data_15999_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15999
_Entry.PDB_ID 2K9Q
_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 14 . 1 1 1 A 2 2 GLU H H 2 9.070 8.157 0.913 1
1 15 . 1 1 1 A 2 2 GLU HA H 2 4.520 4.538 -0.018 1
1 20 . 1 1 1 A 2 2 GLU C C 2 176.300 178.306 -2.006 1
1 21 . 1 1 1 A 2 2 GLU CA C 2 55.800 55.464 0.336 1
1 22 . 1 1 1 A 2 2 GLU CB C 2 31.000 31.166 -0.166 1
1 24 . 1 1 1 A 2 2 GLU N N 2 123.100 120.883 2.217 1
1 25 . 1 1 1 A 3 3 LEU H H 3 8.750 8.760 -0.010 1
1 26 . 1 1 1 A 3 3 LEU HA H 3 3.750 4.091 -0.341 1
1 36 . 1 1 1 A 3 3 LEU C C 3 177.400 178.745 -1.345 1
1 37 . 1 1 1 A 3 3 LEU CA C 3 58.300 58.159 0.141 1
1 38 . 1 1 1 A 3 3 LEU CB C 3 41.500 41.240 0.260 1
1 42 . 1 1 1 A 3 3 LEU N N 3 122.600 126.940 -4.340 1
1 43 . 1 1 1 A 4 4 SER H H 4 8.350 8.168 0.182 1
1 44 . 1 1 1 A 4 4 SER HA H 4 3.890 4.316 -0.426 1
1 47 . 1 1 1 A 4 4 SER C C 4 175.100 176.414 -1.314 1
1 48 . 1 1 1 A 4 4 SER CA C 4 61.500 61.284 0.216 1
1 49 . 1 1 1 A 4 4 SER CB C 4 62.000 63.206 -1.206 1
1 50 . 1 1 1 A 4 4 SER N N 4 112.900 116.959 -4.059 1
1 51 . 1 1 1 A 5 5 ASN H H 5 7.180 8.153 -0.973 1
1 52 . 1 1 1 A 5 5 ASN HA H 5 4.470 4.417 0.053 1
1 57 . 1 1 1 A 5 5 ASN C C 5 177.400 177.169 0.231 1
1 58 . 1 1 1 A 5 5 ASN CA C 5 56.000 57.003 -1.003 1
1 59 . 1 1 1 A 5 5 ASN CB C 5 39.400 39.106 0.294 1
1 61 . 1 1 1 A 5 5 ASN N N 5 116.600 119.847 -3.247 1
1 63 . 1 1 1 A 6 6 GLU H H 6 7.950 8.173 -0.223 1
1 64 . 1 1 1 A 6 6 GLU HA H 6 4.070 4.085 -0.015 1
1 69 . 1 1 1 A 6 6 GLU C C 6 178.500 178.914 -0.414 1
1 70 . 1 1 1 A 6 6 GLU CA C 6 58.100 59.180 -1.080 1
1 71 . 1 1 1 A 6 6 GLU CB C 6 29.300 28.813 0.487 1
1 73 . 1 1 1 A 6 6 GLU N N 6 117.600 117.621 -0.021 1
1 74 . 1 1 1 A 7 7 LEU H H 7 8.140 7.814 0.326 1
1 75 . 1 1 1 A 7 7 LEU HA H 7 3.640 4.090 -0.450 1
1 85 . 1 1 1 A 7 7 LEU C C 7 177.700 178.947 -1.247 1
1 86 . 1 1 1 A 7 7 LEU CA C 7 58.300 57.569 0.731 1
1 87 . 1 1 1 A 7 7 LEU CB C 7 40.600 41.830 -1.230 1
1 91 . 1 1 1 A 7 7 LEU N N 7 118.500 122.825 -4.325 1
1 92 . 1 1 1 A 8 8 LYS H H 8 7.090 7.791 -0.701 1
1 93 . 1 1 1 A 8 8 LYS HA H 8 4.080 4.021 0.059 1
1 102 . 1 1 1 A 8 8 LYS C C 8 178.300 178.768 -0.468 1
1 103 . 1 1 1 A 8 8 LYS CA C 8 59.700 59.404 0.296 1
1 104 . 1 1 1 A 8 8 LYS CB C 8 32.300 32.471 -0.171 1
1 108 . 1 1 1 A 8 8 LYS N N 8 118.200 119.850 -1.650 1
1 109 . 1 1 1 A 9 9 VAL H H 9 7.940 7.676 0.264 1
1 110 . 1 1 1 A 9 9 VAL HA H 9 3.440 3.531 -0.091 1
1 118 . 1 1 1 A 9 9 VAL C C 9 179.500 177.972 1.528 1
1 119 . 1 1 1 A 9 9 VAL CA C 9 66.700 66.563 0.137 1
1 120 . 1 1 1 A 9 9 VAL CB C 9 31.600 31.407 0.193 1
1 123 . 1 1 1 A 9 9 VAL N N 9 117.600 120.439 -2.839 1
1 124 . 1 1 1 A 10 10 GLU H H 10 7.830 8.266 -0.436 1
1 125 . 1 1 1 A 10 10 GLU HA H 10 4.130 4.015 0.115 1
1 130 . 1 1 1 A 10 10 GLU C C 10 178.700 178.992 -0.292 1
1 131 . 1 1 1 A 10 10 GLU CA C 10 58.300 59.142 -0.842 1
1 132 . 1 1 1 A 10 10 GLU CB C 10 28.500 29.266 -0.766 1
1 134 . 1 1 1 A 10 10 GLU N N 10 118.300 119.685 -1.385 1
1 135 . 1 1 1 A 11 11 ARG H H 11 8.330 7.446 0.884 1
1 136 . 1 1 1 A 11 11 ARG HA H 11 3.770 4.096 -0.326 1
1 144 . 1 1 1 A 11 11 ARG C C 11 174.600 178.876 -4.276 1
1 145 . 1 1 1 A 11 11 ARG CA C 11 61.300 58.889 2.411 1
1 146 . 1 1 1 A 11 11 ARG CB C 11 28.500 29.944 -1.444 1
1 149 . 1 1 1 A 11 11 ARG N N 11 121.400 119.487 1.913 1
1 151 . 1 1 1 A 12 12 ILE H H 12 8.540 8.459 0.081 1
1 152 . 1 1 1 A 12 12 ILE HA H 12 3.780 3.741 0.039 1
1 162 . 1 1 1 A 12 12 ILE C C 12 181.400 177.712 3.688 1
1 163 . 1 1 1 A 12 12 ILE CA C 12 64.800 65.131 -0.331 1
1 164 . 1 1 1 A 12 12 ILE CB C 12 37.700 37.536 0.164 1
1 168 . 1 1 1 A 12 12 ILE N N 12 118.700 119.866 -1.166 1
1 169 . 1 1 1 A 13 13 ARG H H 13 8.470 8.698 -0.228 1
1 170 . 1 1 1 A 13 13 ARG HA H 13 4.060 3.949 0.111 1
1 178 . 1 1 1 A 13 13 ARG C C 13 178.600 178.322 0.278 1
1 179 . 1 1 1 A 13 13 ARG CA C 13 59.600 59.263 0.337 1
1 180 . 1 1 1 A 13 13 ARG CB C 13 30.000 30.042 -0.042 1
1 183 . 1 1 1 A 13 13 ARG N N 13 124.600 121.513 3.087 1
1 185 . 1 1 1 A 14 14 LEU H H 14 7.430 7.977 -0.547 1
1 186 . 1 1 1 A 14 14 LEU HA H 14 4.240 4.360 -0.120 1
1 196 . 1 1 1 A 14 14 LEU C C 14 176.000 176.171 -0.171 1
1 197 . 1 1 1 A 14 14 LEU CA C 14 55.300 54.611 0.689 1
1 198 . 1 1 1 A 14 14 LEU CB C 14 43.000 41.962 1.038 1
1 202 . 1 1 1 A 14 14 LEU N N 14 118.500 118.428 0.072 1
1 203 . 1 1 1 A 15 15 SER H H 15 8.260 8.047 0.213 1
1 204 . 1 1 1 A 15 15 SER HA H 15 4.030 4.117 -0.087 1
1 207 . 1 1 1 A 15 15 SER C C 15 174.000 173.208 0.792 1
1 208 . 1 1 1 A 15 15 SER CA C 15 58.700 59.023 -0.323 1
1 209 . 1 1 1 A 15 15 SER CB C 15 61.300 61.540 -0.240 1
1 210 . 1 1 1 A 15 15 SER N N 15 112.500 115.127 -2.627 1
1 211 . 1 1 1 A 16 16 LEU H H 16 7.310 7.590 -0.280 1
1 212 . 1 1 1 A 16 16 LEU HA H 16 4.880 4.755 0.125 1
1 222 . 1 1 1 A 16 16 LEU C C 16 177.900 177.147 0.753 1
1 223 . 1 1 1 A 16 16 LEU CA C 16 52.600 53.435 -0.835 1
1 224 . 1 1 1 A 16 16 LEU CB C 16 43.500 43.842 -0.342 1
1 228 . 1 1 1 A 16 16 LEU N N 16 117.800 121.366 -3.566 1
1 229 . 1 1 1 A 17 17 THR H H 17 8.640 8.818 -0.178 1
1 230 . 1 1 1 A 17 17 THR HA H 17 4.250 4.694 -0.444 1
1 235 . 1 1 1 A 17 17 THR C C 17 174.900 175.748 -0.848 1
1 236 . 1 1 1 A 17 17 THR CA C 17 60.500 60.671 -0.171 1
1 237 . 1 1 1 A 17 17 THR CB C 17 70.500 71.245 -0.745 1
1 239 . 1 1 1 A 17 17 THR N N 17 115.200 115.799 -0.599 1
1 240 . 1 1 1 A 18 18 ALA H H 18 8.820 9.040 -0.220 1
1 241 . 1 1 1 A 18 18 ALA HA H 18 3.680 4.004 -0.324 1
1 245 . 1 1 1 A 18 18 ALA C C 18 178.900 179.469 -0.569 1
1 246 . 1 1 1 A 18 18 ALA CA C 18 55.200 55.127 0.073 1
1 247 . 1 1 1 A 18 18 ALA CB C 18 17.800 18.017 -0.217 1
1 248 . 1 1 1 A 18 18 ALA N N 18 125.600 124.750 0.850 1
1 249 . 1 1 1 A 19 19 LYS H H 19 8.280 7.965 0.315 1
1 250 . 1 1 1 A 19 19 LYS HA H 19 3.740 3.950 -0.210 1
1 259 . 1 1 1 A 19 19 LYS C C 19 177.900 178.442 -0.542 1
1 260 . 1 1 1 A 19 19 LYS CA C 19 59.800 59.379 0.421 1
1 261 . 1 1 1 A 19 19 LYS CB C 19 33.300 32.388 0.912 1
1 265 . 1 1 1 A 19 19 LYS N N 19 115.800 119.083 -3.283 1
1 266 . 1 1 1 A 20 20 SER H H 20 7.860 7.908 -0.048 1
1 267 . 1 1 1 A 20 20 SER HA H 20 4.210 4.227 -0.017 1
1 271 . 1 1 1 A 20 20 SER C C 20 177.200 177.548 -0.348 1
1 272 . 1 1 1 A 20 20 SER CA C 20 61.900 61.621 0.279 1
1 273 . 1 1 1 A 20 20 SER CB C 20 63.000 63.028 -0.028 1
1 274 . 1 1 1 A 20 20 SER N N 20 114.600 114.384 0.216 1
1 275 . 1 1 1 A 21 21 VAL H H 21 7.830 8.026 -0.196 1
1 276 . 1 1 1 A 21 21 VAL HA H 21 3.280 3.545 -0.265 1
1 284 . 1 1 1 A 21 21 VAL C C 21 177.500 178.052 -0.552 1
1 285 . 1 1 1 A 21 21 VAL CA C 21 66.800 66.571 0.229 1
1 286 . 1 1 1 A 21 21 VAL CB C 21 31.400 31.494 -0.094 1
1 289 . 1 1 1 A 21 21 VAL N N 21 122.600 121.109 1.491 1
1 290 . 1 1 1 A 22 22 ALA H H 22 8.230 8.451 -0.221 1
1 291 . 1 1 1 A 22 22 ALA HA H 22 3.510 3.950 -0.440 1
1 295 . 1 1 1 A 22 22 ALA C C 22 179.500 179.777 -0.277 1
1 296 . 1 1 1 A 22 22 ALA CA C 22 55.500 55.547 -0.047 1
1 297 . 1 1 1 A 22 22 ALA CB C 22 16.900 18.061 -1.161 1
1 298 . 1 1 1 A 22 22 ALA N N 22 121.200 121.531 -0.331 1
1 299 . 1 1 1 A 23 23 GLU H H 23 7.900 8.001 -0.101 1
1 300 . 1 1 1 A 23 23 GLU HA H 23 3.990 4.053 -0.063 1
1 305 . 1 1 1 A 23 23 GLU C C 23 180.000 179.135 0.865 1
1 306 . 1 1 1 A 23 23 GLU CA C 23 59.300 59.490 -0.190 1
1 307 . 1 1 1 A 23 23 GLU CB C 23 29.300 29.619 -0.319 1
1 309 . 1 1 1 A 23 23 GLU N N 23 115.300 117.745 -2.445 1
1 310 . 1 1 1 A 24 24 GLU H H 24 7.950 8.055 -0.105 1
1 311 . 1 1 1 A 24 24 GLU HA H 24 4.060 4.074 -0.014 1
1 316 . 1 1 1 A 24 24 GLU C C 24 179.100 179.761 -0.661 1
1 317 . 1 1 1 A 24 24 GLU CA C 24 59.700 59.242 0.458 1
1 318 . 1 1 1 A 24 24 GLU CB C 24 29.500 29.628 -0.128 1
1 320 . 1 1 1 A 24 24 GLU N N 24 120.100 120.134 -0.034 1
1 321 . 1 1 1 A 25 25 MET H H 25 8.150 8.562 -0.412 1
1 322 . 1 1 1 A 25 25 MET HA H 25 4.110 4.332 -0.222 1
1 330 . 1 1 1 A 25 25 MET C C 25 176.600 176.643 -0.043 1
1 331 . 1 1 1 A 25 25 MET CA C 25 57.100 56.869 0.231 1
1 332 . 1 1 1 A 25 25 MET CB C 25 34.900 32.704 2.196 1
1 335 . 1 1 1 A 25 25 MET N N 25 115.500 117.562 -2.062 1
1 336 . 1 1 1 A 26 26 GLY H H 26 7.940 8.862 -0.922 1
1 337 . 1 1 1 A 26 26 GLY HA2 H 26 3.860 3.936 -0.076 1
1 338 . 1 1 1 A 26 26 GLY HA3 H 26 3.960 3.938 0.022 1
1 339 . 1 1 1 A 26 26 GLY C C 26 175.100 173.817 1.283 1
1 340 . 1 1 1 A 26 26 GLY CA C 26 46.600 45.878 0.722 1
1 341 . 1 1 1 A 26 26 GLY N N 26 109.000 107.012 1.988 1
1 342 . 1 1 1 A 27 27 ILE H H 27 7.880 7.383 0.497 1
1 343 . 1 1 1 A 27 27 ILE HA H 27 4.790 4.814 -0.024 1
1 353 . 1 1 1 A 27 27 ILE C C 27 174.300 174.917 -0.617 1
1 354 . 1 1 1 A 27 27 ILE CA C 27 59.000 58.579 0.421 1
1 355 . 1 1 1 A 27 27 ILE CB C 27 40.900 41.492 -0.592 1
1 359 . 1 1 1 A 27 27 ILE N N 27 112.700 115.792 -3.092 1
1 360 . 1 1 1 A 28 28 SER H H 28 8.570 9.055 -0.485 1
1 361 . 1 1 1 A 28 28 SER HA H 28 4.540 4.510 0.030 1
1 364 . 1 1 1 A 28 28 SER C C 28 175.600 175.707 -0.107 1
1 365 . 1 1 1 A 28 28 SER CA C 28 56.800 57.792 -0.992 1
1 366 . 1 1 1 A 28 28 SER CB C 28 65.500 64.109 1.391 1
1 367 . 1 1 1 A 28 28 SER N N 28 115.400 119.521 -4.121 1
1 368 . 1 1 1 A 29 29 ARG H H 29 8.980 9.057 -0.077 1
1 369 . 1 1 1 A 29 29 ARG HA H 29 3.660 3.970 -0.310 1
1 377 . 1 1 1 A 29 29 ARG C C 29 178.700 178.246 0.454 1
1 378 . 1 1 1 A 29 29 ARG CA C 29 59.500 60.213 -0.713 1
1 379 . 1 1 1 A 29 29 ARG CB C 29 29.500 29.761 -0.261 1
1 382 . 1 1 1 A 29 29 ARG N N 29 122.000 124.921 -2.921 1
1 384 . 1 1 1 A 30 30 GLN H H 30 8.580 8.174 0.406 1
1 385 . 1 1 1 A 30 30 GLN HA H 30 3.860 4.090 -0.230 1
1 392 . 1 1 1 A 30 30 GLN C C 30 178.100 178.918 -0.818 1
1 393 . 1 1 1 A 30 30 GLN CA C 30 59.200 59.065 0.135 1
1 394 . 1 1 1 A 30 30 GLN CB C 30 28.100 28.444 -0.344 1
1 397 . 1 1 1 A 30 30 GLN N N 30 118.700 119.589 -0.889 1
1 399 . 1 1 1 A 31 31 GLN H H 31 7.990 7.881 0.109 1
1 400 . 1 1 1 A 31 31 GLN HA H 31 3.980 4.040 -0.060 1
1 407 . 1 1 1 A 31 31 GLN C C 31 178.700 178.587 0.113 1
1 408 . 1 1 1 A 31 31 GLN CA C 31 59.100 58.788 0.312 1
1 409 . 1 1 1 A 31 31 GLN CB C 31 28.700 27.804 0.896 1
1 412 . 1 1 1 A 31 31 GLN N N 31 119.600 119.250 0.350 1
1 414 . 1 1 1 A 32 32 LEU H H 32 7.630 7.616 0.014 1
1 415 . 1 1 1 A 32 32 LEU HA H 32 3.740 4.079 -0.339 1
1 425 . 1 1 1 A 32 32 LEU C C 32 178.300 178.569 -0.269 1
1 426 . 1 1 1 A 32 32 LEU CA C 32 57.700 57.875 -0.175 1
1 427 . 1 1 1 A 32 32 LEU CB C 32 41.500 41.313 0.187 1
1 431 . 1 1 1 A 32 32 LEU N N 32 120.700 122.005 -1.305 1
1 432 . 1 1 1 A 33 33 CYS H H 33 8.240 8.286 -0.046 1
1 433 . 1 1 1 A 33 33 CYS HA H 33 3.990 4.104 -0.114 1
1 436 . 1 1 1 A 33 33 CYS C C 33 177.000 176.952 0.048 1
1 437 . 1 1 1 A 33 33 CYS CA C 33 63.100 63.209 -0.109 1
1 438 . 1 1 1 A 33 33 CYS CB C 33 26.100 27.186 -1.086 1
1 439 . 1 1 1 A 33 33 CYS N N 33 117.400 117.362 0.038 1
1 440 . 1 1 1 A 34 34 ASN H H 34 8.210 7.959 0.251 1
1 441 . 1 1 1 A 34 34 ASN HA H 34 4.370 4.448 -0.078 1
1 446 . 1 1 1 A 34 34 ASN C C 34 178.700 177.946 0.754 1
1 447 . 1 1 1 A 34 34 ASN CA C 34 56.000 56.589 -0.589 1
1 448 . 1 1 1 A 34 34 ASN CB C 34 37.800 39.642 -1.842 1
1 450 . 1 1 1 A 34 34 ASN N N 34 117.300 119.883 -2.583 1
1 452 . 1 1 1 A 35 35 ILE H H 35 7.850 7.530 0.320 1
1 453 . 1 1 1 A 35 35 ILE HA H 35 3.850 3.613 0.237 1
1 463 . 1 1 1 A 35 35 ILE C C 35 178.100 177.725 0.375 1
1 464 . 1 1 1 A 35 35 ILE CA C 35 64.800 65.493 -0.693 1
1 465 . 1 1 1 A 35 35 ILE CB C 35 38.000 37.787 0.213 1
1 469 . 1 1 1 A 35 35 ILE N N 35 120.400 119.600 0.800 1
1 470 . 1 1 1 A 36 36 GLU H H 36 7.680 7.857 -0.177 1
1 471 . 1 1 1 A 36 36 GLU HA H 36 4.120 4.072 0.048 1
1 476 . 1 1 1 A 36 36 GLU C C 36 176.300 178.371 -2.071 1
1 477 . 1 1 1 A 36 36 GLU CA C 36 58.600 59.598 -0.998 1
1 478 . 1 1 1 A 36 36 GLU CB C 36 30.000 29.374 0.626 1
1 480 . 1 1 1 A 36 36 GLU N N 36 116.500 120.010 -3.510 1
1 481 . 1 1 1 A 37 37 GLN H H 37 7.630 7.400 0.230 1
1 482 . 1 1 1 A 37 37 GLN HA H 37 4.540 4.391 0.149 1
