 A 27 27 GLY HA2 H 180 3.760 3.804 -0.044 1
1 365 . 10 1 1 A 27 27 GLY HA3 H 180 4.520 3.809 0.711 1
1 366 . 10 1 1 A 27 27 GLY C C 180 174.160 176.072 -1.912 1
1 367 . 10 1 1 A 27 27 GLY CA C 180 47.920 47.515 0.405 1
1 368 . 10 1 1 A 27 27 GLY N N 180 106.260 105.470 0.790 1
1 369 . 10 1 1 A 28 28 ILE H H 181 8.780 8.048 0.732 1
1 370 . 10 1 1 A 28 28 ILE HA H 181 3.590 3.846 -0.256 1
1 380 . 10 1 1 A 28 28 ILE C C 181 177.130 177.372 -0.242 1
1 381 . 10 1 1 A 28 28 ILE CA C 181 65.340 64.634 0.706 1
1 382 . 10 1 1 A 28 28 ILE CB C 181 36.900 37.603 -0.703 1
1 386 . 10 1 1 A 28 28 ILE N N 181 123.970 122.620 1.350 1
1 387 . 10 1 1 A 29 29 TYR H H 182 8.110 8.640 -0.530 1
1 388 . 10 1 1 A 29 29 TYR HA H 182 3.880 4.067 -0.187 1
1 395 . 10 1 1 A 29 29 TYR C C 182 176.970 176.857 0.113 1
1 396 . 10 1 1 A 29 29 TYR CA C 182 61.900 61.604 0.296 1
1 397 . 10 1 1 A 29 29 TYR CB C 182 37.910 38.330 -0.420 1
1 403 . 10 1 1 A 29 29 TYR N N 182 119.570 120.388 -0.818 1
1 404 . 10 1 1 A 30 30 ILE H H 183 8.490 8.211 0.279 1
1 405 . 10 1 1 A 30 30 ILE HA H 183 3.400 3.652 -0.252 1
1 415 . 10 1 1 A 30 30 ILE C C 183 177.760 177.640 0.120 1
1 416 . 10 1 1 A 30 30 ILE CA C 183 65.020 64.964 0.056 1
1 417 . 10 1 1 A 30 30 ILE CB C 183 37.600 37.945 -0.345 1
1 421 . 10 1 1 A 30 30 ILE N N 183 118.000 119.380 -1.380 1
1 422 . 10 1 1 A 31 31 GLY H H 184 9.360 8.241 1.119 1
1 423 . 10 1 1 A 31 31 GLY HA2 H 184 3.650 3.777 -0.127 1
1 424 . 10 1 1 A 31 31 GLY HA3 H 184 3.940 3.788 0.152 1
1 425 . 10 1 1 A 31 31 GLY C C 184 174.320 175.938 -1.618 1
1 426 . 10 1 1 A 31 31 GLY CA C 184 47.380 47.049 0.331 1
1 427 . 10 1 1 A 31 31 GLY N N 184 106.260 107.293 -1.033 1
1 428 . 10 1 1 A 32 32 ARG H H 185 8.090 9.090 -1.000 1
1 429 . 10 1 1 A 32 32 ARG HA H 185 4.030 4.090 -0.060 1
1 441 . 10 1 1 A 32 32 ARG C C 185 177.290 177.018 0.272 1
1 442 . 10 1 1 A 32 32 ARG CA C 185 57.050 58.308 -1.258 1
1 443 . 10 1 1 A 32 32 ARG CB C 185 29.630 29.693 -0.063 1
1 447 . 10 1 1 A 32 32 ARG N N 185 118.050 120.887 -2.837 1
1 451 . 10 1 1 A 33 33 ARG H H 186 7.760 7.375 0.385 1
1 452 . 10 1 1 A 33 33 ARG HA H 186 4.260 4.610 -0.350 1
1 464 . 10 1 1 A 33 33 ARG C C 186 176.190 176.358 -0.168 1
1 465 . 10 1 1 A 33 33 ARG CA C 186 55.670 54.877 0.793 1
1 466 . 10 1 1 A 33 33 ARG CB C 186 29.710 29.863 -0.153 1
1 470 . 10 1 1 A 33 33 ARG N N 186 117.390 118.716 -1.326 1
1 474 . 10 1 1 A 34 34 LEU H H 187 7.530 7.772 -0.242 1
1 475 . 10 1 1 A 34 34 LEU HA H 187 4.390 3.936 0.454 1
1 485 . 10 1 1 A 34 34 LEU C C 187 175.410 177.011 -1.601 1
1 486 . 10 1 1 A 34 34 LEU CA C 187 54.440 57.216 -2.776 1
1 487 . 10 1 1 A 34 34 LEU CB C 187 41.590 42.064 -0.474 1
1 491 . 10 1 1 A 34 34 LEU N N 187 119.360 120.432 -1.072 1
1 5 . 11 1 1 A 2 2 GLY H H 155 8.570 8.427 0.143 1
1 6 . 11 1 1 A 2 2 GLY HA2 H 155 3.950 4.229 -0.279 1
1 7 . 11 1 1 A 2 2 GLY HA3 H 155 4.070 4.252 -0.182 1
1 8 . 11 1 1 A 2 2 GLY C C 155 173.690 174.332 -0.642 1
1 9 . 11 1 1 A 2 2 GLY CA C 155 44.560 45.532 -0.972 1
1 10 . 11 1 1 A 2 2 GLY N N 155 108.940 111.235 -2.295 1
1 11 . 11 1 1 A 3 3 ILE H H 156 8.340 8.903 -0.563 1
1 12 . 11 1 1 A 3 3 ILE HA H 156 3.640 3.606 0.034 1
1 22 . 11 1 1 A 3 3 ILE C C 156 174.470 177.316 -2.846 1
1 23 . 11 1 1 A 3 3 ILE CA C 156 62.060 64.210 -2.150 1
1 24 . 11 1 1 A 3 3 ILE CB C 156 37.680 37.490 0.190 1
1 28 . 11 1 1 A 3 3 ILE N N 156 119.870 120.601 -0.731 1
1 29 . 11 1 1 A 4 4 PHE H H 157 7.850 7.775 0.075 1
1 30 . 11 1 1 A 4 4 PHE HA H 157 4.570 4.320 0.250 1
1 38 . 11 1 1 A 4 4 PHE C C 157 174.320 176.697 -2.377 1
1 39 . 11 1 1 A 4 4 PHE CA C 157 56.310 60.832 -4.522 1
1 40 . 11 1 1 A 4 4 PHE CB C 157 37.840 39.216 -1.376 1
1 47 . 11 1 1 A 4 4 PHE N N 157 117.790 120.021 -2.231 1
1 48 . 11 1 1 A 5 5 SER H H 158 7.970 8.263 -0.293 1
1 49 . 11 1 1 A 5 5 SER HA H 158 4.560 4.408 0.152 1
1 52 . 11 1 1 A 5 5 SER C C 158 174.160 175.505 -1.345 1
1 53 . 11 1 1 A 5 5 SER CA C 158 57.010 60.917 -3.907 1
1 54 . 11 1 1 A 5 5 SER CB C 158 64.870 62.932 1.938 1
1 55 . 11 1 1 A 5 5 SER N N 158 115.670 114.183 1.487 1
1 56 . 11 1 1 A 6 6 ALA H H 159 9.000 8.486 0.514 1
1 57 . 11 1 1 A 6 6 ALA HA H 159 4.080 4.139 -0.059 1
1 61 . 11 1 1 A 6 6 ALA C C 159 178.290 179.398 -1.108 1
1 62 . 11 1 1 A 6 6 ALA CA C 159 54.850 55.483 -0.633 1
1 63 . 11 1 1 A 6 6 ALA CB C 159 18.070 18.527 -0.457 1
1 64 . 11 1 1 A 6 6 ALA N N 159 125.390 122.604 2.786 1
1 65 . 11 1 1 A 7 7 GLU H H 160 8.590 8.019 0.571 1
1 66 . 11 1 1 A 7 7 GLU HA H 160 3.990 4.156 -0.166 1
1 71 . 11 1 1 A 7 7 GLU C C 160 177.440 178.809 -1.369 1
1 72 . 11 1 1 A 7 7 GLU CA C 160 59.010 58.986 0.024 1
1 73 . 11 1 1 A 7 7 GLU CB C 160 28.220 29.802 -1.582 1
1 75 . 11 1 1 A 7 7 GLU N N 160 116.180 119.132 -2.952 1
1 76 . 11 1 1 A 8 8 PHE H H 161 7.860 8.065 -0.205 1
1 77 . 11 1 1 A 8 8 PHE HA H 161 4.330 4.160 0.170 1
1 85 . 11 1 1 A 8 8 PHE C C 161 177.130 177.355 -0.225 1
1 86 . 11 1 1 A 8 8 PHE CA C 161 60.330 61.041 -0.711 1
1 87 . 11 1 1 A 8 8 PHE CB C 161 39.160 39.409 -0.249 1
1 94 . 11 1 1 A 8 8 PHE N N 161 118.050 121.027 -2.977 1
1 95 . 11 1 1 A 9 9 LEU H H 162 8.240 9.335 -1.095 1
1 96 . 11 1 1 A 9 9 LEU HA H 162 3.990 3.948 0.042 1
1 106 . 11 1 1 A 9 9 LEU C C 162 177.130 179.526 -2.396 1
1 107 . 11 1 1 A 9 9 LEU CA C 162 57.990 57.910 0.080 1
1 108 . 11 1 1 A 9 9 LEU CB C 162 41.510 41.498 0.012 1
1 112 . 11 1 1 A 9 9 LEU N N 162 119.110 119.558 -0.448 1
1 113 . 11 1 1 A 10 10 LYS H H 163 7.950 8.977 -1.027 1
1 114 . 11 1 1 A 10 10 LYS HA H 163 3.920 4.171 -0.251 1
1 123 . 11 1 1 A 10 10 LYS C C 163 174.010 177.104 -3.094 1
1 124 . 11 1 1 A 10 10 LYS CA C 163 58.850 58.902 -0.052 1
1 125 . 11 1 1 A 10 10 LYS CB C 163 32.290 32.139 0.151 1
1 129 . 11 1 1 A 10 10 LYS N N 163 115.320 117.941 -2.621 1
1 130 . 11 1 1 A 11 11 VAL H H 164 6.940 7.029 -0.089 1
1 131 . 11 1 1 A 11 11 VAL HA H 164 4.180 4.441 -0.261 1
1 139 . 11 1 1 A 11 11 VAL C C 164 177.290 176.079 1.211 1
1 140 . 11 1 1 A 11 11 VAL CA C 164 62.680 60.663 2.017 1
1 141 . 11 1 1 A 11 11 VAL CB C 164 32.680 31.585 1.095 1
1 144 . 11 1 1 A 11 11 VAL N N 164 110.250 115.609 -5.359 1
1 145 . 11 1 1 A 12 12 PHE H H 165 8.610 8.108 0.502 1
1 146 . 11 1 1 A 12 12 PHE HA H 165 4.180 4.667 -0.487 1
1 154 . 11 1 1 A 12 12 PHE C C 165 175.720 176.746 -1.026 1
1 155 . 11 1 1 A 12 12 PHE CA C 165 60.410 59.095 1.315 1
1 156 . 11 1 1 A 12 12 PHE CB C 165 40.330 41.003 -0.673 1
1 163 . 11 1 1 A 12 12 PHE N N 165 121.290 121.306 -0.016 1
1 164 . 11 1 1 A 13 13 LEU H H 166 8.420 8.485 -0.065 1
1 165 . 11 1 1 A 13 13 LEU HA H 166 4.160 3.862 0.298 1
1 175 . 11 1 1 A 13 13 LEU CA C 166 59.090 60.134 -1.044 1
1 176 . 11 1 1 A 13 13 LEU CB C 166 38.380 40.210 -1.830 1
1 180 . 11 1 1 A 13 13 LEU N N 166 115.420 119.626 -4.206 1
1 181 . 11 1 1 A 14 14 PRO HA H 167 4.130 4.168 -0.038 1
1 188 . 11 1 1 A 14 14 PRO C C 167 177.150 179.376 -2.226 1
1 189 . 11 1 1 A 14 14 PRO CA C 167 65.800 66.591 -0.791 1
1 190 . 11 1 1 A 14 14 PRO CB C 167 30.340 30.677 -0.337 1
1 193 . 11 1 1 A 15 15 SER H H 168 7.150 8.193 -1.043 1
1 194 . 11 1 1 A 15 15 SER HA H 168 4.040 4.046 -0.006 1
1 197 . 11 1 1 A 15 15 SER C C 168 174.160 176.247 -2.087 1
1 198 . 11 1 1 A 15 15 SER CA C 168 63.330 61.518 1.812 1
1 199 . 11 1 1 A 15 15 SER CB C 168 62.060 62.664 -0.604 1
1 200 . 11 1 1 A 15 15 SER N N 168 112.330 112.821 -0.491 1
1 201 . 11 1 1 A 16 16 LEU H H 169 7.770 8.051 -0.281 1
1 202 . 11 1 1 A 16 16 LEU HA H 169 4.800 3.578 1.222 1
1 212 . 11 1 1 A 16 16 LEU C C 169 180.100 178.898 1.202 1
1 213 . 11 1 1 A 16 16 LEU CA C 169 55.340 57.733 -2.393 1
1 214 . 11 1 1 A 16 16 LEU CB C 169 41.980 41.369 0.611 1
1 218 . 11 1 1 A 16 16 LEU N N 169 120.480 120.392 0.088 1
1 219 . 11 1 1 A 17 17 LEU H H 170 8.050 7.792 0.258 1
1 220 . 11 1 1 A 17 17 LEU HA H 170 4.070 4.144 -0.074 1
1 230 . 11 1 1 A 17 17 LEU C C 170 176.970 179.090 -2.120 1
1 231 . 11 1 1 A 17 17 LEU CA C 170 57.910 57.959 -0.049 1
1 232 . 11 1 1 A 17 17 LEU CB C 170 40.800 41.680 -0.880 1
1 236 . 11 1 1 A 17 17 LEU N N 170 122.150 118.762 3.388 1
1 237 . 11 1 1 A 18 18 LEU H H 171 7.940 8.189 -0.249 1
1 238 . 11 1 1 A 18 18 LEU HA H 171 3.990 3.818 0.172 1
1 248 . 11 1 1 A 18 18 LEU C C 171 177.910 179.312 -1.402 1
1 249 . 11 1 1 A 18 18 LEU CA C 171 57.760 58.003 -0.243 1
1 250 . 11 1 1 A 18 18 LEU CB C 171 41.120 41.189 -0.069 1
1 254 . 11 1 1 A 18 18 LEU N N 171 117.490 118.965 -1.475 1
1 255 . 11 1 1 A 19 19 SER H H 172 8.970 7.696 1.274 1
1 256 . 11 1 1 A 19 19 SER HA H 172 3.840 4.035 -0.195 1
1 259 . 11 1 1 A 19 19 SER C C 172 176.820 176.681 0.139 1
1 260 . 11 1 1 A 19 19 SER CA C 172 63.190 62.239 0.951 1
1 261 . 11 1 1 A 19 19 SER CB C 172 59.730 62.898 -3.168 1
1 262 . 11 1 1 A 19 19 SER N N 172 115.970 113.990 1.980 1
1 263 . 11 1 1 A 20 20 HIS H H 173 7.600 7.467 0.133 1
1 264 . 11 1 1 A 20 20 HIS HA H 173 4.080 4.282 -0.202 1
1 269 . 11 1 1 A 20 20 HIS C C 173 176.970 177.757 -0.787 1
1 270 . 11 1 1 A 20 20 HIS CA C 173 62.220 59.056 3.164 1
1 271 . 11 1 1 A 20 20 HIS CB C 173 27.440 29.891 -2.451 1
1 275 . 11 1 1 A 20 20 HIS N N 173 119.720 119.703 0.017 1
1 276 . 11 1 1 A 21 21 LEU H H 174 8.200 9.002 -0.802 1
1 277 . 11 1 1 A 21 21 LEU HA H 174 4.070 3.823 0.247 1
1 287 . 11 1 1 A 21 21 LEU C C 174 178.220 179.141 -0.921 1
1 288 . 11 1 1 A 21 21 LEU CA C 174 57.910 58.157 -0.247 1
1 289 . 11 1 1 A 21 21 LEU CB C 174 40.960 41.889 -0.929 1
1 293 . 11 1 1 A 21 21 LEU N N 174 120.780 119.896 0.884 1
1 294 . 11 1 1 A 22 22 LEU H H 175 8.510 8.426 0.084 1
1 295 . 11 1 1 A 22 22 LEU HA H 175 3.930 3.866 0.064 1
1 305 . 11 1 1 A 22 22 LEU C C 175 177.440 178.928 -1.488 1
1 306 . 11 1 1 A 22 22 LEU CA C 175 57.760 57.984 -0.224 1
1 307 . 11 1 1 A 22 22 LEU CB C 175 40.800 41.532 -0.732 1
1 311 . 11 1 1 A 22 22 LEU N N 175 118.600 118.006 0.594 1
1 312 . 11 1 1 A 23 23 ALA H H 176 7.830 8.488 -0.658 1
1 313 . 11 1 1 A 23 23 ALA HA H 176 3.970 4.068 -0.098 1
1 317 . 11 1 1 A 23 23 ALA C C 176 178.220 179.916 -1.696 1
1 318 . 11 1 1 A 23 23 ALA CA C 176 55.260 55.360 -0.100 1
1 319 . 11 1 1 A 23 23 ALA CB C 176 18.070 18.392 -0.322 1
1 320 . 11 1 1 A 23 23 ALA N N 176 121.030 121.162 -0.132 1
1 321 . 11 1 1 A 24 24 ILE H H 177 8.210 8.186 0.024 1
1 322 . 11 1 1 A 24 24 ILE HA H 177 3.900 3.752 0.148 1
1 332 . 11 1 1 A 24 24 ILE C C 177 178.380 177.935 0.445 1
1 333 . 11 1 1 A 24 24 ILE CA C 177 64.870 65.073 -0.203 1
1 334 . 11 1 1 A 24 24 ILE CB C 177 37.370 37.721 -0.351 1
1 338 . 11 1 1 A 24 24 ILE N N 177 118.330 118.230 0.100 1
1 339 . 11 1 1 A 25 25 GLY H H 178 8.590 8.292 0.298 1
1 340 . 11 1 1 A 25 25 GLY HA2 H 178 3.600 3.789 -0.189 1
1 341 . 11 1 1 A 25 25 GLY HA3 H 178 3.630 3.804 -0.174 1
1 342 . 11 1 1 A 25 25 GLY C C 178 173.850 176.206 -2.356 1
1 343 . 11 1 1 A 25 25 GLY CA C 178 47.530 47.354 0.176 1
1 344 . 11 1 1 A 25 25 GLY N N 178 107.320 108.422 -1.102 1
1 345 . 11 1 1 A 26 26 LEU H H 179 8.830 8.360 0.470 1
1 346 . 11 1 1 A 26 26 LEU HA H 179 4.110 4.038 0.072 1
1 356 . 11 1 1 A 26 26 LEU C C 179 178.220 179.033 -0.813 1
1 357 . 11 1 1 A 26 26 LEU CA C 179 57.600 58.561 -0.961 1
1 358 . 11 1 1 A 26 26 LEU CB C 179 41.040 42.050 -1.010 1
1 362 . 11 1 1 A 26 26 LEU N N 179 122.350 122.772 -0.422 1
1 363 . 11 1 1 A 27 27 GLY H H 180 8.520 8.080 0.440 1
1 364 . 11 1 1 A 27 27 GLY HA2 H 180 3.760 3.783 -0.023 1
1 365 . 11 1 1 A 27 27 GLY HA3 H 180 4.520 3.791 0.729 1
1 366 . 11 1 1 A 27 27 GLY C C 180 174.160 176.217 -2.057 1
1 367 . 11 1 1 A 27 27 GLY CA C 180 47.920 47.470 0.450 1
1 368 . 11 1 1 A 27 27 GLY N N 180 106.260 105.093 1.167 1
1 369 . 11 1 1 A 28 28 ILE H H 181 8.780 8.080 0.700 1
1 370 . 11 1 1 A 28 28 ILE HA H 181 3.590 3.842 -0.252 1
1 380 . 11 1 1 A 28 28 ILE C C 181 177.130 177.390 -0.260 1
1 381 . 11 1 1 A 28 28 ILE CA C 181 65.340 64.687 0.653 1
1 382 . 11 1 1 A 28 28 ILE CB C 181 36.900 37.609 -0.709 1
1 386 . 11 1 1 A 28 28 ILE N N 181 123.970 122.400 1.570 1
1 387 . 11 1 1 A 29 29 TYR H H 182 8.110 8.624 -0.514 1
1 388 . 11 1 1 A 29 29 TYR HA H 182 3.880 4.116 -0.236 1
1 395 . 11 1 1 A 29 29 TYR C C 182 176.970 177.118 -0.148 1
1 396 . 11 1 1 A 29 29 TYR CA C 182 61.900 61.569 0.331 1
1 397 . 11 1 1 A 29 29 TYR CB C 182 37.910 38.368 -0.458 1
1 403 . 11 1 1 A 29 29 TYR N N 182 119.570 120.466 -0.896 1
1 404 . 11 1 1 A 30 30 ILE H H 183 8.490 8.494 -0.004 1
1 405 . 11 1 1 A 30 30 ILE HA H 183 3.400 3.754 -0.354 1
1 415 . 11 1 1 A 30 30 ILE C C 183 177.760 177.635 0.125 1
1 416 . 11 1 1 A 30 30 ILE CA C 183 65.020 65.009 0.011 1
1 417 . 11 1 1 A 30 30 ILE CB C 183 37.600 37.798 -0.198 1
1 421 . 11 1 1 A 30 30 ILE N N 183 118.000 119.550 -1.550 1
1 422 . 11 1 1 A 31 31 GLY H H 184 9.360 7.991 1.369 1
1 423 . 11 1 1 A 31 31 GLY HA2 H 184 3.650 3.762 -0.112 1
1 424 . 11 1 1 A 31 31 GLY HA3 H 184 3.940 3.766 0.174 1
1 425 . 11 1 1 A 31 31 GLY C C 184 174.320 175.882 -1.562 1
1 426 . 11 1 1 A 31 31 GLY CA C 184 47.380 47.056 0.324 1
1 427 . 11 1 1 A 31 31 GLY N N 184 106.260 107.413 -1.153 1
1 428 . 11 1 1 A 32 32 ARG H H 185 8.090 8.634 -0.544 1
1 429 . 11 1 1 A 32 32 ARG HA H 185 4.030 4.133 -0.103 1
1 441 . 11 1 1 A 32 32 ARG C C 185 177.290 176.572 0.718 1
1 442 . 11 1 1 A 32 32 ARG CA C 185 57.050 57.882 -0.832 1
1 443 . 11 1 1 A 32 32 ARG CB C 185 29.630 29.446 0.184 1
1 447 . 11 1 1 A 32 32 ARG N N 185 118.050 120.239 -2.189 1
1 451 . 11 1 1 A 33 33 ARG H H 186 7.760 7.390 0.370 1
1 452 . 11 1 1 A 33 33 ARG HA H 186 4.260 4.429 -0.169 1
1 464 . 11 1 1 A 33 33 ARG C C 186 176.190 176.837 -0.647 1
1 465 . 11 1 1 A 33 33 ARG CA C 186 55.670 54.916 0.754 1
1 466 . 11 1 1 A 33 33 ARG CB C 186 29.710 29.944 -0.234 1
1 470 . 11 1 1 A 33 33 ARG N N 186 117.390 116.579 0.811 1
1 474 . 11 1 1 A 34 34 LEU H H 187 7.530 7.765 -0.235 1
1 475 . 11 1 1 A 34 34 LEU HA H 187 4.390 4.237 0.153 1
1 485 . 11 1 1 A 34 34 LEU C C 187 175.410 176.723 -1.313 1
1 486 . 11 1 1 A 34 34 LEU CA C 187 54.440 56.440 -2.000 1
1 487 . 11 1 1 A 34 34 LEU CB C 187 41.590 42.594 -1.004 1
1 491 . 11 1 1 A 34 34 LEU N N 187 119.360 123.456 -4.096 1
1 5 . 12 1 1 A 2 2 GLY H H 155 8.570 8.612 -0.042 1
1 6 . 12 1 1 A 2 2 GLY HA2 H 155 3.950 4.067 -0.117 1
1 7 . 12 1 1 A 2 2 GLY HA3 H 155 4.070 4.080 -0.010 1
1 8 . 12 1 1 A 2 2 GLY C C 155 173.690 174.860 -1.170 1
1 9 . 12 1 1 A 2 2 GLY CA C 155 44.560 45.364 -0.804 1
1 10 . 12 1 1 A 2 2 GLY N N 155 108.940 111.999 -3.059 1
1 11 . 12 1 1 A 3 3 ILE H H 156 8.340 8.646 -0.306 1
1 12 . 12 1 1 A 3 3 ILE HA H 156 3.640 3.610 0.030 1
1 22 . 12 1 1 A 3 3 ILE C C 156 174.470 177.425 -2.955 1
1 23 . 12 1 1 A 3 3 ILE CA C 156 62.060 64.650 -2.590 1
1 24 . 12 1 1 A 3 3 ILE CB C 156 37.680 37.898 -0.218 1
1 28 . 12 1 1 A 3 3 ILE N N 156 119.870 121.755 -1.885 1
1 29 . 12 1 1 A 4 4 PHE H H 157 7.850 8.279 -0.429 1
1 30 . 12 1 1 A 4 4 PHE HA H 157 4.570 4.316 0.254 1
1 38 . 12 1 1 A 4 4 PHE C C 157 174.320 176.637 -2.317 1
1 39 . 12 1 1 A 4 4 PHE CA C 157 56.310 60.829 -4.519 1
1 40 . 12 1 1 A 4 4 PHE CB C 157 37.840 39.271 -1.431 1
1 47 . 12 1 1 A 4 4 PHE N N 157 117.790 119.855 -2.065 1
1 48 . 12 1 1 A 5 5 SER H H 158 7.970 8.327 -0.357 1
1 49 . 12 1 1 A 5 5 SER HA H 158 4.560 4.408 0.152 1
1 52 . 12 1 1 A 5 5 SER C C 158 174.160 175.491 -1.331 1
1 53 . 12 1 1 A 5 5 SER CA C 158 57.010 60.806 -3.796 1
1 54 . 12 1 1 A 5 5 SER CB C 158 64.870 62.906 1.964 1
1 55 . 12 1 1 A 5 5 SER N N 158 115.670 114.364 1.306 1
1 56 . 12 1 1 A 6 6 ALA H H 159 9.000 8.308 0.692 1
1 57 . 12 1 1 A 6 6 ALA HA H 159 4.080 4.148 -0.068 1
1 61 . 12 1 1 A 6 6 ALA C C 159 178.290 179.479 -1.189 1
1 62 . 12 1 1 A 6 6 ALA CA C 159 54.850 55.494 -0.644 1
1 63 . 12 1 1 A 6 6 ALA CB C 159 18.070 18.337 -0.267 1
1 64 . 12 1 1 A 6 6 ALA N N 159 125.390 122.654 2.736 1
1 65 . 12 1 1 A 7 7 GLU H H 160 8.590 7.913 0.677 1
1 66 . 12 1 1 A 7 7 GLU HA H 160 3.990 4.140 -0.150 1
1 71 . 12 1 1 A 7 7 GLU C C 160 177.440 178.770 -1.330 1
1 72 . 12 1 1 A 7 7 GLU CA C 160 59.010 59.298 -0.288 1
1 73 . 12 1 1 A 7 7 GLU CB C 160 28.220 29.451 -1.231 1
1 75 . 12 1 1 A 7 7 GLU N N 160 116.180 118.792 -2.612 1
1 76 . 12 1 1 A 8 8 PHE H H 161 7.860 8.440 -0.580 1
1 77 . 12 1 1 A 8 8 PHE HA H 161 4.330 4.225 0.105 1
1 85 . 12 1 1 A 8 8 PHE C C 161 177.130 177.353 -0.223 1
1 86 . 12 1 1 A 8 8 PHE CA C 161 60.330 61.363 -1.033 1
1 87 . 12 1 1 A 8 8 PHE CB C 161 39.160 39.655 -0.495 1
1 94 . 12 1 1 A 8 8 PHE N N 161 118.050 121.033 -2.983 1
1 95 . 12 1 1 A 9 9 LEU H H 162 8.240 9.431 -1.191 1