1 489 . 1 1 1 A 37 37 GLN C C 37 176.000 175.351 0.649 1
1 490 . 1 1 1 A 37 37 GLN CA C 37 54.900 55.331 -0.431 1
1 491 . 1 1 1 A 37 37 GLN CB C 37 29.600 29.496 0.104 1
1 494 . 1 1 1 A 37 37 GLN N N 37 115.000 117.073 -2.073 1
1 496 . 1 1 1 A 38 38 SER H H 38 7.380 7.474 -0.094 1
1 497 . 1 1 1 A 38 38 SER HA H 38 4.410 4.438 -0.028 1
1 500 . 1 1 1 A 38 38 SER C C 38 175.500 174.171 1.329 1
1 501 . 1 1 1 A 38 38 SER CA C 38 59.200 58.204 0.996 1
1 502 . 1 1 1 A 38 38 SER CB C 38 64.100 63.912 0.188 1
1 503 . 1 1 1 A 38 38 SER N N 38 115.200 115.727 -0.527 1
1 504 . 1 1 1 A 39 39 GLU H H 39 9.040 8.436 0.604 1
1 505 . 1 1 1 A 39 39 GLU HA H 39 4.450 4.906 -0.456 1
1 510 . 1 1 1 A 39 39 GLU C C 39 176.300 176.614 -0.314 1
1 511 . 1 1 1 A 39 39 GLU CA C 39 57.100 55.167 1.933 1
1 512 . 1 1 1 A 39 39 GLU CB C 39 30.300 31.653 -1.353 1
1 514 . 1 1 1 A 39 39 GLU N N 39 125.400 119.526 5.874 1
1 515 . 1 1 1 A 40 40 THR H H 40 7.920 8.750 -0.830 1
1 516 . 1 1 1 A 40 40 THR HA H 40 4.590 4.282 0.308 1
1 521 . 1 1 1 A 40 40 THR C C 40 173.500 173.296 0.204 1
1 522 . 1 1 1 A 40 40 THR CA C 40 60.500 62.193 -1.693 1
1 523 . 1 1 1 A 40 40 THR CB C 40 71.100 68.841 2.259 1
1 525 . 1 1 1 A 40 40 THR N N 40 112.800 117.147 -4.347 1
1 526 . 1 1 1 A 41 41 ALA H H 41 8.780 8.283 0.497 1
1 527 . 1 1 1 A 41 41 ALA HA H 41 4.870 4.558 0.312 1
1 531 . 1 1 1 A 41 41 ALA CA C 41 49.700 50.490 -0.790 1
1 532 . 1 1 1 A 41 41 ALA CB C 41 19.300 18.990 0.310 1
1 533 . 1 1 1 A 41 41 ALA N N 41 127.000 124.751 2.249 1
1 534 . 1 1 1 A 42 42 PRO HA H 42 4.660 4.624 0.036 1
1 541 . 1 1 1 A 42 42 PRO C C 42 178.300 177.546 0.754 1
1 542 . 1 1 1 A 42 42 PRO CA C 42 62.500 62.666 -0.166 1
1 543 . 1 1 1 A 42 42 PRO CB C 42 32.600 32.816 -0.216 1
1 546 . 1 1 1 A 43 43 VAL H H 43 8.840 8.680 0.160 1
1 547 . 1 1 1 A 43 43 VAL HA H 43 3.660 3.797 -0.137 1
1 555 . 1 1 1 A 43 43 VAL CA C 43 66.800 65.387 1.413 1
1 556 . 1 1 1 A 43 43 VAL CB C 43 31.100 31.481 -0.381 1
1 559 . 1 1 1 A 43 43 VAL N N 43 123.000 120.817 2.183 1
1 560 . 1 1 1 A 44 44 VAL HA H 44 4.030 3.595 0.435 1
1 568 . 1 1 1 A 44 44 VAL C C 44 176.700 178.634 -1.934 1
1 569 . 1 1 1 A 44 44 VAL CA C 44 65.900 66.999 -1.099 1
1 570 . 1 1 1 A 44 44 VAL CB C 44 30.900 31.572 -0.672 1
1 573 . 1 1 1 A 45 45 VAL H H 45 7.500 8.248 -0.748 1
1 574 . 1 1 1 A 45 45 VAL HA H 45 3.760 3.664 0.096 1
1 582 . 1 1 1 A 45 45 VAL C C 45 177.500 178.155 -0.655 1
1 583 . 1 1 1 A 45 45 VAL CA C 45 66.700 66.654 0.046 1
1 584 . 1 1 1 A 45 45 VAL CB C 45 31.000 31.491 -0.491 1
1 587 . 1 1 1 A 45 45 VAL N N 45 120.100 120.413 -0.313 1
1 588 . 1 1 1 A 46 46 LYS H H 46 7.610 7.590 0.020 1
1 589 . 1 1 1 A 46 46 LYS HA H 46 4.140 4.020 0.120 1
1 598 . 1 1 1 A 46 46 LYS C C 46 179.500 178.784 0.716 1
1 599 . 1 1 1 A 46 46 LYS CA C 46 59.900 59.237 0.663 1
1 600 . 1 1 1 A 46 46 LYS CB C 46 31.500 32.095 -0.595 1
1 604 . 1 1 1 A 46 46 LYS N N 46 120.700 118.588 2.112 1
1 605 . 1 1 1 A 47 47 TYR H H 47 8.550 8.251 0.299 1
1 606 . 1 1 1 A 47 47 TYR HA H 47 5.000 4.202 0.798 1
1 613 . 1 1 1 A 47 47 TYR C C 47 177.300 177.276 0.024 1
1 614 . 1 1 1 A 47 47 TYR CA C 47 57.300 61.408 -4.108 1
1 615 . 1 1 1 A 47 47 TYR CB C 47 37.700 38.700 -1.000 1
1 620 . 1 1 1 A 47 47 TYR N N 47 122.700 120.589 2.111 1
1 621 . 1 1 1 A 48 48 ILE H H 48 8.250 8.166 0.084 1
1 622 . 1 1 1 A 48 48 ILE HA H 48 3.160 3.731 -0.571 1
1 632 . 1 1 1 A 48 48 ILE C C 48 177.100 177.994 -0.894 1
1 633 . 1 1 1 A 48 48 ILE CA C 48 67.000 65.623 1.377 1
1 634 . 1 1 1 A 48 48 ILE CB C 48 37.800 38.505 -0.705 1
1 638 . 1 1 1 A 48 48 ILE N N 48 121.200 120.910 0.290 1
1 639 . 1 1 1 A 49 49 ALA H H 49 8.310 8.505 -0.195 1
1 640 . 1 1 1 A 49 49 ALA HA H 49 3.940 4.096 -0.156 1
1 644 . 1 1 1 A 49 49 ALA C C 49 179.300 179.697 -0.397 1
1 645 . 1 1 1 A 49 49 ALA CA C 49 55.500 54.976 0.524 1
1 646 . 1 1 1 A 49 49 ALA CB C 49 18.200 18.126 0.074 1
1 647 . 1 1 1 A 49 49 ALA N N 49 120.300 121.922 -1.622 1
1 648 . 1 1 1 A 50 50 PHE H H 50 8.630 7.851 0.779 1
1 649 . 1 1 1 A 50 50 PHE HA H 50 4.200 4.236 -0.036 1
1 656 . 1 1 1 A 50 50 PHE C C 50 179.000 176.778 2.222 1
1 657 . 1 1 1 A 50 50 PHE CA C 50 61.300 61.497 -0.197 1
1 658 . 1 1 1 A 50 50 PHE CB C 50 39.200 39.208 -0.008 1
1 663 . 1 1 1 A 50 50 PHE N N 50 121.300 120.548 0.752 1
1 664 . 1 1 1 A 51 51 LEU H H 51 8.920 8.131 0.789 1
1 665 . 1 1 1 A 51 51 LEU HA H 51 3.630 3.856 -0.226 1
1 675 . 1 1 1 A 51 51 LEU C C 51 180.000 179.213 0.787 1
1 676 . 1 1 1 A 51 51 LEU CA C 51 58.100 57.726 0.374 1
1 677 . 1 1 1 A 51 51 LEU CB C 51 39.800 41.414 -1.614 1
1 681 . 1 1 1 A 51 51 LEU N N 51 121.900 118.673 3.227 1
1 682 . 1 1 1 A 52 52 ARG H H 52 8.410 7.865 0.545 1
1 683 . 1 1 1 A 52 52 ARG HA H 52 4.420 3.958 0.462 1
1 691 . 1 1 1 A 52 52 ARG C C 52 179.800 178.847 0.953 1
1 692 . 1 1 1 A 52 52 ARG CA C 52 57.800 59.680 -1.880 1
1 693 . 1 1 1 A 52 52 ARG CB C 52 28.200 29.788 -1.588 1
1 695 . 1 1 1 A 52 52 ARG N N 52 120.500 120.729 -0.229 1
1 697 . 1 1 1 A 53 53 SER H H 53 8.480 7.936 0.544 1
1 698 . 1 1 1 A 53 53 SER HA H 53 4.300 4.204 0.096 1
1 701 . 1 1 1 A 53 53 SER C C 53 174.600 175.245 -0.645 1
1 702 . 1 1 1 A 53 53 SER CA C 53 61.500 60.704 0.796 1
1 703 . 1 1 1 A 53 53 SER CB C 53 62.300 62.672 -0.372 1
1 704 . 1 1 1 A 53 53 SER N N 53 119.500 114.425 5.075 1
1 705 . 1 1 1 A 54 54 LYS H H 54 7.080 7.463 -0.383 1
1 706 . 1 1 1 A 54 54 LYS HA H 54 4.350 4.275 0.075 1
1 715 . 1 1 1 A 54 54 LYS C C 54 176.500 176.865 -0.365 1
1 716 . 1 1 1 A 54 54 LYS CA C 54 53.700 55.835 -2.135 1
1 717 . 1 1 1 A 54 54 LYS CB C 54 31.800 32.395 -0.595 1
1 721 . 1 1 1 A 54 54 LYS N N 54 119.200 117.848 1.352 1
1 722 . 1 1 1 A 55 55 GLY H H 55 8.040 8.522 -0.482 1
1 723 . 1 1 1 A 55 55 GLY HA2 H 55 3.540 3.913 -0.373 1
1 724 . 1 1 1 A 55 55 GLY HA3 H 55 4.300 3.914 0.386 1
1 725 . 1 1 1 A 55 55 GLY C C 55 174.500 174.818 -0.318 1
1 726 . 1 1 1 A 55 55 GLY CA C 55 44.700 45.902 -1.202 1
1 727 . 1 1 1 A 55 55 GLY N N 55 106.600 108.118 -1.518 1
1 728 . 1 1 1 A 56 56 VAL H H 56 7.580 7.472 0.108 1
1 729 . 1 1 1 A 56 56 VAL HA H 56 3.630 3.867 -0.237 1
1 737 . 1 1 1 A 56 56 VAL C C 56 174.700 175.447 -0.747 1
1 738 . 1 1 1 A 56 56 VAL CA C 56 64.000 62.382 1.618 1
1 739 . 1 1 1 A 56 56 VAL CB C 56 31.600 32.067 -0.467 1
1 742 . 1 1 1 A 56 56 VAL N N 56 122.000 122.190 -0.190 1
1 743 . 1 1 1 A 57 57 ASP H H 57 8.440 9.074 -0.634 1
1 744 . 1 1 1 A 57 57 ASP HA H 57 4.500 4.760 -0.260 1
1 747 . 1 1 1 A 57 57 ASP C C 57 176.900 176.488 0.412 1
1 748 . 1 1 1 A 57 57 ASP CA C 57 52.600 53.809 -1.209 1
1 749 . 1 1 1 A 57 57 ASP CB C 57 39.900 39.605 0.295 1
1 750 . 1 1 1 A 57 57 ASP N N 57 124.100 127.871 -3.771 1
1 751 . 1 1 1 A 58 58 LEU H H 58 9.720 8.339 1.381 1
1 752 . 1 1 1 A 58 58 LEU HA H 58 4.020 4.051 -0.031 1
1 762 . 1 1 1 A 58 58 LEU C C 58 179.400 178.249 1.151 1
1 763 . 1 1 1 A 58 58 LEU CA C 58 56.300 58.486 -2.186 1
1 764 . 1 1 1 A 58 58 LEU CB C 58 43.300 41.369 1.931 1
1 768 . 1 1 1 A 58 58 LEU N N 58 127.800 122.739 5.061 1
1 769 . 1 1 1 A 59 59 ASN H H 59 7.740 8.692 -0.952 1
1 770 . 1 1 1 A 59 59 ASN HA H 59 4.340 4.503 -0.163 1
1 775 . 1 1 1 A 59 59 ASN C C 59 176.300 177.620 -1.320 1
1 776 . 1 1 1 A 59 59 ASN CA C 59 56.300 56.097 0.203 1
1 777 . 1 1 1 A 59 59 ASN CB C 59 36.400 37.934 -1.534 1
1 779 . 1 1 1 A 59 59 ASN N N 59 119.500 115.812 3.688 1
1 781 . 1 1 1 A 60 60 ALA H H 60 7.220 7.692 -0.472 1
1 782 . 1 1 1 A 60 60 ALA HA H 60 4.030 4.162 -0.132 1
1 786 . 1 1 1 A 60 60 ALA C C 60 180.100 180.112 -0.012 1
1 787 . 1 1 1 A 60 60 ALA CA C 60 54.300 55.025 -0.725 1
1 788 . 1 1 1 A 60 60 ALA CB C 60 18.200 18.459 -0.259 1
1 789 . 1 1 1 A 60 60 ALA N N 60 121.400 122.480 -1.080 1
1 790 . 1 1 1 A 61 61 LEU H H 61 7.320 7.907 -0.587 1
1 791 . 1 1 1 A 61 61 LEU HA H 61 3.840 4.048 -0.208 1
1 801 . 1 1 1 A 61 61 LEU C C 61 177.200 178.297 -1.097 1
1 802 . 1 1 1 A 61 61 LEU CA C 61 58.500 58.148 0.352 1
1 803 . 1 1 1 A 61 61 LEU CB C 61 42.600 41.690 0.910 1
1 807 . 1 1 1 A 61 61 LEU N N 61 118.600 120.387 -1.787 1
1 808 . 1 1 1 A 62 62 PHE H H 62 8.360 7.934 0.426 1
1 809 . 1 1 1 A 62 62 PHE HA H 62 3.930 4.136 -0.206 1
1 817 . 1 1 1 A 62 62 PHE C C 62 178.200 177.939 0.261 1
1 818 . 1 1 1 A 62 62 PHE CA C 62 62.800 60.740 2.060 1
1 819 . 1 1 1 A 62 62 PHE CB C 62 38.500 38.545 -0.045 1
1 825 . 1 1 1 A 62 62 PHE N N 62 114.400 117.520 -3.120 1
1 826 . 1 1 1 A 63 63 ASP H H 63 8.680 8.146 0.534 1
1 827 . 1 1 1 A 63 63 ASP HA H 63 4.530 4.243 0.287 1
1 830 . 1 1 1 A 63 63 ASP C C 63 178.600 178.936 -0.336 1
1 831 . 1 1 1 A 63 63 ASP CA C 63 57.500 57.075 0.425 1
1 832 . 1 1 1 A 63 63 ASP CB C 63 39.600 40.240 -0.640 1
1 833 . 1 1 1 A 63 63 ASP N N 63 120.400 118.880 1.520 1
1 834 . 1 1 1 A 64 64 ARG H H 64 7.540 7.849 -0.309 1
1 835 . 1 1 1 A 64 64 ARG HA H 64 4.290 4.231 0.059 1
1 843 . 1 1 1 A 64 64 ARG C C 64 177.600 178.733 -1.133 1
1 844 . 1 1 1 A 64 64 ARG CA C 64 58.300 58.559 -0.259 1
1 845 . 1 1 1 A 64 64 ARG CB C 64 30.000 29.901 0.099 1
1 848 . 1 1 1 A 64 64 ARG N N 64 116.800 120.665 -3.865 1
1 850 . 1 1 1 A 65 65 ILE H H 65 7.260 7.409 -0.149 1
1 851 . 1 1 1 A 65 65 ILE HA H 65 4.130 3.743 0.387 1
1 861 . 1 1 1 A 65 65 ILE C C 65 177.000 176.533 0.467 1
1 862 . 1 1 1 A 65 65 ILE CA C 65 62.600 65.415 -2.815 1
1 863 . 1 1 1 A 65 65 ILE CB C 65 38.700 38.207 0.493 1
1 867 . 1 1 1 A 65 65 ILE N N 65 117.000 118.435 -1.435 1
1 868 . 1 1 1 A 66 66 ILE H H 66 7.980 7.207 0.773 1
1 869 . 1 1 1 A 66 66 ILE HA H 66 4.000 4.281 -0.281 1
1 879 . 1 1 1 A 66 66 ILE C C 66 176.400 175.800 0.600 1
1 880 . 1 1 1 A 66 66 ILE CA C 66 63.100 60.613 2.487 1
1 881 . 1 1 1 A 66 66 ILE CB C 66 38.800 39.033 -0.233 1
1 885 . 1 1 1 A 66 66 ILE N N 66 120.700 118.890 1.810 1
1 886 . 1 1 1 A 67 67 VAL H H 67 8.130 8.508 -0.378 1
1 887 . 1 1 1 A 67 67 VAL HA H 67 3.980 4.032 -0.052 1
1 895 . 1 1 1 A 67 67 VAL C C 67 177.300 175.083 2.217 1
1 896 . 1 1 1 A 67 67 VAL CA C 67 63.900 64.159 -0.259 1
1 897 . 1 1 1 A 67 67 VAL CB C 67 32.500 30.682 1.818 1
1 900 . 1 1 1 A 67 67 VAL N N 67 121.600 120.453 1.147 1
1 901 . 1 1 1 A 68 68 ASN H H 68 8.170 8.577 -0.407 1
1 902 . 1 1 1 A 68 68 ASN HA H 68 4.680 4.592 0.088 1
1 907 . 1 1 1 A 68 68 ASN CA C 68 54.200 53.928 0.272 1
1 908 . 1 1 1 A 68 68 ASN CB C 68 39.100 39.556 -0.456 1
1 910 . 1 1 1 A 68 68 ASN N N 68 120.500 122.693 -2.193 1
1 912 . 1 1 1 A 69 69 LYS H H 69 8.230 8.427 -0.197 1
1 913 . 1 1 1 A 69 69 LYS HA H 69 4.260 4.315 -0.055 1
1 922 . 1 1 1 A 69 69 LYS C C 69 176.900 176.315 0.585 1
1 923 . 1 1 1 A 69 69 LYS CA C 69 57.000 55.994 1.006 1
1 924 . 1 1 1 A 69 69 LYS CB C 69 32.800 32.275 0.525 1
1 928 . 1 1 1 A 69 69 LYS N N 69 121.300 121.891 -0.591 1
1 929 . 1 1 1 A 70 70 LEU H H 70 8.150 8.351 -0.201 1
1 930 . 1 1 1 A 70 70 LEU HA H 70 4.300 4.712 -0.412 1
1 940 . 1 1 1 A 70 70 LEU C C 70 178.900 176.484 2.416 1
1 941 . 1 1 1 A 70 70 LEU CA C 70 55.400 53.591 1.809 1
1 942 . 1 1 1 A 70 70 LEU CB C 70 42.100 42.923 -0.823 1
1 946 . 1 1 1 A 70 70 LEU N N 70 121.900 123.886 -1.986 1
1 947 . 1 1 1 A 71 71 GLU H H 71 8.210 8.307 -0.097 1
1 948 . 1 1 1 A 71 71 GLU HA H 71 4.180 4.498 -0.318 1
1 953 . 1 1 1 A 71 71 GLU C C 71 176.300 177.146 -0.846 1
1 954 . 1 1 1 A 71 71 GLU CA C 71 56.600 56.938 -0.338 1
1 955 . 1 1 1 A 71 71 GLU CB C 71 30.200 30.675 -0.475 1
1 957 . 1 1 1 A 71 71 GLU N N 71 120.900 120.773 0.127 1
1 958 . 1 1 1 A 72 72 HIS H H 72 8.380 7.712 0.668 1
1 959 . 1 1 1 A 72 72 HIS HA H 72 4.600 4.229 0.371 1
1 962 . 1 1 1 A 72 72 HIS C C 72 174.600 173.378 1.222 1
1 963 . 1 1 1 A 72 72 HIS CA C 72 55.600 56.836 -1.236 1
1 964 . 1 1 1 A 72 72 HIS CB C 72 29.600 26.983 2.617 1
1 965 . 1 1 1 A 72 72 HIS N N 72 119.300 115.277 4.023 1
1 966 . 1 1 1 A 73 73 HIS H H 73 8.410 7.897 0.513 1
1 967 . 1 1 1 A 73 73 HIS HA H 73 4.610 4.611 -0.001 1
1 970 . 1 1 1 A 73 73 HIS C C 73 173.700 174.838 -1.138 1
1 971 . 1 1 1 A 73 73 HIS CA C 73 55.700 54.925 0.775 1
1 972 . 1 1 1 A 73 73 HIS CB C 73 29.600 30.441 -0.841 1
1 973 . 1 1 1 A 73 73 HIS N N 73 119.410 118.672 0.738 1
1 974 . 1 1 1 A 74 74 HIS H H 74 8.310 8.270 0.040 1
1 975 . 1 1 1 A 74 74 HIS HA H 74 4.630 4.933 -0.303 1
1 978 . 1 1 1 A 74 74 HIS CA C 74 57.100 55.149 1.951 1
1 979 . 1 1 1 A 74 74 HIS CB C 74 29.800 31.843 -2.043 1
1 14 . 2 1 1 A 2 2 GLU H H 2 9.070 8.532 0.538 1
1 15 . 2 1 1 A 2 2 GLU HA H 2 4.520 4.596 -0.076 1
1 20 . 2 1 1 A 2 2 GLU C C 2 176.300 176.286 0.014 1
1 21 . 2 1 1 A 2 2 GLU CA C 2 55.800 55.823 -0.023 1
1 22 . 2 1 1 A 2 2 GLU CB C 2 31.000 29.560 1.440 1
1 24 . 2 1 1 A 2 2 GLU N N 2 123.100 122.307 0.793 1
1 25 . 2 1 1 A 3 3 LEU H H 3 8.750 8.358 0.392 1
1 26 . 2 1 1 A 3 3 LEU HA H 3 3.750 4.243 -0.493 1
1 36 . 2 1 1 A 3 3 LEU C C 3 177.400 178.604 -1.204 1
1 37 . 2 1 1 A 3 3 LEU CA C 3 58.300 57.768 0.532 1
1 38 . 2 1 1 A 3 3 LEU CB C 3 41.500 41.949 -0.449 1
1 42 . 2 1 1 A 3 3 LEU N N 3 122.600 124.436 -1.836 1
1 43 . 2 1 1 A 4 4 SER H H 4 8.350 8.164 0.186 1
1 44 . 2 1 1 A 4 4 SER HA H 4 3.890 4.266 -0.376 1
1 47 . 2 1 1 A 4 4 SER C C 4 175.100 176.437 -1.337 1
1 48 . 2 1 1 A 4 4 SER CA C 4 61.500 61.178 0.322 1
1 49 . 2 1 1 A 4 4 SER CB C 4 62.000 63.144 -1.144 1
1 50 . 2 1 1 A 4 4 SER N N 4 112.900 116.755 -3.855 1
1 51 . 2 1 1 A 5 5 ASN H H 5 7.180 8.374 -1.194 1
1 52 . 2 1 1 A 5 5 ASN HA H 5 4.470 4.391 0.079 1
1 57 . 2 1 1 A 5 5 ASN C C 5 177.400 177.304 0.096 1
1 58 . 2 1 1 A 5 5 ASN CA C 5 56.000 57.045 -1.045 1
1 59 . 2 1 1 A 5 5 ASN CB C 5 39.400 39.116 0.284 1
1 61 . 2 1 1 A 5 5 ASN N N 5 116.600 120.007 -3.407 1
1 63 . 2 1 1 A 6 6 GLU H H 6 7.950 8.006 -0.056 1
1 64 . 2 1 1 A 6 6 GLU HA H 6 4.070 4.095 -0.025 1
1 69 . 2 1 1 A 6 6 GLU C C 6 178.500 179.525 -1.025 1
1 70 . 2 1 1 A 6 6 GLU CA C 6 58.100 59.157 -1.057 1
1 71 . 2 1 1 A 6 6 GLU CB C 6 29.300 29.450 -0.150 1
1 73 . 2 1 1 A 6 6 GLU N N 6 117.600 117.715 -0.115 1
1 74 . 2 1 1 A 7 7 LEU H H 7 8.140 8.090 0.050 1
1 75 . 2 1 1 A 7 7 LEU HA H 7 3.640 4.248 -0.608 1
1 85 . 2 1 1 A 7 7 LEU C C 7 177.700 179.203 -1.503 1
1 86 . 2 1 1 A 7 7 LEU CA C 7 58.300 58.007 0.293 1
1 87 . 2 1 1 A 7 7 LEU CB C 7 40.600 41.156 -0.556 1
1 91 . 2 1 1 A 7 7 LEU N N 7 118.500 121.719 -3.219 1
1 92 . 2 1 1 A 8 8 LYS H H 8 7.090 8.681 -1.591 1
1 93 . 2 1 1 A 8 8 LYS HA H 8 4.080 4.055 0.025 1
1 102 . 2 1 1 A 8 8 LYS C C 8 178.300 178.887 -0.587 1
1 103 . 2 1 1 A 8 8 LYS CA C 8 59.700 59.097 0.603 1
1 104 . 2 1 1 A 8 8 LYS CB C 8 32.300 32.131 0.169 1
1 108 . 2 1 1 A 8 8 LYS N N 8 118.200 120.340 -2.140 1
1 109 . 2 1 1 A 9 9 VAL H H 9 7.940 8.154 -0.214 1
1 110 . 2 1 1 A 9 9 VAL HA H 9 3.440 3.532 -0.092 1
1 118 . 2 1 1 A 9 9 VAL C C 9 179.500 177.675 1.825 1
1 119 . 2 1 1 A 9 9 VAL CA C 9 66.700 66.307 0.393 1
1 120 . 2 1 1 A 9 9 VAL CB C 9 31.600 31.364 0.236 1
1 123 . 2 1 1 A 9 9 VAL N N 9 117.600 119.597 -1.997 1
1 124 . 2 1 1 A 10 10 GLU H H 10 7.830 8.144 -0.314 1
1 125 . 2 1 1 A 10 10 GLU HA H 10 4.130 3.963 0.167 1
1 130 . 2 1 1 A 10 10 GLU C C 10 178.700 179.335 -0.635 1
1 131 . 2 1 1 A 10 10 GLU CA C 10 58.300 59.557 -1.257 1
1 132 . 2 1 1 A 10 10 GLU CB C 10 28.500 29.100 -0.600 1
1 134 . 2 1 1 A 10 10 GLU N N 10 118.300 118.366 -0.066 1
1 135 . 2 1 1 A 11 11 ARG H H 11 8.330 7.541 0.789 1
1 136 . 2 1 1 A 11 11 ARG HA H 11 3.770 4.094 -0.324 1
1 144 . 2 1 1 A 11 11 ARG C C 11 174.600 178.390 -3.790 1
1 145 . 2 1 1 A 11 11 ARG CA C 11 61.300 59.112 2.188 1
1 146 . 2 1 1 A 11 11 ARG CB C 11 28.500 29.845 -1.345 1
1 149 . 2 1 1 A 11 11 ARG N N 11 121.400 119.706 1.694 1
1 151 . 2 1 1 A 12 12 ILE H H 12 8.540 8.018 0.522 1
1 152 . 2 1 1 A 12 12 ILE HA H 12 3.780 3.633 0.147 1
1 162 . 2 1 1 A 12 12 ILE C C 12 181.400 177.966 3.434 1
1 163 . 2 1 1 A 12 12 ILE CA C 12 64.800 65.242 -0.442 1
1 164 . 2 1 1 A 12 12 ILE CB C 12 37.700 37.820 -0.120 1
1 168 . 2 1 1 A 12 12 ILE N N 12 118.700 120.619 -1.919 1
1 169 . 2 1 1 A 13 13 ARG H H 13 8.470 7.874 0.596 1
1 170 . 2 1 1 A 13 13 ARG HA H 13 4.060 4.074 -0.014 1
1 178 . 2 1 1 A 13 13 ARG C C 13 178.600 178.128 0.472 1
1 179 . 2 1 1 A 13 13 ARG CA C 13 59.600 59.424 0.176 1
1 180 . 2 1 1 A 13 13 ARG CB C 13 30.000 29.987 0.013 1
1 183 . 2 1 1 A 13 13 ARG N N 13 124.600 119.554 5.046 1
1 185 . 2 1 1 A 14 14 LEU H H 14 7.430 8.260 -0.830 1
1 186 . 2 1 1 A 14 14 LEU HA H 14 4.240 4.289 -0.049 1
1 196 . 2 1 1 A 14 14 LEU C C 14 176.000 176.070 -0.070 1
1 197 . 2 1 1 A 14 14 LEU CA C 14 55.300 54.801 0.499 1
1 198 . 2 1 1 A 14 14 LEU CB C 14 43.000 41.901 1.099 1
1 202 . 2 1 1 A 14 14 LEU N N 14 118.500 118.177 0.323 1
1 203 . 2 1 1 A 15 15 SER H H 15 8.260 7.838 0.422 1
1 204 . 2 1 1 A 15 15 SER HA H 15 4.030 4.121 -0.091 1
1 207 . 2 1 1 A 15 15 SER C C 15 174.000 173.168 0.832 1
1 208 . 2 1 1 A 15 15 SER CA C 15 58.700 59.069 -0.369 1
1 209 . 2 1 1 A 15 15 SER CB C 15 61.300 61.594 -0.294 1
1 210 . 2 1 1 A 15 15 SER N N 15 112.500 115.093 -2.593 1
1 211 . 2 1 1 A 16 16 LEU H H 16 7.310 7.752 -0.442 1
1 212 . 2 1 1 A 16 16 LEU HA H 16 4.880 4.837 0.043 1
1 222 . 2 1 1 A 16 16 LEU C C 16 177.900 176.497 1.403 1
1 223 . 2 1 1 A 16 16 LEU CA C 16 52.600 53.540 -0.940 1
1 224 . 2 1 1 A 16 16 LEU CB C 16 43.500 44.153 -0.653 1
1 228 . 2 1 1 A 16 16 LEU N N 16 117.800 120.658 -2.858 1
1 229 . 2 1 1 A 17 17 THR H H 17 8.640 8.495 0.145 1
1 230 . 2 1 1 A 17 17 THR HA H 17 4.250 4.982 -0.732 1
1 235 . 2 1 1 A 17 17 THR C C 17 174.900 175.696 -0.796 1
1 236 . 2 1 1 A 17 17 THR CA C 17 60.500 59.325 1.175 1
1 237 . 2 1 1 A 17 17 THR CB C 17 70.500 71.799 -1.299 1
1 239 . 2 1 1 A 17 17 THR N N 17 115.200 112.708 2.492 1
1 240 . 2 1 1 A 18 18 ALA H H 18 8.820 9.070 -0.250 1
1 241 . 2 1 1 A 18 18 ALA HA H 18 3.680 4.002 -0.322 1
1 245 . 2 1 1 A 18 18 ALA C C 18 178.900 179.404 -0.504 1
1 246 . 2 1 1 A 18 18 ALA CA C 18 55.200 55.251 -0.051 1
1 247 . 2 1 1 A 18 18 ALA CB C 18 17.800 18.109 -0.309 1
1 248 . 2 1 1 A 18 18 ALA N N 18 125.600 125.770 -0.170 1
1 249 . 2 1 1 A 19 19 LYS H H 19 8.280 7.951 0.329 1
1 250 . 2 1 1 A 19 19 LYS HA H 19 3.740 3.958 -0.218 1
1 259 . 2 1 1 A 19 19 LYS C C 19 177.900 178.448 -0.548 1
1 260 . 2 1 1 A 19 19 LYS CA C 19 59.800 59.326 0.474 1
1 261 . 2 1 1 A 19 19 LYS CB C 19 33.300 32.289 1.011 1
1 265 . 2 1 1 A 19 19 LYS N N 19 115.800 119.068 -3.268 1
1 266 . 2 1 1 A 20 20 SER H H 20 7.860 7.582 0.278 1
1 267 . 2 1 1 A 20 20 SER HA H 20 4.210 4.228 -0.018 1
1 271 . 2 1 1 A 20 20 SER C C 20 177.200 177.488 -0.288 1
1 272 . 2 1 1 A 20 20 SER CA C 20 61.900 61.632 0.268 1
1 273 . 2 1 1 A 20 20 SER CB C 20 63.000 63.229 -0.229 1
1 274 . 2 1 1 A 20 20 SER N N 20 114.600 114.425 0.175 1
1 275 . 2 1 1 A 21 21 VAL H H 21 7.830 8.100 -0.270 1
1 276 . 2 1 1 A 21 21 VAL HA H 21 3.280 3.552 -0.272 1
1 284 . 2 1 1 A 21 21 VAL C C 21 177.500 178.018 -0.518 1
1 285 . 2 1 1 A 21 21 VAL CA C 21 66.800 66.655 0.145 1
1 286 . 2 1 1 A 21 21 VAL CB C 21 31.400 31.540 -0.140 1
1 289 . 2 1 1 A 21 21 VAL N N 21 122.600 120.937 1.663 1
1 290 . 2 1 1 A 22 22 ALA H H 22 8.230 8.475 -0.245 1
1 291 . 2 1 1 A 22 22 ALA HA H 22 3.510 3.976 -0.466 1
1 295 . 2 1 1 A 22 22 ALA C C 22 179.500 179.305 0.195 1
1 296 . 2 1 1 A 22 22 ALA CA C 22 55.500 55.748 -0.248 1
1 297 . 2 1 1 A 22 22 ALA CB C 22 16.900 18.201 -1.301 1
1 298 . 2 1 1 A 22 22 ALA N N 22 121.200 122.120 -0.920 1
1 299 . 2 1 1 A 23 23 GLU H H 23 7.900 8.602 -0.702 1
1 300 . 2 1 1 A 23 23 GLU HA H 23 3.990 4.091 -0.101 1
1 305 . 2 1 1 A 23 23 GLU C C 23 180.000 178.250 1.750 1
1 306 . 2 1 1 A 23 23 GLU CA C 23 59.300 59.108 0.192 1
1 307 . 2 1 1 A 23 23 GLU CB C 23 29.300 29.327 -0.027 1
1 309 . 2 1 1 A 23 23 GLU N N 23 115.300 118.346 -3.046 1
1 310 . 2 1 1 A 24 24 GLU H H 24 7.950 8.138 -0.188 1
1 311 . 2 1 1 A 24 24 GLU HA H 24 4.060 4.080 -0.020 1
1 316 . 2 1 1 A 24 24 GLU C C 24 179.100 178.884 0.216 1
1 317 . 2 1 1 A 24 24 GLU CA C 24 59.700 59.088 0.612 1
1 318 . 2 1 1 A 24 24 GLU CB C 24 29.500 29.584 -0.084 1
1 320 . 2 1 1 A 24 24 GLU N N 24 120.100 119.804 0.296 1
1 321 . 2 1 1 A 25 25 MET H H 25 8.150 8.508 -0.358 1
1 322 . 2 1 1 A 25 25 MET HA H 25 4.110 4.339 -0.229 1
1 330 . 2 1 1 A 25 25 MET C C 25 176.600 176.640 -0.040 1
1 331 . 2 1 1 A 25 25 MET CA C 25 57.100 56.734 0.366 1
1 332 . 2 1 1 A 25 25 MET CB C 25 34.900 32.735 2.165 1
1 335 . 2 1 1 A 25 25 MET N N 25 115.500 116.852 -1.352 1
1 336 . 2 1 1 A 26 26 GLY H H 26 7.940 8.847 -0.907 1
1 337 . 2 1 1 A 26 26 GLY HA2 H 26 3.860 4.000 -0.140 1
1 338 . 2 1 1 A 26 26 GLY HA3 H 26 3.960 4.026 -0.066 1
1 339 . 2 1 1 A 26 26 GLY C C 26 175.100 173.857 1.243 1
1 340 . 2 1 1 A 26 26 GLY CA C 26 46.600 45.847 0.753 1
1 341 . 2 1 1 A 26 26 GLY N N 26 109.000 106.796 2.204 1
1 342 . 2 1 1 A 27 27 ILE H H 27 7.880 7.466 0.414 1
1 343 . 2 1 1 A 27 27 ILE HA H 27 4.790 4.809 -0.019 1
1 353 . 2 1 1 A 27 27 ILE C C 27 174.300 174.841 -0.541 1
1 354 . 2 1 1 A 27 27 ILE CA C 27 59.000 58.519 0.481 1
1 355 . 2 1 1 A 27 27 ILE CB C 27 40.900 41.545 -0.645 1
1 359 . 2 1 1 A 27 27 ILE N N 27 112.700 115.733 -3.033 1
1 360 . 2 1 1 A 28 28 SER H H 28 8.570 8.584 -0.014 1
1 361 . 2 1 1 A 28 28 SER HA H 28 4.540 4.615 -0.075 1
1 364 . 2 1 1 A 28 28 SER C C 28 175.600 175.630 -0.030 1
1 365 . 2 1 1 A 28 28 SER CA C 28 56.800 58.093 -1.293 1
1 366 . 2 1 1 A 28 28 SER CB C 28 65.500 63.668 1.832 1
1 367 . 2 1 1 A 28 28 SER N N 28 115.400 118.342 -2.942 1
1 368 . 2 1 1 A 29 29 ARG H H 29 8.980 9.034 -0.054 1
1 369 . 2 1 1 A 29 29 ARG HA H 29 3.660 3.953 -0.293 1
1 377 . 2 1 1 A 29 29 ARG C C 29 178.700 178.733 -0.033 1
1 378 . 2 1 1 A 29 29 ARG CA C 29 59.500 60.211 -0.711 1
1 379 . 2 1 1 A 29 29 ARG CB C 29 29.500 29.810 -0.310 1
1 382 . 2 1 1 A 29 29 ARG N N 29 122.000 126.983 -4.983 1
1 384 . 2 1 1 A 30 30 GLN H H 30 8.580 7.725 0.855 1
1 385 . 2 1 1 A 30 30 GLN HA H 30 3.860 3.993 -0.133 1
1 392 . 2 1 1 A 30 30 GLN C C 30 178.100 178.492 -0.392 1
1 393 . 2 1 1 A 30 30 GLN CA C 30 59.200 59.241 -0.041 1
1 394 . 2 1 1 A 30 30 GLN CB C 30 28.100 28.178 -0.078 1
1 397 . 2 1 1 A 30 30 GLN N N 30 118.700 119.286 -0.586 1
1 399 . 2 1 1 A 31 31 GLN H H 31 7.990 7.814 0.176 1
1 400 . 2 1 1 A 31 31 GLN HA H 31 3.980 4.025 -0.045 1
1 407 . 2 1 1 A 31 31 GLN C C 31 178.700 178.223 0.477 1
1 408 . 2 1 1 A 31 31 GLN CA C 31 59.100 58.515 0.585 1
1 409 . 2 1 1 A 31 31 GLN CB C 31 28.700 28.041 0.659 1
1 412 . 2 1 1 A 31 31 GLN N N 31 119.600 119.366 0.234 1
1 414 . 2 1 1 A 32 32 LEU H H 32 7.630 7.655 -0.025 1
1 415 . 2 1 1 A 32 32 LEU HA H 32 3.740 4.094 -0.354 1
1 425 . 2 1 1 A 32 32 LEU C C 32 178.300 178.632 -0.332 1
1 426 . 2 1 1 A 32 32 LEU CA C 32 57.700 57.839 -0.139 1
1 427 . 2 1 1 A 32 32 LEU CB C 32 41.500 41.395 0.105 1
1 431 . 2 1 1 A 32 32 LEU N N 32 120.700 120.935 -0.235 1
1 432 . 2 1 1 A 33 33 CYS H H 33 8.240 8.454 -0.214 1
1 433 . 2 1 1 A 33 33 CYS HA H 33 3.990 4.065 -0.075 1
1 436 . 2 1 1 A 33 33 CYS C C 33 177.000 177.036 -0.036 1
1 437 . 2 1 1 A 33 33 CYS CA C 33 63.100 63.310 -0.210 1
1 438 . 2 1 1 A 33 33 CYS CB C 33 26.100 26.946 -0.846 1
1 439 . 2 1 1 A 33 33 CYS N N 33 117.400 117.276 0.124 1
1 440 . 2 1 1 A 34 34 ASN H H 34 8.210 7.836 0.374 1
1 441 . 2 1 1 A 34 34 ASN HA H 34 4.370 4.473 -0.103 1
1 446 . 2 1 1 A 34 34 ASN C C 34 178.700 178.272 0.428 1
1 447 . 2 1 1 A 34 34 ASN CA C 34 56.000 56.544 -0.544 1
1 448 . 2 1 1 A 34 34 ASN CB C 34 37.800 38.054 -0.254 1
1 450 . 2 1 1 A 34 34 ASN N N 34 117.300 118.459 -1.159 1
1 452 . 2 1 1 A 35 35 ILE H H 35 7.850 7.572 0.278 1
1 453 . 2 1 1 A 35 35 ILE HA H 35 3.850 3.606 0.244 1
1 463 . 2 1 1 A 35 35 ILE C C 35 178.100 177.831 0.269 1
1 464 . 2 1 1 A 35 35 ILE CA C 35 64.800 65.518 -0.718 1
1 465 . 2 1 1 A 35 35 ILE CB C 35 38.000 37.900 0.100 1
1 469 . 2 1 1 A 35 35 ILE N N 35 120.400 120.635 -0.235 1
1 470 . 2 1 1 A 36 36 GLU H H 36 7.680 7.701 -0.021 1
1 471 . 2 1 1 A 36 36 GLU HA H 36 4.120 4.086 0.034 1
1 476 . 2 1 1 A 36 36 GLU C C 36 176.300 178.100 -1.800 1
1 477 . 2 1 1 A 36 36 GLU CA C 36 58.600 59.632 -1.032 1
1 478 . 2 1 1 A 36 36 GLU CB C 36 30.000 29.568 0.432 1
1 480 . 2 1 1 A 36 36 GLU N N 36 116.500 120.294 -3.794 1