1 96 . 12 1 1 A 9 9 LEU HA H 162 3.990 3.866 0.124 1
1 106 . 12 1 1 A 9 9 LEU C C 162 177.130 179.448 -2.318 1
1 107 . 12 1 1 A 9 9 LEU CA C 162 57.990 57.129 0.861 1
1 108 . 12 1 1 A 9 9 LEU CB C 162 41.510 40.956 0.554 1
1 112 . 12 1 1 A 9 9 LEU N N 162 119.110 119.102 0.008 1
1 113 . 12 1 1 A 10 10 LYS H H 163 7.950 8.508 -0.558 1
1 114 . 12 1 1 A 10 10 LYS HA H 163 3.920 3.991 -0.071 1
1 123 . 12 1 1 A 10 10 LYS C C 163 174.010 178.392 -4.382 1
1 124 . 12 1 1 A 10 10 LYS CA C 163 58.850 59.676 -0.826 1
1 125 . 12 1 1 A 10 10 LYS CB C 163 32.290 32.225 0.065 1
1 129 . 12 1 1 A 10 10 LYS N N 163 115.320 120.997 -5.677 1
1 130 . 12 1 1 A 11 11 VAL H H 164 6.940 7.587 -0.647 1
1 131 . 12 1 1 A 11 11 VAL HA H 164 4.180 4.178 0.002 1
1 139 . 12 1 1 A 11 11 VAL C C 164 177.290 177.824 -0.534 1
1 140 . 12 1 1 A 11 11 VAL CA C 164 62.680 62.974 -0.294 1
1 141 . 12 1 1 A 11 11 VAL CB C 164 32.680 32.768 -0.088 1
1 144 . 12 1 1 A 11 11 VAL N N 164 110.250 113.630 -3.380 1
1 145 . 12 1 1 A 12 12 PHE H H 165 8.610 8.614 -0.004 1
1 146 . 12 1 1 A 12 12 PHE HA H 165 4.180 3.980 0.200 1
1 154 . 12 1 1 A 12 12 PHE C C 165 175.720 177.271 -1.551 1
1 155 . 12 1 1 A 12 12 PHE CA C 165 60.410 60.883 -0.473 1
1 156 . 12 1 1 A 12 12 PHE CB C 165 40.330 38.328 2.002 1
1 163 . 12 1 1 A 12 12 PHE N N 165 121.290 124.094 -2.804 1
1 164 . 12 1 1 A 13 13 LEU H H 166 8.420 8.156 0.264 1
1 165 . 12 1 1 A 13 13 LEU HA H 166 4.160 3.774 0.386 1
1 175 . 12 1 1 A 13 13 LEU CA C 166 59.090 60.140 -1.050 1
1 176 . 12 1 1 A 13 13 LEU CB C 166 38.380 40.750 -2.370 1
1 180 . 12 1 1 A 13 13 LEU N N 166 115.420 120.188 -4.768 1
1 181 . 12 1 1 A 14 14 PRO HA H 167 4.130 4.221 -0.091 1
1 188 . 12 1 1 A 14 14 PRO C C 167 177.150 178.425 -1.275 1
1 189 . 12 1 1 A 14 14 PRO CA C 167 65.800 66.514 -0.714 1
1 190 . 12 1 1 A 14 14 PRO CB C 167 30.340 30.774 -0.434 1
1 193 . 12 1 1 A 15 15 SER H H 168 7.150 8.142 -0.992 1
1 194 . 12 1 1 A 15 15 SER HA H 168 4.040 4.103 -0.063 1
1 197 . 12 1 1 A 15 15 SER C C 168 174.160 177.341 -3.181 1
1 198 . 12 1 1 A 15 15 SER CA C 168 63.330 61.310 2.020 1
1 199 . 12 1 1 A 15 15 SER CB C 168 62.060 62.420 -0.360 1
1 200 . 12 1 1 A 15 15 SER N N 168 112.330 112.532 -0.202 1
1 201 . 12 1 1 A 16 16 LEU H H 169 7.770 7.801 -0.031 1
1 202 . 12 1 1 A 16 16 LEU HA H 169 4.800 3.676 1.124 1
1 212 . 12 1 1 A 16 16 LEU C C 169 180.100 179.132 0.968 1
1 213 . 12 1 1 A 16 16 LEU CA C 169 55.340 57.873 -2.533 1
1 214 . 12 1 1 A 16 16 LEU CB C 169 41.980 41.765 0.215 1
1 218 . 12 1 1 A 16 16 LEU N N 169 120.480 122.459 -1.979 1
1 219 . 12 1 1 A 17 17 LEU H H 170 8.050 7.633 0.417 1
1 220 . 12 1 1 A 17 17 LEU HA H 170 4.070 4.088 -0.018 1
1 230 . 12 1 1 A 17 17 LEU C C 170 176.970 179.145 -2.175 1
1 231 . 12 1 1 A 17 17 LEU CA C 170 57.910 58.085 -0.175 1
1 232 . 12 1 1 A 17 17 LEU CB C 170 40.800 41.468 -0.668 1
1 236 . 12 1 1 A 17 17 LEU N N 170 122.150 117.645 4.505 1
1 237 . 12 1 1 A 18 18 LEU H H 171 7.940 8.226 -0.286 1
1 238 . 12 1 1 A 18 18 LEU HA H 171 3.990 3.843 0.147 1
1 248 . 12 1 1 A 18 18 LEU C C 171 177.910 179.236 -1.326 1
1 249 . 12 1 1 A 18 18 LEU CA C 171 57.760 57.978 -0.218 1
1 250 . 12 1 1 A 18 18 LEU CB C 171 41.120 41.147 -0.027 1
1 254 . 12 1 1 A 18 18 LEU N N 171 117.490 118.532 -1.042 1
1 255 . 12 1 1 A 19 19 SER H H 172 8.970 7.885 1.085 1
1 256 . 12 1 1 A 19 19 SER HA H 172 3.840 4.025 -0.185 1
1 259 . 12 1 1 A 19 19 SER C C 172 176.820 176.716 0.104 1
1 260 . 12 1 1 A 19 19 SER CA C 172 63.190 62.289 0.901 1
1 261 . 12 1 1 A 19 19 SER CB C 172 59.730 62.916 -3.186 1
1 262 . 12 1 1 A 19 19 SER N N 172 115.970 114.128 1.842 1
1 263 . 12 1 1 A 20 20 HIS H H 173 7.600 7.666 -0.066 1
1 264 . 12 1 1 A 20 20 HIS HA H 173 4.080 4.255 -0.175 1
1 269 . 12 1 1 A 20 20 HIS C C 173 176.970 177.719 -0.749 1
1 270 . 12 1 1 A 20 20 HIS CA C 173 62.220 59.151 3.069 1
1 271 . 12 1 1 A 20 20 HIS CB C 173 27.440 29.899 -2.459 1
1 275 . 12 1 1 A 20 20 HIS N N 173 119.720 119.429 0.291 1
1 276 . 12 1 1 A 21 21 LEU H H 174 8.200 8.610 -0.410 1
1 277 . 12 1 1 A 21 21 LEU HA H 174 4.070 3.789 0.281 1
1 287 . 12 1 1 A 21 21 LEU C C 174 178.220 178.948 -0.728 1
1 288 . 12 1 1 A 21 21 LEU CA C 174 57.910 58.200 -0.290 1
1 289 . 12 1 1 A 21 21 LEU CB C 174 40.960 42.021 -1.061 1
1 293 . 12 1 1 A 21 21 LEU N N 174 120.780 119.900 0.880 1
1 294 . 12 1 1 A 22 22 LEU H H 175 8.510 8.446 0.064 1
1 295 . 12 1 1 A 22 22 LEU HA H 175 3.930 3.886 0.044 1
1 305 . 12 1 1 A 22 22 LEU C C 175 177.440 178.889 -1.449 1
1 306 . 12 1 1 A 22 22 LEU CA C 175 57.760 57.980 -0.220 1
1 307 . 12 1 1 A 22 22 LEU CB C 175 40.800 41.425 -0.625 1
1 311 . 12 1 1 A 22 22 LEU N N 175 118.600 117.989 0.611 1
1 312 . 12 1 1 A 23 23 ALA H H 176 7.830 8.256 -0.426 1
1 313 . 12 1 1 A 23 23 ALA HA H 176 3.970 4.057 -0.087 1
1 317 . 12 1 1 A 23 23 ALA C C 176 178.220 179.908 -1.688 1
1 318 . 12 1 1 A 23 23 ALA CA C 176 55.260 55.355 -0.095 1
1 319 . 12 1 1 A 23 23 ALA CB C 176 18.070 18.407 -0.337 1
1 320 . 12 1 1 A 23 23 ALA N N 176 121.030 121.669 -0.639 1
1 321 . 12 1 1 A 24 24 ILE H H 177 8.210 7.975 0.235 1
1 322 . 12 1 1 A 24 24 ILE HA H 177 3.900 3.745 0.155 1
1 332 . 12 1 1 A 24 24 ILE C C 177 178.380 177.922 0.458 1
1 333 . 12 1 1 A 24 24 ILE CA C 177 64.870 65.079 -0.209 1
1 334 . 12 1 1 A 24 24 ILE CB C 177 37.370 37.713 -0.343 1
1 338 . 12 1 1 A 24 24 ILE N N 177 118.330 118.420 -0.090 1
1 339 . 12 1 1 A 25 25 GLY H H 178 8.590 8.019 0.571 1
1 340 . 12 1 1 A 25 25 GLY HA2 H 178 3.600 3.795 -0.195 1
1 341 . 12 1 1 A 25 25 GLY HA3 H 178 3.630 3.809 -0.179 1
1 342 . 12 1 1 A 25 25 GLY C C 178 173.850 176.149 -2.299 1
1 343 . 12 1 1 A 25 25 GLY CA C 178 47.530 47.395 0.135 1
1 344 . 12 1 1 A 25 25 GLY N N 178 107.320 108.325 -1.005 1
1 345 . 12 1 1 A 26 26 LEU H H 179 8.830 8.301 0.529 1
1 346 . 12 1 1 A 26 26 LEU HA H 179 4.110 4.085 0.025 1
1 356 . 12 1 1 A 26 26 LEU C C 179 178.220 179.005 -0.785 1
1 357 . 12 1 1 A 26 26 LEU CA C 179 57.600 58.533 -0.933 1
1 358 . 12 1 1 A 26 26 LEU CB C 179 41.040 42.058 -1.018 1
1 362 . 12 1 1 A 26 26 LEU N N 179 122.350 122.757 -0.407 1
1 363 . 12 1 1 A 27 27 GLY H H 180 8.520 8.148 0.372 1
1 364 . 12 1 1 A 27 27 GLY HA2 H 180 3.760 3.777 -0.017 1
1 365 . 12 1 1 A 27 27 GLY HA3 H 180 4.520 3.779 0.741 1
1 366 . 12 1 1 A 27 27 GLY C C 180 174.160 176.148 -1.988 1
1 367 . 12 1 1 A 27 27 GLY CA C 180 47.920 47.488 0.432 1
1 368 . 12 1 1 A 27 27 GLY N N 180 106.260 105.333 0.927 1
1 369 . 12 1 1 A 28 28 ILE H H 181 8.780 8.057 0.723 1
1 370 . 12 1 1 A 28 28 ILE HA H 181 3.590 3.849 -0.259 1
1 380 . 12 1 1 A 28 28 ILE C C 181 177.130 177.354 -0.224 1
1 381 . 12 1 1 A 28 28 ILE CA C 181 65.340 64.551 0.789 1
1 382 . 12 1 1 A 28 28 ILE CB C 181 36.900 37.612 -0.712 1
1 386 . 12 1 1 A 28 28 ILE N N 181 123.970 122.564 1.406 1
1 387 . 12 1 1 A 29 29 TYR H H 182 8.110 8.383 -0.273 1
1 388 . 12 1 1 A 29 29 TYR HA H 182 3.880 4.129 -0.249 1
1 395 . 12 1 1 A 29 29 TYR C C 182 176.970 177.021 -0.051 1
1 396 . 12 1 1 A 29 29 TYR CA C 182 61.900 61.558 0.342 1
1 397 . 12 1 1 A 29 29 TYR CB C 182 37.910 38.556 -0.646 1
1 403 . 12 1 1 A 29 29 TYR N N 182 119.570 120.470 -0.900 1
1 404 . 12 1 1 A 30 30 ILE H H 183 8.490 8.160 0.330 1
1 405 . 12 1 1 A 30 30 ILE HA H 183 3.400 3.566 -0.166 1
1 415 . 12 1 1 A 30 30 ILE C C 183 177.760 177.580 0.180 1
1 416 . 12 1 1 A 30 30 ILE CA C 183 65.020 64.935 0.085 1
1 417 . 12 1 1 A 30 30 ILE CB C 183 37.600 37.919 -0.319 1
1 421 . 12 1 1 A 30 30 ILE N N 183 118.000 119.227 -1.227 1
1 422 . 12 1 1 A 31 31 GLY H H 184 9.360 8.228 1.132 1
1 423 . 12 1 1 A 31 31 GLY HA2 H 184 3.650 3.745 -0.095 1
1 424 . 12 1 1 A 31 31 GLY HA3 H 184 3.940 3.758 0.182 1
1 425 . 12 1 1 A 31 31 GLY C C 184 174.320 175.840 -1.520 1
1 426 . 12 1 1 A 31 31 GLY CA C 184 47.380 47.062 0.318 1
1 427 . 12 1 1 A 31 31 GLY N N 184 106.260 107.527 -1.267 1
1 428 . 12 1 1 A 32 32 ARG H H 185 8.090 8.681 -0.591 1
1 429 . 12 1 1 A 32 32 ARG HA H 185 4.030 4.137 -0.107 1
1 441 . 12 1 1 A 32 32 ARG C C 185 177.290 176.259 1.031 1
1 442 . 12 1 1 A 32 32 ARG CA C 185 57.050 58.087 -1.037 1
1 443 . 12 1 1 A 32 32 ARG CB C 185 29.630 29.477 0.153 1
1 447 . 12 1 1 A 32 32 ARG N N 185 118.050 120.475 -2.425 1
1 451 . 12 1 1 A 33 33 ARG H H 186 7.760 7.366 0.394 1
1 452 . 12 1 1 A 33 33 ARG HA H 186 4.260 4.443 -0.183 1
1 464 . 12 1 1 A 33 33 ARG C C 186 176.190 176.708 -0.518 1
1 465 . 12 1 1 A 33 33 ARG CA C 186 55.670 54.519 1.151 1
1 466 . 12 1 1 A 33 33 ARG CB C 186 29.710 30.386 -0.676 1
1 470 . 12 1 1 A 33 33 ARG N N 186 117.390 118.824 -1.434 1
1 474 . 12 1 1 A 34 34 LEU H H 187 7.530 8.147 -0.617 1
1 475 . 12 1 1 A 34 34 LEU HA H 187 4.390 4.238 0.152 1
1 485 . 12 1 1 A 34 34 LEU C C 187 175.410 176.582 -1.172 1
1 486 . 12 1 1 A 34 34 LEU CA C 187 54.440 56.460 -2.020 1
1 487 . 12 1 1 A 34 34 LEU CB C 187 41.590 42.221 -0.631 1
1 491 . 12 1 1 A 34 34 LEU N N 187 119.360 124.940 -5.580 1
1 5 . 13 1 1 A 2 2 GLY H H 155 8.570 8.326 0.244 1
1 6 . 13 1 1 A 2 2 GLY HA2 H 155 3.950 4.219 -0.269 1
1 7 . 13 1 1 A 2 2 GLY HA3 H 155 4.070 4.220 -0.150 1
1 8 . 13 1 1 A 2 2 GLY C C 155 173.690 174.197 -0.507 1
1 9 . 13 1 1 A 2 2 GLY CA C 155 44.560 45.774 -1.214 1
1 10 . 13 1 1 A 2 2 GLY N N 155 108.940 108.181 0.759 1
1 11 . 13 1 1 A 3 3 ILE H H 156 8.340 8.896 -0.556 1
1 12 . 13 1 1 A 3 3 ILE HA H 156 3.640 3.672 -0.032 1
1 22 . 13 1 1 A 3 3 ILE C C 156 174.470 177.414 -2.944 1
1 23 . 13 1 1 A 3 3 ILE CA C 156 62.060 64.216 -2.156 1
1 24 . 13 1 1 A 3 3 ILE CB C 156 37.680 37.586 0.094 1
1 28 . 13 1 1 A 3 3 ILE N N 156 119.870 119.883 -0.013 1
1 29 . 13 1 1 A 4 4 PHE H H 157 7.850 8.043 -0.193 1
1 30 . 13 1 1 A 4 4 PHE HA H 157 4.570 4.306 0.264 1
1 38 . 13 1 1 A 4 4 PHE C C 157 174.320 176.160 -1.840 1
1 39 . 13 1 1 A 4 4 PHE CA C 157 56.310 60.718 -4.408 1
1 40 . 13 1 1 A 4 4 PHE CB C 157 37.840 39.346 -1.506 1
1 47 . 13 1 1 A 4 4 PHE N N 157 117.790 119.807 -2.017 1
1 48 . 13 1 1 A 5 5 SER H H 158 7.970 8.009 -0.039 1
1 49 . 13 1 1 A 5 5 SER HA H 158 4.560 4.138 0.422 1
1 52 . 13 1 1 A 5 5 SER C C 158 174.160 175.778 -1.618 1
1 53 . 13 1 1 A 5 5 SER CA C 158 57.010 60.956 -3.946 1
1 54 . 13 1 1 A 5 5 SER CB C 158 64.870 61.766 3.104 1
1 55 . 13 1 1 A 5 5 SER N N 158 115.670 112.299 3.371 1
1 56 . 13 1 1 A 6 6 ALA H H 159 9.000 8.535 0.465 1
1 57 . 13 1 1 A 6 6 ALA HA H 159 4.080 4.142 -0.062 1
1 61 . 13 1 1 A 6 6 ALA C C 159 178.290 179.418 -1.128 1
1 62 . 13 1 1 A 6 6 ALA CA C 159 54.850 55.555 -0.705 1
1 63 . 13 1 1 A 6 6 ALA CB C 159 18.070 18.592 -0.522 1
1 64 . 13 1 1 A 6 6 ALA N N 159 125.390 124.257 1.133 1
1 65 . 13 1 1 A 7 7 GLU H H 160 8.590 8.331 0.259 1
1 66 . 13 1 1 A 7 7 GLU HA H 160 3.990 4.109 -0.119 1
1 71 . 13 1 1 A 7 7 GLU C C 160 177.440 178.700 -1.260 1
1 72 . 13 1 1 A 7 7 GLU CA C 160 59.010 59.309 -0.299 1
1 73 . 13 1 1 A 7 7 GLU CB C 160 28.220 29.621 -1.401 1
1 75 . 13 1 1 A 7 7 GLU N N 160 116.180 119.169 -2.989 1
1 76 . 13 1 1 A 8 8 PHE H H 161 7.860 8.466 -0.606 1
1 77 . 13 1 1 A 8 8 PHE HA H 161 4.330 4.142 0.188 1
1 85 . 13 1 1 A 8 8 PHE C C 161 177.130 177.373 -0.243 1
1 86 . 13 1 1 A 8 8 PHE CA C 161 60.330 61.403 -1.073 1
1 87 . 13 1 1 A 8 8 PHE CB C 161 39.160 39.407 -0.247 1
1 94 . 13 1 1 A 8 8 PHE N N 161 118.050 121.085 -3.035 1
1 95 . 13 1 1 A 9 9 LEU H H 162 8.240 9.704 -1.464 1
1 96 . 13 1 1 A 9 9 LEU HA H 162 3.990 4.099 -0.109 1
1 106 . 13 1 1 A 9 9 LEU C C 162 177.130 179.416 -2.286 1
1 107 . 13 1 1 A 9 9 LEU CA C 162 57.990 58.232 -0.242 1
1 108 . 13 1 1 A 9 9 LEU CB C 162 41.510 41.487 0.023 1
1 112 . 13 1 1 A 9 9 LEU N N 162 119.110 119.656 -0.546 1
1 113 . 13 1 1 A 10 10 LYS H H 163 7.950 8.453 -0.503 1
1 114 . 13 1 1 A 10 10 LYS HA H 163 3.920 4.120 -0.200 1
1 123 . 13 1 1 A 10 10 LYS C C 163 174.010 177.842 -3.832 1
1 124 . 13 1 1 A 10 10 LYS CA C 163 58.850 58.662 0.188 1
1 125 . 13 1 1 A 10 10 LYS CB C 163 32.290 32.831 -0.541 1
1 129 . 13 1 1 A 10 10 LYS N N 163 115.320 117.306 -1.986 1
1 130 . 13 1 1 A 11 11 VAL H H 164 6.940 7.119 -0.179 1
1 131 . 13 1 1 A 11 11 VAL HA H 164 4.180 4.611 -0.431 1
1 139 . 13 1 1 A 11 11 VAL C C 164 177.290 176.290 1.000 1
1 140 . 13 1 1 A 11 11 VAL CA C 164 62.680 60.755 1.925 1
1 141 . 13 1 1 A 11 11 VAL CB C 164 32.680 31.531 1.149 1
1 144 . 13 1 1 A 11 11 VAL N N 164 110.250 109.635 0.615 1
1 145 . 13 1 1 A 12 12 PHE H H 165 8.610 8.035 0.575 1
1 146 . 13 1 1 A 12 12 PHE HA H 165 4.180 4.440 -0.260 1
1 154 . 13 1 1 A 12 12 PHE C C 165 175.720 177.411 -1.691 1
1 155 . 13 1 1 A 12 12 PHE CA C 165 60.410 59.881 0.529 1
1 156 . 13 1 1 A 12 12 PHE CB C 165 40.330 40.278 0.052 1
1 163 . 13 1 1 A 12 12 PHE N N 165 121.290 121.670 -0.380 1
1 164 . 13 1 1 A 13 13 LEU H H 166 8.420 7.732 0.688 1
1 165 . 13 1 1 A 13 13 LEU HA H 166 4.160 3.895 0.265 1
1 175 . 13 1 1 A 13 13 LEU CA C 166 59.090 59.996 -0.906 1
1 176 . 13 1 1 A 13 13 LEU CB C 166 38.380 39.776 -1.396 1
1 180 . 13 1 1 A 13 13 LEU N N 166 115.420 119.642 -4.222 1
1 181 . 13 1 1 A 14 14 PRO HA H 167 4.130 4.220 -0.090 1
1 188 . 13 1 1 A 14 14 PRO C C 167 177.150 179.283 -2.133 1
1 189 . 13 1 1 A 14 14 PRO CA C 167 65.800 66.436 -0.636 1
1 190 . 13 1 1 A 14 14 PRO CB C 167 30.340 30.836 -0.496 1
1 193 . 13 1 1 A 15 15 SER H H 168 7.150 8.246 -1.096 1
1 194 . 13 1 1 A 15 15 SER HA H 168 4.040 4.147 -0.107 1
1 197 . 13 1 1 A 15 15 SER C C 168 174.160 176.090 -1.930 1
1 198 . 13 1 1 A 15 15 SER CA C 168 63.330 61.579 1.751 1
1 199 . 13 1 1 A 15 15 SER CB C 168 62.060 62.765 -0.705 1
1 200 . 13 1 1 A 15 15 SER N N 168 112.330 114.082 -1.752 1
1 201 . 13 1 1 A 16 16 LEU H H 169 7.770 7.902 -0.132 1
1 202 . 13 1 1 A 16 16 LEU HA H 169 4.800 3.829 0.971 1
1 212 . 13 1 1 A 16 16 LEU C C 169 180.100 179.318 0.782 1
1 213 . 13 1 1 A 16 16 LEU CA C 169 55.340 58.117 -2.777 1
1 214 . 13 1 1 A 16 16 LEU CB C 169 41.980 41.335 0.645 1
1 218 . 13 1 1 A 16 16 LEU N N 169 120.480 120.435 0.045 1
1 219 . 13 1 1 A 17 17 LEU H H 170 8.050 7.998 0.052 1
1 220 . 13 1 1 A 17 17 LEU HA H 170 4.070 4.065 0.005 1
1 230 . 13 1 1 A 17 17 LEU C C 170 176.970 179.314 -2.344 1
1 231 . 13 1 1 A 17 17 LEU CA C 170 57.910 58.083 -0.173 1
1 232 . 13 1 1 A 17 17 LEU CB C 170 40.800 41.662 -0.862 1
1 236 . 13 1 1 A 17 17 LEU N N 170 122.150 118.801 3.349 1
1 237 . 13 1 1 A 18 18 LEU H H 171 7.940 8.002 -0.062 1
1 238 . 13 1 1 A 18 18 LEU HA H 171 3.990 3.836 0.154 1
1 248 . 13 1 1 A 18 18 LEU C C 171 177.910 179.164 -1.254 1
1 249 . 13 1 1 A 18 18 LEU CA C 171 57.760 58.056 -0.296 1
1 250 . 13 1 1 A 18 18 LEU CB C 171 41.120 41.275 -0.155 1
1 254 . 13 1 1 A 18 18 LEU N N 171 117.490 118.963 -1.473 1
1 255 . 13 1 1 A 19 19 SER H H 172 8.970 7.708 1.262 1
1 256 . 13 1 1 A 19 19 SER HA H 172 3.840 4.039 -0.199 1
1 259 . 13 1 1 A 19 19 SER C C 172 176.820 176.741 0.079 1
1 260 . 13 1 1 A 19 19 SER CA C 172 63.190 62.390 0.800 1
1 261 . 13 1 1 A 19 19 SER CB C 172 59.730 62.828 -3.098 1
1 262 . 13 1 1 A 19 19 SER N N 172 115.970 114.247 1.723 1
1 263 . 13 1 1 A 20 20 HIS H H 173 7.600 7.790 -0.190 1
1 264 . 13 1 1 A 20 20 HIS HA H 173 4.080 4.287 -0.207 1
1 269 . 13 1 1 A 20 20 HIS C C 173 176.970 177.739 -0.769 1
1 270 . 13 1 1 A 20 20 HIS CA C 173 62.220 59.200 3.020 1
1 271 . 13 1 1 A 20 20 HIS CB C 173 27.440 30.057 -2.617 1
1 275 . 13 1 1 A 20 20 HIS N N 173 119.720 119.306 0.414 1
1 276 . 13 1 1 A 21 21 LEU H H 174 8.200 8.889 -0.689 1
1 277 . 13 1 1 A 21 21 LEU HA H 174 4.070 3.805 0.265 1
1 287 . 13 1 1 A 21 21 LEU C C 174 178.220 179.040 -0.820 1
1 288 . 13 1 1 A 21 21 LEU CA C 174 57.910 58.208 -0.298 1
1 289 . 13 1 1 A 21 21 LEU CB C 174 40.960 41.860 -0.900 1
1 293 . 13 1 1 A 21 21 LEU N N 174 120.780 119.866 0.914 1
1 294 . 13 1 1 A 22 22 LEU H H 175 8.510 8.620 -0.110 1
1 295 . 13 1 1 A 22 22 LEU HA H 175 3.930 3.884 0.046 1
1 305 . 13 1 1 A 22 22 LEU C C 175 177.440 178.964 -1.524 1
1 306 . 13 1 1 A 22 22 LEU CA C 175 57.760 57.860 -0.100 1
1 307 . 13 1 1 A 22 22 LEU CB C 175 40.800 41.656 -0.856 1
1 311 . 13 1 1 A 22 22 LEU N N 175 118.600 118.024 0.576 1
1 312 . 13 1 1 A 23 23 ALA H H 176 7.830 8.463 -0.633 1
1 313 . 13 1 1 A 23 23 ALA HA H 176 3.970 4.092 -0.122 1
1 317 . 13 1 1 A 23 23 ALA C C 176 178.220 179.727 -1.507 1
1 318 . 13 1 1 A 23 23 ALA CA C 176 55.260 55.348 -0.088 1
1 319 . 13 1 1 A 23 23 ALA CB C 176 18.070 18.431 -0.361 1
1 320 . 13 1 1 A 23 23 ALA N N 176 121.030 121.718 -0.688 1
1 321 . 13 1 1 A 24 24 ILE H H 177 8.210 8.357 -0.147 1