1 481 . 2 1 1 A 37 37 GLN H H 37 7.630 7.505 0.125 1
1 482 . 2 1 1 A 37 37 GLN HA H 37 4.540 4.766 -0.226 1
1 489 . 2 1 1 A 37 37 GLN C C 37 176.000 176.660 -0.660 1
1 490 . 2 1 1 A 37 37 GLN CA C 37 54.900 55.197 -0.297 1
1 491 . 2 1 1 A 37 37 GLN CB C 37 29.600 29.250 0.350 1
1 494 . 2 1 1 A 37 37 GLN N N 37 115.000 116.598 -1.598 1
1 496 . 2 1 1 A 38 38 SER H H 38 7.380 7.532 -0.152 1
1 497 . 2 1 1 A 38 38 SER HA H 38 4.410 4.301 0.109 1
1 500 . 2 1 1 A 38 38 SER C C 38 175.500 174.994 0.506 1
1 501 . 2 1 1 A 38 38 SER CA C 38 59.200 59.644 -0.444 1
1 502 . 2 1 1 A 38 38 SER CB C 38 64.100 64.372 -0.272 1
1 503 . 2 1 1 A 38 38 SER N N 38 115.200 114.819 0.381 1
1 504 . 2 1 1 A 39 39 GLU H H 39 9.040 8.146 0.894 1
1 505 . 2 1 1 A 39 39 GLU HA H 39 4.450 4.210 0.240 1
1 510 . 2 1 1 A 39 39 GLU C C 39 176.300 175.768 0.532 1
1 511 . 2 1 1 A 39 39 GLU CA C 39 57.100 59.534 -2.434 1
1 512 . 2 1 1 A 39 39 GLU CB C 39 30.300 29.130 1.170 1
1 514 . 2 1 1 A 39 39 GLU N N 39 125.400 120.628 4.772 1
1 515 . 2 1 1 A 40 40 THR H H 40 7.920 8.047 -0.127 1
1 516 . 2 1 1 A 40 40 THR HA H 40 4.590 4.677 -0.087 1
1 521 . 2 1 1 A 40 40 THR C C 40 173.500 173.520 -0.020 1
1 522 . 2 1 1 A 40 40 THR CA C 40 60.500 60.254 0.246 1
1 523 . 2 1 1 A 40 40 THR CB C 40 71.100 70.402 0.698 1
1 525 . 2 1 1 A 40 40 THR N N 40 112.800 115.402 -2.602 1
1 526 . 2 1 1 A 41 41 ALA H H 41 8.780 8.590 0.190 1
1 527 . 2 1 1 A 41 41 ALA HA H 41 4.870 4.771 0.099 1
1 531 . 2 1 1 A 41 41 ALA CA C 41 49.700 49.294 0.406 1
1 532 . 2 1 1 A 41 41 ALA CB C 41 19.300 20.123 -0.823 1
1 533 . 2 1 1 A 41 41 ALA N N 41 127.000 128.267 -1.267 1
1 534 . 2 1 1 A 42 42 PRO HA H 42 4.660 4.500 0.160 1
1 541 . 2 1 1 A 42 42 PRO C C 42 178.300 177.501 0.799 1
1 542 . 2 1 1 A 42 42 PRO CA C 42 62.500 62.835 -0.335 1
1 543 . 2 1 1 A 42 42 PRO CB C 42 32.600 32.534 0.066 1
1 546 . 2 1 1 A 43 43 VAL H H 43 8.840 8.566 0.274 1
1 547 . 2 1 1 A 43 43 VAL HA H 43 3.660 3.762 -0.102 1
1 555 . 2 1 1 A 43 43 VAL CA C 43 66.800 65.344 1.456 1
1 556 . 2 1 1 A 43 43 VAL CB C 43 31.100 31.519 -0.419 1
1 559 . 2 1 1 A 43 43 VAL N N 43 123.000 123.611 -0.611 1
1 560 . 2 1 1 A 44 44 VAL HA H 44 4.030 3.816 0.214 1
1 568 . 2 1 1 A 44 44 VAL C C 44 176.700 177.512 -0.812 1
1 569 . 2 1 1 A 44 44 VAL CA C 44 65.900 65.235 0.665 1
1 570 . 2 1 1 A 44 44 VAL CB C 44 30.900 31.224 -0.324 1
1 573 . 2 1 1 A 45 45 VAL H H 45 7.500 7.823 -0.323 1
1 574 . 2 1 1 A 45 45 VAL HA H 45 3.760 3.630 0.130 1
1 582 . 2 1 1 A 45 45 VAL C C 45 177.500 177.698 -0.198 1
1 583 . 2 1 1 A 45 45 VAL CA C 45 66.700 66.799 -0.099 1
1 584 . 2 1 1 A 45 45 VAL CB C 45 31.000 31.411 -0.411 1
1 587 . 2 1 1 A 45 45 VAL N N 45 120.100 121.199 -1.099 1
1 588 . 2 1 1 A 46 46 LYS H H 46 7.610 7.472 0.138 1
1 589 . 2 1 1 A 46 46 LYS HA H 46 4.140 4.109 0.031 1
1 598 . 2 1 1 A 46 46 LYS C C 46 179.500 178.385 1.115 1
1 599 . 2 1 1 A 46 46 LYS CA C 46 59.900 58.841 1.059 1
1 600 . 2 1 1 A 46 46 LYS CB C 46 31.500 32.175 -0.675 1
1 604 . 2 1 1 A 46 46 LYS N N 46 120.700 118.594 2.106 1
1 605 . 2 1 1 A 47 47 TYR H H 47 8.550 7.991 0.559 1
1 606 . 2 1 1 A 47 47 TYR HA H 47 5.000 4.193 0.807 1
1 613 . 2 1 1 A 47 47 TYR C C 47 177.300 177.158 0.142 1
1 614 . 2 1 1 A 47 47 TYR CA C 47 57.300 61.470 -4.170 1
1 615 . 2 1 1 A 47 47 TYR CB C 47 37.700 38.661 -0.961 1
1 620 . 2 1 1 A 47 47 TYR N N 47 122.700 121.321 1.379 1
1 621 . 2 1 1 A 48 48 ILE H H 48 8.250 8.045 0.205 1
1 622 . 2 1 1 A 48 48 ILE HA H 48 3.160 3.670 -0.510 1
1 632 . 2 1 1 A 48 48 ILE C C 48 177.100 177.998 -0.898 1
1 633 . 2 1 1 A 48 48 ILE CA C 48 67.000 65.523 1.477 1
1 634 . 2 1 1 A 48 48 ILE CB C 48 37.800 38.508 -0.708 1
1 638 . 2 1 1 A 48 48 ILE N N 48 121.200 120.681 0.519 1
1 639 . 2 1 1 A 49 49 ALA H H 49 8.310 8.226 0.084 1
1 640 . 2 1 1 A 49 49 ALA HA H 49 3.940 4.024 -0.084 1
1 644 . 2 1 1 A 49 49 ALA C C 49 179.300 178.947 0.353 1
1 645 . 2 1 1 A 49 49 ALA CA C 49 55.500 55.010 0.490 1
1 646 . 2 1 1 A 49 49 ALA CB C 49 18.200 18.366 -0.166 1
1 647 . 2 1 1 A 49 49 ALA N N 49 120.300 120.120 0.180 1
1 648 . 2 1 1 A 50 50 PHE H H 50 8.630 8.312 0.318 1
1 649 . 2 1 1 A 50 50 PHE HA H 50 4.200 4.168 0.032 1
1 656 . 2 1 1 A 50 50 PHE C C 50 179.000 176.722 2.278 1
1 657 . 2 1 1 A 50 50 PHE CA C 50 61.300 61.342 -0.042 1
1 658 . 2 1 1 A 50 50 PHE CB C 50 39.200 39.198 0.002 1
1 663 . 2 1 1 A 50 50 PHE N N 50 121.300 120.381 0.919 1
1 664 . 2 1 1 A 51 51 LEU H H 51 8.920 8.168 0.752 1
1 665 . 2 1 1 A 51 51 LEU HA H 51 3.630 3.781 -0.151 1
1 675 . 2 1 1 A 51 51 LEU C C 51 180.000 179.276 0.724 1
1 676 . 2 1 1 A 51 51 LEU CA C 51 58.100 57.707 0.393 1
1 677 . 2 1 1 A 51 51 LEU CB C 51 39.800 41.366 -1.566 1
1 681 . 2 1 1 A 51 51 LEU N N 51 121.900 118.904 2.996 1
1 682 . 2 1 1 A 52 52 ARG H H 52 8.410 8.046 0.364 1
1 683 . 2 1 1 A 52 52 ARG HA H 52 4.420 4.021 0.399 1
1 691 . 2 1 1 A 52 52 ARG C C 52 179.800 179.636 0.164 1
1 692 . 2 1 1 A 52 52 ARG CA C 52 57.800 59.589 -1.789 1
1 693 . 2 1 1 A 52 52 ARG CB C 52 28.200 29.953 -1.753 1
1 695 . 2 1 1 A 52 52 ARG N N 52 120.500 119.472 1.028 1
1 697 . 2 1 1 A 53 53 SER H H 53 8.480 7.772 0.708 1
1 698 . 2 1 1 A 53 53 SER HA H 53 4.300 4.167 0.133 1
1 701 . 2 1 1 A 53 53 SER C C 53 174.600 175.282 -0.682 1
1 702 . 2 1 1 A 53 53 SER CA C 53 61.500 60.688 0.812 1
1 703 . 2 1 1 A 53 53 SER CB C 53 62.300 62.796 -0.496 1
1 704 . 2 1 1 A 53 53 SER N N 53 119.500 115.241 4.259 1
1 705 . 2 1 1 A 54 54 LYS H H 54 7.080 7.492 -0.412 1
1 706 . 2 1 1 A 54 54 LYS HA H 54 4.350 4.281 0.069 1
1 715 . 2 1 1 A 54 54 LYS C C 54 176.500 176.873 -0.373 1
1 716 . 2 1 1 A 54 54 LYS CA C 54 53.700 55.785 -2.085 1
1 717 . 2 1 1 A 54 54 LYS CB C 54 31.800 32.742 -0.942 1
1 721 . 2 1 1 A 54 54 LYS N N 54 119.200 117.777 1.423 1
1 722 . 2 1 1 A 55 55 GLY H H 55 8.040 8.556 -0.516 1
1 723 . 2 1 1 A 55 55 GLY HA2 H 55 3.540 3.850 -0.310 1
1 724 . 2 1 1 A 55 55 GLY HA3 H 55 4.300 3.856 0.444 1
1 725 . 2 1 1 A 55 55 GLY C C 55 174.500 174.889 -0.389 1
1 726 . 2 1 1 A 55 55 GLY CA C 55 44.700 45.865 -1.165 1
1 727 . 2 1 1 A 55 55 GLY N N 55 106.600 108.048 -1.448 1
1 728 . 2 1 1 A 56 56 VAL H H 56 7.580 7.452 0.128 1
1 729 . 2 1 1 A 56 56 VAL HA H 56 3.630 3.817 -0.187 1
1 737 . 2 1 1 A 56 56 VAL C C 56 174.700 175.335 -0.635 1
1 738 . 2 1 1 A 56 56 VAL CA C 56 64.000 62.494 1.506 1
1 739 . 2 1 1 A 56 56 VAL CB C 56 31.600 32.048 -0.448 1
1 742 . 2 1 1 A 56 56 VAL N N 56 122.000 121.998 0.002 1
1 743 . 2 1 1 A 57 57 ASP H H 57 8.440 8.563 -0.123 1
1 744 . 2 1 1 A 57 57 ASP HA H 57 4.500 4.603 -0.103 1
1 747 . 2 1 1 A 57 57 ASP C C 57 176.900 176.504 0.396 1
1 748 . 2 1 1 A 57 57 ASP CA C 57 52.600 53.303 -0.703 1
1 749 . 2 1 1 A 57 57 ASP CB C 57 39.900 40.459 -0.559 1
1 750 . 2 1 1 A 57 57 ASP N N 57 124.100 127.018 -2.918 1
1 751 . 2 1 1 A 58 58 LEU H H 58 9.720 8.296 1.424 1
1 752 . 2 1 1 A 58 58 LEU HA H 58 4.020 4.242 -0.222 1
1 762 . 2 1 1 A 58 58 LEU C C 58 179.400 178.695 0.705 1
1 763 . 2 1 1 A 58 58 LEU CA C 58 56.300 56.914 -0.614 1
1 764 . 2 1 1 A 58 58 LEU CB C 58 43.300 42.007 1.293 1
1 768 . 2 1 1 A 58 58 LEU N N 58 127.800 127.649 0.151 1
1 769 . 2 1 1 A 59 59 ASN H H 59 7.740 8.402 -0.662 1
1 770 . 2 1 1 A 59 59 ASN HA H 59 4.340 4.385 -0.045 1
1 775 . 2 1 1 A 59 59 ASN C C 59 176.300 177.839 -1.539 1
1 776 . 2 1 1 A 59 59 ASN CA C 59 56.300 56.301 -0.001 1
1 777 . 2 1 1 A 59 59 ASN CB C 59 36.400 37.842 -1.442 1
1 779 . 2 1 1 A 59 59 ASN N N 59 119.500 117.493 2.007 1
1 781 . 2 1 1 A 60 60 ALA H H 60 7.220 7.756 -0.536 1
1 782 . 2 1 1 A 60 60 ALA HA H 60 4.030 4.140 -0.110 1
1 786 . 2 1 1 A 60 60 ALA C C 60 180.100 180.144 -0.044 1
1 787 . 2 1 1 A 60 60 ALA CA C 60 54.300 54.997 -0.697 1
1 788 . 2 1 1 A 60 60 ALA CB C 60 18.200 18.126 0.074 1
1 789 . 2 1 1 A 60 60 ALA N N 60 121.400 122.811 -1.411 1
1 790 . 2 1 1 A 61 61 LEU H H 61 7.320 8.136 -0.816 1
1 791 . 2 1 1 A 61 61 LEU HA H 61 3.840 4.131 -0.291 1
1 801 . 2 1 1 A 61 61 LEU C C 61 177.200 178.488 -1.288 1
1 802 . 2 1 1 A 61 61 LEU CA C 61 58.500 58.112 0.388 1
1 803 . 2 1 1 A 61 61 LEU CB C 61 42.600 42.001 0.599 1
1 807 . 2 1 1 A 61 61 LEU N N 61 118.600 120.623 -2.023 1
1 808 . 2 1 1 A 62 62 PHE H H 62 8.360 8.519 -0.159 1
1 809 . 2 1 1 A 62 62 PHE HA H 62 3.930 4.124 -0.194 1
1 817 . 2 1 1 A 62 62 PHE C C 62 178.200 177.899 0.301 1
1 818 . 2 1 1 A 62 62 PHE CA C 62 62.800 60.380 2.420 1
1 819 . 2 1 1 A 62 62 PHE CB C 62 38.500 38.979 -0.479 1
1 825 . 2 1 1 A 62 62 PHE N N 62 114.400 117.897 -3.497 1
1 826 . 2 1 1 A 63 63 ASP H H 63 8.680 8.532 0.148 1
1 827 . 2 1 1 A 63 63 ASP HA H 63 4.530 4.189 0.341 1
1 830 . 2 1 1 A 63 63 ASP C C 63 178.600 178.729 -0.129 1
1 831 . 2 1 1 A 63 63 ASP CA C 63 57.500 57.298 0.202 1
1 832 . 2 1 1 A 63 63 ASP CB C 63 39.600 40.058 -0.458 1
1 833 . 2 1 1 A 63 63 ASP N N 63 120.400 118.559 1.841 1
1 834 . 2 1 1 A 64 64 ARG H H 64 7.540 7.871 -0.331 1
1 835 . 2 1 1 A 64 64 ARG HA H 64 4.290 4.228 0.062 1
1 843 . 2 1 1 A 64 64 ARG C C 64 177.600 178.850 -1.250 1
1 844 . 2 1 1 A 64 64 ARG CA C 64 58.300 58.482 -0.182 1
1 845 . 2 1 1 A 64 64 ARG CB C 64 30.000 30.095 -0.095 1
1 848 . 2 1 1 A 64 64 ARG N N 64 116.800 120.000 -3.200 1
1 850 . 2 1 1 A 65 65 ILE H H 65 7.260 7.889 -0.629 1
1 851 . 2 1 1 A 65 65 ILE HA H 65 4.130 3.822 0.308 1
1 861 . 2 1 1 A 65 65 ILE C C 65 177.000 176.975 0.025 1
1 862 . 2 1 1 A 65 65 ILE CA C 65 62.600 65.119 -2.519 1
1 863 . 2 1 1 A 65 65 ILE CB C 65 38.700 38.311 0.389 1
1 867 . 2 1 1 A 65 65 ILE N N 65 117.000 118.479 -1.479 1
1 868 . 2 1 1 A 66 66 ILE H H 66 7.980 8.494 -0.514 1
1 869 . 2 1 1 A 66 66 ILE HA H 66 4.000 3.993 0.007 1
1 879 . 2 1 1 A 66 66 ILE C C 66 176.400 175.827 0.573 1
1 880 . 2 1 1 A 66 66 ILE CA C 66 63.100 61.867 1.233 1
1 881 . 2 1 1 A 66 66 ILE CB C 66 38.800 37.667 1.133 1
1 885 . 2 1 1 A 66 66 ILE N N 66 120.700 121.593 -0.893 1
1 886 . 2 1 1 A 67 67 VAL H H 67 8.130 8.718 -0.588 1
1 887 . 2 1 1 A 67 67 VAL HA H 67 3.980 4.731 -0.751 1
1 895 . 2 1 1 A 67 67 VAL C C 67 177.300 174.286 3.014 1
1 896 . 2 1 1 A 67 67 VAL CA C 67 63.900 59.648 4.252 1
1 897 . 2 1 1 A 67 67 VAL CB C 67 32.500 34.924 -2.424 1
1 900 . 2 1 1 A 67 67 VAL N N 67 121.600 120.704 0.896 1
1 901 . 2 1 1 A 68 68 ASN H H 68 8.170 8.983 -0.813 1
1 902 . 2 1 1 A 68 68 ASN HA H 68 4.680 4.879 -0.199 1
1 907 . 2 1 1 A 68 68 ASN CA C 68 54.200 53.322 0.878 1
1 908 . 2 1 1 A 68 68 ASN CB C 68 39.100 38.996 0.104 1
1 910 . 2 1 1 A 68 68 ASN N N 68 120.500 126.587 -6.087 1
1 912 . 2 1 1 A 69 69 LYS H H 69 8.230 9.067 -0.837 1
1 913 . 2 1 1 A 69 69 LYS HA H 69 4.260 4.531 -0.271 1
1 922 . 2 1 1 A 69 69 LYS C C 69 176.900 177.215 -0.315 1
1 923 . 2 1 1 A 69 69 LYS CA C 69 57.000 55.702 1.298 1
1 924 . 2 1 1 A 69 69 LYS CB C 69 32.800 33.594 -0.794 1
1 928 . 2 1 1 A 69 69 LYS N N 69 121.300 126.747 -5.447 1
1 929 . 2 1 1 A 70 70 LEU H H 70 8.150 8.655 -0.505 1
1 930 . 2 1 1 A 70 70 LEU HA H 70 4.300 4.293 0.007 1
1 940 . 2 1 1 A 70 70 LEU C C 70 178.900 176.810 2.090 1
1 941 . 2 1 1 A 70 70 LEU CA C 70 55.400 54.922 0.478 1
1 942 . 2 1 1 A 70 70 LEU CB C 70 42.100 41.600 0.500 1
1 946 . 2 1 1 A 70 70 LEU N N 70 121.900 122.476 -0.576 1
1 947 . 2 1 1 A 71 71 GLU H H 71 8.210 7.574 0.636 1
1 948 . 2 1 1 A 71 71 GLU HA H 71 4.180 4.421 -0.241 1
1 953 . 2 1 1 A 71 71 GLU C C 71 176.300 176.416 -0.116 1
1 954 . 2 1 1 A 71 71 GLU CA C 71 56.600 55.944 0.656 1
1 955 . 2 1 1 A 71 71 GLU CB C 71 30.200 30.397 -0.197 1
1 957 . 2 1 1 A 71 71 GLU N N 71 120.900 119.609 1.291 1
1 958 . 2 1 1 A 72 72 HIS H H 72 8.380 8.310 0.070 1
1 959 . 2 1 1 A 72 72 HIS HA H 72 4.600 4.212 0.388 1
1 962 . 2 1 1 A 72 72 HIS C C 72 174.600 174.476 0.124 1
1 963 . 2 1 1 A 72 72 HIS CA C 72 55.600 57.911 -2.311 1
1 964 . 2 1 1 A 72 72 HIS CB C 72 29.600 30.108 -0.508 1
1 965 . 2 1 1 A 72 72 HIS N N 72 119.300 122.530 -3.230 1
1 966 . 2 1 1 A 73 73 HIS H H 73 8.410 7.368 1.042 1
1 967 . 2 1 1 A 73 73 HIS HA H 73 4.610 4.052 0.558 1
1 970 . 2 1 1 A 73 73 HIS C C 73 173.700 175.613 -1.913 1
1 971 . 2 1 1 A 73 73 HIS CA C 73 55.700 58.305 -2.605 1
1 972 . 2 1 1 A 73 73 HIS CB C 73 29.600 28.448 1.152 1
1 973 . 2 1 1 A 73 73 HIS N N 73 119.410 117.933 1.477 1
1 974 . 2 1 1 A 74 74 HIS H H 74 8.310 9.084 -0.774 1
1 975 . 2 1 1 A 74 74 HIS HA H 74 4.630 4.150 0.480 1
1 978 . 2 1 1 A 74 74 HIS CA C 74 57.100 56.542 0.558 1
1 979 . 2 1 1 A 74 74 HIS CB C 74 29.800 27.506 2.294 1
1 14 . 3 1 1 A 2 2 GLU H H 2 9.070 7.764 1.306 1
1 15 . 3 1 1 A 2 2 GLU HA H 2 4.520 4.440 0.080 1
1 20 . 3 1 1 A 2 2 GLU C C 2 176.300 177.692 -1.392 1
1 21 . 3 1 1 A 2 2 GLU CA C 2 55.800 56.005 -0.205 1
1 22 . 3 1 1 A 2 2 GLU CB C 2 31.000 30.694 0.306 1
1 24 . 3 1 1 A 2 2 GLU N N 2 123.100 118.162 4.938 1
1 25 . 3 1 1 A 3 3 LEU H H 3 8.750 8.760 -0.010 1
1 26 . 3 1 1 A 3 3 LEU HA H 3 3.750 4.072 -0.322 1
1 36 . 3 1 1 A 3 3 LEU C C 3 177.400 178.784 -1.384 1
1 37 . 3 1 1 A 3 3 LEU CA C 3 58.300 58.394 -0.094 1
1 38 . 3 1 1 A 3 3 LEU CB C 3 41.500 41.296 0.204 1
1 42 . 3 1 1 A 3 3 LEU N N 3 122.600 126.841 -4.241 1
1 43 . 3 1 1 A 4 4 SER H H 4 8.350 8.029 0.321 1
1 44 . 3 1 1 A 4 4 SER HA H 4 3.890 4.070 -0.180 1
1 47 . 3 1 1 A 4 4 SER C C 4 175.100 176.041 -0.941 1
1 48 . 3 1 1 A 4 4 SER CA C 4 61.500 62.080 -0.580 1
1 49 . 3 1 1 A 4 4 SER CB C 4 62.000 62.800 -0.800 1
1 50 . 3 1 1 A 4 4 SER N N 4 112.900 117.023 -4.123 1
1 51 . 3 1 1 A 5 5 ASN H H 5 7.180 8.333 -1.153 1
1 52 . 3 1 1 A 5 5 ASN HA H 5 4.470 4.395 0.075 1
1 57 . 3 1 1 A 5 5 ASN C C 5 177.400 178.190 -0.790 1
1 58 . 3 1 1 A 5 5 ASN CA C 5 56.000 56.913 -0.913 1
1 59 . 3 1 1 A 5 5 ASN CB C 5 39.400 39.328 0.072 1
1 61 . 3 1 1 A 5 5 ASN N N 5 116.600 120.383 -3.783 1
1 63 . 3 1 1 A 6 6 GLU H H 6 7.950 8.142 -0.192 1
1 64 . 3 1 1 A 6 6 GLU HA H 6 4.070 4.147 -0.077 1
1 69 . 3 1 1 A 6 6 GLU C C 6 178.500 178.839 -0.339 1
1 70 . 3 1 1 A 6 6 GLU CA C 6 58.100 58.894 -0.794 1
1 71 . 3 1 1 A 6 6 GLU CB C 6 29.300 29.590 -0.290 1
1 73 . 3 1 1 A 6 6 GLU N N 6 117.600 119.384 -1.784 1
1 74 . 3 1 1 A 7 7 LEU H H 7 8.140 8.694 -0.554 1
1 75 . 3 1 1 A 7 7 LEU HA H 7 3.640 4.288 -0.648 1
1 85 . 3 1 1 A 7 7 LEU C C 7 177.700 178.312 -0.612 1
1 86 . 3 1 1 A 7 7 LEU CA C 7 58.300 57.904 0.396 1
1 87 . 3 1 1 A 7 7 LEU CB C 7 40.600 41.798 -1.198 1
1 91 . 3 1 1 A 7 7 LEU N N 7 118.500 121.246 -2.746 1
1 92 . 3 1 1 A 8 8 LYS H H 8 7.090 8.082 -0.992 1
1 93 . 3 1 1 A 8 8 LYS HA H 8 4.080 3.981 0.099 1
1 102 . 3 1 1 A 8 8 LYS C C 8 178.300 178.711 -0.411 1
1 103 . 3 1 1 A 8 8 LYS CA C 8 59.700 59.519 0.181 1
1 104 . 3 1 1 A 8 8 LYS CB C 8 32.300 32.341 -0.041 1
1 108 . 3 1 1 A 8 8 LYS N N 8 118.200 119.184 -0.984 1
1 109 . 3 1 1 A 9 9 VAL H H 9 7.940 7.839 0.101 1
1 110 . 3 1 1 A 9 9 VAL HA H 9 3.440 3.529 -0.089 1
1 118 . 3 1 1 A 9 9 VAL C C 9 179.500 177.879 1.621 1
1 119 . 3 1 1 A 9 9 VAL CA C 9 66.700 66.653 0.047 1
1 120 . 3 1 1 A 9 9 VAL CB C 9 31.600 31.423 0.177 1
1 123 . 3 1 1 A 9 9 VAL N N 9 117.600 119.394 -1.794 1
1 124 . 3 1 1 A 10 10 GLU H H 10 7.830 8.541 -0.711 1
1 125 . 3 1 1 A 10 10 GLU HA H 10 4.130 3.946 0.184 1
1 130 . 3 1 1 A 10 10 GLU C C 10 178.700 179.296 -0.596 1
1 131 . 3 1 1 A 10 10 GLU CA C 10 58.300 59.771 -1.471 1
1 132 . 3 1 1 A 10 10 GLU CB C 10 28.500 29.426 -0.926 1
1 134 . 3 1 1 A 10 10 GLU N N 10 118.300 118.393 -0.093 1
1 135 . 3 1 1 A 11 11 ARG H H 11 8.330 7.542 0.788 1
1 136 . 3 1 1 A 11 11 ARG HA H 11 3.770 4.094 -0.324 1
1 144 . 3 1 1 A 11 11 ARG C C 11 174.600 178.902 -4.302 1
1 145 . 3 1 1 A 11 11 ARG CA C 11 61.300 58.950 2.350 1
1 146 . 3 1 1 A 11 11 ARG CB C 11 28.500 29.940 -1.440 1
1 149 . 3 1 1 A 11 11 ARG N N 11 121.400 119.989 1.411 1
1 151 . 3 1 1 A 12 12 ILE H H 12 8.540 7.719 0.821 1
1 152 . 3 1 1 A 12 12 ILE HA H 12 3.780 3.903 -0.123 1
1 162 . 3 1 1 A 12 12 ILE C C 12 181.400 177.973 3.427 1
1 163 . 3 1 1 A 12 12 ILE CA C 12 64.800 64.441 0.359 1
1 164 . 3 1 1 A 12 12 ILE CB C 12 37.700 37.100 0.600 1
1 168 . 3 1 1 A 12 12 ILE N N 12 118.700 119.606 -0.906 1
1 169 . 3 1 1 A 13 13 ARG H H 13 8.470 8.696 -0.226 1
1 170 . 3 1 1 A 13 13 ARG HA H 13 4.060 4.014 0.046 1
1 178 . 3 1 1 A 13 13 ARG C C 13 178.600 178.510 0.090 1
1 179 . 3 1 1 A 13 13 ARG CA C 13 59.600 59.133 0.467 1
1 180 . 3 1 1 A 13 13 ARG CB C 13 30.000 30.081 -0.081 1
1 183 . 3 1 1 A 13 13 ARG N N 13 124.600 121.907 2.693 1
1 185 . 3 1 1 A 14 14 LEU H H 14 7.430 7.798 -0.368 1
1 186 . 3 1 1 A 14 14 LEU HA H 14 4.240 4.323 -0.083 1
1 196 . 3 1 1 A 14 14 LEU C C 14 176.000 176.283 -0.283 1
1 197 . 3 1 1 A 14 14 LEU CA C 14 55.300 54.795 0.505 1
1 198 . 3 1 1 A 14 14 LEU CB C 14 43.000 42.196 0.804 1
1 202 . 3 1 1 A 14 14 LEU N N 14 118.500 118.123 0.377 1
1 203 . 3 1 1 A 15 15 SER H H 15 8.260 8.131 0.129 1
1 204 . 3 1 1 A 15 15 SER HA H 15 4.030 4.164 -0.134 1
1 207 . 3 1 1 A 15 15 SER C C 15 174.000 173.467 0.533 1
1 208 . 3 1 1 A 15 15 SER CA C 15 58.700 59.002 -0.302 1
1 209 . 3 1 1 A 15 15 SER CB C 15 61.300 60.702 0.598 1
1 210 . 3 1 1 A 15 15 SER N N 15 112.500 113.976 -1.476 1
1 211 . 3 1 1 A 16 16 LEU H H 16 7.310 7.508 -0.198 1
1 212 . 3 1 1 A 16 16 LEU HA H 16 4.880 4.726 0.154 1
1 222 . 3 1 1 A 16 16 LEU C C 16 177.900 176.802 1.098 1
1 223 . 3 1 1 A 16 16 LEU CA C 16 52.600 53.491 -0.891 1
1 224 . 3 1 1 A 16 16 LEU CB C 16 43.500 44.388 -0.888 1
1 228 . 3 1 1 A 16 16 LEU N N 16 117.800 121.473 -3.673 1
1 229 . 3 1 1 A 17 17 THR H H 17 8.640 8.777 -0.137 1
1 230 . 3 1 1 A 17 17 THR HA H 17 4.250 4.702 -0.452 1
1 235 . 3 1 1 A 17 17 THR C C 17 174.900 175.866 -0.966 1
1 236 . 3 1 1 A 17 17 THR CA C 17 60.500 60.720 -0.220 1
1 237 . 3 1 1 A 17 17 THR CB C 17 70.500 71.193 -0.693 1
1 239 . 3 1 1 A 17 17 THR N N 17 115.200 115.645 -0.445 1
1 240 . 3 1 1 A 18 18 ALA H H 18 8.820 9.038 -0.218 1
1 241 . 3 1 1 A 18 18 ALA HA H 18 3.680 3.994 -0.314 1
1 245 . 3 1 1 A 18 18 ALA C C 18 178.900 180.152 -1.252 1
1 246 . 3 1 1 A 18 18 ALA CA C 18 55.200 55.148 0.052 1
1 247 . 3 1 1 A 18 18 ALA CB C 18 17.800 18.144 -0.344 1
1 248 . 3 1 1 A 18 18 ALA N N 18 125.600 124.956 0.644 1
1 249 . 3 1 1 A 19 19 LYS H H 19 8.280 8.040 0.240 1
1 250 . 3 1 1 A 19 19 LYS HA H 19 3.740 4.080 -0.340 1
1 259 . 3 1 1 A 19 19 LYS C C 19 177.900 178.354 -0.454 1
1 260 . 3 1 1 A 19 19 LYS CA C 19 59.800 59.189 0.611 1
1 261 . 3 1 1 A 19 19 LYS CB C 19 33.300 32.224 1.076 1
1 265 . 3 1 1 A 19 19 LYS N N 19 115.800 116.909 -1.109 1
1 266 . 3 1 1 A 20 20 SER H H 20 7.860 8.362 -0.502 1
1 267 . 3 1 1 A 20 20 SER HA H 20 4.210 4.161 0.049 1
1 271 . 3 1 1 A 20 20 SER C C 20 177.200 177.285 -0.085 1
1 272 . 3 1 1 A 20 20 SER CA C 20 61.900 61.264 0.636 1
1 273 . 3 1 1 A 20 20 SER CB C 20 63.000 62.287 0.713 1
1 274 . 3 1 1 A 20 20 SER N N 20 114.600 114.647 -0.047 1
1 275 . 3 1 1 A 21 21 VAL H H 21 7.830 7.721 0.109 1
1 276 . 3 1 1 A 21 21 VAL HA H 21 3.280 3.547 -0.267 1
1 284 . 3 1 1 A 21 21 VAL C C 21 177.500 178.020 -0.520 1
1 285 . 3 1 1 A 21 21 VAL CA C 21 66.800 66.658 0.142 1
1 286 . 3 1 1 A 21 21 VAL CB C 21 31.400 31.545 -0.145 1
1 289 . 3 1 1 A 21 21 VAL N N 21 122.600 122.258 0.342 1
1 290 . 3 1 1 A 22 22 ALA H H 22 8.230 8.494 -0.264 1
1 291 . 3 1 1 A 22 22 ALA HA H 22 3.510 3.952 -0.442 1
1 295 . 3 1 1 A 22 22 ALA C C 22 179.500 179.289 0.211 1
1 296 . 3 1 1 A 22 22 ALA CA C 22 55.500 55.577 -0.077 1
1 297 . 3 1 1 A 22 22 ALA CB C 22 16.900 18.071 -1.171 1
1 298 . 3 1 1 A 22 22 ALA N N 22 121.200 122.116 -0.916 1
1 299 . 3 1 1 A 23 23 GLU H H 23 7.900 8.434 -0.534 1
1 300 . 3 1 1 A 23 23 GLU HA H 23 3.990 4.038 -0.048 1
1 305 . 3 1 1 A 23 23 GLU C C 23 180.000 179.110 0.890 1
1 306 . 3 1 1 A 23 23 GLU CA C 23 59.300 59.575 -0.275 1
1 307 . 3 1 1 A 23 23 GLU CB C 23 29.300 29.279 0.021 1
1 309 . 3 1 1 A 23 23 GLU N N 23 115.300 118.690 -3.390 1
1 310 . 3 1 1 A 24 24 GLU H H 24 7.950 8.159 -0.209 1
1 311 . 3 1 1 A 24 24 GLU HA H 24 4.060 4.094 -0.034 1
1 316 . 3 1 1 A 24 24 GLU C C 24 179.100 179.522 -0.422 1
1 317 . 3 1 1 A 24 24 GLU CA C 24 59.700 59.394 0.306 1
1 318 . 3 1 1 A 24 24 GLU CB C 24 29.500 29.254 0.246 1
1 320 . 3 1 1 A 24 24 GLU N N 24 120.100 119.604 0.496 1
1 321 . 3 1 1 A 25 25 MET H H 25 8.150 8.288 -0.138 1
1 322 . 3 1 1 A 25 25 MET HA H 25 4.110 4.333 -0.223 1
1 330 . 3 1 1 A 25 25 MET C C 25 176.600 176.585 0.015 1
1 331 . 3 1 1 A 25 25 MET CA C 25 57.100 56.527 0.573 1
1 332 . 3 1 1 A 25 25 MET CB C 25 34.900 32.608 2.292 1
1 335 . 3 1 1 A 25 25 MET N N 25 115.500 117.550 -2.050 1
1 336 . 3 1 1 A 26 26 GLY H H 26 7.940 8.270 -0.330 1
1 337 . 3 1 1 A 26 26 GLY HA2 H 26 3.860 3.937 -0.077 1
1 338 . 3 1 1 A 26 26 GLY HA3 H 26 3.960 3.938 0.022 1
1 339 . 3 1 1 A 26 26 GLY C C 26 175.100 173.784 1.316 1
1 340 . 3 1 1 A 26 26 GLY CA C 26 46.600 45.444 1.156 1
1 341 . 3 1 1 A 26 26 GLY N N 26 109.000 107.029 1.971 1
1 342 . 3 1 1 A 27 27 ILE H H 27 7.880 7.414 0.466 1
1 343 . 3 1 1 A 27 27 ILE HA H 27 4.790 4.817 -0.027 1
1 353 . 3 1 1 A 27 27 ILE C C 27 174.300 174.943 -0.643 1
1 354 . 3 1 1 A 27 27 ILE CA C 27 59.000 58.531 0.469 1
1 355 . 3 1 1 A 27 27 ILE CB C 27 40.900 41.477 -0.577 1
1 359 . 3 1 1 A 27 27 ILE N N 27 112.700 116.082 -3.382 1
1 360 . 3 1 1 A 28 28 SER H H 28 8.570 8.563 0.007 1
1 361 . 3 1 1 A 28 28 SER HA H 28 4.540 4.572 -0.032 1
1 364 . 3 1 1 A 28 28 SER C C 28 175.600 175.822 -0.222 1
1 365 . 3 1 1 A 28 28 SER CA C 28 56.800 58.536 -1.736 1
1 366 . 3 1 1 A 28 28 SER CB C 28 65.500 63.527 1.973 1
1 367 . 3 1 1 A 28 28 SER N N 28 115.400 117.948 -2.548 1
1 368 . 3 1 1 A 29 29 ARG H H 29 8.980 9.066 -0.086 1
1 369 . 3 1 1 A 29 29 ARG HA H 29 3.660 3.952 -0.292 1
1 377 . 3 1 1 A 29 29 ARG C C 29 178.700 178.750 -0.050 1
1 378 . 3 1 1 A 29 29 ARG CA C 29 59.500 60.257 -0.757 1
1 379 . 3 1 1 A 29 29 ARG CB C 29 29.500 29.722 -0.222 1
1 382 . 3 1 1 A 29 29 ARG N N 29 122.000 127.309 -5.309 1
1 384 . 3 1 1 A 30 30 GLN H H 30 8.580 7.637 0.943 1
1 385 . 3 1 1 A 30 30 GLN HA H 30 3.860 4.036 -0.176 1
1 392 . 3 1 1 A 30 30 GLN C C 30 178.100 178.274 -0.174 1
1 393 . 3 1 1 A 30 30 GLN CA C 30 59.200 59.248 -0.048 1
1 394 . 3 1 1 A 30 30 GLN CB C 30 28.100 28.286 -0.186 1
1 397 . 3 1 1 A 30 30 GLN N N 30 118.700 119.176 -0.476 1
1 399 . 3 1 1 A 31 31 GLN H H 31 7.990 7.878 0.112 1
1 400 . 3 1 1 A 31 31 GLN HA H 31 3.980 4.057 -0.077 1
1 407 . 3 1 1 A 31 31 GLN C C 31 178.700 178.187 0.513 1
1 408 . 3 1 1 A 31 31 GLN CA C 31 59.100 58.605 0.495 1
1 409 . 3 1 1 A 31 31 GLN CB C 31 28.700 28.107 0.593 1
1 412 . 3 1 1 A 31 31 GLN N N 31 119.600 119.303 0.297 1
1 414 . 3 1 1 A 32 32 LEU H H 32 7.630 7.694 -0.064 1
1 415 . 3 1 1 A 32 32 LEU HA H 32 3.740 4.132 -0.392 1
1 425 . 3 1 1 A 32 32 LEU C C 32 178.300 178.772 -0.472 1
1 426 . 3 1 1 A 32 32 LEU CA C 32 57.700 57.609 0.091 1
1 427 . 3 1 1 A 32 32 LEU CB C 32 41.500 41.278 0.222 1
1 431 . 3 1 1 A 32 32 LEU N N 32 120.700 120.871 -0.171 1
1 432 . 3 1 1 A 33 33 CYS H H 33 8.240 8.343 -0.103 1
1 433 . 3 1 1 A 33 33 CYS HA H 33 3.990 4.052 -0.062 1
1 436 . 3 1 1 A 33 33 CYS C C 33 177.000 176.975 0.025 1
1 437 . 3 1 1 A 33 33 CYS CA C 33 63.100 63.192 -0.092 1
1 438 . 3 1 1 A 33 33 CYS CB C 33 26.100 26.899 -0.799 1
1 439 . 3 1 1 A 33 33 CYS N N 33 117.400 117.794 -0.394 1
1 440 . 3 1 1 A 34 34 ASN H H 34 8.210 7.935 0.275 1
1 441 . 3 1 1 A 34 34 ASN HA H 34 4.370 4.453 -0.083 1
1 446 . 3 1 1 A 34 34 ASN C C 34 178.700 177.865 0.835 1
1 447 . 3 1 1 A 34 34 ASN CA C 34 56.000 56.690 -0.690 1
1 448 . 3 1 1 A 34 34 ASN CB C 34 37.800 39.522 -1.722 1
1 450 . 3 1 1 A 34 34 ASN N N 34 117.300 119.820 -2.520 1
1 452 . 3 1 1 A 35 35 ILE H H 35 7.850 7.521 0.329 1
1 453 . 3 1 1 A 35 35 ILE HA H 35 3.850 3.625 0.225 1
1 463 . 3 1 1 A 35 35 ILE C C 35 178.100 177.912 0.188 1
1 464 . 3 1 1 A 35 35 ILE CA C 35 64.800 65.326 -0.526 1
1 465 . 3 1 1 A 35 35 ILE CB C 35 38.000 37.728 0.272 1
1 469 . 3 1 1 A 35 35 ILE N N 35 120.400 119.563 0.837 1
1 470 . 3 1 1 A 36 36 GLU H H 36 7.680 8.046 -0.366 1
1 471 . 3 1 1 A 36 36 GLU HA H 36 4.120 4.004 0.116 1
1 476 . 3 1 1 A 36 36 GLU C C 36 176.300 177.900 -1.600 1