1 322 . 13 1 1 A 24 24 ILE HA H 177 3.900 3.752 0.148 1
1 332 . 13 1 1 A 24 24 ILE C C 177 178.380 177.882 0.498 1
1 333 . 13 1 1 A 24 24 ILE CA C 177 64.870 65.099 -0.229 1
1 334 . 13 1 1 A 24 24 ILE CB C 177 37.370 37.773 -0.403 1
1 338 . 13 1 1 A 24 24 ILE N N 177 118.330 118.370 -0.040 1
1 339 . 13 1 1 A 25 25 GLY H H 178 8.590 8.396 0.194 1
1 340 . 13 1 1 A 25 25 GLY HA2 H 178 3.600 3.771 -0.171 1
1 341 . 13 1 1 A 25 25 GLY HA3 H 178 3.630 3.783 -0.153 1
1 342 . 13 1 1 A 25 25 GLY C C 178 173.850 176.193 -2.343 1
1 343 . 13 1 1 A 25 25 GLY CA C 178 47.530 47.297 0.233 1
1 344 . 13 1 1 A 25 25 GLY N N 178 107.320 108.440 -1.120 1
1 345 . 13 1 1 A 26 26 LEU H H 179 8.830 8.127 0.703 1
1 346 . 13 1 1 A 26 26 LEU HA H 179 4.110 4.047 0.063 1
1 356 . 13 1 1 A 26 26 LEU C C 179 178.220 179.079 -0.859 1
1 357 . 13 1 1 A 26 26 LEU CA C 179 57.600 58.209 -0.609 1
1 358 . 13 1 1 A 26 26 LEU CB C 179 41.040 41.743 -0.703 1
1 362 . 13 1 1 A 26 26 LEU N N 179 122.350 122.646 -0.296 1
1 363 . 13 1 1 A 27 27 GLY H H 180 8.520 8.169 0.351 1
1 364 . 13 1 1 A 27 27 GLY HA2 H 180 3.760 3.777 -0.017 1
1 365 . 13 1 1 A 27 27 GLY HA3 H 180 4.520 3.785 0.735 1
1 366 . 13 1 1 A 27 27 GLY C C 180 174.160 176.116 -1.956 1
1 367 . 13 1 1 A 27 27 GLY CA C 180 47.920 47.495 0.425 1
1 368 . 13 1 1 A 27 27 GLY N N 180 106.260 105.568 0.692 1
1 369 . 13 1 1 A 28 28 ILE H H 181 8.780 8.015 0.765 1
1 370 . 13 1 1 A 28 28 ILE HA H 181 3.590 3.848 -0.258 1
1 380 . 13 1 1 A 28 28 ILE C C 181 177.130 177.488 -0.358 1
1 381 . 13 1 1 A 28 28 ILE CA C 181 65.340 64.536 0.804 1
1 382 . 13 1 1 A 28 28 ILE CB C 181 36.900 37.411 -0.511 1
1 386 . 13 1 1 A 28 28 ILE N N 181 123.970 122.427 1.543 1
1 387 . 13 1 1 A 29 29 TYR H H 182 8.110 8.103 0.007 1
1 388 . 13 1 1 A 29 29 TYR HA H 182 3.880 4.076 -0.196 1
1 395 . 13 1 1 A 29 29 TYR C C 182 176.970 176.813 0.157 1
1 396 . 13 1 1 A 29 29 TYR CA C 182 61.900 61.587 0.313 1
1 397 . 13 1 1 A 29 29 TYR CB C 182 37.910 38.482 -0.572 1
1 403 . 13 1 1 A 29 29 TYR N N 182 119.570 120.372 -0.802 1
1 404 . 13 1 1 A 30 30 ILE H H 183 8.490 8.270 0.220 1
1 405 . 13 1 1 A 30 30 ILE HA H 183 3.400 3.802 -0.402 1
1 415 . 13 1 1 A 30 30 ILE C C 183 177.760 177.633 0.127 1
1 416 . 13 1 1 A 30 30 ILE CA C 183 65.020 65.050 -0.030 1
1 417 . 13 1 1 A 30 30 ILE CB C 183 37.600 38.003 -0.403 1
1 421 . 13 1 1 A 30 30 ILE N N 183 118.000 119.486 -1.486 1
1 422 . 13 1 1 A 31 31 GLY H H 184 9.360 8.181 1.179 1
1 423 . 13 1 1 A 31 31 GLY HA2 H 184 3.650 3.771 -0.121 1
1 424 . 13 1 1 A 31 31 GLY HA3 H 184 3.940 3.775 0.165 1
1 425 . 13 1 1 A 31 31 GLY C C 184 174.320 175.947 -1.627 1
1 426 . 13 1 1 A 31 31 GLY CA C 184 47.380 47.116 0.264 1
1 427 . 13 1 1 A 31 31 GLY N N 184 106.260 107.295 -1.035 1
1 428 . 13 1 1 A 32 32 ARG H H 185 8.090 9.140 -1.050 1
1 429 . 13 1 1 A 32 32 ARG HA H 185 4.030 4.092 -0.062 1
1 441 . 13 1 1 A 32 32 ARG C C 185 177.290 176.693 0.597 1
1 442 . 13 1 1 A 32 32 ARG CA C 185 57.050 58.211 -1.161 1
1 443 . 13 1 1 A 32 32 ARG CB C 185 29.630 29.626 0.004 1
1 447 . 13 1 1 A 32 32 ARG N N 185 118.050 120.687 -2.637 1
1 451 . 13 1 1 A 33 33 ARG H H 186 7.760 7.611 0.149 1
1 452 . 13 1 1 A 33 33 ARG HA H 186 4.260 4.336 -0.076 1
1 464 . 13 1 1 A 33 33 ARG C C 186 176.190 176.756 -0.566 1
1 465 . 13 1 1 A 33 33 ARG CA C 186 55.670 55.674 -0.004 1
1 466 . 13 1 1 A 33 33 ARG CB C 186 29.710 29.447 0.263 1
1 470 . 13 1 1 A 33 33 ARG N N 186 117.390 117.426 -0.036 1
1 474 . 13 1 1 A 34 34 LEU H H 187 7.530 7.626 -0.096 1
1 475 . 13 1 1 A 34 34 LEU HA H 187 4.390 4.152 0.238 1
1 485 . 13 1 1 A 34 34 LEU C C 187 175.410 178.805 -3.395 1
1 486 . 13 1 1 A 34 34 LEU CA C 187 54.440 56.404 -1.964 1
1 487 . 13 1 1 A 34 34 LEU CB C 187 41.590 42.171 -0.581 1
1 491 . 13 1 1 A 34 34 LEU N N 187 119.360 121.895 -2.535 1
1 5 . 14 1 1 A 2 2 GLY H H 155 8.570 7.388 1.182 1
1 6 . 14 1 1 A 2 2 GLY HA2 H 155 3.950 4.017 -0.067 1
1 7 . 14 1 1 A 2 2 GLY HA3 H 155 4.070 4.035 0.035 1
1 8 . 14 1 1 A 2 2 GLY C C 155 173.690 174.551 -0.861 1
1 9 . 14 1 1 A 2 2 GLY CA C 155 44.560 45.133 -0.573 1
1 10 . 14 1 1 A 2 2 GLY N N 155 108.940 105.822 3.118 1
1 11 . 14 1 1 A 3 3 ILE H H 156 8.340 8.933 -0.593 1
1 12 . 14 1 1 A 3 3 ILE HA H 156 3.640 3.634 0.006 1
1 22 . 14 1 1 A 3 3 ILE C C 156 174.470 177.460 -2.990 1
1 23 . 14 1 1 A 3 3 ILE CA C 156 62.060 64.355 -2.295 1
1 24 . 14 1 1 A 3 3 ILE CB C 156 37.680 37.640 0.040 1
1 28 . 14 1 1 A 3 3 ILE N N 156 119.870 120.354 -0.484 1
1 29 . 14 1 1 A 4 4 PHE H H 157 7.850 7.931 -0.081 1
1 30 . 14 1 1 A 4 4 PHE HA H 157 4.570 4.325 0.245 1
1 38 . 14 1 1 A 4 4 PHE C C 157 174.320 176.430 -2.110 1
1 39 . 14 1 1 A 4 4 PHE CA C 157 56.310 60.697 -4.387 1
1 40 . 14 1 1 A 4 4 PHE CB C 157 37.840 39.041 -1.201 1
1 47 . 14 1 1 A 4 4 PHE N N 157 117.790 119.844 -2.054 1
1 48 . 14 1 1 A 5 5 SER H H 158 7.970 8.057 -0.087 1
1 49 . 14 1 1 A 5 5 SER HA H 158 4.560 4.235 0.325 1
1 52 . 14 1 1 A 5 5 SER C C 158 174.160 175.904 -1.744 1
1 53 . 14 1 1 A 5 5 SER CA C 158 57.010 60.854 -3.844 1
1 54 . 14 1 1 A 5 5 SER CB C 158 64.870 61.982 2.888 1
1 55 . 14 1 1 A 5 5 SER N N 158 115.670 113.392 2.278 1
1 56 . 14 1 1 A 6 6 ALA H H 159 9.000 8.483 0.517 1
1 57 . 14 1 1 A 6 6 ALA HA H 159 4.080 4.138 -0.058 1
1 61 . 14 1 1 A 6 6 ALA C C 159 178.290 179.412 -1.122 1
1 62 . 14 1 1 A 6 6 ALA CA C 159 54.850 55.476 -0.626 1
1 63 . 14 1 1 A 6 6 ALA CB C 159 18.070 18.321 -0.251 1
1 64 . 14 1 1 A 6 6 ALA N N 159 125.390 124.650 0.740 1
1 65 . 14 1 1 A 7 7 GLU H H 160 8.590 8.075 0.515 1
1 66 . 14 1 1 A 7 7 GLU HA H 160 3.990 4.140 -0.150 1
1 71 . 14 1 1 A 7 7 GLU C C 160 177.440 178.713 -1.273 1
1 72 . 14 1 1 A 7 7 GLU CA C 160 59.010 59.131 -0.121 1
1 73 . 14 1 1 A 7 7 GLU CB C 160 28.220 29.608 -1.388 1
1 75 . 14 1 1 A 7 7 GLU N N 160 116.180 118.700 -2.520 1
1 76 . 14 1 1 A 8 8 PHE H H 161 7.860 8.085 -0.225 1
1 77 . 14 1 1 A 8 8 PHE HA H 161 4.330 4.161 0.169 1
1 85 . 14 1 1 A 8 8 PHE C C 161 177.130 177.507 -0.377 1
1 86 . 14 1 1 A 8 8 PHE CA C 161 60.330 61.359 -1.029 1
1 87 . 14 1 1 A 8 8 PHE CB C 161 39.160 39.478 -0.318 1
1 94 . 14 1 1 A 8 8 PHE N N 161 118.050 121.169 -3.119 1
1 95 . 14 1 1 A 9 9 LEU H H 162 8.240 9.408 -1.168 1
1 96 . 14 1 1 A 9 9 LEU HA H 162 3.990 3.796 0.194 1
1 106 . 14 1 1 A 9 9 LEU C C 162 177.130 179.314 -2.184 1
1 107 . 14 1 1 A 9 9 LEU CA C 162 57.990 57.909 0.081 1
1 108 . 14 1 1 A 9 9 LEU CB C 162 41.510 41.519 -0.009 1
1 112 . 14 1 1 A 9 9 LEU N N 162 119.110 119.832 -0.722 1
1 113 . 14 1 1 A 10 10 LYS H H 163 7.950 8.362 -0.412 1
1 114 . 14 1 1 A 10 10 LYS HA H 163 3.920 4.120 -0.200 1
1 123 . 14 1 1 A 10 10 LYS C C 163 174.010 177.736 -3.726 1
1 124 . 14 1 1 A 10 10 LYS CA C 163 58.850 58.487 0.363 1
1 125 . 14 1 1 A 10 10 LYS CB C 163 32.290 32.606 -0.316 1
1 129 . 14 1 1 A 10 10 LYS N N 163 115.320 117.267 -1.947 1
1 130 . 14 1 1 A 11 11 VAL H H 164 6.940 7.185 -0.245 1
1 131 . 14 1 1 A 11 11 VAL HA H 164 4.180 4.553 -0.373 1
1 139 . 14 1 1 A 11 11 VAL C C 164 177.290 176.013 1.277 1
1 140 . 14 1 1 A 11 11 VAL CA C 164 62.680 60.706 1.974 1
1 141 . 14 1 1 A 11 11 VAL CB C 164 32.680 31.476 1.204 1
1 144 . 14 1 1 A 11 11 VAL N N 164 110.250 109.439 0.811 1
1 145 . 14 1 1 A 12 12 PHE H H 165 8.610 8.010 0.600 1
1 146 . 14 1 1 A 12 12 PHE HA H 165 4.180 4.623 -0.443 1
1 154 . 14 1 1 A 12 12 PHE C C 165 175.720 176.781 -1.061 1
1 155 . 14 1 1 A 12 12 PHE CA C 165 60.410 59.166 1.244 1
1 156 . 14 1 1 A 12 12 PHE CB C 165 40.330 40.658 -0.328 1
1 163 . 14 1 1 A 12 12 PHE N N 165 121.290 120.879 0.411 1
1 164 . 14 1 1 A 13 13 LEU H H 166 8.420 8.127 0.293 1
1 165 . 14 1 1 A 13 13 LEU HA H 166 4.160 3.878 0.282 1
1 175 . 14 1 1 A 13 13 LEU CA C 166 59.090 60.159 -1.069 1
1 176 . 14 1 1 A 13 13 LEU CB C 166 38.380 40.272 -1.892 1
1 180 . 14 1 1 A 13 13 LEU N N 166 115.420 119.939 -4.519 1
1 181 . 14 1 1 A 14 14 PRO HA H 167 4.130 4.268 -0.138 1
1 188 . 14 1 1 A 14 14 PRO C C 167 177.150 178.703 -1.553 1
1 189 . 14 1 1 A 14 14 PRO CA C 167 65.800 66.119 -0.319 1
1 190 . 14 1 1 A 14 14 PRO CB C 167 30.340 30.554 -0.214 1
1 193 . 14 1 1 A 15 15 SER H H 168 7.150 8.114 -0.964 1
1 194 . 14 1 1 A 15 15 SER HA H 168 4.040 4.084 -0.044 1
1 197 . 14 1 1 A 15 15 SER C C 168 174.160 177.368 -3.208 1
1 198 . 14 1 1 A 15 15 SER CA C 168 63.330 61.011 2.319 1
1 199 . 14 1 1 A 15 15 SER CB C 168 62.060 62.690 -0.630 1
1 200 . 14 1 1 A 15 15 SER N N 168 112.330 111.994 0.336 1
1 201 . 14 1 1 A 16 16 LEU H H 169 7.770 7.779 -0.009 1
1 202 . 14 1 1 A 16 16 LEU HA H 169 4.800 3.581 1.219 1
1 212 . 14 1 1 A 16 16 LEU C C 169 180.100 178.803 1.297 1
1 213 . 14 1 1 A 16 16 LEU CA C 169 55.340 57.952 -2.612 1
1 214 . 14 1 1 A 16 16 LEU CB C 169 41.980 41.671 0.309 1
1 218 . 14 1 1 A 16 16 LEU N N 169 120.480 122.015 -1.535 1
1 219 . 14 1 1 A 17 17 LEU H H 170 8.050 7.592 0.458 1
1 220 . 14 1 1 A 17 17 LEU HA H 170 4.070 4.139 -0.069 1
1 230 . 14 1 1 A 17 17 LEU C C 170 176.970 179.177 -2.207 1
1 231 . 14 1 1 A 17 17 LEU CA C 170 57.910 58.013 -0.103 1
1 232 . 14 1 1 A 17 17 LEU CB C 170 40.800 41.550 -0.750 1
1 236 . 14 1 1 A 17 17 LEU N N 170 122.150 117.584 4.566 1
1 237 . 14 1 1 A 18 18 LEU H H 171 7.940 8.325 -0.385 1
1 238 . 14 1 1 A 18 18 LEU HA H 171 3.990 3.808 0.182 1
1 248 . 14 1 1 A 18 18 LEU C C 171 177.910 179.249 -1.339 1
1 249 . 14 1 1 A 18 18 LEU CA C 171 57.760 58.040 -0.280 1
1 250 . 14 1 1 A 18 18 LEU CB C 171 41.120 41.280 -0.160 1
1 254 . 14 1 1 A 18 18 LEU N N 171 117.490 118.943 -1.453 1
1 255 . 14 1 1 A 19 19 SER H H 172 8.970 7.914 1.056 1
1 256 . 14 1 1 A 19 19 SER HA H 172 3.840 4.060 -0.220 1
1 259 . 14 1 1 A 19 19 SER C C 172 176.820 176.768 0.052 1
1 260 . 14 1 1 A 19 19 SER CA C 172 63.190 62.205 0.985 1
1 261 . 14 1 1 A 19 19 SER CB C 172 59.730 62.894 -3.164 1
1 262 . 14 1 1 A 19 19 SER N N 172 115.970 114.160 1.810 1
1 263 . 14 1 1 A 20 20 HIS H H 173 7.600 7.660 -0.060 1
1 264 . 14 1 1 A 20 20 HIS HA H 173 4.080 4.267 -0.187 1
1 269 . 14 1 1 A 20 20 HIS C C 173 176.970 177.704 -0.734 1
1 270 . 14 1 1 A 20 20 HIS CA C 173 62.220 58.994 3.226 1
1 271 . 14 1 1 A 20 20 HIS CB C 173 27.440 30.022 -2.582 1
1 275 . 14 1 1 A 20 20 HIS N N 173 119.720 119.687 0.033 1
1 276 . 14 1 1 A 21 21 LEU H H 174 8.200 8.881 -0.681 1
1 277 . 14 1 1 A 21 21 LEU HA H 174 4.070 3.821 0.249 1
1 287 . 14 1 1 A 21 21 LEU C C 174 178.220 178.920 -0.700 1
1 288 . 14 1 1 A 21 21 LEU CA C 174 57.910 58.186 -0.276 1
1 289 . 14 1 1 A 21 21 LEU CB C 174 40.960 41.999 -1.039 1
1 293 . 14 1 1 A 21 21 LEU N N 174 120.780 119.882 0.898 1
1 294 . 14 1 1 A 22 22 LEU H H 175 8.510 8.190 0.320 1
1 295 . 14 1 1 A 22 22 LEU HA H 175 3.930 3.906 0.024 1
1 305 . 14 1 1 A 22 22 LEU C C 175 177.440 178.876 -1.436 1
1 306 . 14 1 1 A 22 22 LEU CA C 175 57.760 57.928 -0.168 1
1 307 . 14 1 1 A 22 22 LEU CB C 175 40.800 41.434 -0.634 1
1 311 . 14 1 1 A 22 22 LEU N N 175 118.600 117.684 0.916 1
1 312 . 14 1 1 A 23 23 ALA H H 176 7.830 8.489 -0.659 1
1 313 . 14 1 1 A 23 23 ALA HA H 176 3.970 4.099 -0.129 1
1 317 . 14 1 1 A 23 23 ALA C C 176 178.220 179.726 -1.506 1
1 318 . 14 1 1 A 23 23 ALA CA C 176 55.260 55.360 -0.100 1
1 319 . 14 1 1 A 23 23 ALA CB C 176 18.070 18.465 -0.395 1
1 320 . 14 1 1 A 23 23 ALA N N 176 121.030 121.736 -0.706 1
1 321 . 14 1 1 A 24 24 ILE H H 177 8.210 8.194 0.016 1
1 322 . 14 1 1 A 24 24 ILE HA H 177 3.900 3.748 0.152 1
1 332 . 14 1 1 A 24 24 ILE C C 177 178.380 177.898 0.482 1
1 333 . 14 1 1 A 24 24 ILE CA C 177 64.870 65.081 -0.211 1
1 334 . 14 1 1 A 24 24 ILE CB C 177 37.370 37.680 -0.310 1
1 338 . 14 1 1 A 24 24 ILE N N 177 118.330 118.331 -0.001 1
1 339 . 14 1 1 A 25 25 GLY H H 178 8.590 8.135 0.455 1
1 340 . 14 1 1 A 25 25 GLY HA2 H 178 3.600 3.790 -0.190 1
1 341 . 14 1 1 A 25 25 GLY HA3 H 178 3.630 3.806 -0.176 1
1 342 . 14 1 1 A 25 25 GLY C C 178 173.850 176.251 -2.401 1
1 343 . 14 1 1 A 25 25 GLY CA C 178 47.530 47.360 0.170 1
1 344 . 14 1 1 A 25 25 GLY N N 178 107.320 108.390 -1.070 1
1 345 . 14 1 1 A 26 26 LEU H H 179 8.830 8.293 0.537 1
1 346 . 14 1 1 A 26 26 LEU HA H 179 4.110 4.001 0.109 1
1 356 . 14 1 1 A 26 26 LEU C C 179 178.220 179.009 -0.789 1
1 357 . 14 1 1 A 26 26 LEU CA C 179 57.600 58.390 -0.790 1
1 358 . 14 1 1 A 26 26 LEU CB C 179 41.040 41.979 -0.939 1
1 362 . 14 1 1 A 26 26 LEU N N 179 122.350 122.743 -0.393 1
1 363 . 14 1 1 A 27 27 GLY H H 180 8.520 8.132 0.388 1
1 364 . 14 1 1 A 27 27 GLY HA2 H 180 3.760 3.758 0.002 1
1 365 . 14 1 1 A 27 27 GLY HA3 H 180 4.520 3.765 0.755 1
1 366 . 14 1 1 A 27 27 GLY C C 180 174.160 175.958 -1.798 1
1 367 . 14 1 1 A 27 27 GLY CA C 180 47.920 47.492 0.428 1
1 368 . 14 1 1 A 27 27 GLY N N 180 106.260 105.229 1.031 1
1 369 . 14 1 1 A 28 28 ILE H H 181 8.780 8.205 0.575 1
1 370 . 14 1 1 A 28 28 ILE HA H 181 3.590 3.860 -0.270 1
1 380 . 14 1 1 A 28 28 ILE C C 181 177.130 177.539 -0.409 1
1 381 . 14 1 1 A 28 28 ILE CA C 181 65.340 64.453 0.887 1
1 382 . 14 1 1 A 28 28 ILE CB C 181 36.900 37.404 -0.504 1
1 386 . 14 1 1 A 28 28 ILE N N 181 123.970 122.423 1.547 1
1 387 . 14 1 1 A 29 29 TYR H H 182 8.110 8.622 -0.512 1
1 388 . 14 1 1 A 29 29 TYR HA H 182 3.880 4.097 -0.217 1
1 395 . 14 1 1 A 29 29 TYR C C 182 176.970 176.820 0.150 1
1 396 . 14 1 1 A 29 29 TYR CA C 182 61.900 61.551 0.349 1
1 397 . 14 1 1 A 29 29 TYR CB C 182 37.910 38.508 -0.598 1
1 403 . 14 1 1 A 29 29 TYR N N 182 119.570 120.896 -1.326 1
1 404 . 14 1 1 A 30 30 ILE H H 183 8.490 8.342 0.148 1
1 405 . 14 1 1 A 30 30 ILE HA H 183 3.400 3.835 -0.435 1
1 415 . 14 1 1 A 30 30 ILE C C 183 177.760 177.643 0.117 1
1 416 . 14 1 1 A 30 30 ILE CA C 183 65.020 65.067 -0.047 1
1 417 . 14 1 1 A 30 30 ILE CB C 183 37.600 38.005 -0.405 1
1 421 . 14 1 1 A 30 30 ILE N N 183 118.000 119.415 -1.415 1
1 422 . 14 1 1 A 31 31 GLY H H 184 9.360 7.976 1.384 1
1 423 . 14 1 1 A 31 31 GLY HA2 H 184 3.650 3.770 -0.120 1
1 424 . 14 1 1 A 31 31 GLY HA3 H 184 3.940 3.771 0.169 1
1 425 . 14 1 1 A 31 31 GLY C C 184 174.320 176.080 -1.760 1
1 426 . 14 1 1 A 31 31 GLY CA C 184 47.380 47.123 0.257 1
1 427 . 14 1 1 A 31 31 GLY N N 184 106.260 107.162 -0.902 1
1 428 . 14 1 1 A 32 32 ARG H H 185 8.090 8.896 -0.806 1
1 429 . 14 1 1 A 32 32 ARG HA H 185 4.030 4.022 0.008 1
1 441 . 14 1 1 A 32 32 ARG C C 185 177.290 176.565 0.725 1
1 442 . 14 1 1 A 32 32 ARG CA C 185 57.050 58.500 -1.450 1
1 443 . 14 1 1 A 32 32 ARG CB C 185 29.630 30.120 -0.490 1
1 447 . 14 1 1 A 32 32 ARG N N 185 118.050 120.756 -2.706 1
1 451 . 14 1 1 A 33 33 ARG H H 186 7.760 7.688 0.072 1
1 452 . 14 1 1 A 33 33 ARG HA H 186 4.260 4.228 0.032 1
1 464 . 14 1 1 A 33 33 ARG C C 186 176.190 176.667 -0.477 1
1 465 . 14 1 1 A 33 33 ARG CA C 186 55.670 55.646 0.024 1
1 466 . 14 1 1 A 33 33 ARG CB C 186 29.710 29.932 -0.222 1
1 470 . 14 1 1 A 33 33 ARG N N 186 117.390 117.821 -0.431 1
1 474 . 14 1 1 A 34 34 LEU H H 187 7.530 7.501 0.029 1
1 475 . 14 1 1 A 34 34 LEU HA H 187 4.390 4.092 0.298 1
1 485 . 14 1 1 A 34 34 LEU C C 187 175.410 177.131 -1.721 1
1 486 . 14 1 1 A 34 34 LEU CA C 187 54.440 57.680 -3.240 1
1 487 . 14 1 1 A 34 34 LEU CB C 187 41.590 42.239 -0.649 1
1 491 . 14 1 1 A 34 34 LEU N N 187 119.360 121.856 -2.496 1
1 5 . 15 1 1 A 2 2 GLY H H 155 8.570 7.892 0.678 1
1 6 . 15 1 1 A 2 2 GLY HA2 H 155 3.950 4.173 -0.223 1
1 7 . 15 1 1 A 2 2 GLY HA3 H 155 4.070 4.186 -0.116 1
1 8 . 15 1 1 A 2 2 GLY C C 155 173.690 174.940 -1.250 1
1 9 . 15 1 1 A 2 2 GLY CA C 155 44.560 44.168 0.392 1
1 10 . 15 1 1 A 2 2 GLY N N 155 108.940 107.635 1.305 1
1 11 . 15 1 1 A 3 3 ILE H H 156 8.340 8.333 0.007 1
1 12 . 15 1 1 A 3 3 ILE HA H 156 3.640 3.626 0.014 1
1 22 . 15 1 1 A 3 3 ILE C C 156 174.470 176.403 -1.933 1
1 23 . 15 1 1 A 3 3 ILE CA C 156 62.060 63.588 -1.528 1
1 24 . 15 1 1 A 3 3 ILE CB C 156 37.680 38.391 -0.711 1
1 28 . 15 1 1 A 3 3 ILE N N 156 119.870 119.785 0.085 1
1 29 . 15 1 1 A 4 4 PHE H H 157 7.850 7.832 0.018 1
1 30 . 15 1 1 A 4 4 PHE HA H 157 4.570 4.605 -0.035 1
1 38 . 15 1 1 A 4 4 PHE C C 157 174.320 176.384 -2.064 1
1 39 . 15 1 1 A 4 4 PHE CA C 157 56.310 58.770 -2.460 1
1 40 . 15 1 1 A 4 4 PHE CB C 157 37.840 41.108 -3.268 1
1 47 . 15 1 1 A 4 4 PHE N N 157 117.790 117.510 0.280 1
1 48 . 15 1 1 A 5 5 SER H H 158 7.970 8.307 -0.337 1
1 49 . 15 1 1 A 5 5 SER HA H 158 4.560 4.405 0.155 1
1 52 . 15 1 1 A 5 5 SER C C 158 174.160 175.359 -1.199 1
1 53 . 15 1 1 A 5 5 SER CA C 158 57.010 60.809 -3.799 1
1 54 . 15 1 1 A 5 5 SER CB C 158 64.870 62.849 2.021 1
1 55 . 15 1 1 A 5 5 SER N N 158 115.670 115.008 0.662 1
1 56 . 15 1 1 A 6 6 ALA H H 159 9.000 8.340 0.660 1
1 57 . 15 1 1 A 6 6 ALA HA H 159 4.080 4.124 -0.044 1
1 61 . 15 1 1 A 6 6 ALA C C 159 178.290 179.728 -1.438 1
1 62 . 15 1 1 A 6 6 ALA CA C 159 54.850 55.417 -0.567 1
1 63 . 15 1 1 A 6 6 ALA CB C 159 18.070 18.510 -0.440 1
1 64 . 15 1 1 A 6 6 ALA N N 159 125.390 122.634 2.756 1
1 65 . 15 1 1 A 7 7 GLU H H 160 8.590 7.903 0.687 1
1 66 . 15 1 1 A 7 7 GLU HA H 160 3.990 4.137 -0.147 1
1 71 . 15 1 1 A 7 7 GLU C C 160 177.440 178.886 -1.446 1
1 72 . 15 1 1 A 7 7 GLU CA C 160 59.010 59.194 -0.184 1
1 73 . 15 1 1 A 7 7 GLU CB C 160 28.220 29.567 -1.347 1
1 75 . 15 1 1 A 7 7 GLU N N 160 116.180 119.033 -2.853 1
1 76 . 15 1 1 A 8 8 PHE H H 161 7.860 8.464 -0.604 1
1 77 . 15 1 1 A 8 8 PHE HA H 161 4.330 4.109 0.221 1
1 85 . 15 1 1 A 8 8 PHE C C 161 177.130 177.091 0.039 1
1 86 . 15 1 1 A 8 8 PHE CA C 161 60.330 61.243 -0.913 1
1 87 . 15 1 1 A 8 8 PHE CB C 161 39.160 39.307 -0.147 1
1 94 . 15 1 1 A 8 8 PHE N N 161 118.050 120.981 -2.931 1
1 95 . 15 1 1 A 9 9 LEU H H 162 8.240 9.131 -0.891 1
1 96 . 15 1 1 A 9 9 LEU HA H 162 3.990 3.884 0.106 1
1 106 . 15 1 1 A 9 9 LEU C C 162 177.130 179.246 -2.116 1
1 107 . 15 1 1 A 9 9 LEU CA C 162 57.990 57.799 0.191 1
1 108 . 15 1 1 A 9 9 LEU CB C 162 41.510 41.424 0.086 1
1 112 . 15 1 1 A 9 9 LEU N N 162 119.110 119.391 -0.281 1
1 113 . 15 1 1 A 10 10 LYS H H 163 7.950 7.933 0.017 1
1 114 . 15 1 1 A 10 10 LYS HA H 163 3.920 4.087 -0.167 1
1 123 . 15 1 1 A 10 10 LYS C C 163 174.010 177.740 -3.730 1
1 124 . 15 1 1 A 10 10 LYS CA C 163 58.850 58.656 0.194 1
1 125 . 15 1 1 A 10 10 LYS CB C 163 32.290 32.810 -0.520 1
1 129 . 15 1 1 A 10 10 LYS N N 163 115.320 117.456 -2.136 1
1 130 . 15 1 1 A 11 11 VAL H H 164 6.940 7.032 -0.092 1
1 131 . 15 1 1 A 11 11 VAL HA H 164 4.180 4.534 -0.354 1
1 139 . 15 1 1 A 11 11 VAL C C 164 177.290 176.001 1.289 1
1 140 . 15 1 1 A 11 11 VAL CA C 164 62.680 60.672 2.008 1
1 141 . 15 1 1 A 11 11 VAL CB C 164 32.680 31.408 1.272 1
1 144 . 15 1 1 A 11 11 VAL N N 164 110.250 109.101 1.149 1
1 145 . 15 1 1 A 12 12 PHE H H 165 8.610 7.878 0.732 1
1 146 . 15 1 1 A 12 12 PHE HA H 165 4.180 4.607 -0.427 1
1 154 . 15 1 1 A 12 12 PHE C C 165 175.720 176.763 -1.043 1
1 155 . 15 1 1 A 12 12 PHE CA C 165 60.410 59.136 1.274 1
1 156 . 15 1 1 A 12 12 PHE CB C 165 40.330 40.452 -0.122 1
1 163 . 15 1 1 A 12 12 PHE N N 165 121.290 120.438 0.852 1
1 164 . 15 1 1 A 13 13 LEU H H 166 8.420 7.783 0.637 1
1 165 . 15 1 1 A 13 13 LEU HA H 166 4.160 3.798 0.362 1
1 175 . 15 1 1 A 13 13 LEU CA C 166 59.090 60.086 -0.996 1
1 176 . 15 1 1 A 13 13 LEU CB C 166 38.380 40.191 -1.811 1
1 180 . 15 1 1 A 13 13 LEU N N 166 115.420 119.934 -4.514 1
1 181 . 15 1 1 A 14 14 PRO HA H 167 4.130 4.300 -0.170 1
1 188 . 15 1 1 A 14 14 PRO C C 167 177.150 178.950 -1.800 1
1 189 . 15 1 1 A 14 14 PRO CA C 167 65.800 65.689 0.111 1
1 190 . 15 1 1 A 14 14 PRO CB C 167 30.340 30.601 -0.261 1
1 193 . 15 1 1 A 15 15 SER H H 168 7.150 8.194 -1.044 1
1 194 . 15 1 1 A 15 15 SER HA H 168 4.040 4.100 -0.060 1
1 197 . 15 1 1 A 15 15 SER C C 168 174.160 176.131 -1.971 1
1 198 . 15 1 1 A 15 15 SER CA C 168 63.330 61.532 1.798 1
1 199 . 15 1 1 A 15 15 SER CB C 168 62.060 62.754 -0.694 1
1 200 . 15 1 1 A 15 15 SER N N 168 112.330 114.384 -2.054 1
1 201 . 15 1 1 A 16 16 LEU H H 169 7.770 7.839 -0.069 1
1 202 . 15 1 1 A 16 16 LEU HA H 169 4.800 3.592 1.208 1
1 212 . 15 1 1 A 16 16 LEU C C 169 180.100 178.963 1.137 1
1 213 . 15 1 1 A 16 16 LEU CA C 169 55.340 57.905 -2.565 1
1 214 . 15 1 1 A 16 16 LEU CB C 169 41.980 41.432 0.548 1
1 218 . 15 1 1 A 16 16 LEU N N 169 120.480 120.316 0.164 1
1 219 . 15 1 1 A 17 17 LEU H H 170 8.050 7.598 0.452 1
1 220 . 15 1 1 A 17 17 LEU HA H 170 4.070 4.082 -0.012 1
1 230 . 15 1 1 A 17 17 LEU C C 170 176.970 179.160 -2.190 1
1 231 . 15 1 1 A 17 17 LEU CA C 170 57.910 57.991 -0.081 1
1 232 . 15 1 1 A 17 17 LEU CB C 170 40.800 41.583 -0.783 1
1 236 . 15 1 1 A 17 17 LEU N N 170 122.150 118.385 3.765 1
1 237 . 15 1 1 A 18 18 LEU H H 171 7.940 8.158 -0.218 1
1 238 . 15 1 1 A 18 18 LEU HA H 171 3.990 3.839 0.151 1
1 248 . 15 1 1 A 18 18 LEU C C 171 177.910 179.091 -1.181 1
1 249 . 15 1 1 A 18 18 LEU CA C 171 57.760 57.884 -0.124 1
1 250 . 15 1 1 A 18 18 LEU CB C 171 41.120 41.187 -0.067 1
1 254 . 15 1 1 A 18 18 LEU N N 171 117.490 118.095 -0.605 1
1 255 . 15 1 1 A 19 19 SER H H 172 8.970 8.301 0.669 1
1 256 . 15 1 1 A 19 19 SER HA H 172 3.840 3.983 -0.143 1
1 259 . 15 1 1 A 19 19 SER C C 172 176.820 176.578 0.242 1
1 260 . 15 1 1 A 19 19 SER CA C 172 63.190 62.371 0.819 1
1 261 . 15 1 1 A 19 19 SER CB C 172 59.730 62.685 -2.955 1
1 262 . 15 1 1 A 19 19 SER N N 172 115.970 114.104 1.866 1
1 263 . 15 1 1 A 20 20 HIS H H 173 7.600 7.687 -0.087 1
1 264 . 15 1 1 A 20 20 HIS HA H 173 4.080 4.282 -0.202 1
1 269 . 15 1 1 A 20 20 HIS C C 173 176.970 177.703 -0.733 1
1 270 . 15 1 1 A 20 20 HIS CA C 173 62.220 59.001 3.219 1
1 271 . 15 1 1 A 20 20 HIS CB C 173 27.440 30.133 -2.693 1
1 275 . 15 1 1 A 20 20 HIS N N 173 119.720 119.299 0.421 1
1 276 . 15 1 1 A 21 21 LEU H H 174 8.200 8.353 -0.153 1
1 277 . 15 1 1 A 21 21 LEU HA H 174 4.070 3.787 0.283 1
1 287 . 15 1 1 A 21 21 LEU C C 174 178.220 179.168 -0.948 1
1 288 . 15 1 1 A 21 21 LEU CA C 174 57.910 58.118 -0.208 1
1 289 . 15 1 1 A 21 21 LEU CB C 174 40.960 41.481 -0.521 1
1 293 . 15 1 1 A 21 21 LEU N N 174 120.780 119.866 0.914 1
1 294 . 15 1 1 A 22 22 LEU H H 175 8.510 8.767 -0.257 1
1 295 . 15 1 1 A 22 22 LEU HA H 175 3.930 3.852 0.078 1
1 305 . 15 1 1 A 22 22 LEU C C 175 177.440 178.851 -1.411 1
1 306 . 15 1 1 A 22 22 LEU CA C 175 57.760 57.814 -0.054 1
1 307 . 15 1 1 A 22 22 LEU CB C 175 40.800 41.870 -1.070 1
1 311 . 15 1 1 A 22 22 LEU N N 175 118.600 118.557 0.043 1
1 312 . 15 1 1 A 23 23 ALA H H 176 7.830 8.722 -0.892 1
1 313 . 15 1 1 A 23 23 ALA HA H 176 3.970 4.095 -0.125 1
1 317 . 15 1 1 A 23 23 ALA C C 176 178.220 179.817 -1.597 1
1 318 . 15 1 1 A 23 23 ALA CA C 176 55.260 55.305 -0.045 1
1 319 . 15 1 1 A 23 23 ALA CB C 176 18.070 18.433 -0.363 1
1 320 . 15 1 1 A 23 23 ALA N N 176 121.030 121.295 -0.265 1
1 321 . 15 1 1 A 24 24 ILE H H 177 8.210 8.033 0.177 1
1 322 . 15 1 1 A 24 24 ILE HA H 177 3.900 3.750 0.150 1
1 332 . 15 1 1 A 24 24 ILE C C 177 178.380 177.916 0.464 1
1 333 . 15 1 1 A 24 24 ILE CA C 177 64.870 65.123 -0.253 1
1 334 . 15 1 1 A 24 24 ILE CB C 177 37.370 37.699 -0.329 1
1 338 . 15 1 1 A 24 24 ILE N N 177 118.330 118.298 0.032 1
1 339 . 15 1 1 A 25 25 GLY H H 178 8.590 8.251 0.339 1
1 340 . 15 1 1 A 25 25 GLY HA2 H 178 3.600 3.766 -0.166 1
1 341 . 15 1 1 A 25 25 GLY HA3 H 178 3.630 3.789 -0.159 1
1 342 . 15 1 1 A 25 25 GLY C C 178 173.850 176.156 -2.306 1
1 343 . 15 1 1 A 25 25 GLY CA C 178 47.530 47.317 0.213 1
1 344 . 15 1 1 A 25 25 GLY N N 178 107.320 108.390 -1.070 1
1 345 . 15 1 1 A 26 26 LEU H H 179 8.830 8.290 0.540 1
1 346 . 15 1 1 A 26 26 LEU HA H 179 4.110 4.049 0.061 1
1 356 . 15 1 1 A 26 26 LEU C C 179 178.220 179.068 -0.848 1
1 357 . 15 1 1 A 26 26 LEU CA C 179 57.600 58.172 -0.572 1
1 358 . 15 1 1 A 26 26 LEU CB C 179 41.040 41.903 -0.863 1
1 362 . 15 1 1 A 26 26 LEU N N 179 122.350 122.448 -0.098 1
1 363 . 15 1 1 A 27 27 GLY H H 180 8.520 8.146 0.374 1
1 364 . 15 1 1 A 27 27 GLY HA2 H 180 3.760 3.795 -0.035 1
1 365 . 15 1 1 A 27 27 GLY HA3 H 180 4.520 3.802 0.718 1
1 366 . 15 1 1 A 27 27 GLY C C 180 174.160 175.929 -1.769 1
1 367 . 15 1 1 A 27 27 GLY CA C 180 47.920 47.468 0.452 1
1 368 . 15 1 1 A 27 27 GLY N N 180 106.260 105.738 0.522 1
1 369 . 15 1 1 A 28 28 ILE H H 181 8.780 8.317 0.463 1
1 370 . 15 1 1 A 28 28 ILE HA H 181 3.590 3.847 -0.257 1
1 380 . 15 1 1 A 28 28 ILE C C 181 177.130 177.500 -0.370 1
1 381 . 15 1 1 A 28 28 ILE CA C 181 65.340 64.526 0.814 1
1 382 . 15 1 1 A 28 28 ILE CB C 181 36.900 37.410 -0.510 1
1 386 . 15 1 1 A 28 28 ILE N N 181 123.970 122.384 1.586 1
1 387 . 15 1 1 A 29 29 TYR H H 182 8.110 8.483 -0.373 1
1 388 . 15 1 1 A 29 29 TYR HA H 182 3.880 4.068 -0.188 1
1 395 . 15 1 1 A 29 29 TYR C C 182 176.970 176.726 0.244 1
1 396 . 15 1 1 A 29 29 TYR CA C 182 61.900 61.714 0.186 1
1 397 . 15 1 1 A 29 29 TYR CB C 182 37.910 38.300 -0.390 1
1 403 . 15 1 1 A 29 29 TYR N N 182 119.570 120.409 -0.839 1
1 404 . 15 1 1 A 30 30 ILE H H 183 8.490 8.306 0.184 1
1 405 . 15 1 1 A 30 30 ILE HA H 183 3.400 3.749 -0.349 1
1 415 . 15 1 1 A 30 30 ILE C C 183 177.760 177.674 0.086 1
1 416 . 15 1 1 A 30 30 ILE CA C 183 65.020 65.038 -0.018 1
1 417 . 15 1 1 A 30 30 ILE CB C 183 37.600 38.014 -0.414 1
1 421 . 15 1 1 A 30 30 ILE N N 183 118.000 119.477 -1.477 1
1 422 . 15 1 1 A 31 31 GLY H H 184 9.360 8.205 1.155 1
1 423 . 15 1 1 A 31 31 GLY HA2 H 184 3.650 3.783 -0.133 1
1 424 . 15 1 1 A 31 31 GLY HA3 H 184 3.940 3.789 0.151 1
1 425 . 15 1 1 A 31 31 GLY C C 184 174.320 175.930 -1.610 1
1 426 . 15 1 1 A 31 31 GLY CA C 184 47.380 47.055 0.325 1
1 427 . 15 1 1 A 31 31 GLY N N 184 106.260 107.442 -1.182 1
1 428 . 15 1 1 A 32 32 ARG H H 185 8.090 9.168 -1.078 1
1 429 . 15 1 1 A 32 32 ARG HA H 185 4.030 4.109 -0.079 1
1 441 . 15 1 1 A 32 32 ARG C C 185 177.290 176.978 0.312 1
1 442 . 15 1 1 A 32 32 ARG CA C 185 57.050 58.135 -1.085 1
1 443 . 15 1 1 A 32 32 ARG CB C 185 29.630 29.585 0.045 1
1 447 . 15 1 1 A 32 32 ARG N N 185 118.050 120.754 -2.704 1
1 451 . 15 1 1 A 33 33 ARG H H 186 7.760 7.689 0.071 1
1 452 . 15 1 1 A 33 33 ARG HA H 186 4.260 4.648 -0.388 1
1 464 . 15 1 1 A 33 33 ARG C C 186 176.190 176.537 -0.347 1
1 465 . 15 1 1 A 33 33 ARG CA C 186 55.670 54.824 0.846 1
1 466 . 15 1 1 A 33 33 ARG CB C 186 29.710 30.090 -0.380 1
1 470 . 15 1 1 A 33 33 ARG N N 186 117.390 118.743 -1.353 1
1 474 . 15 1 1 A 34 34 LEU H H 187 7.530 7.653 -0.123 1
1 475 . 15 1 1 A 34 34 LEU HA H 187 4.390 4.141 0.249 1
1 485 . 15 1 1 A 34 34 LEU C C 187 175.410 177.093 -1.683 1
1 486 . 15 1 1 A 34 34 LEU CA C 187 54.440 56.900 -2.460 1
1 487 . 15 1 1 A 34 34 LEU CB C 187 41.590 43.153 -1.563 1
1 491 . 15 1 1 A 34 34 LEU N N 187 119.360 120.175 -0.815 1
1 5 . 16 1 1 A 2 2 GLY H H 155 8.570 8.739 -0.169 1
1 6 . 16 1 1 A 2 2 GLY HA2 H 155 3.950 4.042 -0.092 1
1 7 . 16 1 1 A 2 2 GLY HA3 H 155 4.070 4.061 0.009 1
1 8 . 16 1 1 A 2 2 GLY C C 155 173.690 174.705 -1.015 1
1 9 . 16 1 1 A 2 2 GLY CA C 155 44.560 44.617 -0.057 1
1 10 . 16 1 1 A 2 2 GLY N N 155 108.940 112.822 -3.882 1
1 11 . 16 1 1 A 3 3 ILE H H 156 8.340 8.552 -0.212 1
1 12 . 16 1 1 A 3 3 ILE HA H 156 3.640 3.561 0.079 1
1 22 . 16 1 1 A 3 3 ILE C C 156 174.470 177.542 -3.072 1
1 23 . 16 1 1 A 3 3 ILE CA C 156 62.060 64.437 -2.377 1
1 24 . 16 1 1 A 3 3 ILE CB C 156 37.680 37.524 0.156 1
1 28 . 16 1 1 A 3 3 ILE N N 156 119.870 119.636 0.234 1
1 29 . 16 1 1 A 4 4 PHE H H 157 7.850 7.691 0.159 1
1 30 . 16 1 1 A 4 4 PHE HA H 157 4.570 4.340 0.230 1
1 38 . 16 1 1 A 4 4 PHE C C 157 174.320 176.557 -2.237 1
1 39 . 16 1 1 A 4 4 PHE CA C 157 56.310 60.687 -4.377 1
1 40 . 16 1 1 A 4 4 PHE CB C 157 37.840 39.181 -1.341 1
1 47 . 16 1 1 A 4 4 PHE N N 157 117.790 119.829 -2.039 1
1 48 . 16 1 1 A 5 5 SER H H 158 7.970 8.412 -0.442 1
1 49 . 16 1 1 A 5 5 SER HA H 158 4.560 4.446 0.114 1
1 52 . 16 1 1 A 5 5 SER C C 158 174.160 175.325 -1.165 1
1 53 . 16 1 1 A 5 5 SER CA C 158 57.010 60.788 -3.778 1
1 54 . 16 1 1 A 5 5 SER CB C 158 64.870 62.845 2.025 1
1 55 . 16 1 1 A 5 5 SER N N 158 115.670 113.693 1.977 1
1 56 . 16 1 1 A 6 6 ALA H H 159 9.000 8.537 0.463 1
1 57 . 16 1 1 A 6 6 ALA HA H 159 4.080 4.159 -0.079 1
1 61 . 16 1 1 A 6 6 ALA C C 159 178.290 180.429 -2.139 1
1 62 . 16 1 1 A 6 6 ALA CA C 159 54.850 55.460 -0.610 1
1 63 . 16 1 1 A 6 6 ALA CB C 159 18.070 18.284 -0.214 1
1 64 . 16 1 1 A 6 6 ALA N N 159 125.390 123.085 2.305 1
1 65 . 16 1 1 A 7 7 GLU H H 160 8.590 8.150 0.440 1
1 66 . 16 1 1 A 7 7 GLU HA H 160 3.990 4.116 -0.126 1
1 71 . 16 1 1 A 7 7 GLU C C 160 177.440 178.462 -1.022 1
1 72 . 16 1 1 A 7 7 GLU CA C 160 59.010 58.844 0.166 1
1 73 . 16 1 1 A 7 7 GLU CB C 160 28.220 29.475 -1.255 1
1 75 . 16 1 1 A 7 7 GLU N N 160 116.180 118.292 -2.112 1
1 76 . 16 1 1 A 8 8 PHE H H 161 7.860 8.001 -0.141 1
1 77 . 16 1 1 A 8 8 PHE HA H 161 4.330 4.206 0.124 1
1 85 . 16 1 1 A 8 8 PHE C C 161 177.130 177.377 -0.247 1
1 86 . 16 1 1 A 8 8 PHE CA C 161 60.330 60.999 -0.669 1
1 87 . 16 1 1 A 8 8 PHE CB C 161 39.160 39.427 -0.267 1
1 94 . 16 1 1 A 8 8 PHE N N 161 118.050 123.234 -5.184 1
1 95 . 16 1 1 A 9 9 LEU H H 162 8.240 9.330 -1.090 1
1 96 . 16 1 1 A 9 9 LEU HA H 162 3.990 3.855 0.135 1
1 106 . 16 1 1 A 9 9 LEU C C 162 177.130 179.170 -2.040 1
1 107 . 16 1 1 A 9 9 LEU CA C 162 57.990 57.913 0.077 1
1 108 . 16 1 1 A 9 9 LEU CB C 162 41.510 41.488 0.022 1
1 112 . 16 1 1 A 9 9 LEU N N 162 119.110 119.410 -0.300 1
1 113 . 16 1 1 A 10 10 LYS H H 163 7.950 8.372 -0.422 1
1 114 . 16 1 1 A 10 10 LYS HA H 163 3.920 4.081 -0.161 1
1 123 . 16 1 1 A 10 10 LYS C C 163 174.010 177.617 -3.607 1
1 124 . 16 1 1 A 10 10 LYS CA C 163 58.850 58.738 0.112 1
1 125 . 16 1 1 A 10 10 LYS CB C 163 32.290 32.816 -0.526 1
1 129 . 16 1 1 A 10 10 LYS N N 163 115.320 117.092 -1.772 1
1 130 . 16 1 1 A 11 11 VAL H H 164 6.940 7.029 -0.089 1
1 131 . 16 1 1 A 11 11 VAL HA H 164 4.180 4.533 -0.353 1
1 139 . 16 1 1 A 11 11 VAL C C 164 177.290 175.804 1.486 1
1 140 . 16 1 1 A 11 11 VAL CA C 164 62.680 60.605 2.075 1
1 141 . 16 1 1 A 11 11 VAL CB C 164 32.680 31.421 1.259 1
1 144 . 16 1 1 A 11 11 VAL N N 164 110.250 109.396 0.854 1
1 145 . 16 1 1 A 12 12 PHE H H 165 8.610 7.695 0.915 1
1 146 . 16 1 1 A 12 12 PHE HA H 165 4.180 4.600 -0.420 1
1 154 . 16 1 1 A 12 12 PHE C C 165 175.720 176.784 -1.064 1
1 155 . 16 1 1 A 12 12 PHE CA C 165 60.410 58.913 1.497 1
1 156 . 16 1 1 A 12 12 PHE CB C 165 40.330 40.582 -0.252 1
1 163 . 16 1 1 A 12 12 PHE N N 165 121.290 121.334 -0.044 1
1 164 . 16 1 1 A 13 13 LEU H H 166 8.420 7.865 0.555 1
1 165 . 16 1 1 A 13 13 LEU HA H 166 4.160 3.852 0.308 1
1 175 . 16 1 1 A 13 13 LEU CA C 166 59.090 60.046 -0.956 1
1 176 . 16 1 1 A 13 13 LEU CB C 166 38.380 39.936 -1.556 1
1 180 . 16 1 1 A 13 13 LEU N N 166 115.420 119.966 -4.546 1
1 181 . 16 1 1 A 14 14 PRO HA H 167 4.130 4.241 -0.111 1
1 188 . 16 1 1 A 14 14 PRO C C 167 177.150 178.577 -1.427 1
1 189 . 16 1 1 A 14 14 PRO CA C 167 65.800 66.173 -0.373 1
1 190 . 16 1 1 A 14 14 PRO CB C 167 30.340 30.762 -0.422 1
1 193 . 16 1 1 A 15 15 SER H H 168 7.150 8.020 -0.870 1
1 194 . 16 1 1 A 15 15 SER HA H 168 4.040 4.160 -0.120 1
1 197 . 16 1 1 A 15 15 SER C C 168 174.160 177.383 -3.223 1
1 198 . 16 1 1 A 15 15 SER CA C 168 63.330 60.869 2.461 1
1 199 . 16 1 1 A 15 15 SER CB C 168 62.060 62.663 -0.603 1
1 200 . 16 1 1 A 15 15 SER N N 168 112.330 112.351 -0.021 1
1 201 . 16 1 1 A 16 16 LEU H H 169 7.770 8.147 -0.377 1
1 202 . 16 1 1 A 16 16 LEU HA H 169 4.800 3.697 1.103 1
1 212 . 16 1 1 A 16 16 LEU C C 169 180.100 179.200 0.900 1
1 213 . 16 1 1 A 16 16 LEU CA C 169 55.340 57.901 -2.561 1
1 214 . 16 1 1 A 16 16 LEU CB C 169 41.980 41.252 0.728 1
1 218 . 16 1 1 A 16 16 LEU N N 169 120.480 121.983 -1.503 1
1 219 . 16 1 1 A 17 17 LEU H H 170 8.050 7.953 0.097 1
1 220 . 16 1 1 A 17 17 LEU HA H 170 4.070 4.015 0.055 1
1 230 . 16 1 1 A 17 17 LEU C C 170 176.970 179.020 -2.050 1
1 231 . 16 1 1 A 17 17 LEU CA C 170 57.910 58.062 -0.152 1
1 232 . 16 1 1 A 17 17 LEU CB C 170 40.800 41.843 -1.043 1
1 236 . 16 1 1 A 17 17 LEU N N 170 122.150 119.291 2.859 1
1 237 . 16 1 1 A 18 18 LEU H H 171 7.940 7.787 0.153 1
1 238 . 16 1 1 A 18 18 LEU HA H 171 3.990 3.833 0.157 1
1 248 . 16 1 1 A 18 18 LEU C C 171 177.910 179.286 -1.376 1
1 249 . 16 1 1 A 18 18 LEU CA C 171 57.760 57.911 -0.151 1
1 250 . 16 1 1 A 18 18 LEU CB C 171 41.120 41.183 -0.063 1
1 254 . 16 1 1 A 18 18 LEU N N 171 117.490 118.050 -0.560 1
1 255 . 16 1 1 A 19 19 SER H H 172 8.970 7.944 1.026 1
1 256 . 16 1 1 A 19 19 SER HA H 172 3.840 4.028 -0.188 1
1 259 . 16 1 1 A 19 19 SER C C 172 176.820 176.724 0.096 1
1 260 . 16 1 1 A 19 19 SER CA C 172 63.190 62.412 0.778 1
1 261 . 16 1 1 A 19 19 SER CB C 172 59.730 62.789 -3.059 1
1 262 . 16 1 1 A 19 19 SER N N 172 115.970 113.990 1.980 1
1 263 . 16 1 1 A 20 20 HIS H H 173 7.600 8.174 -0.574 1
1 264 . 16 1 1 A 20 20 HIS HA H 173 4.080 4.322 -0.242 1
1 269 . 16 1 1 A 20 20 HIS C C 173 176.970 177.726 -0.756 1
1 270 . 16 1 1 A 20 20 HIS CA C 173 62.220 59.221 2.999 1
1 271 . 16 1 1 A 20 20 HIS CB C 173 27.440 29.892 -2.452 1
1 275 . 16 1 1 A 20 20 HIS N N 173 119.720 119.490 0.230 1
1 276 . 16 1 1 A 21 21 LEU H H 174 8.200 9.120 -0.920 1
1 277 . 16 1 1 A 21 21 LEU HA H 174 4.070 3.808 0.262 1