1 477 . 3 1 1 A 36 36 GLU CA C 36 58.600 59.721 -1.121 1
1 478 . 3 1 1 A 36 36 GLU CB C 36 30.000 29.278 0.722 1
1 480 . 3 1 1 A 36 36 GLU N N 36 116.500 121.608 -5.108 1
1 481 . 3 1 1 A 37 37 GLN H H 37 7.630 7.877 -0.247 1
1 482 . 3 1 1 A 37 37 GLN HA H 37 4.540 4.412 0.128 1
1 489 . 3 1 1 A 37 37 GLN C C 37 176.000 175.908 0.092 1
1 490 . 3 1 1 A 37 37 GLN CA C 37 54.900 55.129 -0.229 1
1 491 . 3 1 1 A 37 37 GLN CB C 37 29.600 27.830 1.770 1
1 494 . 3 1 1 A 37 37 GLN N N 37 115.000 115.604 -0.604 1
1 496 . 3 1 1 A 38 38 SER H H 38 7.380 7.618 -0.238 1
1 497 . 3 1 1 A 38 38 SER HA H 38 4.410 4.432 -0.022 1
1 500 . 3 1 1 A 38 38 SER C C 38 175.500 173.910 1.590 1
1 501 . 3 1 1 A 38 38 SER CA C 38 59.200 58.342 0.858 1
1 502 . 3 1 1 A 38 38 SER CB C 38 64.100 63.761 0.339 1
1 503 . 3 1 1 A 38 38 SER N N 38 115.200 115.574 -0.374 1
1 504 . 3 1 1 A 39 39 GLU H H 39 9.040 8.709 0.331 1
1 505 . 3 1 1 A 39 39 GLU HA H 39 4.450 4.735 -0.285 1
1 510 . 3 1 1 A 39 39 GLU C C 39 176.300 176.091 0.209 1
1 511 . 3 1 1 A 39 39 GLU CA C 39 57.100 54.644 2.456 1
1 512 . 3 1 1 A 39 39 GLU CB C 39 30.300 31.822 -1.522 1
1 514 . 3 1 1 A 39 39 GLU N N 39 125.400 123.594 1.806 1
1 515 . 3 1 1 A 40 40 THR H H 40 7.920 8.629 -0.709 1
1 516 . 3 1 1 A 40 40 THR HA H 40 4.590 4.286 0.304 1
1 521 . 3 1 1 A 40 40 THR C C 40 173.500 172.623 0.877 1
1 522 . 3 1 1 A 40 40 THR CA C 40 60.500 61.958 -1.458 1
1 523 . 3 1 1 A 40 40 THR CB C 40 71.100 68.879 2.221 1
1 525 . 3 1 1 A 40 40 THR N N 40 112.800 121.726 -8.926 1
1 526 . 3 1 1 A 41 41 ALA H H 41 8.780 8.435 0.345 1
1 527 . 3 1 1 A 41 41 ALA HA H 41 4.870 4.698 0.172 1
1 531 . 3 1 1 A 41 41 ALA CA C 41 49.700 49.305 0.395 1
1 532 . 3 1 1 A 41 41 ALA CB C 41 19.300 19.994 -0.694 1
1 533 . 3 1 1 A 41 41 ALA N N 41 127.000 124.785 2.215 1
1 534 . 3 1 1 A 42 42 PRO HA H 42 4.660 4.502 0.158 1
1 541 . 3 1 1 A 42 42 PRO C C 42 178.300 177.492 0.808 1
1 542 . 3 1 1 A 42 42 PRO CA C 42 62.500 62.914 -0.414 1
1 543 . 3 1 1 A 42 42 PRO CB C 42 32.600 32.538 0.062 1
1 546 . 3 1 1 A 43 43 VAL H H 43 8.840 8.558 0.282 1
1 547 . 3 1 1 A 43 43 VAL HA H 43 3.660 3.772 -0.112 1
1 555 . 3 1 1 A 43 43 VAL CA C 43 66.800 65.336 1.464 1
1 556 . 3 1 1 A 43 43 VAL CB C 43 31.100 31.507 -0.407 1
1 559 . 3 1 1 A 43 43 VAL N N 43 123.000 123.663 -0.663 1
1 560 . 3 1 1 A 44 44 VAL HA H 44 4.030 3.815 0.215 1
1 568 . 3 1 1 A 44 44 VAL C C 44 176.700 177.524 -0.824 1
1 569 . 3 1 1 A 44 44 VAL CA C 44 65.900 65.148 0.752 1
1 570 . 3 1 1 A 44 44 VAL CB C 44 30.900 31.270 -0.370 1
1 573 . 3 1 1 A 45 45 VAL H H 45 7.500 8.145 -0.645 1
1 574 . 3 1 1 A 45 45 VAL HA H 45 3.760 3.586 0.174 1
1 582 . 3 1 1 A 45 45 VAL C C 45 177.500 177.643 -0.143 1
1 583 . 3 1 1 A 45 45 VAL CA C 45 66.700 66.851 -0.151 1
1 584 . 3 1 1 A 45 45 VAL CB C 45 31.000 31.309 -0.309 1
1 587 . 3 1 1 A 45 45 VAL N N 45 120.100 121.213 -1.113 1
1 588 . 3 1 1 A 46 46 LYS H H 46 7.610 7.400 0.210 1
1 589 . 3 1 1 A 46 46 LYS HA H 46 4.140 4.052 0.088 1
1 598 . 3 1 1 A 46 46 LYS C C 46 179.500 178.582 0.918 1
1 599 . 3 1 1 A 46 46 LYS CA C 46 59.900 58.916 0.984 1
1 600 . 3 1 1 A 46 46 LYS CB C 46 31.500 31.949 -0.449 1
1 604 . 3 1 1 A 46 46 LYS N N 46 120.700 118.591 2.109 1
1 605 . 3 1 1 A 47 47 TYR H H 47 8.550 7.810 0.740 1
1 606 . 3 1 1 A 47 47 TYR HA H 47 5.000 4.181 0.819 1
1 613 . 3 1 1 A 47 47 TYR C C 47 177.300 177.316 -0.016 1
1 614 . 3 1 1 A 47 47 TYR CA C 47 57.300 61.558 -4.258 1
1 615 . 3 1 1 A 47 47 TYR CB C 47 37.700 38.615 -0.915 1
1 620 . 3 1 1 A 47 47 TYR N N 47 122.700 121.170 1.530 1
1 621 . 3 1 1 A 48 48 ILE H H 48 8.250 8.029 0.221 1
1 622 . 3 1 1 A 48 48 ILE HA H 48 3.160 3.677 -0.517 1
1 632 . 3 1 1 A 48 48 ILE C C 48 177.100 178.015 -0.915 1
1 633 . 3 1 1 A 48 48 ILE CA C 48 67.000 65.600 1.400 1
1 634 . 3 1 1 A 48 48 ILE CB C 48 37.800 38.406 -0.606 1
1 638 . 3 1 1 A 48 48 ILE N N 48 121.200 120.632 0.568 1
1 639 . 3 1 1 A 49 49 ALA H H 49 8.310 8.038 0.272 1
1 640 . 3 1 1 A 49 49 ALA HA H 49 3.940 4.065 -0.125 1
1 644 . 3 1 1 A 49 49 ALA C C 49 179.300 179.610 -0.310 1
1 645 . 3 1 1 A 49 49 ALA CA C 49 55.500 54.994 0.506 1
1 646 . 3 1 1 A 49 49 ALA CB C 49 18.200 17.807 0.393 1
1 647 . 3 1 1 A 49 49 ALA N N 49 120.300 121.878 -1.578 1
1 648 . 3 1 1 A 50 50 PHE H H 50 8.630 7.869 0.761 1
1 649 . 3 1 1 A 50 50 PHE HA H 50 4.200 4.139 0.061 1
1 656 . 3 1 1 A 50 50 PHE C C 50 179.000 176.594 2.406 1
1 657 . 3 1 1 A 50 50 PHE CA C 50 61.300 61.365 -0.065 1
1 658 . 3 1 1 A 50 50 PHE CB C 50 39.200 39.174 0.026 1
1 663 . 3 1 1 A 50 50 PHE N N 50 121.300 120.251 1.049 1
1 664 . 3 1 1 A 51 51 LEU H H 51 8.920 8.110 0.810 1
1 665 . 3 1 1 A 51 51 LEU HA H 51 3.630 3.877 -0.247 1
1 675 . 3 1 1 A 51 51 LEU C C 51 180.000 178.965 1.035 1
1 676 . 3 1 1 A 51 51 LEU CA C 51 58.100 57.600 0.500 1
1 677 . 3 1 1 A 51 51 LEU CB C 51 39.800 41.299 -1.499 1
1 681 . 3 1 1 A 51 51 LEU N N 51 121.900 118.936 2.964 1
1 682 . 3 1 1 A 52 52 ARG H H 52 8.410 8.359 0.051 1
1 683 . 3 1 1 A 52 52 ARG HA H 52 4.420 3.919 0.501 1
1 691 . 3 1 1 A 52 52 ARG C C 52 179.800 178.804 0.996 1
1 692 . 3 1 1 A 52 52 ARG CA C 52 57.800 59.625 -1.825 1
1 693 . 3 1 1 A 52 52 ARG CB C 52 28.200 29.962 -1.762 1
1 695 . 3 1 1 A 52 52 ARG N N 52 120.500 120.664 -0.164 1
1 697 . 3 1 1 A 53 53 SER H H 53 8.480 8.246 0.234 1
1 698 . 3 1 1 A 53 53 SER HA H 53 4.300 4.212 0.088 1
1 701 . 3 1 1 A 53 53 SER C C 53 174.600 175.311 -0.711 1
1 702 . 3 1 1 A 53 53 SER CA C 53 61.500 60.715 0.785 1
1 703 . 3 1 1 A 53 53 SER CB C 53 62.300 62.687 -0.387 1
1 704 . 3 1 1 A 53 53 SER N N 53 119.500 114.534 4.966 1
1 705 . 3 1 1 A 54 54 LYS H H 54 7.080 7.427 -0.347 1
1 706 . 3 1 1 A 54 54 LYS HA H 54 4.350 4.292 0.058 1
1 715 . 3 1 1 A 54 54 LYS C C 54 176.500 176.885 -0.385 1
1 716 . 3 1 1 A 54 54 LYS CA C 54 53.700 55.833 -2.133 1
1 717 . 3 1 1 A 54 54 LYS CB C 54 31.800 32.537 -0.737 1
1 721 . 3 1 1 A 54 54 LYS N N 54 119.200 118.006 1.194 1
1 722 . 3 1 1 A 55 55 GLY H H 55 8.040 8.581 -0.541 1
1 723 . 3 1 1 A 55 55 GLY HA2 H 55 3.540 3.899 -0.359 1
1 724 . 3 1 1 A 55 55 GLY HA3 H 55 4.300 3.901 0.399 1
1 725 . 3 1 1 A 55 55 GLY C C 55 174.500 174.895 -0.395 1
1 726 . 3 1 1 A 55 55 GLY CA C 55 44.700 45.914 -1.214 1
1 727 . 3 1 1 A 55 55 GLY N N 55 106.600 108.132 -1.532 1
1 728 . 3 1 1 A 56 56 VAL H H 56 7.580 7.491 0.089 1
1 729 . 3 1 1 A 56 56 VAL HA H 56 3.630 3.872 -0.242 1
1 737 . 3 1 1 A 56 56 VAL C C 56 174.700 175.697 -0.997 1
1 738 . 3 1 1 A 56 56 VAL CA C 56 64.000 62.491 1.509 1
1 739 . 3 1 1 A 56 56 VAL CB C 56 31.600 32.139 -0.539 1
1 742 . 3 1 1 A 56 56 VAL N N 56 122.000 122.074 -0.074 1
1 743 . 3 1 1 A 57 57 ASP H H 57 8.440 8.856 -0.416 1
1 744 . 3 1 1 A 57 57 ASP HA H 57 4.500 4.745 -0.245 1
1 747 . 3 1 1 A 57 57 ASP C C 57 176.900 176.805 0.095 1
1 748 . 3 1 1 A 57 57 ASP CA C 57 52.600 53.378 -0.778 1
1 749 . 3 1 1 A 57 57 ASP CB C 57 39.900 38.857 1.043 1
1 750 . 3 1 1 A 57 57 ASP N N 57 124.100 127.919 -3.819 1
1 751 . 3 1 1 A 58 58 LEU H H 58 9.720 8.111 1.609 1
1 752 . 3 1 1 A 58 58 LEU HA H 58 4.020 4.369 -0.349 1
1 762 . 3 1 1 A 58 58 LEU C C 58 179.400 178.681 0.719 1
1 763 . 3 1 1 A 58 58 LEU CA C 58 56.300 56.947 -0.647 1
1 764 . 3 1 1 A 58 58 LEU CB C 58 43.300 42.115 1.185 1
1 768 . 3 1 1 A 58 58 LEU N N 58 127.800 120.940 6.860 1
1 769 . 3 1 1 A 59 59 ASN H H 59 7.740 8.653 -0.913 1
1 770 . 3 1 1 A 59 59 ASN HA H 59 4.340 4.412 -0.072 1
1 775 . 3 1 1 A 59 59 ASN C C 59 176.300 177.644 -1.344 1
1 776 . 3 1 1 A 59 59 ASN CA C 59 56.300 55.961 0.339 1
1 777 . 3 1 1 A 59 59 ASN CB C 59 36.400 37.748 -1.348 1
1 779 . 3 1 1 A 59 59 ASN N N 59 119.500 120.615 -1.115 1
1 781 . 3 1 1 A 60 60 ALA H H 60 7.220 7.769 -0.549 1
1 782 . 3 1 1 A 60 60 ALA HA H 60 4.030 4.120 -0.090 1
1 786 . 3 1 1 A 60 60 ALA C C 60 180.100 180.295 -0.195 1
1 787 . 3 1 1 A 60 60 ALA CA C 60 54.300 54.764 -0.464 1
1 788 . 3 1 1 A 60 60 ALA CB C 60 18.200 18.655 -0.455 1
1 789 . 3 1 1 A 60 60 ALA N N 60 121.400 122.282 -0.882 1
1 790 . 3 1 1 A 61 61 LEU H H 61 7.320 8.255 -0.935 1
1 791 . 3 1 1 A 61 61 LEU HA H 61 3.840 4.115 -0.275 1
1 801 . 3 1 1 A 61 61 LEU C C 61 177.200 178.425 -1.225 1
1 802 . 3 1 1 A 61 61 LEU CA C 61 58.500 58.262 0.238 1
1 803 . 3 1 1 A 61 61 LEU CB C 61 42.600 41.883 0.717 1
1 807 . 3 1 1 A 61 61 LEU N N 61 118.600 120.609 -2.009 1
1 808 . 3 1 1 A 62 62 PHE H H 62 8.360 8.248 0.112 1
1 809 . 3 1 1 A 62 62 PHE HA H 62 3.930 4.143 -0.213 1
1 817 . 3 1 1 A 62 62 PHE C C 62 178.200 177.727 0.473 1
1 818 . 3 1 1 A 62 62 PHE CA C 62 62.800 60.947 1.853 1
1 819 . 3 1 1 A 62 62 PHE CB C 62 38.500 38.435 0.065 1
1 825 . 3 1 1 A 62 62 PHE N N 62 114.400 117.276 -2.876 1
1 826 . 3 1 1 A 63 63 ASP H H 63 8.680 8.470 0.210 1
1 827 . 3 1 1 A 63 63 ASP HA H 63 4.530 4.371 0.159 1
1 830 . 3 1 1 A 63 63 ASP C C 63 178.600 178.659 -0.059 1
1 831 . 3 1 1 A 63 63 ASP CA C 63 57.500 57.659 -0.159 1
1 832 . 3 1 1 A 63 63 ASP CB C 63 39.600 41.574 -1.974 1
1 833 . 3 1 1 A 63 63 ASP N N 63 120.400 120.307 0.093 1
1 834 . 3 1 1 A 64 64 ARG H H 64 7.540 7.709 -0.169 1
1 835 . 3 1 1 A 64 64 ARG HA H 64 4.290 4.045 0.245 1
1 843 . 3 1 1 A 64 64 ARG C C 64 177.600 178.751 -1.151 1
1 844 . 3 1 1 A 64 64 ARG CA C 64 58.300 59.105 -0.805 1
1 845 . 3 1 1 A 64 64 ARG CB C 64 30.000 30.086 -0.086 1
1 848 . 3 1 1 A 64 64 ARG N N 64 116.800 118.532 -1.732 1
1 850 . 3 1 1 A 65 65 ILE H H 65 7.260 7.403 -0.143 1
1 851 . 3 1 1 A 65 65 ILE HA H 65 4.130 3.656 0.474 1
1 861 . 3 1 1 A 65 65 ILE C C 65 177.000 176.576 0.424 1
1 862 . 3 1 1 A 65 65 ILE CA C 65 62.600 64.614 -2.014 1
1 863 . 3 1 1 A 65 65 ILE CB C 65 38.700 37.429 1.271 1
1 867 . 3 1 1 A 65 65 ILE N N 65 117.000 119.810 -2.810 1
1 868 . 3 1 1 A 66 66 ILE H H 66 7.980 7.629 0.351 1
1 869 . 3 1 1 A 66 66 ILE HA H 66 4.000 3.861 0.139 1
1 879 . 3 1 1 A 66 66 ILE C C 66 176.400 174.568 1.832 1
1 880 . 3 1 1 A 66 66 ILE CA C 66 63.100 63.492 -0.392 1
1 881 . 3 1 1 A 66 66 ILE CB C 66 38.800 36.706 2.094 1
1 885 . 3 1 1 A 66 66 ILE N N 66 120.700 121.351 -0.651 1
1 886 . 3 1 1 A 67 67 VAL H H 67 8.130 8.327 -0.197 1
1 887 . 3 1 1 A 67 67 VAL HA H 67 3.980 4.505 -0.525 1
1 895 . 3 1 1 A 67 67 VAL C C 67 177.300 175.843 1.457 1
1 896 . 3 1 1 A 67 67 VAL CA C 67 63.900 60.943 2.957 1
1 897 . 3 1 1 A 67 67 VAL CB C 67 32.500 33.924 -1.424 1
1 900 . 3 1 1 A 67 67 VAL N N 67 121.600 124.818 -3.218 1
1 901 . 3 1 1 A 68 68 ASN H H 68 8.170 8.684 -0.514 1
1 902 . 3 1 1 A 68 68 ASN HA H 68 4.680 4.555 0.125 1
1 907 . 3 1 1 A 68 68 ASN CA C 68 54.200 55.342 -1.142 1
1 908 . 3 1 1 A 68 68 ASN CB C 68 39.100 37.279 1.821 1
1 910 . 3 1 1 A 68 68 ASN N N 68 120.500 120.400 0.100 1
1 912 . 3 1 1 A 69 69 LYS H H 69 8.230 8.409 -0.179 1
1 913 . 3 1 1 A 69 69 LYS HA H 69 4.260 4.438 -0.178 1
1 922 . 3 1 1 A 69 69 LYS C C 69 176.900 176.627 0.273 1
1 923 . 3 1 1 A 69 69 LYS CA C 69 57.000 55.453 1.547 1
1 924 . 3 1 1 A 69 69 LYS CB C 69 32.800 33.582 -0.782 1
1 928 . 3 1 1 A 69 69 LYS N N 69 121.300 122.578 -1.278 1
1 929 . 3 1 1 A 70 70 LEU H H 70 8.150 8.357 -0.207 1
1 930 . 3 1 1 A 70 70 LEU HA H 70 4.300 4.228 0.072 1
1 940 . 3 1 1 A 70 70 LEU C C 70 178.900 177.467 1.433 1
1 941 . 3 1 1 A 70 70 LEU CA C 70 55.400 55.288 0.112 1
1 942 . 3 1 1 A 70 70 LEU CB C 70 42.100 42.203 -0.103 1
1 946 . 3 1 1 A 70 70 LEU N N 70 121.900 124.860 -2.960 1
1 947 . 3 1 1 A 71 71 GLU H H 71 8.210 8.674 -0.464 1
1 948 . 3 1 1 A 71 71 GLU HA H 71 4.180 4.203 -0.023 1
1 953 . 3 1 1 A 71 71 GLU C C 71 176.300 175.806 0.494 1
1 954 . 3 1 1 A 71 71 GLU CA C 71 56.600 55.397 1.203 1
1 955 . 3 1 1 A 71 71 GLU CB C 71 30.200 30.258 -0.058 1
1 957 . 3 1 1 A 71 71 GLU N N 71 120.900 121.053 -0.153 1
1 958 . 3 1 1 A 72 72 HIS H H 72 8.380 8.093 0.287 1
1 959 . 3 1 1 A 72 72 HIS HA H 72 4.600 4.388 0.212 1
1 962 . 3 1 1 A 72 72 HIS C C 72 174.600 175.375 -0.775 1
1 963 . 3 1 1 A 72 72 HIS CA C 72 55.600 56.364 -0.764 1
1 964 . 3 1 1 A 72 72 HIS CB C 72 29.600 29.028 0.572 1
1 965 . 3 1 1 A 72 72 HIS N N 72 119.300 119.654 -0.354 1