1 287 . 16 1 1 A 21 21 LEU C C 174 178.220 179.049 -0.829 1
1 288 . 16 1 1 A 21 21 LEU CA C 174 57.910 58.202 -0.292 1
1 289 . 16 1 1 A 21 21 LEU CB C 174 40.960 41.996 -1.036 1
1 293 . 16 1 1 A 21 21 LEU N N 174 120.780 119.905 0.875 1
1 294 . 16 1 1 A 22 22 LEU H H 175 8.510 8.475 0.035 1
1 295 . 16 1 1 A 22 22 LEU HA H 175 3.930 3.912 0.018 1
1 305 . 16 1 1 A 22 22 LEU C C 175 177.440 178.931 -1.491 1
1 306 . 16 1 1 A 22 22 LEU CA C 175 57.760 57.921 -0.161 1
1 307 . 16 1 1 A 22 22 LEU CB C 175 40.800 41.488 -0.688 1
1 311 . 16 1 1 A 22 22 LEU N N 175 118.600 117.853 0.747 1
1 312 . 16 1 1 A 23 23 ALA H H 176 7.830 8.277 -0.447 1
1 313 . 16 1 1 A 23 23 ALA HA H 176 3.970 4.107 -0.137 1
1 317 . 16 1 1 A 23 23 ALA C C 176 178.220 179.876 -1.656 1
1 318 . 16 1 1 A 23 23 ALA CA C 176 55.260 55.336 -0.076 1
1 319 . 16 1 1 A 23 23 ALA CB C 176 18.070 18.401 -0.331 1
1 320 . 16 1 1 A 23 23 ALA N N 176 121.030 121.533 -0.503 1
1 321 . 16 1 1 A 24 24 ILE H H 177 8.210 8.251 -0.041 1
1 322 . 16 1 1 A 24 24 ILE HA H 177 3.900 3.734 0.166 1
1 332 . 16 1 1 A 24 24 ILE C C 177 178.380 177.931 0.449 1
1 333 . 16 1 1 A 24 24 ILE CA C 177 64.870 65.042 -0.172 1
1 334 . 16 1 1 A 24 24 ILE CB C 177 37.370 37.677 -0.307 1
1 338 . 16 1 1 A 24 24 ILE N N 177 118.330 118.625 -0.295 1
1 339 . 16 1 1 A 25 25 GLY H H 178 8.590 8.050 0.540 1
1 340 . 16 1 1 A 25 25 GLY HA2 H 178 3.600 3.797 -0.197 1
1 341 . 16 1 1 A 25 25 GLY HA3 H 178 3.630 3.816 -0.186 1
1 342 . 16 1 1 A 25 25 GLY C C 178 173.850 176.163 -2.313 1
1 343 . 16 1 1 A 25 25 GLY CA C 178 47.530 47.432 0.098 1
1 344 . 16 1 1 A 25 25 GLY N N 178 107.320 108.370 -1.050 1
1 345 . 16 1 1 A 26 26 LEU H H 179 8.830 8.184 0.646 1
1 346 . 16 1 1 A 26 26 LEU HA H 179 4.110 4.022 0.088 1
1 356 . 16 1 1 A 26 26 LEU C C 179 178.220 179.045 -0.825 1
1 357 . 16 1 1 A 26 26 LEU CA C 179 57.600 58.384 -0.784 1
1 358 . 16 1 1 A 26 26 LEU CB C 179 41.040 41.979 -0.939 1
1 362 . 16 1 1 A 26 26 LEU N N 179 122.350 122.758 -0.408 1
1 363 . 16 1 1 A 27 27 GLY H H 180 8.520 8.082 0.438 1
1 364 . 16 1 1 A 27 27 GLY HA2 H 180 3.760 3.782 -0.022 1
1 365 . 16 1 1 A 27 27 GLY HA3 H 180 4.520 3.788 0.732 1
1 366 . 16 1 1 A 27 27 GLY C C 180 174.160 176.005 -1.845 1
1 367 . 16 1 1 A 27 27 GLY CA C 180 47.920 47.477 0.443 1
1 368 . 16 1 1 A 27 27 GLY N N 180 106.260 105.342 0.918 1
1 369 . 16 1 1 A 28 28 ILE H H 181 8.780 8.148 0.632 1
1 370 . 16 1 1 A 28 28 ILE HA H 181 3.590 3.861 -0.271 1
1 380 . 16 1 1 A 28 28 ILE C C 181 177.130 177.578 -0.448 1
1 381 . 16 1 1 A 28 28 ILE CA C 181 65.340 64.474 0.866 1
1 382 . 16 1 1 A 28 28 ILE CB C 181 36.900 37.404 -0.504 1
1 386 . 16 1 1 A 28 28 ILE N N 181 123.970 122.518 1.452 1
1 387 . 16 1 1 A 29 29 TYR H H 182 8.110 8.628 -0.518 1
1 388 . 16 1 1 A 29 29 TYR HA H 182 3.880 4.141 -0.261 1
1 395 . 16 1 1 A 29 29 TYR C C 182 176.970 176.861 0.109 1
1 396 . 16 1 1 A 29 29 TYR CA C 182 61.900 61.536 0.364 1
1 397 . 16 1 1 A 29 29 TYR CB C 182 37.910 38.533 -0.623 1
1 403 . 16 1 1 A 29 29 TYR N N 182 119.570 120.670 -1.100 1
1 404 . 16 1 1 A 30 30 ILE H H 183 8.490 8.405 0.085 1
1 405 . 16 1 1 A 30 30 ILE HA H 183 3.400 3.818 -0.418 1
1 415 . 16 1 1 A 30 30 ILE C C 183 177.760 177.693 0.067 1
1 416 . 16 1 1 A 30 30 ILE CA C 183 65.020 65.069 -0.049 1
1 417 . 16 1 1 A 30 30 ILE CB C 183 37.600 38.001 -0.401 1
1 421 . 16 1 1 A 30 30 ILE N N 183 118.000 119.344 -1.344 1
1 422 . 16 1 1 A 31 31 GLY H H 184 9.360 8.187 1.173 1
1 423 . 16 1 1 A 31 31 GLY HA2 H 184 3.650 3.793 -0.143 1
1 424 . 16 1 1 A 31 31 GLY HA3 H 184 3.940 3.796 0.144 1
1 425 . 16 1 1 A 31 31 GLY C C 184 174.320 175.943 -1.623 1
1 426 . 16 1 1 A 31 31 GLY CA C 184 47.380 47.063 0.317 1
1 427 . 16 1 1 A 31 31 GLY N N 184 106.260 107.359 -1.099 1
1 428 . 16 1 1 A 32 32 ARG H H 185 8.090 8.949 -0.859 1
1 429 . 16 1 1 A 32 32 ARG HA H 185 4.030 4.078 -0.048 1
1 441 . 16 1 1 A 32 32 ARG C C 185 177.290 177.127 0.163 1
1 442 . 16 1 1 A 32 32 ARG CA C 185 57.050 58.270 -1.220 1
1 443 . 16 1 1 A 32 32 ARG CB C 185 29.630 29.663 -0.033 1
1 447 . 16 1 1 A 32 32 ARG N N 185 118.050 120.999 -2.949 1
1 451 . 16 1 1 A 33 33 ARG H H 186 7.760 7.362 0.398 1
1 452 . 16 1 1 A 33 33 ARG HA H 186 4.260 4.616 -0.356 1
1 464 . 16 1 1 A 33 33 ARG C C 186 176.190 176.430 -0.240 1
1 465 . 16 1 1 A 33 33 ARG CA C 186 55.670 54.912 0.758 1
1 466 . 16 1 1 A 33 33 ARG CB C 186 29.710 30.095 -0.385 1
1 470 . 16 1 1 A 33 33 ARG N N 186 117.390 118.925 -1.535 1
1 474 . 16 1 1 A 34 34 LEU H H 187 7.530 7.497 0.033 1
1 475 . 16 1 1 A 34 34 LEU HA H 187 4.390 3.971 0.419 1
1 485 . 16 1 1 A 34 34 LEU C C 187 175.410 178.306 -2.896 1
1 486 . 16 1 1 A 34 34 LEU CA C 187 54.440 57.996 -3.556 1
1 487 . 16 1 1 A 34 34 LEU CB C 187 41.590 42.140 -0.550 1
1 491 . 16 1 1 A 34 34 LEU N N 187 119.360 120.334 -0.974 1
1 5 . 17 1 1 A 2 2 GLY H H 155 8.570 7.777 0.793 1
1 6 . 17 1 1 A 2 2 GLY HA2 H 155 3.950 4.115 -0.165 1
1 7 . 17 1 1 A 2 2 GLY HA3 H 155 4.070 4.117 -0.047 1
1 8 . 17 1 1 A 2 2 GLY C C 155 173.690 174.808 -1.118 1
1 9 . 17 1 1 A 2 2 GLY CA C 155 44.560 44.100 0.460 1
1 10 . 17 1 1 A 2 2 GLY N N 155 108.940 108.027 0.913 1
1 11 . 17 1 1 A 3 3 ILE H H 156 8.340 8.728 -0.388 1
1 12 . 17 1 1 A 3 3 ILE HA H 156 3.640 3.630 0.010 1
1 22 . 17 1 1 A 3 3 ILE C C 156 174.470 177.684 -3.214 1
1 23 . 17 1 1 A 3 3 ILE CA C 156 62.060 64.553 -2.493 1
1 24 . 17 1 1 A 3 3 ILE CB C 156 37.680 38.026 -0.346 1
1 28 . 17 1 1 A 3 3 ILE N N 156 119.870 119.837 0.033 1
1 29 . 17 1 1 A 4 4 PHE H H 157 7.850 8.222 -0.372 1
1 30 . 17 1 1 A 4 4 PHE HA H 157 4.570 4.342 0.228 1
1 38 . 17 1 1 A 4 4 PHE C C 157 174.320 176.166 -1.846 1
1 39 . 17 1 1 A 4 4 PHE CA C 157 56.310 60.693 -4.383 1
1 40 . 17 1 1 A 4 4 PHE CB C 157 37.840 38.998 -1.158 1
1 47 . 17 1 1 A 4 4 PHE N N 157 117.790 119.727 -1.937 1
1 48 . 17 1 1 A 5 5 SER H H 158 7.970 7.999 -0.029 1
1 49 . 17 1 1 A 5 5 SER HA H 158 4.560 4.165 0.395 1
1 52 . 17 1 1 A 5 5 SER C C 158 174.160 175.809 -1.649 1
1 53 . 17 1 1 A 5 5 SER CA C 158 57.010 60.854 -3.844 1
1 54 . 17 1 1 A 5 5 SER CB C 158 64.870 61.882 2.988 1
1 55 . 17 1 1 A 5 5 SER N N 158 115.670 112.961 2.709 1
1 56 . 17 1 1 A 6 6 ALA H H 159 9.000 8.342 0.658 1
1 57 . 17 1 1 A 6 6 ALA HA H 159 4.080 4.138 -0.058 1
1 61 . 17 1 1 A 6 6 ALA C C 159 178.290 180.325 -2.035 1
1 62 . 17 1 1 A 6 6 ALA CA C 159 54.850 55.423 -0.573 1
1 63 . 17 1 1 A 6 6 ALA CB C 159 18.070 18.527 -0.457 1
1 64 . 17 1 1 A 6 6 ALA N N 159 125.390 124.356 1.034 1
1 65 . 17 1 1 A 7 7 GLU H H 160 8.590 7.959 0.631 1
1 66 . 17 1 1 A 7 7 GLU HA H 160 3.990 4.168 -0.178 1
1 71 . 17 1 1 A 7 7 GLU C C 160 177.440 178.875 -1.435 1
1 72 . 17 1 1 A 7 7 GLU CA C 160 59.010 58.947 0.063 1
1 73 . 17 1 1 A 7 7 GLU CB C 160 28.220 29.371 -1.151 1
1 75 . 17 1 1 A 7 7 GLU N N 160 116.180 117.763 -1.583 1
1 76 . 17 1 1 A 8 8 PHE H H 161 7.860 8.507 -0.647 1
1 77 . 17 1 1 A 8 8 PHE HA H 161 4.330 4.174 0.156 1
1 85 . 17 1 1 A 8 8 PHE C C 161 177.130 177.052 0.078 1
1 86 . 17 1 1 A 8 8 PHE CA C 161 60.330 61.297 -0.967 1
1 87 . 17 1 1 A 8 8 PHE CB C 161 39.160 38.996 0.164 1
1 94 . 17 1 1 A 8 8 PHE N N 161 118.050 122.938 -4.888 1
1 95 . 17 1 1 A 9 9 LEU H H 162 8.240 9.170 -0.930 1
1 96 . 17 1 1 A 9 9 LEU HA H 162 3.990 4.018 -0.028 1
1 106 . 17 1 1 A 9 9 LEU C C 162 177.130 179.447 -2.317 1
1 107 . 17 1 1 A 9 9 LEU CA C 162 57.990 57.987 0.003 1
1 108 . 17 1 1 A 9 9 LEU CB C 162 41.510 41.504 0.006 1
1 112 . 17 1 1 A 9 9 LEU N N 162 119.110 119.422 -0.312 1
1 113 . 17 1 1 A 10 10 LYS H H 163 7.950 7.848 0.102 1
1 114 . 17 1 1 A 10 10 LYS HA H 163 3.920 4.112 -0.192 1
1 123 . 17 1 1 A 10 10 LYS C C 163 174.010 177.868 -3.858 1
1 124 . 17 1 1 A 10 10 LYS CA C 163 58.850 58.606 0.244 1
1 125 . 17 1 1 A 10 10 LYS CB C 163 32.290 32.540 -0.250 1
1 129 . 17 1 1 A 10 10 LYS N N 163 115.320 117.519 -2.199 1
1 130 . 17 1 1 A 11 11 VAL H H 164 6.940 7.126 -0.186 1
1 131 . 17 1 1 A 11 11 VAL HA H 164 4.180 4.554 -0.374 1
1 139 . 17 1 1 A 11 11 VAL C C 164 177.290 176.259 1.031 1
1 140 . 17 1 1 A 11 11 VAL CA C 164 62.680 60.651 2.029 1
1 141 . 17 1 1 A 11 11 VAL CB C 164 32.680 31.444 1.236 1
1 144 . 17 1 1 A 11 11 VAL N N 164 110.250 109.468 0.782 1
1 145 . 17 1 1 A 12 12 PHE H H 165 8.610 8.254 0.356 1
1 146 . 17 1 1 A 12 12 PHE HA H 165 4.180 4.729 -0.549 1
1 154 . 17 1 1 A 12 12 PHE C C 165 175.720 177.042 -1.322 1
1 155 . 17 1 1 A 12 12 PHE CA C 165 60.410 59.385 1.025 1
1 156 . 17 1 1 A 12 12 PHE CB C 165 40.330 40.434 -0.104 1
1 163 . 17 1 1 A 12 12 PHE N N 165 121.290 120.841 0.449 1
1 164 . 17 1 1 A 13 13 LEU H H 166 8.420 8.049 0.371 1
1 165 . 17 1 1 A 13 13 LEU HA H 166 4.160 3.840 0.320 1
1 175 . 17 1 1 A 13 13 LEU CA C 166 59.090 60.026 -0.936 1
1 176 . 17 1 1 A 13 13 LEU CB C 166 38.380 39.888 -1.508 1
1 180 . 17 1 1 A 13 13 LEU N N 166 115.420 120.212 -4.792 1
1 181 . 17 1 1 A 14 14 PRO HA H 167 4.130 4.243 -0.113 1
1 188 . 17 1 1 A 14 14 PRO C C 167 177.150 178.870 -1.720 1
1 189 . 17 1 1 A 14 14 PRO CA C 167 65.800 66.417 -0.617 1
1 190 . 17 1 1 A 14 14 PRO CB C 167 30.340 30.752 -0.412 1
1 193 . 17 1 1 A 15 15 SER H H 168 7.150 8.142 -0.992 1
1 194 . 17 1 1 A 15 15 SER HA H 168 4.040 4.088 -0.048 1
1 197 . 17 1 1 A 15 15 SER C C 168 174.160 177.414 -3.254 1
1 198 . 17 1 1 A 15 15 SER CA C 168 63.330 61.501 1.829 1
1 199 . 17 1 1 A 15 15 SER CB C 168 62.060 62.834 -0.774 1
1 200 . 17 1 1 A 15 15 SER N N 168 112.330 112.146 0.184 1
1 201 . 17 1 1 A 16 16 LEU H H 169 7.770 7.779 -0.009 1
1 202 . 17 1 1 A 16 16 LEU HA H 169 4.800 3.737 1.063 1
1 212 . 17 1 1 A 16 16 LEU C C 169 180.100 179.144 0.956 1
1 213 . 17 1 1 A 16 16 LEU CA C 169 55.340 57.869 -2.529 1
1 214 . 17 1 1 A 16 16 LEU CB C 169 41.980 41.331 0.649 1
1 218 . 17 1 1 A 16 16 LEU N N 169 120.480 121.339 -0.859 1
1 219 . 17 1 1 A 17 17 LEU H H 170 8.050 7.826 0.224 1
1 220 . 17 1 1 A 17 17 LEU HA H 170 4.070 4.077 -0.007 1
1 230 . 17 1 1 A 17 17 LEU C C 170 176.970 179.058 -2.088 1
1 231 . 17 1 1 A 17 17 LEU CA C 170 57.910 58.082 -0.172 1
1 232 . 17 1 1 A 17 17 LEU CB C 170 40.800 41.730 -0.930 1
1 236 . 17 1 1 A 17 17 LEU N N 170 122.150 119.261 2.889 1
1 237 . 17 1 1 A 18 18 LEU H H 171 7.940 8.524 -0.584 1
1 238 . 17 1 1 A 18 18 LEU HA H 171 3.990 3.850 0.140 1
1 248 . 17 1 1 A 18 18 LEU C C 171 177.910 179.378 -1.468 1
1 249 . 17 1 1 A 18 18 LEU CA C 171 57.760 58.008 -0.248 1
1 250 . 17 1 1 A 18 18 LEU CB C 171 41.120 41.265 -0.145 1
1 254 . 17 1 1 A 18 18 LEU N N 171 117.490 118.599 -1.109 1
1 255 . 17 1 1 A 19 19 SER H H 172 8.970 7.694 1.276 1
1 256 . 17 1 1 A 19 19 SER HA H 172 3.840 4.019 -0.179 1
1 259 . 17 1 1 A 19 19 SER C C 172 176.820 176.628 0.192 1
1 260 . 17 1 1 A 19 19 SER CA C 172 63.190 62.381 0.809 1
1 261 . 17 1 1 A 19 19 SER CB C 172 59.730 62.780 -3.050 1
1 262 . 17 1 1 A 19 19 SER N N 172 115.970 114.171 1.799 1
1 263 . 17 1 1 A 20 20 HIS H H 173 7.600 7.827 -0.227 1
1 264 . 17 1 1 A 20 20 HIS HA H 173 4.080 4.291 -0.211 1
1 269 . 17 1 1 A 20 20 HIS C C 173 176.970 177.695 -0.725 1
1 270 . 17 1 1 A 20 20 HIS CA C 173 62.220 58.833 3.387 1
1 271 . 17 1 1 A 20 20 HIS CB C 173 27.440 30.092 -2.652 1
1 275 . 17 1 1 A 20 20 HIS N N 173 119.720 119.671 0.049 1
1 276 . 17 1 1 A 21 21 LEU H H 174 8.200 8.421 -0.221 1
1 277 . 17 1 1 A 21 21 LEU HA H 174 4.070 3.780 0.290 1
1 287 . 17 1 1 A 21 21 LEU C C 174 178.220 179.037 -0.817 1
1 288 . 17 1 1 A 21 21 LEU CA C 174 57.910 58.169 -0.259 1
1 289 . 17 1 1 A 21 21 LEU CB C 174 40.960 41.669 -0.709 1
1 293 . 17 1 1 A 21 21 LEU N N 174 120.780 119.882 0.898 1
1 294 . 17 1 1 A 22 22 LEU H H 175 8.510 8.260 0.250 1
1 295 . 17 1 1 A 22 22 LEU HA H 175 3.930 3.873 0.057 1
1 305 . 17 1 1 A 22 22 LEU C C 175 177.440 178.868 -1.428 1
1 306 . 17 1 1 A 22 22 LEU CA C 175 57.760 57.854 -0.094 1
1 307 . 17 1 1 A 22 22 LEU CB C 175 40.800 41.798 -0.998 1
1 311 . 17 1 1 A 22 22 LEU N N 175 118.600 118.150 0.450 1
1 312 . 17 1 1 A 23 23 ALA H H 176 7.830 8.840 -1.010 1
1 313 . 17 1 1 A 23 23 ALA HA H 176 3.970 4.051 -0.081 1
1 317 . 17 1 1 A 23 23 ALA C C 176 178.220 179.936 -1.716 1
1 318 . 17 1 1 A 23 23 ALA CA C 176 55.260 55.343 -0.083 1
1 319 . 17 1 1 A 23 23 ALA CB C 176 18.070 18.383 -0.313 1
1 320 . 17 1 1 A 23 23 ALA N N 176 121.030 121.277 -0.247 1
1 321 . 17 1 1 A 24 24 ILE H H 177 8.210 8.094 0.116 1
1 322 . 17 1 1 A 24 24 ILE HA H 177 3.900 3.731 0.169 1
1 332 . 17 1 1 A 24 24 ILE C C 177 178.380 177.919 0.461 1
1 333 . 17 1 1 A 24 24 ILE CA C 177 64.870 65.072 -0.202 1
1 334 . 17 1 1 A 24 24 ILE CB C 177 37.370 37.681 -0.311 1
1 338 . 17 1 1 A 24 24 ILE N N 177 118.330 118.409 -0.079 1
1 339 . 17 1 1 A 25 25 GLY H H 178 8.590 7.988 0.602 1
1 340 . 17 1 1 A 25 25 GLY HA2 H 178 3.600 3.792 -0.192 1
1 341 . 17 1 1 A 25 25 GLY HA3 H 178 3.630 3.805 -0.175 1
1 342 . 17 1 1 A 25 25 GLY C C 178 173.850 176.165 -2.315 1
1 343 . 17 1 1 A 25 25 GLY CA C 178 47.530 47.394 0.136 1
1 344 . 17 1 1 A 25 25 GLY N N 178 107.320 108.360 -1.040 1
1 345 . 17 1 1 A 26 26 LEU H H 179 8.830 8.244 0.586 1
1 346 . 17 1 1 A 26 26 LEU HA H 179 4.110 4.034 0.076 1
1 356 . 17 1 1 A 26 26 LEU C C 179 178.220 179.056 -0.836 1
1 357 . 17 1 1 A 26 26 LEU CA C 179 57.600 58.286 -0.686 1
1 358 . 17 1 1 A 26 26 LEU CB C 179 41.040 41.897 -0.857 1
1 362 . 17 1 1 A 26 26 LEU N N 179 122.350 122.727 -0.377 1
1 363 . 17 1 1 A 27 27 GLY H H 180 8.520 8.128 0.392 1
1 364 . 17 1 1 A 27 27 GLY HA2 H 180 3.760 3.801 -0.041 1
1 365 . 17 1 1 A 27 27 GLY HA3 H 180 4.520 3.809 0.711 1
1 366 . 17 1 1 A 27 27 GLY C C 180 174.160 176.126 -1.966 1
1 367 . 17 1 1 A 27 27 GLY CA C 180 47.920 47.480 0.440 1
1 368 . 17 1 1 A 27 27 GLY N N 180 106.260 105.425 0.835 1
1 369 . 17 1 1 A 28 28 ILE H H 181 8.780 7.964 0.816 1
1 370 . 17 1 1 A 28 28 ILE HA H 181 3.590 3.845 -0.255 1
1 380 . 17 1 1 A 28 28 ILE C C 181 177.130 177.480 -0.350 1
1 381 . 17 1 1 A 28 28 ILE CA C 181 65.340 64.606 0.734 1
1 382 . 17 1 1 A 28 28 ILE CB C 181 36.900 37.555 -0.655 1
1 386 . 17 1 1 A 28 28 ILE N N 181 123.970 122.634 1.336 1
1 387 . 17 1 1 A 29 29 TYR H H 182 8.110 8.285 -0.175 1
1 388 . 17 1 1 A 29 29 TYR HA H 182 3.880 4.104 -0.224 1
1 395 . 17 1 1 A 29 29 TYR C C 182 176.970 176.773 0.197 1
1 396 . 17 1 1 A 29 29 TYR CA C 182 61.900 61.567 0.333 1
1 397 . 17 1 1 A 29 29 TYR CB C 182 37.910 38.492 -0.582 1
1 403 . 17 1 1 A 29 29 TYR N N 182 119.570 120.406 -0.836 1
1 404 . 17 1 1 A 30 30 ILE H H 183 8.490 8.235 0.255 1
1 405 . 17 1 1 A 30 30 ILE HA H 183 3.400 3.787 -0.387 1
1 415 . 17 1 1 A 30 30 ILE C C 183 177.760 177.716 0.044 1
1 416 . 17 1 1 A 30 30 ILE CA C 183 65.020 65.149 -0.129 1
1 417 . 17 1 1 A 30 30 ILE CB C 183 37.600 38.014 -0.414 1
1 421 . 17 1 1 A 30 30 ILE N N 183 118.000 119.398 -1.398 1
1 422 . 17 1 1 A 31 31 GLY H H 184 9.360 8.281 1.079 1
1 423 . 17 1 1 A 31 31 GLY HA2 H 184 3.650 3.784 -0.134 1
1 424 . 17 1 1 A 31 31 GLY HA3 H 184 3.940 3.790 0.150 1
1 425 . 17 1 1 A 31 31 GLY C C 184 174.320 175.870 -1.550 1
1 426 . 17 1 1 A 31 31 GLY CA C 184 47.380 47.058 0.322 1
1 427 . 17 1 1 A 31 31 GLY N N 184 106.260 107.415 -1.155 1
1 428 . 17 1 1 A 32 32 ARG H H 185 8.090 9.213 -1.123 1
1 429 . 17 1 1 A 32 32 ARG HA H 185 4.030 4.139 -0.109 1
1 441 . 17 1 1 A 32 32 ARG C C 185 177.290 177.002 0.288 1
1 442 . 17 1 1 A 32 32 ARG CA C 185 57.050 57.958 -0.908 1
1 443 . 17 1 1 A 32 32 ARG CB C 185 29.630 29.475 0.155 1
1 447 . 17 1 1 A 32 32 ARG N N 185 118.050 120.494 -2.444 1
1 451 . 17 1 1 A 33 33 ARG H H 186 7.760 7.316 0.444 1
1 452 . 17 1 1 A 33 33 ARG HA H 186 4.260 4.614 -0.354 1
1 464 . 17 1 1 A 33 33 ARG C C 186 176.190 176.300 -0.110 1
1 465 . 17 1 1 A 33 33 ARG CA C 186 55.670 54.881 0.789 1
1 466 . 17 1 1 A 33 33 ARG CB C 186 29.710 29.961 -0.251 1
1 470 . 17 1 1 A 33 33 ARG N N 186 117.390 118.821 -1.431 1
1 474 . 17 1 1 A 34 34 LEU H H 187 7.530 7.304 0.226 1
1 475 . 17 1 1 A 34 34 LEU HA H 187 4.390 4.297 0.093 1
1 485 . 17 1 1 A 34 34 LEU C C 187 175.410 178.352 -2.942 1
1 486 . 17 1 1 A 34 34 LEU CA C 187 54.440 56.078 -1.638 1
1 487 . 17 1 1 A 34 34 LEU CB C 187 41.590 42.202 -0.612 1
1 491 . 17 1 1 A 34 34 LEU N N 187 119.360 119.719 -0.359 1
1 5 . 18 1 1 A 2 2 GLY H H 155 8.570 8.249 0.321 1
1 6 . 18 1 1 A 2 2 GLY HA2 H 155 3.950 4.383 -0.433 1
1 7 . 18 1 1 A 2 2 GLY HA3 H 155 4.070 4.411 -0.341 1
1 8 . 18 1 1 A 2 2 GLY C C 155 173.690 174.805 -1.115 1
1 9 . 18 1 1 A 2 2 GLY CA C 155 44.560 44.223 0.337 1
1 10 . 18 1 1 A 2 2 GLY N N 155 108.940 108.458 0.482 1
1 11 . 18 1 1 A 3 3 ILE H H 156 8.340 8.686 -0.346 1
1 12 . 18 1 1 A 3 3 ILE HA H 156 3.640 3.611 0.029 1
1 22 . 18 1 1 A 3 3 ILE C C 156 174.470 177.394 -2.924 1
1 23 . 18 1 1 A 3 3 ILE CA C 156 62.060 64.150 -2.090 1
1 24 . 18 1 1 A 3 3 ILE CB C 156 37.680 37.153 0.527 1
1 28 . 18 1 1 A 3 3 ILE N N 156 119.870 120.695 -0.825 1
1 29 . 18 1 1 A 4 4 PHE H H 157 7.850 7.696 0.154 1
1 30 . 18 1 1 A 4 4 PHE HA H 157 4.570 4.318 0.252 1
1 38 . 18 1 1 A 4 4 PHE C C 157 174.320 176.354 -2.034 1
1 39 . 18 1 1 A 4 4 PHE CA C 157 56.310 60.725 -4.415 1
1 40 . 18 1 1 A 4 4 PHE CB C 157 37.840 39.249 -1.409 1
1 47 . 18 1 1 A 4 4 PHE N N 157 117.790 120.792 -3.002 1
1 48 . 18 1 1 A 5 5 SER H H 158 7.970 8.339 -0.369 1
1 49 . 18 1 1 A 5 5 SER HA H 158 4.560 4.461 0.099 1
1 52 . 18 1 1 A 5 5 SER C C 158 174.160 175.664 -1.504 1
1 53 . 18 1 1 A 5 5 SER CA C 158 57.010 60.700 -3.690 1
1 54 . 18 1 1 A 5 5 SER CB C 158 64.870 62.888 1.982 1
1 55 . 18 1 1 A 5 5 SER N N 158 115.670 113.896 1.774 1
1 56 . 18 1 1 A 6 6 ALA H H 159 9.000 8.652 0.348 1
1 57 . 18 1 1 A 6 6 ALA HA H 159 4.080 4.169 -0.089 1
1 61 . 18 1 1 A 6 6 ALA C C 159 178.290 180.363 -2.073 1
1 62 . 18 1 1 A 6 6 ALA CA C 159 54.850 55.473 -0.623 1
1 63 . 18 1 1 A 6 6 ALA CB C 159 18.070 18.426 -0.356 1
1 64 . 18 1 1 A 6 6 ALA N N 159 125.390 123.347 2.043 1
1 65 . 18 1 1 A 7 7 GLU H H 160 8.590 8.237 0.353 1
1 66 . 18 1 1 A 7 7 GLU HA H 160 3.990 4.068 -0.078 1
1 71 . 18 1 1 A 7 7 GLU C C 160 177.440 179.252 -1.812 1
1 72 . 18 1 1 A 7 7 GLU CA C 160 59.010 59.291 -0.281 1
1 73 . 18 1 1 A 7 7 GLU CB C 160 28.220 29.661 -1.441 1
1 75 . 18 1 1 A 7 7 GLU N N 160 116.180 118.120 -1.940 1
1 76 . 18 1 1 A 8 8 PHE H H 161 7.860 8.242 -0.382 1
1 77 . 18 1 1 A 8 8 PHE HA H 161 4.330 4.154 0.176 1
1 85 . 18 1 1 A 8 8 PHE C C 161 177.130 177.051 0.079 1
1 86 . 18 1 1 A 8 8 PHE CA C 161 60.330 61.251 -0.921 1
1 87 . 18 1 1 A 8 8 PHE CB C 161 39.160 38.928 0.232 1
1 94 . 18 1 1 A 8 8 PHE N N 161 118.050 121.569 -3.519 1
1 95 . 18 1 1 A 9 9 LEU H H 162 8.240 9.589 -1.349 1
1 96 . 18 1 1 A 9 9 LEU HA H 162 3.990 4.013 -0.023 1
1 106 . 18 1 1 A 9 9 LEU C C 162 177.130 179.280 -2.150 1
1 107 . 18 1 1 A 9 9 LEU CA C 162 57.990 57.696 0.294 1
1 108 . 18 1 1 A 9 9 LEU CB C 162 41.510 40.872 0.638 1
1 112 . 18 1 1 A 9 9 LEU N N 162 119.110 119.283 -0.173 1
1 113 . 18 1 1 A 10 10 LYS H H 163 7.950 8.063 -0.113 1
1 114 . 18 1 1 A 10 10 LYS HA H 163 3.920 4.100 -0.180 1
1 123 . 18 1 1 A 10 10 LYS C C 163 174.010 177.705 -3.695 1
1 124 . 18 1 1 A 10 10 LYS CA C 163 58.850 58.747 0.103 1
1 125 . 18 1 1 A 10 10 LYS CB C 163 32.290 32.695 -0.405 1
1 129 . 18 1 1 A 10 10 LYS N N 163 115.320 117.905 -2.585 1
1 130 . 18 1 1 A 11 11 VAL H H 164 6.940 7.114 -0.174 1
1 131 . 18 1 1 A 11 11 VAL HA H 164 4.180 4.489 -0.309 1
1 139 . 18 1 1 A 11 11 VAL C C 164 177.290 176.044 1.246 1
1 140 . 18 1 1 A 11 11 VAL CA C 164 62.680 60.614 2.066 1
1 141 . 18 1 1 A 11 11 VAL CB C 164 32.680 31.382 1.298 1
1 144 . 18 1 1 A 11 11 VAL N N 164 110.250 109.296 0.954 1
1 145 . 18 1 1 A 12 12 PHE H H 165 8.610 7.924 0.686 1
1 146 . 18 1 1 A 12 12 PHE HA H 165 4.180 4.654 -0.474 1
1 154 . 18 1 1 A 12 12 PHE C C 165 175.720 176.827 -1.107 1
1 155 . 18 1 1 A 12 12 PHE CA C 165 60.410 59.251 1.159 1
1 156 . 18 1 1 A 12 12 PHE CB C 165 40.330 40.832 -0.502 1
1 163 . 18 1 1 A 12 12 PHE N N 165 121.290 120.945 0.345 1
1 164 . 18 1 1 A 13 13 LEU H H 166 8.420 8.143 0.277 1
1 165 . 18 1 1 A 13 13 LEU HA H 166 4.160 3.719 0.441 1
1 175 . 18 1 1 A 13 13 LEU CA C 166 59.090 59.994 -0.904 1
1 176 . 18 1 1 A 13 13 LEU CB C 166 38.380 39.927 -1.547 1
1 180 . 18 1 1 A 13 13 LEU N N 166 115.420 119.807 -4.387 1
1 181 . 18 1 1 A 14 14 PRO HA H 167 4.130 4.184 -0.054 1
1 188 . 18 1 1 A 14 14 PRO C C 167 177.150 178.857 -1.707 1
1 189 . 18 1 1 A 14 14 PRO CA C 167 65.800 66.600 -0.800 1
1 190 . 18 1 1 A 14 14 PRO CB C 167 30.340 30.703 -0.363 1
1 193 . 18 1 1 A 15 15 SER H H 168 7.150 8.175 -1.025 1
1 194 . 18 1 1 A 15 15 SER HA H 168 4.040 4.137 -0.097 1
1 197 . 18 1 1 A 15 15 SER C C 168 174.160 177.433 -3.273 1
1 198 . 18 1 1 A 15 15 SER CA C 168 63.330 61.088 2.242 1
1 199 . 18 1 1 A 15 15 SER CB C 168 62.060 62.899 -0.839 1
1 200 . 18 1 1 A 15 15 SER N N 168 112.330 112.030 0.300 1
1 201 . 18 1 1 A 16 16 LEU H H 169 7.770 8.082 -0.312 1
1 202 . 18 1 1 A 16 16 LEU HA H 169 4.800 3.717 1.083 1
1 212 . 18 1 1 A 16 16 LEU C C 169 180.100 179.129 0.971 1
1 213 . 18 1 1 A 16 16 LEU CA C 169 55.340 57.871 -2.531 1
1 214 . 18 1 1 A 16 16 LEU CB C 169 41.980 41.468 0.512 1
1 218 . 18 1 1 A 16 16 LEU N N 169 120.480 122.011 -1.531 1
1 219 . 18 1 1 A 17 17 LEU H H 170 8.050 7.906 0.144 1
1 220 . 18 1 1 A 17 17 LEU HA H 170 4.070 4.167 -0.097 1
1 230 . 18 1 1 A 17 17 LEU C C 170 176.970 179.181 -2.211 1
1 231 . 18 1 1 A 17 17 LEU CA C 170 57.910 58.165 -0.255 1
1 232 . 18 1 1 A 17 17 LEU CB C 170 40.800 41.439 -0.639 1
1 236 . 18 1 1 A 17 17 LEU N N 170 122.150 118.717 3.433 1
1 237 . 18 1 1 A 18 18 LEU H H 171 7.940 8.236 -0.296 1
1 238 . 18 1 1 A 18 18 LEU HA H 171 3.990 3.838 0.152 1
1 248 . 18 1 1 A 18 18 LEU C C 171 177.910 179.223 -1.313 1
1 249 . 18 1 1 A 18 18 LEU CA C 171 57.760 58.048 -0.288 1
1 250 . 18 1 1 A 18 18 LEU CB C 171 41.120 41.204 -0.084 1
1 254 . 18 1 1 A 18 18 LEU N N 171 117.490 118.774 -1.284 1
1 255 . 18 1 1 A 19 19 SER H H 172 8.970 7.702 1.268 1
1 256 . 18 1 1 A 19 19 SER HA H 172 3.840 4.052 -0.212 1
1 259 . 18 1 1 A 19 19 SER C C 172 176.820 176.662 0.158 1
1 260 . 18 1 1 A 19 19 SER CA C 172 63.190 62.250 0.940 1
1 261 . 18 1 1 A 19 19 SER CB C 172 59.730 62.922 -3.192 1
1 262 . 18 1 1 A 19 19 SER N N 172 115.970 114.139 1.831 1
1 263 . 18 1 1 A 20 20 HIS H H 173 7.600 7.828 -0.228 1
1 264 . 18 1 1 A 20 20 HIS HA H 173 4.080 4.325 -0.245 1
1 269 . 18 1 1 A 20 20 HIS C C 173 176.970 177.706 -0.736 1
1 270 . 18 1 1 A 20 20 HIS CA C 173 62.220 58.937 3.283 1
1 271 . 18 1 1 A 20 20 HIS CB C 173 27.440 30.118 -2.678 1
1 275 . 18 1 1 A 20 20 HIS N N 173 119.720 119.713 0.007 1
1 276 . 18 1 1 A 21 21 LEU H H 174 8.200 8.594 -0.394 1
1 277 . 18 1 1 A 21 21 LEU HA H 174 4.070 3.810 0.260 1
1 287 . 18 1 1 A 21 21 LEU C C 174 178.220 179.013 -0.793 1
1 288 . 18 1 1 A 21 21 LEU CA C 174 57.910 58.169 -0.259 1
1 289 . 18 1 1 A 21 21 LEU CB C 174 40.960 41.820 -0.860 1
1 293 . 18 1 1 A 21 21 LEU N N 174 120.780 119.832 0.948 1
1 294 . 18 1 1 A 22 22 LEU H H 175 8.510 8.149 0.361 1
1 295 . 18 1 1 A 22 22 LEU HA H 175 3.930 3.880 0.050 1
1 305 . 18 1 1 A 22 22 LEU C C 175 177.440 178.870 -1.430 1
1 306 . 18 1 1 A 22 22 LEU CA C 175 57.760 57.845 -0.085 1
1 307 . 18 1 1 A 22 22 LEU CB C 175 40.800 41.778 -0.978 1
1 311 . 18 1 1 A 22 22 LEU N N 175 118.600 118.037 0.563 1
1 312 . 18 1 1 A 23 23 ALA H H 176 7.830 8.669 -0.839 1
1 313 . 18 1 1 A 23 23 ALA HA H 176 3.970 4.064 -0.094 1
1 317 . 18 1 1 A 23 23 ALA C C 176 178.220 179.892 -1.672 1
1 318 . 18 1 1 A 23 23 ALA CA C 176 55.260 55.356 -0.096 1
1 319 . 18 1 1 A 23 23 ALA CB C 176 18.070 18.374 -0.304 1
1 320 . 18 1 1 A 23 23 ALA N N 176 121.030 121.545 -0.515 1
1 321 . 18 1 1 A 24 24 ILE H H 177 8.210 8.106 0.104 1
1 322 . 18 1 1 A 24 24 ILE HA H 177 3.900 3.752 0.148 1
1 332 . 18 1 1 A 24 24 ILE C C 177 178.380 177.923 0.457 1
1 333 . 18 1 1 A 24 24 ILE CA C 177 64.870 65.097 -0.227 1
1 334 . 18 1 1 A 24 24 ILE CB C 177 37.370 37.779 -0.409 1
1 338 . 18 1 1 A 24 24 ILE N N 177 118.330 118.255 0.075 1
1 339 . 18 1 1 A 25 25 GLY H H 178 8.590 8.075 0.515 1
1 340 . 18 1 1 A 25 25 GLY HA2 H 178 3.600 3.783 -0.183 1
1 341 . 18 1 1 A 25 25 GLY HA3 H 178 3.630 3.799 -0.169 1
1 342 . 18 1 1 A 25 25 GLY C C 178 173.850 176.205 -2.355 1
1 343 . 18 1 1 A 25 25 GLY CA C 178 47.530 47.310 0.220 1
1 344 . 18 1 1 A 25 25 GLY N N 178 107.320 108.201 -0.881 1
1 345 . 18 1 1 A 26 26 LEU H H 179 8.830 8.287 0.543 1
1 346 . 18 1 1 A 26 26 LEU HA H 179 4.110 4.057 0.053 1
1 356 . 18 1 1 A 26 26 LEU C C 179 178.220 179.035 -0.815 1
1 357 . 18 1 1 A 26 26 LEU CA C 179 57.600 58.473 -0.873 1
1 358 . 18 1 1 A 26 26 LEU CB C 179 41.040 42.032 -0.992 1
1 362 . 18 1 1 A 26 26 LEU N N 179 122.350 122.724 -0.374 1
1 363 . 18 1 1 A 27 27 GLY H H 180 8.520 8.100 0.420 1
1 364 . 18 1 1 A 27 27 GLY HA2 H 180 3.760 3.782 -0.022 1
1 365 . 18 1 1 A 27 27 GLY HA3 H 180 4.520 3.788 0.732 1
1 366 . 18 1 1 A 27 27 GLY C C 180 174.160 176.260 -2.100 1
1 367 . 18 1 1 A 27 27 GLY CA C 180 47.920 47.463 0.457 1
1 368 . 18 1 1 A 27 27 GLY N N 180 106.260 105.118 1.142 1
1 369 . 18 1 1 A 28 28 ILE H H 181 8.780 7.986 0.794 1
1 370 . 18 1 1 A 28 28 ILE HA H 181 3.590 3.841 -0.251 1
1 380 . 18 1 1 A 28 28 ILE C C 181 177.130 177.363 -0.233 1
1 381 . 18 1 1 A 28 28 ILE CA C 181 65.340 64.726 0.614 1
1 382 . 18 1 1 A 28 28 ILE CB C 181 36.900 37.653 -0.753 1
1 386 . 18 1 1 A 28 28 ILE N N 181 123.970 122.486 1.484 1
1 387 . 18 1 1 A 29 29 TYR H H 182 8.110 8.390 -0.280 1
1 388 . 18 1 1 A 29 29 TYR HA H 182 3.880 4.092 -0.212 1
1 395 . 18 1 1 A 29 29 TYR C C 182 176.970 176.846 0.124 1
1 396 . 18 1 1 A 29 29 TYR CA C 182 61.900 61.702 0.198 1
1 397 . 18 1 1 A 29 29 TYR CB C 182 37.910 38.452 -0.542 1
1 403 . 18 1 1 A 29 29 TYR N N 182 119.570 120.382 -0.812 1
1 404 . 18 1 1 A 30 30 ILE H H 183 8.490 8.253 0.237 1
1 405 . 18 1 1 A 30 30 ILE HA H 183 3.400 3.692 -0.292 1
1 415 . 18 1 1 A 30 30 ILE C C 183 177.760 177.623 0.137 1
1 416 . 18 1 1 A 30 30 ILE CA C 183 65.020 64.946 0.074 1
1 417 . 18 1 1 A 30 30 ILE CB C 183 37.600 38.039 -0.439 1
1 421 . 18 1 1 A 30 30 ILE N N 183 118.000 119.303 -1.303 1
1 422 . 18 1 1 A 31 31 GLY H H 184 9.360 8.065 1.295 1
1 423 . 18 1 1 A 31 31 GLY HA2 H 184 3.650 3.752 -0.102 1
1 424 . 18 1 1 A 31 31 GLY HA3 H 184 3.940 3.760 0.180 1
1 425 . 18 1 1 A 31 31 GLY C C 184 174.320 175.991 -1.671 1
1 426 . 18 1 1 A 31 31 GLY CA C 184 47.380 47.045 0.335 1
1 427 . 18 1 1 A 31 31 GLY N N 184 106.260 107.051 -0.791 1
1 428 . 18 1 1 A 32 32 ARG H H 185 8.090 8.603 -0.513 1
1 429 . 18 1 1 A 32 32 ARG HA H 185 4.030 4.052 -0.022 1
1 441 . 18 1 1 A 32 32 ARG C C 185 177.290 176.915 0.375 1
1 442 . 18 1 1 A 32 32 ARG CA C 185 57.050 58.725 -1.675 1
1 443 . 18 1 1 A 32 32 ARG CB C 185 29.630 30.201 -0.571 1
1 447 . 18 1 1 A 32 32 ARG N N 185 118.050 120.800 -2.750 1
1 451 . 18 1 1 A 33 33 ARG H H 186 7.760 7.603 0.157 1
1 452 . 18 1 1 A 33 33 ARG HA H 186 4.260 4.560 -0.300 1
1 464 . 18 1 1 A 33 33 ARG C C 186 176.190 176.322 -0.132 1
1 465 . 18 1 1 A 33 33 ARG CA C 186 55.670 54.895 0.775 1
1 466 . 18 1 1 A 33 33 ARG CB C 186 29.710 29.756 -0.046 1
1 470 . 18 1 1 A 33 33 ARG N N 186 117.390 118.571 -1.181 1
1 474 . 18 1 1 A 34 34 LEU H H 187 7.530 7.387 0.143 1
1 475 . 18 1 1 A 34 34 LEU HA H 187 4.390 4.245 0.145 1
1 485 . 18 1 1 A 34 34 LEU C C 187 175.410 178.232 -2.822 1
1 486 . 18 1 1 A 34 34 LEU CA C 187 54.440 56.505 -2.065 1
1 487 . 18 1 1 A 34 34 LEU CB C 187 41.590 43.550 -1.960 1
1 491 . 18 1 1 A 34 34 LEU N N 187 119.360 120.516 -1.156 1
1 5 . 19 1 1 A 2 2 GLY H H 155 8.570 8.682 -0.112 1
1 6 . 19 1 1 A 2 2 GLY HA2 H 155 3.950 4.071 -0.121 1
1 7 . 19 1 1 A 2 2 GLY HA3 H 155 4.070 4.083 -0.013 1
1 8 . 19 1 1 A 2 2 GLY C C 155 173.690 174.745 -1.055 1
1 9 . 19 1 1 A 2 2 GLY CA C 155 44.560 45.203 -0.643 1
1 10 . 19 1 1 A 2 2 GLY N N 155 108.940 111.957 -3.017 1
1 11 . 19 1 1 A 3 3 ILE H H 156 8.340 8.604 -0.264 1
1 12 . 19 1 1 A 3 3 ILE HA H 156 3.640 3.565 0.075 1
1 22 . 19 1 1 A 3 3 ILE C C 156 174.470 177.385 -2.915 1
1 23 . 19 1 1 A 3 3 ILE CA C 156 62.060 64.718 -2.658 1
1 24 . 19 1 1 A 3 3 ILE CB C 156 37.680 37.783 -0.103 1
1 28 . 19 1 1 A 3 3 ILE N N 156 119.870 121.690 -1.820 1
1 29 . 19 1 1 A 4 4 PHE H H 157 7.850 8.058 -0.208 1
1 30 . 19 1 1 A 4 4 PHE HA H 157 4.570 4.349 0.221 1
1 38 . 19 1 1 A 4 4 PHE C C 157 174.320 176.682 -2.362 1
1 39 . 19 1 1 A 4 4 PHE CA C 157 56.310 60.816 -4.506 1
1 40 . 19 1 1 A 4 4 PHE CB C 157 37.840 39.276 -1.436 1
1 47 . 19 1 1 A 4 4 PHE N N 157 117.790 119.874 -2.084 1
1 48 . 19 1 1 A 5 5 SER H H 158 7.970 8.058 -0.088 1
1 49 . 19 1 1 A 5 5 SER HA H 158 4.560 4.171 0.389 1
1 52 . 19 1 1 A 5 5 SER C C 158 174.160 176.051 -1.891 1
1 53 . 19 1 1 A 5 5 SER CA C 158 57.010 60.911 -3.901 1
1 54 . 19 1 1 A 5 5 SER CB C 158 64.870 61.989 2.881 1
1 55 . 19 1 1 A 5 5 SER N N 158 115.670 113.394 2.276 1
1 56 . 19 1 1 A 6 6 ALA H H 159 9.000 8.482 0.518 1
1 57 . 19 1 1 A 6 6 ALA HA H 159 4.080 4.147 -0.067 1
1 61 . 19 1 1 A 6 6 ALA C C 159 178.290 180.382 -2.092 1
1 62 . 19 1 1 A 6 6 ALA CA C 159 54.850 55.444 -0.594 1
1 63 . 19 1 1 A 6 6 ALA CB C 159 18.070 18.539 -0.469 1
1 64 . 19 1 1 A 6 6 ALA N N 159 125.390 124.985 0.405 1
1 65 . 19 1 1 A 7 7 GLU H H 160 8.590 8.119 0.471 1
1 66 . 19 1 1 A 7 7 GLU HA H 160 3.990 4.140 -0.150 1
1 71 . 19 1 1 A 7 7 GLU C C 160 177.440 178.603 -1.163 1
1 72 . 19 1 1 A 7 7 GLU CA C 160 59.010 58.834 0.176 1
1 73 . 19 1 1 A 7 7 GLU CB C 160 28.220 29.519 -1.299 1
1 75 . 19 1 1 A 7 7 GLU N N 160 116.180 118.143 -1.963 1
1 76 . 19 1 1 A 8 8 PHE H H 161 7.860 8.074 -0.214 1
1 77 . 19 1 1 A 8 8 PHE HA H 161 4.330 4.195 0.135 1
1 85 . 19 1 1 A 8 8 PHE C C 161 177.130 177.341 -0.211 1
1 86 . 19 1 1 A 8 8 PHE CA C 161 60.330 61.202 -0.872 1
1 87 . 19 1 1 A 8 8 PHE CB C 161 39.160 39.319 -0.159 1
1 94 . 19 1 1 A 8 8 PHE N N 161 118.050 123.053 -5.003 1
1 95 . 19 1 1 A 9 9 LEU H H 162 8.240 9.497 -1.257 1
1 96 . 19 1 1 A 9 9 LEU HA H 162 3.990 4.218 -0.228 1
1 106 . 19 1 1 A 9 9 LEU C C 162 177.130 179.639 -2.509 1
1 107 . 19 1 1 A 9 9 LEU CA C 162 57.990 58.100 -0.110 1
1 108 . 19 1 1 A 9 9 LEU CB C 162 41.510 41.654 -0.144 1
1 112 . 19 1 1 A 9 9 LEU N N 162 119.110 119.682 -0.572 1
1 113 . 19 1 1 A 10 10 LYS H H 163 7.950 8.896 -0.946 1
1 114 . 19 1 1 A 10 10 LYS HA H 163 3.920 4.172 -0.252 1
1 123 . 19 1 1 A 10 10 LYS C C 163 174.010 177.080 -3.070 1
1 124 . 19 1 1 A 10 10 LYS CA C 163 58.850 58.986 -0.136 1
1 125 . 19 1 1 A 10 10 LYS CB C 163 32.290 32.130 0.160 1
1 129 . 19 1 1 A 10 10 LYS N N 163 115.320 117.874 -2.554 1
1 130 . 19 1 1 A 11 11 VAL H H 164 6.940 7.022 -0.082 1
1 131 . 19 1 1 A 11 11 VAL HA H 164 4.180 4.464 -0.284 1
1 139 . 19 1 1 A 11 11 VAL C C 164 177.290 176.169 1.121 1
1 140 . 19 1 1 A 11 11 VAL CA C 164 62.680 60.728 1.952 1
1 141 . 19 1 1 A 11 11 VAL CB C 164 32.680 31.578 1.102 1
1 144 . 19 1 1 A 11 11 VAL N N 164 110.250 116.325 -6.075 1
1 145 . 19 1 1 A 12 12 PHE H H 165 8.610 8.053 0.557 1
1 146 . 19 1 1 A 12 12 PHE HA H 165 4.180 4.702 -0.522 1
1 154 . 19 1 1 A 12 12 PHE C C 165 175.720 176.981 -1.261 1
1 155 . 19 1 1 A 12 12 PHE CA C 165 60.410 59.350 1.060 1
1 156 . 19 1 1 A 12 12 PHE CB C 165 40.330 41.045 -0.715 1
1 163 . 19 1 1 A 12 12 PHE N N 165 121.290 121.055 0.235 1
1 164 . 19 1 1 A 13 13 LEU H H 166 8.420 8.494 -0.074 1
1 165 . 19 1 1 A 13 13 LEU HA H 166 4.160 3.819 0.341 1
1 175 . 19 1 1 A 13 13 LEU CA C 166 59.090 60.104 -1.014 1
1 176 . 19 1 1 A 13 13 LEU CB C 166 38.380 40.089 -1.709 1
1 180 . 19 1 1 A 13 13 LEU N N 166 115.420 119.748 -4.328 1
1 181 . 19 1 1 A 14 14 PRO HA H 167 4.130 4.211 -0.081 1
1 188 . 19 1 1 A 14 14 PRO C C 167 177.150 178.460 -1.310 1
1 189 . 19 1 1 A 14 14 PRO CA C 167 65.800 66.628 -0.828 1
1 190 . 19 1 1 A 14 14 PRO CB C 167 30.340 30.836 -0.496 1
1 193 . 19 1 1 A 15 15 SER H H 168 7.150 8.243 -1.093 1
1 194 . 19 1 1 A 15 15 SER HA H 168 4.040 4.088 -0.048 1
1 197 . 19 1 1 A 15 15 SER C C 168 174.160 177.367 -3.207 1
1 198 . 19 1 1 A 15 15 SER CA C 168 63.330 61.300 2.030 1
1 199 . 19 1 1 A 15 15 SER CB C 168 62.060 62.344 -0.284 1
1 200 . 19 1 1 A 15 15 SER N N 168 112.330 113.025 -0.695 1
1 201 . 19 1 1 A 16 16 LEU H H 169 7.770 7.721 0.049 1
1 202 . 19 1 1 A 16 16 LEU HA H 169 4.800 3.564 1.236 1
1 212 . 19 1 1 A 16 16 LEU C C 169 180.100 179.040 1.060 1
1 213 . 19 1 1 A 16 16 LEU CA C 169 55.340 57.809 -2.469 1
1 214 . 19 1 1 A 16 16 LEU CB C 169 41.980 41.500 0.480 1
1 218 . 19 1 1 A 16 16 LEU N N 169 120.480 122.759 -2.279 1
1 219 . 19 1 1 A 17 17 LEU H H 170 8.050 7.736 0.314 1
1 220 . 19 1 1 A 17 17 LEU HA H 170 4.070 4.003 0.067 1
1 230 . 19 1 1 A 17 17 LEU C C 170 176.970 179.034 -2.064 1
1 231 . 19 1 1 A 17 17 LEU CA C 170 57.910 57.993 -0.083 1
1 232 . 19 1 1 A 17 17 LEU CB C 170 40.800 41.836 -1.036 1
1 236 . 19 1 1 A 17 17 LEU N N 170 122.150 118.485 3.665 1
1 237 . 19 1 1 A 18 18 LEU H H 171 7.940 8.252 -0.312 1
1 238 . 19 1 1 A 18 18 LEU HA H 171 3.990 3.833 0.157 1