1 966 . 3 1 1 A 73 73 HIS H H 73 8.410 8.792 -0.382 1
1 967 . 3 1 1 A 73 73 HIS HA H 73 4.610 4.524 0.086 1
1 970 . 3 1 1 A 73 73 HIS C C 73 173.700 175.055 -1.355 1
1 971 . 3 1 1 A 73 73 HIS CA C 73 55.700 57.017 -1.317 1
1 972 . 3 1 1 A 73 73 HIS CB C 73 29.600 30.589 -0.989 1
1 973 . 3 1 1 A 73 73 HIS N N 73 119.410 125.246 -5.836 1
1 974 . 3 1 1 A 74 74 HIS H H 74 8.310 8.486 -0.176 1
1 975 . 3 1 1 A 74 74 HIS HA H 74 4.630 4.656 -0.026 1
1 978 . 3 1 1 A 74 74 HIS CA C 74 57.100 56.375 0.725 1
1 979 . 3 1 1 A 74 74 HIS CB C 74 29.800 30.264 -0.464 1
1 14 . 4 1 1 A 2 2 GLU H H 2 9.070 7.761 1.309 1
1 15 . 4 1 1 A 2 2 GLU HA H 2 4.520 4.500 0.020 1
1 20 . 4 1 1 A 2 2 GLU C C 2 176.300 176.229 0.071 1
1 21 . 4 1 1 A 2 2 GLU CA C 2 55.800 55.666 0.134 1
1 22 . 4 1 1 A 2 2 GLU CB C 2 31.000 30.273 0.727 1
1 24 . 4 1 1 A 2 2 GLU N N 2 123.100 117.117 5.983 1
1 25 . 4 1 1 A 3 3 LEU H H 3 8.750 8.782 -0.032 1
1 26 . 4 1 1 A 3 3 LEU HA H 3 3.750 4.081 -0.331 1
1 36 . 4 1 1 A 3 3 LEU C C 3 177.400 178.119 -0.719 1
1 37 . 4 1 1 A 3 3 LEU CA C 3 58.300 58.140 0.160 1
1 38 . 4 1 1 A 3 3 LEU CB C 3 41.500 41.272 0.228 1
1 42 . 4 1 1 A 3 3 LEU N N 3 122.600 121.585 1.015 1
1 43 . 4 1 1 A 4 4 SER H H 4 8.350 8.066 0.284 1
1 44 . 4 1 1 A 4 4 SER HA H 4 3.890 4.187 -0.297 1
1 47 . 4 1 1 A 4 4 SER C C 4 175.100 176.960 -1.860 1
1 48 . 4 1 1 A 4 4 SER CA C 4 61.500 61.077 0.423 1
1 49 . 4 1 1 A 4 4 SER CB C 4 62.000 63.218 -1.218 1
1 50 . 4 1 1 A 4 4 SER N N 4 112.900 114.493 -1.593 1
1 51 . 4 1 1 A 5 5 ASN H H 5 7.180 8.194 -1.014 1
1 52 . 4 1 1 A 5 5 ASN HA H 5 4.470 4.387 0.083 1
1 57 . 4 1 1 A 5 5 ASN C C 5 177.400 178.242 -0.842 1
1 58 . 4 1 1 A 5 5 ASN CA C 5 56.000 56.992 -0.992 1
1 59 . 4 1 1 A 5 5 ASN CB C 5 39.400 39.321 0.079 1
1 61 . 4 1 1 A 5 5 ASN N N 5 116.600 119.590 -2.990 1
1 63 . 4 1 1 A 6 6 GLU H H 6 7.950 7.735 0.215 1
1 64 . 4 1 1 A 6 6 GLU HA H 6 4.070 4.135 -0.065 1
1 69 . 4 1 1 A 6 6 GLU C C 6 178.500 178.649 -0.149 1
1 70 . 4 1 1 A 6 6 GLU CA C 6 58.100 59.014 -0.914 1
1 71 . 4 1 1 A 6 6 GLU CB C 6 29.300 29.485 -0.185 1
1 73 . 4 1 1 A 6 6 GLU N N 6 117.600 119.491 -1.891 1
1 74 . 4 1 1 A 7 7 LEU H H 7 8.140 7.793 0.347 1
1 75 . 4 1 1 A 7 7 LEU HA H 7 3.640 4.095 -0.455 1
1 85 . 4 1 1 A 7 7 LEU C C 7 177.700 178.286 -0.586 1
1 86 . 4 1 1 A 7 7 LEU CA C 7 58.300 57.747 0.553 1
1 87 . 4 1 1 A 7 7 LEU CB C 7 40.600 42.059 -1.459 1
1 91 . 4 1 1 A 7 7 LEU N N 7 118.500 121.258 -2.758 1
1 92 . 4 1 1 A 8 8 LYS H H 8 7.090 7.806 -0.716 1
1 93 . 4 1 1 A 8 8 LYS HA H 8 4.080 4.069 0.011 1
1 102 . 4 1 1 A 8 8 LYS C C 8 178.300 179.105 -0.805 1
1 103 . 4 1 1 A 8 8 LYS CA C 8 59.700 58.960 0.740 1
1 104 . 4 1 1 A 8 8 LYS CB C 8 32.300 31.931 0.369 1
1 108 . 4 1 1 A 8 8 LYS N N 8 118.200 119.448 -1.248 1
1 109 . 4 1 1 A 9 9 VAL H H 9 7.940 7.707 0.233 1
1 110 . 4 1 1 A 9 9 VAL HA H 9 3.440 3.499 -0.059 1
1 118 . 4 1 1 A 9 9 VAL C C 9 179.500 177.964 1.536 1
1 119 . 4 1 1 A 9 9 VAL CA C 9 66.700 66.648 0.052 1
1 120 . 4 1 1 A 9 9 VAL CB C 9 31.600 31.438 0.162 1
1 123 . 4 1 1 A 9 9 VAL N N 9 117.600 119.761 -2.161 1
1 124 . 4 1 1 A 10 10 GLU H H 10 7.830 8.169 -0.339 1
1 125 . 4 1 1 A 10 10 GLU HA H 10 4.130 4.012 0.118 1
1 130 . 4 1 1 A 10 10 GLU C C 10 178.700 179.001 -0.301 1
1 131 . 4 1 1 A 10 10 GLU CA C 10 58.300 59.217 -0.917 1
1 132 . 4 1 1 A 10 10 GLU CB C 10 28.500 29.102 -0.602 1
1 134 . 4 1 1 A 10 10 GLU N N 10 118.300 119.708 -1.408 1
1 135 . 4 1 1 A 11 11 ARG H H 11 8.330 7.497 0.833 1
1 136 . 4 1 1 A 11 11 ARG HA H 11 3.770 4.086 -0.316 1
1 144 . 4 1 1 A 11 11 ARG C C 11 174.600 178.991 -4.391 1
1 145 . 4 1 1 A 11 11 ARG CA C 11 61.300 59.169 2.131 1
1 146 . 4 1 1 A 11 11 ARG CB C 11 28.500 29.855 -1.355 1
1 149 . 4 1 1 A 11 11 ARG N N 11 121.400 119.612 1.788 1
1 151 . 4 1 1 A 12 12 ILE H H 12 8.540 8.324 0.216 1
1 152 . 4 1 1 A 12 12 ILE HA H 12 3.780 3.755 0.025 1
1 162 . 4 1 1 A 12 12 ILE C C 12 181.400 177.715 3.685 1
1 163 . 4 1 1 A 12 12 ILE CA C 12 64.800 65.254 -0.454 1
1 164 . 4 1 1 A 12 12 ILE CB C 12 37.700 37.359 0.341 1
1 168 . 4 1 1 A 12 12 ILE N N 12 118.700 119.928 -1.228 1
1 169 . 4 1 1 A 13 13 ARG H H 13 8.470 8.698 -0.228 1
1 170 . 4 1 1 A 13 13 ARG HA H 13 4.060 3.988 0.072 1
1 178 . 4 1 1 A 13 13 ARG C C 13 178.600 178.450 0.150 1
1 179 . 4 1 1 A 13 13 ARG CA C 13 59.600 59.416 0.184 1
1 180 . 4 1 1 A 13 13 ARG CB C 13 30.000 29.734 0.266 1
1 183 . 4 1 1 A 13 13 ARG N N 13 124.600 121.346 3.254 1
1 185 . 4 1 1 A 14 14 LEU H H 14 7.430 7.940 -0.510 1
1 186 . 4 1 1 A 14 14 LEU HA H 14 4.240 4.327 -0.087 1
1 196 . 4 1 1 A 14 14 LEU C C 14 176.000 176.437 -0.437 1
1 197 . 4 1 1 A 14 14 LEU CA C 14 55.300 54.758 0.542 1
1 198 . 4 1 1 A 14 14 LEU CB C 14 43.000 41.981 1.019 1
1 202 . 4 1 1 A 14 14 LEU N N 14 118.500 118.360 0.140 1
1 203 . 4 1 1 A 15 15 SER H H 15 8.260 8.422 -0.162 1
1 204 . 4 1 1 A 15 15 SER HA H 15 4.030 4.142 -0.112 1
1 207 . 4 1 1 A 15 15 SER C C 15 174.000 173.479 0.521 1
1 208 . 4 1 1 A 15 15 SER CA C 15 58.700 59.030 -0.330 1
1 209 . 4 1 1 A 15 15 SER CB C 15 61.300 60.919 0.381 1
1 210 . 4 1 1 A 15 15 SER N N 15 112.500 113.982 -1.482 1
1 211 . 4 1 1 A 16 16 LEU H H 16 7.310 7.752 -0.442 1
1 212 . 4 1 1 A 16 16 LEU HA H 16 4.880 4.470 0.410 1
1 222 . 4 1 1 A 16 16 LEU C C 16 177.900 176.714 1.186 1
1 223 . 4 1 1 A 16 16 LEU CA C 16 52.600 54.463 -1.863 1
1 224 . 4 1 1 A 16 16 LEU CB C 16 43.500 42.150 1.350 1
1 228 . 4 1 1 A 16 16 LEU N N 16 117.800 121.673 -3.873 1
1 229 . 4 1 1 A 17 17 THR H H 17 8.640 8.393 0.247 1
1 230 . 4 1 1 A 17 17 THR HA H 17 4.250 5.094 -0.844 1
1 235 . 4 1 1 A 17 17 THR C C 17 174.900 175.462 -0.562 1
1 236 . 4 1 1 A 17 17 THR CA C 17 60.500 60.457 0.043 1
1 237 . 4 1 1 A 17 17 THR CB C 17 70.500 70.645 -0.145 1
1 239 . 4 1 1 A 17 17 THR N N 17 115.200 112.072 3.128 1
1 240 . 4 1 1 A 18 18 ALA H H 18 8.820 9.115 -0.295 1
1 241 . 4 1 1 A 18 18 ALA HA H 18 3.680 4.015 -0.335 1
1 245 . 4 1 1 A 18 18 ALA C C 18 178.900 179.469 -0.569 1
1 246 . 4 1 1 A 18 18 ALA CA C 18 55.200 55.287 -0.087 1
1 247 . 4 1 1 A 18 18 ALA CB C 18 17.800 18.085 -0.285 1
1 248 . 4 1 1 A 18 18 ALA N N 18 125.600 127.027 -1.427 1
1 249 . 4 1 1 A 19 19 LYS H H 19 8.280 7.968 0.312 1
1 250 . 4 1 1 A 19 19 LYS HA H 19 3.740 3.990 -0.250 1
1 259 . 4 1 1 A 19 19 LYS C C 19 177.900 178.525 -0.625 1
1 260 . 4 1 1 A 19 19 LYS CA C 19 59.800 59.485 0.315 1
1 261 . 4 1 1 A 19 19 LYS CB C 19 33.300 32.360 0.940 1
1 265 . 4 1 1 A 19 19 LYS N N 19 115.800 119.191 -3.391 1
1 266 . 4 1 1 A 20 20 SER H H 20 7.860 7.752 0.108 1
1 267 . 4 1 1 A 20 20 SER HA H 20 4.210 4.217 -0.007 1
1 271 . 4 1 1 A 20 20 SER C C 20 177.200 177.536 -0.336 1
1 272 . 4 1 1 A 20 20 SER CA C 20 61.900 61.698 0.202 1
1 273 . 4 1 1 A 20 20 SER CB C 20 63.000 62.915 0.085 1
1 274 . 4 1 1 A 20 20 SER N N 20 114.600 114.829 -0.229 1
1 275 . 4 1 1 A 21 21 VAL H H 21 7.830 7.737 0.093 1
1 276 . 4 1 1 A 21 21 VAL HA H 21 3.280 3.653 -0.373 1
1 284 . 4 1 1 A 21 21 VAL C C 21 177.500 178.390 -0.890 1
1 285 . 4 1 1 A 21 21 VAL CA C 21 66.800 66.464 0.336 1
1 286 . 4 1 1 A 21 21 VAL CB C 21 31.400 31.567 -0.167 1
1 289 . 4 1 1 A 21 21 VAL N N 21 122.600 121.242 1.358 1
1 290 . 4 1 1 A 22 22 ALA H H 22 8.230 8.052 0.178 1
1 291 . 4 1 1 A 22 22 ALA HA H 22 3.510 3.913 -0.403 1
1 295 . 4 1 1 A 22 22 ALA C C 22 179.500 179.974 -0.474 1
1 296 . 4 1 1 A 22 22 ALA CA C 22 55.500 55.422 0.078 1
1 297 . 4 1 1 A 22 22 ALA CB C 22 16.900 18.145 -1.245 1
1 298 . 4 1 1 A 22 22 ALA N N 22 121.200 122.110 -0.910 1
1 299 . 4 1 1 A 23 23 GLU H H 23 7.900 7.791 0.109 1
1 300 . 4 1 1 A 23 23 GLU HA H 23 3.990 4.024 -0.034 1
1 305 . 4 1 1 A 23 23 GLU C C 23 180.000 179.257 0.743 1
1 306 . 4 1 1 A 23 23 GLU CA C 23 59.300 59.558 -0.258 1
1 307 . 4 1 1 A 23 23 GLU CB C 23 29.300 29.453 -0.153 1
1 309 . 4 1 1 A 23 23 GLU N N 23 115.300 118.123 -2.823 1
1 310 . 4 1 1 A 24 24 GLU H H 24 7.950 7.625 0.325 1
1 311 . 4 1 1 A 24 24 GLU HA H 24 4.060 4.086 -0.026 1
1 316 . 4 1 1 A 24 24 GLU C C 24 179.100 179.566 -0.466 1
1 317 . 4 1 1 A 24 24 GLU CA C 24 59.700 59.234 0.466 1
1 318 . 4 1 1 A 24 24 GLU CB C 24 29.500 29.862 -0.362 1
1 320 . 4 1 1 A 24 24 GLU N N 24 120.100 119.900 0.200 1
1 321 . 4 1 1 A 25 25 MET H H 25 8.150 8.279 -0.129 1
1 322 . 4 1 1 A 25 25 MET HA H 25 4.110 4.325 -0.215 1
1 330 . 4 1 1 A 25 25 MET C C 25 176.600 176.674 -0.074 1
1 331 . 4 1 1 A 25 25 MET CA C 25 57.100 56.862 0.238 1
1 332 . 4 1 1 A 25 25 MET CB C 25 34.900 32.680 2.220 1
1 335 . 4 1 1 A 25 25 MET N N 25 115.500 117.790 -2.290 1
1 336 . 4 1 1 A 26 26 GLY H H 26 7.940 9.019 -1.079 1
1 337 . 4 1 1 A 26 26 GLY HA2 H 26 3.860 3.901 -0.041 1
1 338 . 4 1 1 A 26 26 GLY HA3 H 26 3.960 3.902 0.058 1
1 339 . 4 1 1 A 26 26 GLY C C 26 175.100 173.900 1.200 1
1 340 . 4 1 1 A 26 26 GLY CA C 26 46.600 46.069 0.531 1
1 341 . 4 1 1 A 26 26 GLY N N 26 109.000 106.963 2.037 1
1 342 . 4 1 1 A 27 27 ILE H H 27 7.880 7.321 0.559 1
1 343 . 4 1 1 A 27 27 ILE HA H 27 4.790 4.804 -0.014 1
1 353 . 4 1 1 A 27 27 ILE C C 27 174.300 174.899 -0.599 1
1 354 . 4 1 1 A 27 27 ILE CA C 27 59.000 58.539 0.461 1
1 355 . 4 1 1 A 27 27 ILE CB C 27 40.900 41.343 -0.443 1
1 359 . 4 1 1 A 27 27 ILE N N 27 112.700 115.791 -3.091 1
1 360 . 4 1 1 A 28 28 SER H H 28 8.570 8.617 -0.047 1
1 361 . 4 1 1 A 28 28 SER HA H 28 4.540 4.499 0.041 1
1 364 . 4 1 1 A 28 28 SER C C 28 175.600 175.152 0.448 1
1 365 . 4 1 1 A 28 28 SER CA C 28 56.800 58.591 -1.791 1
1 366 . 4 1 1 A 28 28 SER CB C 28 65.500 63.989 1.511 1
1 367 . 4 1 1 A 28 28 SER N N 28 115.400 119.482 -4.082 1
1 368 . 4 1 1 A 29 29 ARG H H 29 8.980 8.665 0.315 1
1 369 . 4 1 1 A 29 29 ARG HA H 29 3.660 3.990 -0.330 1
1 377 . 4 1 1 A 29 29 ARG C C 29 178.700 178.107 0.593 1
1 378 . 4 1 1 A 29 29 ARG CA C 29 59.500 60.124 -0.624 1
1 379 . 4 1 1 A 29 29 ARG CB C 29 29.500 29.868 -0.368 1
1 382 . 4 1 1 A 29 29 ARG N N 29 122.000 124.850 -2.850 1
1 384 . 4 1 1 A 30 30 GLN H H 30 8.580 8.128 0.452 1
1 385 . 4 1 1 A 30 30 GLN HA H 30 3.860 4.092 -0.232 1
1 392 . 4 1 1 A 30 30 GLN C C 30 178.100 178.442 -0.342 1
1 393 . 4 1 1 A 30 30 GLN CA C 30 59.200 59.081 0.119 1
1 394 . 4 1 1 A 30 30 GLN CB C 30 28.100 28.340 -0.240 1
1 397 . 4 1 1 A 30 30 GLN N N 30 118.700 118.114 0.586 1
1 399 . 4 1 1 A 31 31 GLN H H 31 7.990 7.824 0.166 1
1 400 . 4 1 1 A 31 31 GLN HA H 31 3.980 3.986 -0.006 1
1 407 . 4 1 1 A 31 31 GLN C C 31 178.700 177.814 0.886 1
1 408 . 4 1 1 A 31 31 GLN CA C 31 59.100 58.747 0.353 1
1 409 . 4 1 1 A 31 31 GLN CB C 31 28.700 28.105 0.595 1
1 412 . 4 1 1 A 31 31 GLN N N 31 119.600 119.715 -0.115 1
1 414 . 4 1 1 A 32 32 LEU H H 32 7.630 7.648 -0.018 1
1 415 . 4 1 1 A 32 32 LEU HA H 32 3.740 4.131 -0.391 1
1 425 . 4 1 1 A 32 32 LEU C C 32 178.300 178.608 -0.308 1
1 426 . 4 1 1 A 32 32 LEU CA C 32 57.700 57.667 0.033 1
1 427 . 4 1 1 A 32 32 LEU CB C 32 41.500 41.358 0.142 1
1 431 . 4 1 1 A 32 32 LEU N N 32 120.700 120.727 -0.027 1
1 432 . 4 1 1 A 33 33 CYS H H 33 8.240 8.473 -0.233 1
1 433 . 4 1 1 A 33 33 CYS HA H 33 3.990 4.130 -0.140 1
1 436 . 4 1 1 A 33 33 CYS C C 33 177.000 176.950 0.050 1
1 437 . 4 1 1 A 33 33 CYS CA C 33 63.100 63.142 -0.042 1
1 438 . 4 1 1 A 33 33 CYS CB C 33 26.100 27.209 -1.109 1
1 439 . 4 1 1 A 33 33 CYS N N 33 117.400 117.383 0.017 1
1 440 . 4 1 1 A 34 34 ASN H H 34 8.210 8.222 -0.012 1
1 441 . 4 1 1 A 34 34 ASN HA H 34 4.370 4.441 -0.071 1
1 446 . 4 1 1 A 34 34 ASN C C 34 178.700 177.958 0.742 1
1 447 . 4 1 1 A 34 34 ASN CA C 34 56.000 56.495 -0.495 1
1 448 . 4 1 1 A 34 34 ASN CB C 34 37.800 39.647 -1.847 1
1 450 . 4 1 1 A 34 34 ASN N N 34 117.300 119.866 -2.566 1
1 452 . 4 1 1 A 35 35 ILE H H 35 7.850 7.504 0.346 1
1 453 . 4 1 1 A 35 35 ILE HA H 35 3.850 3.599 0.251 1
1 463 . 4 1 1 A 35 35 ILE C C 35 178.100 177.758 0.342 1
1 464 . 4 1 1 A 35 35 ILE CA C 35 64.800 65.520 -0.720 1
1 465 . 4 1 1 A 35 35 ILE CB C 35 38.000 37.910 0.090 1
1 469 . 4 1 1 A 35 35 ILE N N 35 120.400 119.700 0.700 1
1 470 . 4 1 1 A 36 36 GLU H H 36 7.680 7.969 -0.289 1