1 248 . 19 1 1 A 18 18 LEU C C 171 177.910 179.225 -1.315 1
1 249 . 19 1 1 A 18 18 LEU CA C 171 57.760 57.992 -0.232 1
1 250 . 19 1 1 A 18 18 LEU CB C 171 41.120 41.416 -0.296 1
1 254 . 19 1 1 A 18 18 LEU N N 171 117.490 118.905 -1.415 1
1 255 . 19 1 1 A 19 19 SER H H 172 8.970 7.855 1.115 1
1 256 . 19 1 1 A 19 19 SER HA H 172 3.840 4.064 -0.224 1
1 259 . 19 1 1 A 19 19 SER C C 172 176.820 176.670 0.150 1
1 260 . 19 1 1 A 19 19 SER CA C 172 63.190 62.423 0.767 1
1 261 . 19 1 1 A 19 19 SER CB C 172 59.730 62.812 -3.082 1
1 262 . 19 1 1 A 19 19 SER N N 172 115.970 114.229 1.741 1
1 263 . 19 1 1 A 20 20 HIS H H 173 7.600 8.078 -0.478 1
1 264 . 19 1 1 A 20 20 HIS HA H 173 4.080 4.262 -0.182 1
1 269 . 19 1 1 A 20 20 HIS C C 173 176.970 177.732 -0.762 1
1 270 . 19 1 1 A 20 20 HIS CA C 173 62.220 59.059 3.161 1
1 271 . 19 1 1 A 20 20 HIS CB C 173 27.440 30.032 -2.592 1
1 275 . 19 1 1 A 20 20 HIS N N 173 119.720 119.509 0.211 1
1 276 . 19 1 1 A 21 21 LEU H H 174 8.200 9.413 -1.213 1
1 277 . 19 1 1 A 21 21 LEU HA H 174 4.070 3.789 0.281 1
1 287 . 19 1 1 A 21 21 LEU C C 174 178.220 179.033 -0.813 1
1 288 . 19 1 1 A 21 21 LEU CA C 174 57.910 58.166 -0.256 1
1 289 . 19 1 1 A 21 21 LEU CB C 174 40.960 41.977 -1.017 1
1 293 . 19 1 1 A 21 21 LEU N N 174 120.780 119.903 0.877 1
1 294 . 19 1 1 A 22 22 LEU H H 175 8.510 8.237 0.273 1
1 295 . 19 1 1 A 22 22 LEU HA H 175 3.930 3.899 0.031 1
1 305 . 19 1 1 A 22 22 LEU C C 175 177.440 178.963 -1.523 1
1 306 . 19 1 1 A 22 22 LEU CA C 175 57.760 57.884 -0.124 1
1 307 . 19 1 1 A 22 22 LEU CB C 175 40.800 41.629 -0.829 1
1 311 . 19 1 1 A 22 22 LEU N N 175 118.600 117.965 0.635 1
1 312 . 19 1 1 A 23 23 ALA H H 176 7.830 8.386 -0.556 1
1 313 . 19 1 1 A 23 23 ALA HA H 176 3.970 4.121 -0.151 1
1 317 . 19 1 1 A 23 23 ALA C C 176 178.220 180.027 -1.807 1
1 318 . 19 1 1 A 23 23 ALA CA C 176 55.260 55.343 -0.083 1
1 319 . 19 1 1 A 23 23 ALA CB C 176 18.070 18.413 -0.343 1
1 320 . 19 1 1 A 23 23 ALA N N 176 121.030 121.554 -0.524 1
1 321 . 19 1 1 A 24 24 ILE H H 177 8.210 8.265 -0.055 1
1 322 . 19 1 1 A 24 24 ILE HA H 177 3.900 3.756 0.144 1
1 332 . 19 1 1 A 24 24 ILE C C 177 178.380 177.940 0.440 1
1 333 . 19 1 1 A 24 24 ILE CA C 177 64.870 65.107 -0.237 1
1 334 . 19 1 1 A 24 24 ILE CB C 177 37.370 37.869 -0.499 1
1 338 . 19 1 1 A 24 24 ILE N N 177 118.330 118.603 -0.273 1
1 339 . 19 1 1 A 25 25 GLY H H 178 8.590 8.028 0.562 1
1 340 . 19 1 1 A 25 25 GLY HA2 H 178 3.600 3.793 -0.193 1
1 341 . 19 1 1 A 25 25 GLY HA3 H 178 3.630 3.804 -0.174 1
1 342 . 19 1 1 A 25 25 GLY C C 178 173.850 176.183 -2.333 1
1 343 . 19 1 1 A 25 25 GLY CA C 178 47.530 47.367 0.163 1
1 344 . 19 1 1 A 25 25 GLY N N 178 107.320 107.869 -0.549 1
1 345 . 19 1 1 A 26 26 LEU H H 179 8.830 8.251 0.579 1
1 346 . 19 1 1 A 26 26 LEU HA H 179 4.110 4.030 0.080 1
1 356 . 19 1 1 A 26 26 LEU C C 179 178.220 179.048 -0.828 1
1 357 . 19 1 1 A 26 26 LEU CA C 179 57.600 58.572 -0.972 1
1 358 . 19 1 1 A 26 26 LEU CB C 179 41.040 42.004 -0.964 1
1 362 . 19 1 1 A 26 26 LEU N N 179 122.350 122.786 -0.436 1
1 363 . 19 1 1 A 27 27 GLY H H 180 8.520 8.082 0.438 1
1 364 . 19 1 1 A 27 27 GLY HA2 H 180 3.760 3.786 -0.026 1
1 365 . 19 1 1 A 27 27 GLY HA3 H 180 4.520 3.795 0.725 1
1 366 . 19 1 1 A 27 27 GLY C C 180 174.160 176.138 -1.978 1
1 367 . 19 1 1 A 27 27 GLY CA C 180 47.920 47.520 0.400 1
1 368 . 19 1 1 A 27 27 GLY N N 180 106.260 105.267 0.993 1
1 369 . 19 1 1 A 28 28 ILE H H 181 8.780 8.021 0.759 1
1 370 . 19 1 1 A 28 28 ILE HA H 181 3.590 3.855 -0.265 1
1 380 . 19 1 1 A 28 28 ILE C C 181 177.130 177.615 -0.485 1
1 381 . 19 1 1 A 28 28 ILE CA C 181 65.340 64.433 0.907 1
1 382 . 19 1 1 A 28 28 ILE CB C 181 36.900 37.399 -0.499 1
1 386 . 19 1 1 A 28 28 ILE N N 181 123.970 122.528 1.442 1
1 387 . 19 1 1 A 29 29 TYR H H 182 8.110 8.584 -0.474 1
1 388 . 19 1 1 A 29 29 TYR HA H 182 3.880 4.157 -0.277 1
1 395 . 19 1 1 A 29 29 TYR C C 182 176.970 177.313 -0.343 1
1 396 . 19 1 1 A 29 29 TYR CA C 182 61.900 61.646 0.254 1
1 397 . 19 1 1 A 29 29 TYR CB C 182 37.910 38.728 -0.818 1
1 403 . 19 1 1 A 29 29 TYR N N 182 119.570 120.358 -0.788 1
1 404 . 19 1 1 A 30 30 ILE H H 183 8.490 8.249 0.241 1
1 405 . 19 1 1 A 30 30 ILE HA H 183 3.400 3.822 -0.422 1
1 415 . 19 1 1 A 30 30 ILE C C 183 177.760 177.617 0.143 1
1 416 . 19 1 1 A 30 30 ILE CA C 183 65.020 65.059 -0.039 1
1 417 . 19 1 1 A 30 30 ILE CB C 183 37.600 38.012 -0.412 1
1 421 . 19 1 1 A 30 30 ILE N N 183 118.000 119.208 -1.208 1
1 422 . 19 1 1 A 31 31 GLY H H 184 9.360 8.015 1.345 1
1 423 . 19 1 1 A 31 31 GLY HA2 H 184 3.650 3.791 -0.141 1
1 424 . 19 1 1 A 31 31 GLY HA3 H 184 3.940 3.791 0.149 1
1 425 . 19 1 1 A 31 31 GLY C C 184 174.320 175.851 -1.531 1
1 426 . 19 1 1 A 31 31 GLY CA C 184 47.380 47.069 0.311 1
1 427 . 19 1 1 A 31 31 GLY N N 184 106.260 107.327 -1.067 1
1 428 . 19 1 1 A 32 32 ARG H H 185 8.090 8.400 -0.310 1
1 429 . 19 1 1 A 32 32 ARG HA H 185 4.030 4.100 -0.070 1
1 441 . 19 1 1 A 32 32 ARG C C 185 177.290 176.383 0.907 1
1 442 . 19 1 1 A 32 32 ARG CA C 185 57.050 58.053 -1.003 1
1 443 . 19 1 1 A 32 32 ARG CB C 185 29.630 29.604 0.026 1
1 447 . 19 1 1 A 32 32 ARG N N 185 118.050 120.469 -2.419 1
1 451 . 19 1 1 A 33 33 ARG H H 186 7.760 7.558 0.202 1
1 452 . 19 1 1 A 33 33 ARG HA H 186 4.260 4.352 -0.092 1
1 464 . 19 1 1 A 33 33 ARG C C 186 176.190 177.129 -0.939 1
1 465 . 19 1 1 A 33 33 ARG CA C 186 55.670 55.047 0.623 1
1 466 . 19 1 1 A 33 33 ARG CB C 186 29.710 29.788 -0.078 1
1 470 . 19 1 1 A 33 33 ARG N N 186 117.390 119.104 -1.714 1
1 474 . 19 1 1 A 34 34 LEU H H 187 7.530 7.720 -0.190 1
1 475 . 19 1 1 A 34 34 LEU HA H 187 4.390 4.418 -0.028 1
1 485 . 19 1 1 A 34 34 LEU C C 187 175.410 176.541 -1.131 1
1 486 . 19 1 1 A 34 34 LEU CA C 187 54.440 55.834 -1.394 1
1 487 . 19 1 1 A 34 34 LEU CB C 187 41.590 43.544 -1.954 1
1 491 . 19 1 1 A 34 34 LEU N N 187 119.360 123.703 -4.343 1
1 5 . 20 1 1 A 2 2 GLY H H 155 8.570 8.221 0.349 1
1 6 . 20 1 1 A 2 2 GLY HA2 H 155 3.950 4.120 -0.170 1
1 7 . 20 1 1 A 2 2 GLY HA3 H 155 4.070 4.183 -0.113 1
1 8 . 20 1 1 A 2 2 GLY C C 155 173.690 174.924 -1.234 1
1 9 . 20 1 1 A 2 2 GLY CA C 155 44.560 44.334 0.226 1
1 10 . 20 1 1 A 2 2 GLY N N 155 108.940 109.406 -0.466 1
1 11 . 20 1 1 A 3 3 ILE H H 156 8.340 8.690 -0.350 1
1 12 . 20 1 1 A 3 3 ILE HA H 156 3.640 3.655 -0.015 1
1 22 . 20 1 1 A 3 3 ILE C C 156 174.470 177.949 -3.479 1
1 23 . 20 1 1 A 3 3 ILE CA C 156 62.060 64.344 -2.284 1
1 24 . 20 1 1 A 3 3 ILE CB C 156 37.680 37.318 0.362 1
1 28 . 20 1 1 A 3 3 ILE N N 156 119.870 118.772 1.098 1
1 29 . 20 1 1 A 4 4 PHE H H 157 7.850 7.902 -0.052 1
1 30 . 20 1 1 A 4 4 PHE HA H 157 4.570 4.061 0.509 1
1 38 . 20 1 1 A 4 4 PHE C C 157 174.320 176.458 -2.138 1
1 39 . 20 1 1 A 4 4 PHE CA C 157 56.310 61.059 -4.749 1
1 40 . 20 1 1 A 4 4 PHE CB C 157 37.840 39.948 -2.108 1
1 47 . 20 1 1 A 4 4 PHE N N 157 117.790 121.155 -3.365 1
1 48 . 20 1 1 A 5 5 SER H H 158 7.970 7.903 0.067 1
1 49 . 20 1 1 A 5 5 SER HA H 158 4.560 4.555 0.005 1
1 52 . 20 1 1 A 5 5 SER C C 158 174.160 174.730 -0.570 1
1 53 . 20 1 1 A 5 5 SER CA C 158 57.010 58.883 -1.873 1
1 54 . 20 1 1 A 5 5 SER CB C 158 64.870 65.343 -0.473 1
1 55 . 20 1 1 A 5 5 SER N N 158 115.670 110.281 5.389 1
1 56 . 20 1 1 A 6 6 ALA H H 159 9.000 8.158 0.842 1
1 57 . 20 1 1 A 6 6 ALA HA H 159 4.080 4.486 -0.406 1
1 61 . 20 1 1 A 6 6 ALA C C 159 178.290 178.240 0.050 1
1 62 . 20 1 1 A 6 6 ALA CA C 159 54.850 53.572 1.278 1
1 63 . 20 1 1 A 6 6 ALA CB C 159 18.070 20.740 -2.670 1
1 64 . 20 1 1 A 6 6 ALA N N 159 125.390 120.495 4.895 1
1 65 . 20 1 1 A 7 7 GLU H H 160 8.590 8.837 -0.247 1
1 66 . 20 1 1 A 7 7 GLU HA H 160 3.990 4.135 -0.145 1
1 71 . 20 1 1 A 7 7 GLU C C 160 177.440 179.093 -1.653 1
1 72 . 20 1 1 A 7 7 GLU CA C 160 59.010 59.025 -0.015 1
1 73 . 20 1 1 A 7 7 GLU CB C 160 28.220 29.111 -0.891 1
1 75 . 20 1 1 A 7 7 GLU N N 160 116.180 119.319 -3.139 1
1 76 . 20 1 1 A 8 8 PHE H H 161 7.860 8.478 -0.618 1
1 77 . 20 1 1 A 8 8 PHE HA H 161 4.330 4.160 0.170 1
1 85 . 20 1 1 A 8 8 PHE C C 161 177.130 177.084 0.046 1
1 86 . 20 1 1 A 8 8 PHE CA C 161 60.330 61.372 -1.042 1
1 87 . 20 1 1 A 8 8 PHE CB C 161 39.160 39.466 -0.306 1
1 94 . 20 1 1 A 8 8 PHE N N 161 118.050 122.502 -4.452 1
1 95 . 20 1 1 A 9 9 LEU H H 162 8.240 8.511 -0.271 1
1 96 . 20 1 1 A 9 9 LEU HA H 162 3.990 3.900 0.090 1
1 106 . 20 1 1 A 9 9 LEU C C 162 177.130 179.322 -2.192 1
1 107 . 20 1 1 A 9 9 LEU CA C 162 57.990 57.985 0.005 1
1 108 . 20 1 1 A 9 9 LEU CB C 162 41.510 41.433 0.077 1
1 112 . 20 1 1 A 9 9 LEU N N 162 119.110 119.118 -0.008 1
1 113 . 20 1 1 A 10 10 LYS H H 163 7.950 7.791 0.159 1
1 114 . 20 1 1 A 10 10 LYS HA H 163 3.920 4.101 -0.181 1
1 123 . 20 1 1 A 10 10 LYS C C 163 174.010 177.733 -3.723 1
1 124 . 20 1 1 A 10 10 LYS CA C 163 58.850 58.499 0.351 1
1 125 . 20 1 1 A 10 10 LYS CB C 163 32.290 32.599 -0.309 1
1 129 . 20 1 1 A 10 10 LYS N N 163 115.320 117.578 -2.258 1
1 130 . 20 1 1 A 11 11 VAL H H 164 6.940 6.996 -0.056 1
1 131 . 20 1 1 A 11 11 VAL HA H 164 4.180 4.470 -0.290 1
1 139 . 20 1 1 A 11 11 VAL C C 164 177.290 176.218 1.072 1
1 140 . 20 1 1 A 11 11 VAL CA C 164 62.680 60.694 1.986 1
1 141 . 20 1 1 A 11 11 VAL CB C 164 32.680 31.583 1.097 1
1 144 . 20 1 1 A 11 11 VAL N N 164 110.250 109.402 0.848 1
1 145 . 20 1 1 A 12 12 PHE H H 165 8.610 8.285 0.325 1
1 146 . 20 1 1 A 12 12 PHE HA H 165 4.180 4.881 -0.701 1
1 154 . 20 1 1 A 12 12 PHE C C 165 175.720 176.941 -1.221 1
1 155 . 20 1 1 A 12 12 PHE CA C 165 60.410 59.222 1.188 1
1 156 . 20 1 1 A 12 12 PHE CB C 165 40.330 40.275 0.055 1
1 163 . 20 1 1 A 12 12 PHE N N 165 121.290 120.583 0.707 1
1 164 . 20 1 1 A 13 13 LEU H H 166 8.420 8.205 0.215 1
1 165 . 20 1 1 A 13 13 LEU HA H 166 4.160 3.959 0.201 1
1 175 . 20 1 1 A 13 13 LEU CA C 166 59.090 60.179 -1.089 1
1 176 . 20 1 1 A 13 13 LEU CB C 166 38.380 39.929 -1.549 1
1 180 . 20 1 1 A 13 13 LEU N N 166 115.420 120.311 -4.891 1
1 181 . 20 1 1 A 14 14 PRO HA H 167 4.130 4.382 -0.252 1
1 188 . 20 1 1 A 14 14 PRO C C 167 177.150 177.782 -0.632 1
1 189 . 20 1 1 A 14 14 PRO CA C 167 65.800 65.033 0.767 1
1 190 . 20 1 1 A 14 14 PRO CB C 167 30.340 31.346 -1.006 1
1 193 . 20 1 1 A 15 15 SER H H 168 7.150 7.940 -0.790 1
1 194 . 20 1 1 A 15 15 SER HA H 168 4.040 4.337 -0.297 1
1 197 . 20 1 1 A 15 15 SER C C 168 174.160 176.714 -2.554 1
1 198 . 20 1 1 A 15 15 SER CA C 168 63.330 60.713 2.617 1
1 199 . 20 1 1 A 15 15 SER CB C 168 62.060 63.570 -1.510 1
1 200 . 20 1 1 A 15 15 SER N N 168 112.330 112.834 -0.504 1
1 201 . 20 1 1 A 16 16 LEU H H 169 7.770 8.325 -0.555 1
1 202 . 20 1 1 A 16 16 LEU HA H 169 4.800 3.655 1.145 1
1 212 . 20 1 1 A 16 16 LEU C C 169 180.100 179.049 1.051 1
1 213 . 20 1 1 A 16 16 LEU CA C 169 55.340 57.757 -2.417 1
1 214 . 20 1 1 A 16 16 LEU CB C 169 41.980 41.541 0.439 1
1 218 . 20 1 1 A 16 16 LEU N N 169 120.480 122.656 -2.176 1
1 219 . 20 1 1 A 17 17 LEU H H 170 8.050 7.896 0.154 1
1 220 . 20 1 1 A 17 17 LEU HA H 170 4.070 4.009 0.061 1
1 230 . 20 1 1 A 17 17 LEU C C 170 176.970 178.918 -1.948 1
1 231 . 20 1 1 A 17 17 LEU CA C 170 57.910 58.091 -0.181 1
1 232 . 20 1 1 A 17 17 LEU CB C 170 40.800 41.827 -1.027 1
1 236 . 20 1 1 A 17 17 LEU N N 170 122.150 117.872 4.278 1
1 237 . 20 1 1 A 18 18 LEU H H 171 7.940 8.265 -0.325 1
1 238 . 20 1 1 A 18 18 LEU HA H 171 3.990 3.847 0.143 1
1 248 . 20 1 1 A 18 18 LEU C C 171 177.910 179.265 -1.355 1
1 249 . 20 1 1 A 18 18 LEU CA C 171 57.760 57.904 -0.144 1
1 250 . 20 1 1 A 18 18 LEU CB C 171 41.120 41.247 -0.127 1
1 254 . 20 1 1 A 18 18 LEU N N 171 117.490 118.046 -0.556 1
1 255 . 20 1 1 A 19 19 SER H H 172 8.970 7.885 1.085 1
1 256 . 20 1 1 A 19 19 SER HA H 172 3.840 3.973 -0.133 1
1 259 . 20 1 1 A 19 19 SER C C 172 176.820 176.692 0.128 1
1 260 . 20 1 1 A 19 19 SER CA C 172 63.190 62.352 0.838 1
1 261 . 20 1 1 A 19 19 SER CB C 172 59.730 62.630 -2.900 1
1 262 . 20 1 1 A 19 19 SER N N 172 115.970 114.021 1.949 1
1 263 . 20 1 1 A 20 20 HIS H H 173 7.600 7.885 -0.285 1
1 264 . 20 1 1 A 20 20 HIS HA H 173 4.080 4.286 -0.206 1
1 269 . 20 1 1 A 20 20 HIS C C 173 176.970 177.752 -0.782 1
1 270 . 20 1 1 A 20 20 HIS CA C 173 62.220 59.200 3.020 1
1 271 . 20 1 1 A 20 20 HIS CB C 173 27.440 29.890 -2.450 1
1 275 . 20 1 1 A 20 20 HIS N N 173 119.720 119.356 0.364 1
1 276 . 20 1 1 A 21 21 LEU H H 174 8.200 8.787 -0.587 1
1 277 . 20 1 1 A 21 21 LEU HA H 174 4.070 3.824 0.246 1
1 287 . 20 1 1 A 21 21 LEU C C 174 178.220 178.863 -0.643 1
1 288 . 20 1 1 A 21 21 LEU CA C 174 57.910 58.162 -0.252 1
1 289 . 20 1 1 A 21 21 LEU CB C 174 40.960 41.928 -0.968 1
1 293 . 20 1 1 A 21 21 LEU N N 174 120.780 119.901 0.879 1
1 294 . 20 1 1 A 22 22 LEU H H 175 8.510 8.690 -0.180 1
1 295 . 20 1 1 A 22 22 LEU HA H 175 3.930 3.927 0.003 1
1 305 . 20 1 1 A 22 22 LEU C C 175 177.440 178.864 -1.424 1
1 306 . 20 1 1 A 22 22 LEU CA C 175 57.760 57.979 -0.219 1
1 307 . 20 1 1 A 22 22 LEU CB C 175 40.800 41.309 -0.509 1
1 311 . 20 1 1 A 22 22 LEU N N 175 118.600 118.022 0.578 1
1 312 . 20 1 1 A 23 23 ALA H H 176 7.830 8.407 -0.577 1
1 313 . 20 1 1 A 23 23 ALA HA H 176 3.970 4.041 -0.071 1
1 317 . 20 1 1 A 23 23 ALA C C 176 178.220 179.899 -1.679 1
1 318 . 20 1 1 A 23 23 ALA CA C 176 55.260 55.348 -0.088 1
1 319 . 20 1 1 A 23 23 ALA CB C 176 18.070 18.406 -0.336 1
1 320 . 20 1 1 A 23 23 ALA N N 176 121.030 121.903 -0.873 1
1 321 . 20 1 1 A 24 24 ILE H H 177 8.210 7.978 0.232 1
1 322 . 20 1 1 A 24 24 ILE HA H 177 3.900 3.749 0.151 1
1 332 . 20 1 1 A 24 24 ILE C C 177 178.380 177.932 0.448 1
1 333 . 20 1 1 A 24 24 ILE CA C 177 64.870 65.078 -0.208 1
1 334 . 20 1 1 A 24 24 ILE CB C 177 37.370 37.697 -0.327 1
1 338 . 20 1 1 A 24 24 ILE N N 177 118.330 118.384 -0.054 1
1 339 . 20 1 1 A 25 25 GLY H H 178 8.590 8.035 0.555 1
1 340 . 20 1 1 A 25 25 GLY HA2 H 178 3.600 3.810 -0.210 1
1 341 . 20 1 1 A 25 25 GLY HA3 H 178 3.630 3.821 -0.191 1
1 342 . 20 1 1 A 25 25 GLY C C 178 173.850 176.161 -2.311 1
1 343 . 20 1 1 A 25 25 GLY CA C 178 47.530 47.409 0.121 1
1 344 . 20 1 1 A 25 25 GLY N N 178 107.320 108.412 -1.092 1
1 345 . 20 1 1 A 26 26 LEU H H 179 8.830 8.433 0.397 1
1 346 . 20 1 1 A 26 26 LEU HA H 179 4.110 4.011 0.099 1
1 356 . 20 1 1 A 26 26 LEU C C 179 178.220 179.001 -0.781 1
1 357 . 20 1 1 A 26 26 LEU CA C 179 57.600 58.517 -0.917 1
1 358 . 20 1 1 A 26 26 LEU CB C 179 41.040 41.976 -0.936 1
1 362 . 20 1 1 A 26 26 LEU N N 179 122.350 122.806 -0.456 1
1 363 . 20 1 1 A 27 27 GLY H H 180 8.520 8.100 0.420 1
1 364 . 20 1 1 A 27 27 GLY HA2 H 180 3.760 3.772 -0.012 1
1 365 . 20 1 1 A 27 27 GLY HA3 H 180 4.520 3.780 0.740 1
1 366 . 20 1 1 A 27 27 GLY C C 180 174.160 176.166 -2.006 1
1 367 . 20 1 1 A 27 27 GLY CA C 180 47.920 47.499 0.421 1
1 368 . 20 1 1 A 27 27 GLY N N 180 106.260 105.226 1.034 1
1 369 . 20 1 1 A 28 28 ILE H H 181 8.780 8.041 0.739 1
1 370 . 20 1 1 A 28 28 ILE HA H 181 3.590 3.850 -0.260 1
1 380 . 20 1 1 A 28 28 ILE C C 181 177.130 177.542 -0.412 1
1 381 . 20 1 1 A 28 28 ILE CA C 181 65.340 64.527 0.813 1
1 382 . 20 1 1 A 28 28 ILE CB C 181 36.900 37.407 -0.507 1
1 386 . 20 1 1 A 28 28 ILE N N 181 123.970 122.469 1.501 1
1 387 . 20 1 1 A 29 29 TYR H H 182 8.110 8.794 -0.684 1
1 388 . 20 1 1 A 29 29 TYR HA H 182 3.880 4.117 -0.237 1
1 395 . 20 1 1 A 29 29 TYR C C 182 176.970 176.782 0.188 1
1 396 . 20 1 1 A 29 29 TYR CA C 182 61.900 61.706 0.194 1
1 397 . 20 1 1 A 29 29 TYR CB C 182 37.910 38.494 -0.584 1
1 403 . 20 1 1 A 29 29 TYR N N 182 119.570 120.432 -0.862 1
1 404 . 20 1 1 A 30 30 ILE H H 183 8.490 8.400 0.090 1
1 405 . 20 1 1 A 30 30 ILE HA H 183 3.400 3.842 -0.442 1
1 415 . 20 1 1 A 30 30 ILE C C 183 177.760 177.670 0.090 1
1 416 . 20 1 1 A 30 30 ILE CA C 183 65.020 65.050 -0.030 1
1 417 . 20 1 1 A 30 30 ILE CB C 183 37.600 38.076 -0.476 1
1 421 . 20 1 1 A 30 30 ILE N N 183 118.000 119.342 -1.342 1
1 422 . 20 1 1 A 31 31 GLY H H 184 9.360 7.987 1.373 1
1 423 . 20 1 1 A 31 31 GLY HA2 H 184 3.650 3.769 -0.119 1
1 424 . 20 1 1 A 31 31 GLY HA3 H 184 3.940 3.770 0.170 1
1 425 . 20 1 1 A 31 31 GLY C C 184 174.320 175.924 -1.604 1
1 426 . 20 1 1 A 31 31 GLY CA C 184 47.380 47.061 0.319 1
1 427 . 20 1 1 A 31 31 GLY N N 184 106.260 107.081 -0.821 1
1 428 . 20 1 1 A 32 32 ARG H H 185 8.090 8.619 -0.529 1
1 429 . 20 1 1 A 32 32 ARG HA H 185 4.030 4.032 -0.002 1
1 441 . 20 1 1 A 32 32 ARG C C 185 177.290 177.294 -0.004 1
1 442 . 20 1 1 A 32 32 ARG CA C 185 57.050 58.693 -1.643 1
1 443 . 20 1 1 A 32 32 ARG CB C 185 29.630 29.909 -0.279 1
1 447 . 20 1 1 A 32 32 ARG N N 185 118.050 120.792 -2.742 1
1 451 . 20 1 1 A 33 33 ARG H H 186 7.760 7.852 -0.092 1
1 452 . 20 1 1 A 33 33 ARG HA H 186 4.260 4.525 -0.265 1
1 464 . 20 1 1 A 33 33 ARG C C 186 176.190 176.881 -0.691 1
1 465 . 20 1 1 A 33 33 ARG CA C 186 55.670 55.031 0.639 1
1 466 . 20 1 1 A 33 33 ARG CB C 186 29.710 30.359 -0.649 1
1 470 . 20 1 1 A 33 33 ARG N N 186 117.390 117.922 -0.532 1
1 474 . 20 1 1 A 34 34 LEU H H 187 7.530 7.506 0.024 1
1 475 . 20 1 1 A 34 34 LEU HA H 187 4.390 4.390 0.000 1
1 485 . 20 1 1 A 34 34 LEU C C 187 175.410 176.076 -0.666 1
1 486 . 20 1 1 A 34 34 LEU CA C 187 54.440 54.748 -0.308 1
1 487 . 20 1 1 A 34 34 LEU CB C 187 41.590 42.702 -1.112 1
1 491 . 20 1 1 A 34 34 LEU N N 187 119.360 119.268 0.092 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 32 1.544 1
2 1 1 1 "RMS(OBS, PRED)" CA 33 1.560 1
3 1 1 1 "RMS(OBS, PRED)" CB 29 1.188 1
4 1 1 1 "RMS(OBS, PRED)" H 32 0.581 1
5 1 1 1 "RMS(OBS, PRED)" HA 37 0.313 1
6 1 1 1 "RMS(OBS, PRED)" N 32 1.751 1
7 1 2 1 "RMS(OBS, PRED)" C 32 1.638 1
8 1 2 1 "RMS(OBS, PRED)" CA 33 1.623 1
9 1 2 1 "RMS(OBS, PRED)" CB 29 1.073 1
10 1 2 1 "RMS(OBS, PRED)" H 32 0.593 1
11 1 2 1 "RMS(OBS, PRED)" HA 37 0.301 1
12 1 2 1 "RMS(OBS, PRED)" N 32 1.948 1
13 1 3 1 "RMS(OBS, PRED)" C 32 1.647 1
14 1 3 1 "RMS(OBS, PRED)" CA 33 1.565 1
15 1 3 1 "RMS(OBS, PRED)" CB 29 1.154 1
16 1 3 1 "RMS(OBS, PRED)" H 32 0.626 1
17 1 3 1 "RMS(OBS, PRED)" HA 37 0.307 1
18 1 3 1 "RMS(OBS, PRED)" N 32 2.097 1
19 1 4 1 "RMS(OBS, PRED)" C 32 1.717 1
20 1 4 1 "RMS(OBS, PRED)" CA 33 1.546 1
21 1 4 1 "RMS(OBS, PRED)" CB 29 1.172 1
22 1 4 1 "RMS(OBS, PRED)" H 32 0.583 1
23 1 4 1 "RMS(OBS, PRED)" HA 37 0.307 1
24 1 4 1 "RMS(OBS, PRED)" N 32 2.079 1
25 1 5 1 "RMS(OBS, PRED)" C 32 1.547 1
26 1 5 1 "RMS(OBS, PRED)" CA 33 1.532 1
27 1 5 1 "RMS(OBS, PRED)" CB 29 1.128 1
28 1 5 1 "RMS(OBS, PRED)" H 32 0.604 1
29 1 5 1 "RMS(OBS, PRED)" HA 37 0.305 1
30 1 5 1 "RMS(OBS, PRED)" N 32 2.135 1
31 1 6 1 "RMS(OBS, PRED)" C 32 1.619 1
32 1 6 1 "RMS(OBS, PRED)" CA 33 1.582 1
33 1 6 1 "RMS(OBS, PRED)" CB 29 1.135 1
34 1 6 1 "RMS(OBS, PRED)" H 32 0.613 1
35 1 6 1 "RMS(OBS, PRED)" HA 37 0.302 1
36 1 6 1 "RMS(OBS, PRED)" N 32 2.335 1
37 1 7 1 "RMS(OBS, PRED)" C 32 1.531 1
38 1 7 1 "RMS(OBS, PRED)" CA 33 1.618 1
39 1 7 1 "RMS(OBS, PRED)" CB 29 1.077 1
40 1 7 1 "RMS(OBS, PRED)" H 32 0.598 1
41 1 7 1 "RMS(OBS, PRED)" HA 37 0.303 1
42 1 7 1 "RMS(OBS, PRED)" N 32 2.018 1
43 1 8 1 "RMS(OBS, PRED)" C 32 1.531 1
44 1 8 1 "RMS(OBS, PRED)" CA 33 1.435 1
45 1 8 1 "RMS(OBS, PRED)" CB 29 1.152 1
46 1 8 1 "RMS(OBS, PRED)" H 32 0.569 1
47 1 8 1 "RMS(OBS, PRED)" HA 37 0.305 1
48 1 8 1 "RMS(OBS, PRED)" N 32 2.164 1
49 1 9 1 "RMS(OBS, PRED)" C 32 1.730 1
50 1 9 1 "RMS(OBS, PRED)" CA 33 1.584 1
51 1 9 1 "RMS(OBS, PRED)" CB 29 1.240 1
52 1 9 1 "RMS(OBS, PRED)" H 32 0.577 1
53 1 9 1 "RMS(OBS, PRED)" HA 37 0.285 1
54 1 9 1 "RMS(OBS, PRED)" N 32 1.865 1
55 1 10 1 "RMS(OBS, PRED)" C 32 1.611 1
56 1 10 1 "RMS(OBS, PRED)" CA 33 1.570 1
57 1 10 1 "RMS(OBS, PRED)" CB 29 1.120 1
58 1 10 1 "RMS(OBS, PRED)" H 32 0.589 1
59 1 10 1 "RMS(OBS, PRED)" HA 37 0.318 1
60 1 10 1 "RMS(OBS, PRED)" N 32 1.794 1
61 1 11 1 "RMS(OBS, PRED)" C 32 1.572 1
62 1 11 1 "RMS(OBS, PRED)" CA 33 1.550 1
63 1 11 1 "RMS(OBS, PRED)" CB 29 1.128 1
64 1 11 1 "RMS(OBS, PRED)" H 32 0.602 1
65 1 11 1 "RMS(OBS, PRED)" HA 37 0.306 1
66 1 11 1 "RMS(OBS, PRED)" N 32 2.146 1
67 1 12 1 "RMS(OBS, PRED)" C 32 1.686 1
68 1 12 1 "RMS(OBS, PRED)" CA 33 1.546 1
69 1 12 1 "RMS(OBS, PRED)" CB 29 1.187 1
70 1 12 1 "RMS(OBS, PRED)" H 32 0.578 1
71 1 12 1 "RMS(OBS, PRED)" HA 37 0.274 1
72 1 12 1 "RMS(OBS, PRED)" N 32 2.500 1
73 1 13 1 "RMS(OBS, PRED)" C 32 1.692 1
74 1 13 1 "RMS(OBS, PRED)" CA 33 1.537 1
75 1 13 1 "RMS(OBS, PRED)" CB 29 1.190 1
76 1 13 1 "RMS(OBS, PRED)" H 32 0.619 1
77 1 13 1 "RMS(OBS, PRED)" HA 37 0.285 1
78 1 13 1 "RMS(OBS, PRED)" N 32 1.803 1
79 1 14 1 "RMS(OBS, PRED)" C 32 1.655 1
80 1 14 1 "RMS(OBS, PRED)" CA 33 1.641 1
81 1 14 1 "RMS(OBS, PRED)" CB 29 1.180 1
82 1 14 1 "RMS(OBS, PRED)" H 32 0.612 1
83 1 14 1 "RMS(OBS, PRED)" HA 37 0.314 1
84 1 14 1 "RMS(OBS, PRED)" N 32 1.930 1
85 1 15 1 "RMS(OBS, PRED)" C 32 1.526 1
86 1 15 1 "RMS(OBS, PRED)" CA 33 1.383 1
87 1 15 1 "RMS(OBS, PRED)" CB 29 1.275 1
88 1 15 1 "RMS(OBS, PRED)" H 32 0.561 1
89 1 15 1 "RMS(OBS, PRED)" HA 37 0.307 1
90 1 15 1 "RMS(OBS, PRED)" N 32 1.751 1
91 1 16 1 "RMS(OBS, PRED)" C 32 1.700 1
92 1 16 1 "RMS(OBS, PRED)" CA 33 1.644 1
93 1 16 1 "RMS(OBS, PRED)" CB 29 1.092 1
94 1 16 1 "RMS(OBS, PRED)" H 32 0.581 1
95 1 16 1 "RMS(OBS, PRED)" HA 37 0.304 1
96 1 16 1 "RMS(OBS, PRED)" N 32 1.978 1
97 1 17 1 "RMS(OBS, PRED)" C 32 1.756 1
98 1 17 1 "RMS(OBS, PRED)" CA 33 1.539 1
99 1 17 1 "RMS(OBS, PRED)" CB 29 1.166 1
100 1 17 1 "RMS(OBS, PRED)" H 32 0.618 1
101 1 17 1 "RMS(OBS, PRED)" HA 37 0.301 1
102 1 17 1 "RMS(OBS, PRED)" N 32 1.784 1
103 1 18 1 "RMS(OBS, PRED)" C 32 1.740 1
104 1 18 1 "RMS(OBS, PRED)" CA 33 1.568 1
105 1 18 1 "RMS(OBS, PRED)" CB 29 1.201 1
106 1 18 1 "RMS(OBS, PRED)" H 32 0.584 1
107 1 18 1 "RMS(OBS, PRED)" HA 37 0.305 1
108 1 18 1 "RMS(OBS, PRED)" N 32 1.785 1
109 1 19 1 "RMS(OBS, PRED)" C 32 1.656 1
110 1 19 1 "RMS(OBS, PRED)" CA 33 1.554 1
111 1 19 1 "RMS(OBS, PRED)" CB 29 1.237 1
112 1 19 1 "RMS(OBS, PRED)" H 32 0.619 1
113 1 19 1 "RMS(OBS, PRED)" HA 37 0.316 1
114 1 19 1 "RMS(OBS, PRED)" N 32 2.367 1
115 1 20 1 "RMS(OBS, PRED)" C 32 1.566 1
116 1 20 1 "RMS(OBS, PRED)" CA 33 1.469 1
117 1 20 1 "RMS(OBS, PRED)" CB 29 1.200 1
118 1 20 1 "RMS(OBS, PRED)" H 32 0.526 1
119 1 20 1 "RMS(OBS, PRED)" HA 37 0.328 1
120 1 20 1 "RMS(OBS, PRED)" N 32 2.347 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 5 . 1 1 A 2 2 GLY H H 155 8.570 8.203 0.367 2
1 6 . 1 1 A 2 2 GLY HA2 H 155 3.950 4.143 -0.193 2
1 7 . 1 1 A 2 2 GLY HA3 H 155 4.070 4.159 -0.089 2
1 8 . 1 1 A 2 2 GLY C C 155 173.690 174.634 -0.944 2
1 9 . 1 1 A 2 2 GLY CA C 155 44.560 44.873 -0.313 2
1 10 . 1 1 A 2 2 GLY N N 155 108.940 108.939 0.001 2
1 11 . 1 1 A 3 3 ILE H H 156 8.340 8.710 -0.370 2
1 12 . 1 1 A 3 3 ILE HA H 156 3.640 3.617 0.023 2
1 22 . 1 1 A 3 3 ILE C C 156 174.470 177.411 -2.941 2
1 23 . 1 1 A 3 3 ILE CA C 156 62.060 64.373 -2.313 2
1 24 . 1 1 A 3 3 ILE CB C 156 37.680 37.713 -0.033 2
1 28 . 1 1 A 3 3 ILE N N 156 119.870 120.263 -0.393 2
1 29 . 1 1 A 4 4 PHE H H 157 7.850 7.964 -0.114 2
1 30 . 1 1 A 4 4 PHE HA H 157 4.570 4.319 0.251 2
1 38 . 1 1 A 4 4 PHE C C 157 174.320 176.411 -2.091 2
1 39 . 1 1 A 4 4 PHE CA C 157 56.310 60.638 -4.328 2
1 40 . 1 1 A 4 4 PHE CB C 157 37.840 39.300 -1.460 2
1 47 . 1 1 A 4 4 PHE N N 157 117.790 119.817 -2.027 2
1 48 . 1 1 A 5 5 SER H H 158 7.970 8.189 -0.219 2
1 49 . 1 1 A 5 5 SER HA H 158 4.560 4.350 0.210 2
1 52 . 1 1 A 5 5 SER C C 158 174.160 175.567 -1.407 2
1 53 . 1 1 A 5 5 SER CA C 158 57.010 60.684 -3.674 2
1 54 . 1 1 A 5 5 SER CB C 158 64.870 62.716 2.154 2
1 55 . 1 1 A 5 5 SER N N 158 115.670 113.594 2.076 2
1 56 . 1 1 A 6 6 ALA H H 159 9.000 8.441 0.559 2
1 57 . 1 1 A 6 6 ALA HA H 159 4.080 4.160 -0.080 2
1 61 . 1 1 A 6 6 ALA C C 159 178.290 179.737 -1.447 2
1 62 . 1 1 A 6 6 ALA CA C 159 54.850 55.346 -0.496 2
1 63 . 1 1 A 6 6 ALA CB C 159 18.070 18.553 -0.483 2
1 64 . 1 1 A 6 6 ALA N N 159 125.390 123.486 1.904 2
1 65 . 1 1 A 7 7 GLU H H 160 8.590 8.109 0.481 2
1 66 . 1 1 A 7 7 GLU HA H 160 3.990 4.129 -0.139 2
1 71 . 1 1 A 7 7 GLU C C 160 177.440 178.832 -1.392 2
1 72 . 1 1 A 7 7 GLU CA C 160 59.010 59.123 -0.113 2
1 73 . 1 1 A 7 7 GLU CB C 160 28.220 29.548 -1.328 2
1 75 . 1 1 A 7 7 GLU N N 160 116.180 118.651 -2.471 2
1 76 . 1 1 A 8 8 PHE H H 161 7.860 8.318 -0.458 2
1 77 . 1 1 A 8 8 PHE HA H 161 4.330 4.173 0.157 2
1 85 . 1 1 A 8 8 PHE C C 161 177.130 177.269 -0.139 2
1 86 . 1 1 A 8 8 PHE CA C 161 60.330 61.249 -0.919 2
1 87 . 1 1 A 8 8 PHE CB C 161 39.160 39.337 -0.177 2
1 94 . 1 1 A 8 8 PHE N N 161 118.050 121.688 -3.638 2
1 95 . 1 1 A 9 9 LEU H H 162 8.240 9.281 -1.041 2
1 96 . 1 1 A 9 9 LEU HA H 162 3.990 3.946 0.044 2
1 106 . 1 1 A 9 9 LEU C C 162 177.130 179.455 -2.325 2
1 107 . 1 1 A 9 9 LEU CA C 162 57.990 57.908 0.082 2
1 108 . 1 1 A 9 9 LEU CB C 162 41.510 41.401 0.109 2
1 112 . 1 1 A 9 9 LEU N N 162 119.110 119.466 -0.356 2
1 113 . 1 1 A 10 10 LYS H H 163 7.950 8.513 -0.563 2
1 114 . 1 1 A 10 10 LYS HA H 163 3.920 4.121 -0.201 2
1 123 . 1 1 A 10 10 LYS C C 163 174.010 177.474 -3.464 2
1 124 . 1 1 A 10 10 LYS CA C 163 58.850 58.865 -0.015 2
1 125 . 1 1 A 10 10 LYS CB C 163 32.290 32.382 -0.092 2
1 129 . 1 1 A 10 10 LYS N N 163 115.320 117.859 -2.539 2
1 130 . 1 1 A 11 11 VAL H H 164 6.940 7.117 -0.177 2
1 131 . 1 1 A 11 11 VAL HA H 164 4.180 4.500 -0.320 2
1 139 . 1 1 A 11 11 VAL C C 164 177.290 176.219 1.071 2
1 140 . 1 1 A 11 11 VAL CA C 164 62.680 60.817 1.863 2
1 141 . 1 1 A 11 11 VAL CB C 164 32.680 31.540 1.140 2
1 144 . 1 1 A 11 11 VAL N N 164 110.250 112.071 -1.821 2
1 145 . 1 1 A 12 12 PHE H H 165 8.610 8.053 0.557 2
1 146 . 1 1 A 12 12 PHE HA H 165 4.180 4.581 -0.401 2
1 154 . 1 1 A 12 12 PHE C C 165 175.720 176.987 -1.267 2
1 155 . 1 1 A 12 12 PHE CA C 165 60.410 59.519 0.891 2
1 156 . 1 1 A 12 12 PHE CB C 165 40.330 40.393 -0.063 2
1 163 . 1 1 A 12 12 PHE N N 165 121.290 121.072 0.218 2
1 164 . 1 1 A 13 13 LEU H H 166 8.420 7.997 0.423 2
1 165 . 1 1 A 13 13 LEU HA H 166 4.160 3.820 0.340 2
1 175 . 1 1 A 13 13 LEU CA C 166 59.090 60.070 -0.980 2
1 176 . 1 1 A 13 13 LEU CB C 166 38.380 40.087 -1.707 2
1 180 . 1 1 A 13 13 LEU N N 166 115.420 120.035 -4.615 2
1 181 . 1 1 A 14 14 PRO HA H 167 4.130 4.284 -0.154 2
1 188 . 1 1 A 14 14 PRO C C 167 177.150 178.720 -1.570 2
1 189 . 1 1 A 14 14 PRO CA C 167 65.800 65.915 -0.114 2
1 190 . 1 1 A 14 14 PRO CB C 167 30.340 30.809 -0.469 2
1 193 . 1 1 A 15 15 SER H H 168 7.150 8.147 -0.997 2
1 194 . 1 1 A 15 15 SER HA H 168 4.040 4.129 -0.089 2
1 197 . 1 1 A 15 15 SER C C 168 174.160 176.802 -2.642 2
1 198 . 1 1 A 15 15 SER CA C 168 63.330 61.276 2.054 2
1 199 . 1 1 A 15 15 SER CB C 168 62.060 62.743 -0.683 2
1 200 . 1 1 A 15 15 SER N N 168 112.330 113.212 -0.882 2
1 201 . 1 1 A 16 16 LEU H H 169 7.770 7.871 -0.101 2
1 202 . 1 1 A 16 16 LEU HA H 169 4.800 3.658 1.142 2
1 212 . 1 1 A 16 16 LEU C C 169 180.100 179.020 1.080 2
1 213 . 1 1 A 16 16 LEU CA C 169 55.340 57.913 -2.573 2
1 214 . 1 1 A 16 16 LEU CB C 169 41.980 41.525 0.455 2
1 218 . 1 1 A 16 16 LEU N N 169 120.480 121.392 -0.912 2
1 219 . 1 1 A 17 17 LEU H H 170 8.050 7.785 0.265 2
1 220 . 1 1 A 17 17 LEU HA H 170 4.070 4.088 -0.019 2
1 230 . 1 1 A 17 17 LEU C C 170 176.970 179.150 -2.180 2
1 231 . 1 1 A 17 17 LEU CA C 170 57.910 58.054 -0.144 2
1 232 . 1 1 A 17 17 LEU CB C 170 40.800 41.602 -0.802 2
1 236 . 1 1 A 17 17 LEU N N 170 122.150 118.358 3.792 2
1 237 . 1 1 A 18 18 LEU H H 171 7.940 8.107 -0.167 2
1 238 . 1 1 A 18 18 LEU HA H 171 3.990 3.834 0.156 2
1 248 . 1 1 A 18 18 LEU C C 171 177.910 179.207 -1.297 2
1 249 . 1 1 A 18 18 LEU CA C 171 57.760 57.984 -0.224 2
1 250 . 1 1 A 18 18 LEU CB C 171 41.120 41.250 -0.130 2
1 254 . 1 1 A 18 18 LEU N N 171 117.490 118.574 -1.084 2
1 255 . 1 1 A 19 19 SER H H 172 8.970 7.960 1.010 2
1 256 . 1 1 A 19 19 SER HA H 172 3.840 4.024 -0.184 2
1 259 . 1 1 A 19 19 SER C C 172 176.820 176.697 0.123 2
1 260 . 1 1 A 19 19 SER CA C 172 63.190 62.320 0.870 2
1 261 . 1 1 A 19 19 SER CB C 172 59.730 62.816 -3.086 2
1 262 . 1 1 A 19 19 SER N N 172 115.970 114.142 1.828 2
1 263 . 1 1 A 20 20 HIS H H 173 7.600 7.817 -0.217 2
1 264 . 1 1 A 20 20 HIS HA H 173 4.080 4.292 -0.212 2
1 269 . 1 1 A 20 20 HIS C C 173 176.970 177.721 -0.751 2
1 270 . 1 1 A 20 20 HIS CA C 173 62.220 59.036 3.184 2
1 271 . 1 1 A 20 20 HIS CB C 173 27.440 30.027 -2.587 2
1 275 . 1 1 A 20 20 HIS N N 173 119.720 119.542 0.178 2
1 276 . 1 1 A 21 21 LEU H H 174 8.200 8.696 -0.496 2
1 277 . 1 1 A 21 21 LEU HA H 174 4.070 3.800 0.270 2
1 287 . 1 1 A 21 21 LEU C C 174 178.220 179.038 -0.818 2
1 288 . 1 1 A 21 21 LEU CA C 174 57.910 58.177 -0.267 2
1 289 . 1 1 A 21 21 LEU CB C 174 40.960 41.812 -0.852 2
1 293 . 1 1 A 21 21 LEU N N 174 120.780 119.879 0.901 2
1 294 . 1 1 A 22 22 LEU H H 175 8.510 8.422 0.088 2
1 295 . 1 1 A 22 22 LEU HA H 175 3.930 3.886 0.043 2
1 305 . 1 1 A 22 22 LEU C C 175 177.440 178.910 -1.470 2
1 306 . 1 1 A 22 22 LEU CA C 175 57.760 57.913 -0.153 2
1 307 . 1 1 A 22 22 LEU CB C 175 40.800 41.579 -0.779 2
1 311 . 1 1 A 22 22 LEU N N 175 118.600 118.074 0.526 2
1 312 . 1 1 A 23 23 ALA H H 176 7.830 8.512 -0.682 2
1 313 . 1 1 A 23 23 ALA HA H 176 3.970 4.081 -0.111 2
1 317 . 1 1 A 23 23 ALA C C 176 178.220 179.872 -1.652 2
1 318 . 1 1 A 23 23 ALA CA C 176 55.260 55.343 -0.083 2
1 319 . 1 1 A 23 23 ALA CB C 176 18.070 18.394 -0.324 2
1 320 . 1 1 A 23 23 ALA N N 176 121.030 121.567 -0.537 2
1 321 . 1 1 A 24 24 ILE H H 177 8.210 8.104 0.106 2
1 322 . 1 1 A 24 24 ILE HA H 177 3.900 3.747 0.153 2
1 332 . 1 1 A 24 24 ILE C C 177 178.380 177.922 0.459 2
1 333 . 1 1 A 24 24 ILE CA C 177 64.870 65.086 -0.216 2
1 334 . 1 1 A 24 24 ILE CB C 177 37.370 37.743 -0.373 2
1 338 . 1 1 A 24 24 ILE N N 177 118.330 118.389 -0.059 2
1 339 . 1 1 A 25 25 GLY H H 178 8.590 8.135 0.455 2
1 340 . 1 1 A 25 25 GLY HA2 H 178 3.600 3.786 -0.186 2
1 341 . 1 1 A 25 25 GLY HA3 H 178 3.630 3.801 -0.171 2
1 342 . 1 1 A 25 25 GLY C C 178 173.850 176.155 -2.305 2
1 343 . 1 1 A 25 25 GLY CA C 178 47.530 47.362 0.168 2
1 344 . 1 1 A 25 25 GLY N N 178 107.320 108.287 -0.967 2
1 345 . 1 1 A 26 26 LEU H H 179 8.830 8.306 0.525 2
1 346 . 1 1 A 26 26 LEU HA H 179 4.110 4.039 0.071 2
1 356 . 1 1 A 26 26 LEU C C 179 178.220 179.047 -0.827 2
1 357 . 1 1 A 26 26 LEU CA C 179 57.600 58.443 -0.843 2
1 358 . 1 1 A 26 26 LEU CB C 179 41.040 41.979 -0.939 2
1 362 . 1 1 A 26 26 LEU N N 179 122.350 122.695 -0.345 2
1 363 . 1 1 A 27 27 GLY H H 180 8.520 8.114 0.406 2
1 364 . 1 1 A 27 27 GLY HA2 H 180 3.760 3.783 -0.023 2
1 365 . 1 1 A 27 27 GLY HA3 H 180 4.520 3.791 0.729 2
1 366 . 1 1 A 27 27 GLY C C 180 174.160 176.103 -1.944 2
1 367 . 1 1 A 27 27 GLY CA C 180 47.920 47.490 0.430 2
1 368 . 1 1 A 27 27 GLY N N 180 106.260 105.325 0.935 2
1 369 . 1 1 A 28 28 ILE H H 181 8.780 8.080 0.700 2
1 370 . 1 1 A 28 28 ILE HA H 181 3.590 3.851 -0.261 2
1 380 . 1 1 A 28 28 ILE C C 181 177.130 177.492 -0.362 2
1 381 . 1 1 A 28 28 ILE CA C 181 65.340 64.529 0.811 2
1 382 . 1 1 A 28 28 ILE CB C 181 36.900 37.508 -0.608 2
1 386 . 1 1 A 28 28 ILE N N 181 123.970 122.496 1.474 2
1 387 . 1 1 A 29 29 TYR H H 182 8.110 8.495 -0.385 2
1 388 . 1 1 A 29 29 TYR HA H 182 3.880 4.107 -0.227 2
1 395 . 1 1 A 29 29 TYR C C 182 176.970 176.903 0.067 2
1 396 . 1 1 A 29 29 TYR CA C 182 61.900 61.660 0.240 2
1 397 . 1 1 A 29 29 TYR CB C 182 37.910 38.499 -0.589 2
1 403 . 1 1 A 29 29 TYR N N 182 119.570 120.505 -0.935 2
1 404 . 1 1 A 30 30 ILE H H 183 8.490 8.251 0.239 2
1 405 . 1 1 A 30 30 ILE HA H 183 3.400 3.728 -0.328 2
1 415 . 1 1 A 30 30 ILE C C 183 177.760 177.641 0.119 2
1 416 . 1 1 A 30 30 ILE CA C 183 65.020 65.012 0.008 2
1 417 . 1 1 A 30 30 ILE CB C 183 37.600 38.009 -0.409 2
1 421 . 1 1 A 30 30 ILE N N 183 118.000 119.383 -1.383 2
1 422 . 1 1 A 31 31 GLY H H 184 9.360 8.095 1.265 2
1 423 . 1 1 A 31 31 GLY HA2 H 184 3.650 3.765 -0.115 2
1 424 . 1 1 A 31 31 GLY HA3 H 184 3.940 3.771 0.169 2
1 425 . 1 1 A 31 31 GLY C C 184 174.320 175.931 -1.611 2
1 426 . 1 1 A 31 31 GLY CA C 184 47.380 47.062 0.318 2
1 427 . 1 1 A 31 31 GLY N N 184 106.260 107.295 -1.035 2
1 428 . 1 1 A 32 32 ARG H H 185 8.090 8.837 -0.747 2
1 429 . 1 1 A 32 32 ARG HA H 185 4.030 4.088 -0.058 2
1 441 . 1 1 A 32 32 ARG C C 185 177.290 176.848 0.442 2
1 442 . 1 1 A 32 32 ARG CA C 185 57.050 58.301 -1.251 2
1 443 . 1 1 A 32 32 ARG CB C 185 29.630 29.769 -0.139 2
1 447 . 1 1 A 32 32 ARG N N 185 118.050 120.686 -2.636 2
1 451 . 1 1 A 33 33 ARG H H 186 7.760 7.538 0.222 2
1 452 . 1 1 A 33 33 ARG HA H 186 4.260 4.491 -0.231 2
1 464 . 1 1 A 33 33 ARG C C 186 176.190 176.521 -0.331 2
1 465 . 1 1 A 33 33 ARG CA C 186 55.670 55.079 0.591 2
1 466 . 1 1 A 33 33 ARG CB C 186 29.710 29.943 -0.233 2
1 470 . 1 1 A 33 33 ARG N N 186 117.390 118.289 -0.899 2
1 474 . 1 1 A 34 34 LEU H H 187 7.530 7.595 -0.065 2
1 475 . 1 1 A 34 34 LEU HA H 187 4.390 4.185 0.205 2
1 485 . 1 1 A 34 34 LEU C C 187 175.410 177.445 -2.035 2
1 486 . 1 1 A 34 34 LEU CA C 187 54.440 56.553 -2.113 2
1 487 . 1 1 A 34 34 LEU CB C 187 41.590 42.647 -1.057 2
1 491 . 1 1 A 34 34 LEU N N 187 119.360 121.249 -1.889 2
stop_
save_