1 471 . 4 1 1 A 36 36 GLU HA H 36 4.120 4.081 0.039 1
1 476 . 4 1 1 A 36 36 GLU C C 36 176.300 177.901 -1.601 1
1 477 . 4 1 1 A 36 36 GLU CA C 36 58.600 59.485 -0.885 1
1 478 . 4 1 1 A 36 36 GLU CB C 36 30.000 29.475 0.525 1
1 480 . 4 1 1 A 36 36 GLU N N 36 116.500 119.584 -3.084 1
1 481 . 4 1 1 A 37 37 GLN H H 37 7.630 7.275 0.355 1
1 482 . 4 1 1 A 37 37 GLN HA H 37 4.540 4.419 0.121 1
1 489 . 4 1 1 A 37 37 GLN C C 37 176.000 175.418 0.582 1
1 490 . 4 1 1 A 37 37 GLN CA C 37 54.900 54.809 0.091 1
1 491 . 4 1 1 A 37 37 GLN CB C 37 29.600 29.983 -0.383 1
1 494 . 4 1 1 A 37 37 GLN N N 37 115.000 117.020 -2.020 1
1 496 . 4 1 1 A 38 38 SER H H 38 7.380 7.594 -0.214 1
1 497 . 4 1 1 A 38 38 SER HA H 38 4.410 4.433 -0.023 1
1 500 . 4 1 1 A 38 38 SER C C 38 175.500 174.212 1.288 1
1 501 . 4 1 1 A 38 38 SER CA C 38 59.200 58.483 0.717 1
1 502 . 4 1 1 A 38 38 SER CB C 38 64.100 63.778 0.322 1
1 503 . 4 1 1 A 38 38 SER N N 38 115.200 116.513 -1.313 1
1 504 . 4 1 1 A 39 39 GLU H H 39 9.040 8.201 0.839 1
1 505 . 4 1 1 A 39 39 GLU HA H 39 4.450 4.146 0.304 1
1 510 . 4 1 1 A 39 39 GLU C C 39 176.300 175.594 0.706 1
1 511 . 4 1 1 A 39 39 GLU CA C 39 57.100 57.091 0.009 1
1 512 . 4 1 1 A 39 39 GLU CB C 39 30.300 30.090 0.210 1
1 514 . 4 1 1 A 39 39 GLU N N 39 125.400 126.304 -0.904 1
1 515 . 4 1 1 A 40 40 THR H H 40 7.920 8.153 -0.233 1
1 516 . 4 1 1 A 40 40 THR HA H 40 4.590 4.510 0.080 1
1 521 . 4 1 1 A 40 40 THR C C 40 173.500 174.686 -1.186 1
1 522 . 4 1 1 A 40 40 THR CA C 40 60.500 60.799 -0.299 1
1 523 . 4 1 1 A 40 40 THR CB C 40 71.100 71.242 -0.142 1
1 525 . 4 1 1 A 40 40 THR N N 40 112.800 114.962 -2.162 1
1 526 . 4 1 1 A 41 41 ALA H H 41 8.780 8.458 0.322 1
1 527 . 4 1 1 A 41 41 ALA HA H 41 4.870 4.506 0.364 1
1 531 . 4 1 1 A 41 41 ALA CA C 41 49.700 50.967 -1.267 1
1 532 . 4 1 1 A 41 41 ALA CB C 41 19.300 17.716 1.584 1
1 533 . 4 1 1 A 41 41 ALA N N 41 127.000 123.772 3.228 1
1 534 . 4 1 1 A 42 42 PRO HA H 42 4.660 4.568 0.092 1
1 541 . 4 1 1 A 42 42 PRO C C 42 178.300 177.624 0.676 1
1 542 . 4 1 1 A 42 42 PRO CA C 42 62.500 62.837 -0.337 1
1 543 . 4 1 1 A 42 42 PRO CB C 42 32.600 32.567 0.033 1
1 546 . 4 1 1 A 43 43 VAL H H 43 8.840 8.677 0.163 1
1 547 . 4 1 1 A 43 43 VAL HA H 43 3.660 3.799 -0.139 1
1 555 . 4 1 1 A 43 43 VAL CA C 43 66.800 65.568 1.232 1
1 556 . 4 1 1 A 43 43 VAL CB C 43 31.100 31.592 -0.492 1
1 559 . 4 1 1 A 43 43 VAL N N 43 123.000 123.327 -0.327 1
1 560 . 4 1 1 A 44 44 VAL HA H 44 4.030 3.740 0.290 1
1 568 . 4 1 1 A 44 44 VAL C C 44 176.700 177.518 -0.818 1
1 569 . 4 1 1 A 44 44 VAL CA C 44 65.900 65.337 0.563 1
1 570 . 4 1 1 A 44 44 VAL CB C 44 30.900 31.173 -0.273 1
1 573 . 4 1 1 A 45 45 VAL H H 45 7.500 7.915 -0.415 1
1 574 . 4 1 1 A 45 45 VAL HA H 45 3.760 3.673 0.087 1
1 582 . 4 1 1 A 45 45 VAL C C 45 177.500 177.746 -0.246 1
1 583 . 4 1 1 A 45 45 VAL CA C 45 66.700 66.641 0.059 1
1 584 . 4 1 1 A 45 45 VAL CB C 45 31.000 31.479 -0.479 1
1 587 . 4 1 1 A 45 45 VAL N N 45 120.100 121.383 -1.283 1
1 588 . 4 1 1 A 46 46 LYS H H 46 7.610 7.812 -0.202 1
1 589 . 4 1 1 A 46 46 LYS HA H 46 4.140 4.083 0.057 1
1 598 . 4 1 1 A 46 46 LYS C C 46 179.500 178.459 1.041 1
1 599 . 4 1 1 A 46 46 LYS CA C 46 59.900 58.921 0.979 1
1 600 . 4 1 1 A 46 46 LYS CB C 46 31.500 32.040 -0.540 1
1 604 . 4 1 1 A 46 46 LYS N N 46 120.700 118.761 1.939 1
1 605 . 4 1 1 A 47 47 TYR H H 47 8.550 8.106 0.444 1
1 606 . 4 1 1 A 47 47 TYR HA H 47 5.000 4.204 0.796 1
1 613 . 4 1 1 A 47 47 TYR C C 47 177.300 177.195 0.105 1
1 614 . 4 1 1 A 47 47 TYR CA C 47 57.300 61.539 -4.239 1
1 615 . 4 1 1 A 47 47 TYR CB C 47 37.700 38.636 -0.936 1
1 620 . 4 1 1 A 47 47 TYR N N 47 122.700 121.241 1.459 1
1 621 . 4 1 1 A 48 48 ILE H H 48 8.250 8.024 0.226 1
1 622 . 4 1 1 A 48 48 ILE HA H 48 3.160 3.751 -0.591 1
1 632 . 4 1 1 A 48 48 ILE C C 48 177.100 178.112 -1.012 1
1 633 . 4 1 1 A 48 48 ILE CA C 48 67.000 65.636 1.364 1
1 634 . 4 1 1 A 48 48 ILE CB C 48 37.800 38.471 -0.671 1
1 638 . 4 1 1 A 48 48 ILE N N 48 121.200 120.857 0.343 1
1 639 . 4 1 1 A 49 49 ALA H H 49 8.310 8.124 0.186 1
1 640 . 4 1 1 A 49 49 ALA HA H 49 3.940 4.079 -0.139 1
1 644 . 4 1 1 A 49 49 ALA C C 49 179.300 179.540 -0.240 1
1 645 . 4 1 1 A 49 49 ALA CA C 49 55.500 54.998 0.502 1
1 646 . 4 1 1 A 49 49 ALA CB C 49 18.200 18.122 0.078 1
1 647 . 4 1 1 A 49 49 ALA N N 49 120.300 121.461 -1.161 1
1 648 . 4 1 1 A 50 50 PHE H H 50 8.630 8.109 0.521 1
1 649 . 4 1 1 A 50 50 PHE HA H 50 4.200 4.154 0.046 1
1 656 . 4 1 1 A 50 50 PHE C C 50 179.000 176.466 2.534 1
1 657 . 4 1 1 A 50 50 PHE CA C 50 61.300 61.315 -0.015 1
1 658 . 4 1 1 A 50 50 PHE CB C 50 39.200 39.098 0.102 1
1 663 . 4 1 1 A 50 50 PHE N N 50 121.300 120.543 0.757 1
1 664 . 4 1 1 A 51 51 LEU H H 51 8.920 8.179 0.741 1
1 665 . 4 1 1 A 51 51 LEU HA H 51 3.630 3.850 -0.220 1
1 675 . 4 1 1 A 51 51 LEU C C 51 180.000 179.175 0.825 1
1 676 . 4 1 1 A 51 51 LEU CA C 51 58.100 57.844 0.256 1
1 677 . 4 1 1 A 51 51 LEU CB C 51 39.800 41.435 -1.635 1
1 681 . 4 1 1 A 51 51 LEU N N 51 121.900 119.419 2.481 1
1 682 . 4 1 1 A 52 52 ARG H H 52 8.410 8.402 0.008 1
1 683 . 4 1 1 A 52 52 ARG HA H 52 4.420 3.935 0.485 1
1 691 . 4 1 1 A 52 52 ARG C C 52 179.800 179.422 0.378 1
1 692 . 4 1 1 A 52 52 ARG CA C 52 57.800 59.637 -1.837 1
1 693 . 4 1 1 A 52 52 ARG CB C 52 28.200 29.972 -1.772 1
1 695 . 4 1 1 A 52 52 ARG N N 52 120.500 120.531 -0.031 1
1 697 . 4 1 1 A 53 53 SER H H 53 8.480 8.611 -0.131 1
1 698 . 4 1 1 A 53 53 SER HA H 53 4.300 4.192 0.108 1
1 701 . 4 1 1 A 53 53 SER C C 53 174.600 175.282 -0.682 1
1 702 . 4 1 1 A 53 53 SER CA C 53 61.500 61.544 -0.044 1
1 703 . 4 1 1 A 53 53 SER CB C 53 62.300 62.854 -0.554 1
1 704 . 4 1 1 A 53 53 SER N N 53 119.500 117.139 2.361 1
1 705 . 4 1 1 A 54 54 LYS H H 54 7.080 7.282 -0.202 1
1 706 . 4 1 1 A 54 54 LYS HA H 54 4.350 4.272 0.078 1
1 715 . 4 1 1 A 54 54 LYS C C 54 176.500 176.852 -0.352 1
1 716 . 4 1 1 A 54 54 LYS CA C 54 53.700 55.788 -2.088 1
1 717 . 4 1 1 A 54 54 LYS CB C 54 31.800 32.145 -0.345 1
1 721 . 4 1 1 A 54 54 LYS N N 54 119.200 118.256 0.944 1
1 722 . 4 1 1 A 55 55 GLY H H 55 8.040 8.255 -0.215 1
1 723 . 4 1 1 A 55 55 GLY HA2 H 55 3.540 3.945 -0.405 1
1 724 . 4 1 1 A 55 55 GLY HA3 H 55 4.300 3.946 0.354 1
1 725 . 4 1 1 A 55 55 GLY C C 55 174.500 174.745 -0.245 1
1 726 . 4 1 1 A 55 55 GLY CA C 55 44.700 45.966 -1.266 1
1 727 . 4 1 1 A 55 55 GLY N N 55 106.600 107.964 -1.364 1
1 728 . 4 1 1 A 56 56 VAL H H 56 7.580 7.756 -0.176 1
1 729 . 4 1 1 A 56 56 VAL HA H 56 3.630 3.800 -0.170 1
1 737 . 4 1 1 A 56 56 VAL C C 56 174.700 175.311 -0.611 1
1 738 . 4 1 1 A 56 56 VAL CA C 56 64.000 65.487 -1.487 1
1 739 . 4 1 1 A 56 56 VAL CB C 56 31.600 31.957 -0.357 1
1 742 . 4 1 1 A 56 56 VAL N N 56 122.000 118.236 3.764 1
1 743 . 4 1 1 A 57 57 ASP H H 57 8.440 7.972 0.468 1
1 744 . 4 1 1 A 57 57 ASP HA H 57 4.500 4.333 0.167 1
1 747 . 4 1 1 A 57 57 ASP C C 57 176.900 176.158 0.742 1
1 748 . 4 1 1 A 57 57 ASP CA C 57 52.600 54.679 -2.079 1
1 749 . 4 1 1 A 57 57 ASP CB C 57 39.900 39.419 0.481 1
1 750 . 4 1 1 A 57 57 ASP N N 57 124.100 118.427 5.673 1
1 751 . 4 1 1 A 58 58 LEU H H 58 9.720 8.114 1.606 1
1 752 . 4 1 1 A 58 58 LEU HA H 58 4.020 4.459 -0.439 1
1 762 . 4 1 1 A 58 58 LEU C C 58 179.400 177.777 1.623 1
1 763 . 4 1 1 A 58 58 LEU CA C 58 56.300 55.012 1.288 1
1 764 . 4 1 1 A 58 58 LEU CB C 58 43.300 41.926 1.374 1
1 768 . 4 1 1 A 58 58 LEU N N 58 127.800 121.337 6.463 1
1 769 . 4 1 1 A 59 59 ASN H H 59 7.740 7.891 -0.151 1
1 770 . 4 1 1 A 59 59 ASN HA H 59 4.340 4.375 -0.035 1
1 775 . 4 1 1 A 59 59 ASN C C 59 176.300 178.016 -1.716 1
1 776 . 4 1 1 A 59 59 ASN CA C 59 56.300 56.397 -0.097 1
1 777 . 4 1 1 A 59 59 ASN CB C 59 36.400 37.954 -1.554 1
1 779 . 4 1 1 A 59 59 ASN N N 59 119.500 118.243 1.257 1
1 781 . 4 1 1 A 60 60 ALA H H 60 7.220 7.729 -0.509 1
1 782 . 4 1 1 A 60 60 ALA HA H 60 4.030 4.159 -0.129 1
1 786 . 4 1 1 A 60 60 ALA C C 60 180.100 180.051 0.049 1
1 787 . 4 1 1 A 60 60 ALA CA C 60 54.300 55.207 -0.907 1
1 788 . 4 1 1 A 60 60 ALA CB C 60 18.200 18.716 -0.516 1
1 789 . 4 1 1 A 60 60 ALA N N 60 121.400 122.578 -1.178 1
1 790 . 4 1 1 A 61 61 LEU H H 61 7.320 8.318 -0.998 1
1 791 . 4 1 1 A 61 61 LEU HA H 61 3.840 4.040 -0.200 1
1 801 . 4 1 1 A 61 61 LEU C C 61 177.200 179.098 -1.898 1
1 802 . 4 1 1 A 61 61 LEU CA C 61 58.500 57.902 0.598 1
1 803 . 4 1 1 A 61 61 LEU CB C 61 42.600 41.961 0.639 1
1 807 . 4 1 1 A 61 61 LEU N N 61 118.600 118.162 0.438 1
1 808 . 4 1 1 A 62 62 PHE H H 62 8.360 8.989 -0.629 1
1 809 . 4 1 1 A 62 62 PHE HA H 62 3.930 4.242 -0.312 1
1 817 . 4 1 1 A 62 62 PHE C C 62 178.200 177.985 0.215 1
1 818 . 4 1 1 A 62 62 PHE CA C 62 62.800 59.787 3.013 1
1 819 . 4 1 1 A 62 62 PHE CB C 62 38.500 38.829 -0.329 1
1 825 . 4 1 1 A 62 62 PHE N N 62 114.400 118.384 -3.984 1
1 826 . 4 1 1 A 63 63 ASP H H 63 8.680 8.280 0.400 1
1 827 . 4 1 1 A 63 63 ASP HA H 63 4.530 4.313 0.217 1
1 830 . 4 1 1 A 63 63 ASP C C 63 178.600 178.949 -0.349 1
1 831 . 4 1 1 A 63 63 ASP CA C 63 57.500 56.999 0.501 1
1 832 . 4 1 1 A 63 63 ASP CB C 63 39.600 40.237 -0.637 1
1 833 . 4 1 1 A 63 63 ASP N N 63 120.400 118.937 1.463 1
1 834 . 4 1 1 A 64 64 ARG H H 64 7.540 7.606 -0.066 1
1 835 . 4 1 1 A 64 64 ARG HA H 64 4.290 4.080 0.210 1
1 843 . 4 1 1 A 64 64 ARG C C 64 177.600 178.792 -1.192 1
1 844 . 4 1 1 A 64 64 ARG CA C 64 58.300 59.148 -0.848 1
1 845 . 4 1 1 A 64 64 ARG CB C 64 30.000 29.939 0.061 1
1 848 . 4 1 1 A 64 64 ARG N N 64 116.800 120.289 -3.489 1
1 850 . 4 1 1 A 65 65 ILE H H 65 7.260 7.335 -0.075 1
1 851 . 4 1 1 A 65 65 ILE HA H 65 4.130 3.683 0.447 1
1 861 . 4 1 1 A 65 65 ILE C C 65 177.000 176.905 0.095 1
1 862 . 4 1 1 A 65 65 ILE CA C 65 62.600 65.271 -2.671 1
1 863 . 4 1 1 A 65 65 ILE CB C 65 38.700 37.818 0.882 1
1 867 . 4 1 1 A 65 65 ILE N N 65 117.000 119.329 -2.329 1
1 868 . 4 1 1 A 66 66 ILE H H 66 7.980 7.597 0.383 1
1 869 . 4 1 1 A 66 66 ILE HA H 66 4.000 4.173 -0.173 1
1 879 . 4 1 1 A 66 66 ILE C C 66 176.400 176.701 -0.301 1
1 880 . 4 1 1 A 66 66 ILE CA C 66 63.100 60.970 2.130 1
1 881 . 4 1 1 A 66 66 ILE CB C 66 38.800 38.239 0.561 1
1 885 . 4 1 1 A 66 66 ILE N N 66 120.700 120.953 -0.253 1
1 886 . 4 1 1 A 67 67 VAL H H 67 8.130 8.617 -0.487 1
1 887 . 4 1 1 A 67 67 VAL HA H 67 3.980 4.078 -0.098 1
1 895 . 4 1 1 A 67 67 VAL C C 67 177.300 175.535 1.765 1
1 896 . 4 1 1 A 67 67 VAL CA C 67 63.900 62.367 1.533 1
1 897 . 4 1 1 A 67 67 VAL CB C 67 32.500 31.432 1.068 1
1 900 . 4 1 1 A 67 67 VAL N N 67 121.600 125.653 -4.053 1
1 901 . 4 1 1 A 68 68 ASN H H 68 8.170 9.087 -0.917 1
1 902 . 4 1 1 A 68 68 ASN HA H 68 4.680 4.335 0.345 1
1 907 . 4 1 1 A 68 68 ASN CA C 68 54.200 55.634 -1.434 1
1 908 . 4 1 1 A 68 68 ASN CB C 68 39.100 36.307 2.793 1
1 910 . 4 1 1 A 68 68 ASN N N 68 120.500 115.019 5.481 1
1 912 . 4 1 1 A 69 69 LYS H H 69 8.230 9.197 -0.967 1
1 913 . 4 1 1 A 69 69 LYS HA H 69 4.260 3.995 0.265 1
1 922 . 4 1 1 A 69 69 LYS C C 69 176.900 175.288 1.612 1
1 923 . 4 1 1 A 69 69 LYS CA C 69 57.000 57.835 -0.835 1
1 924 . 4 1 1 A 69 69 LYS CB C 69 32.800 32.250 0.550 1
1 928 . 4 1 1 A 69 69 LYS N N 69 121.300 118.373 2.927 1
1 929 . 4 1 1 A 70 70 LEU H H 70 8.150 7.950 0.200 1
1 930 . 4 1 1 A 70 70 LEU HA H 70 4.300 4.693 -0.393 1
1 940 . 4 1 1 A 70 70 LEU C C 70 178.900 177.091 1.809 1
1 941 . 4 1 1 A 70 70 LEU CA C 70 55.400 54.125 1.275 1
1 942 . 4 1 1 A 70 70 LEU CB C 70 42.100 43.612 -1.512 1
1 946 . 4 1 1 A 70 70 LEU N N 70 121.900 122.910 -1.010 1
1 947 . 4 1 1 A 71 71 GLU H H 71 8.210 8.587 -0.377 1
1 948 . 4 1 1 A 71 71 GLU HA H 71 4.180 4.311 -0.131 1
1 953 . 4 1 1 A 71 71 GLU C C 71 176.300 176.992 -0.692 1
1 954 . 4 1 1 A 71 71 GLU CA C 71 56.600 55.993 0.607 1
1 955 . 4 1 1 A 71 71 GLU CB C 71 30.200 28.526 1.674 1
1 957 . 4 1 1 A 71 71 GLU N N 71 120.900 124.578 -3.678 1
1 958 . 4 1 1 A 72 72 HIS H H 72 8.380 9.114 -0.734 1
1 959 . 4 1 1 A 72 72 HIS HA H 72 4.600 3.955 0.645 1
1 962 . 4 1 1 A 72 72 HIS C C 72 174.600 175.059 -0.459 1
1 963 . 4 1 1 A 72 72 HIS CA C 72 55.600 58.373 -2.773 1
1 964 . 4 1 1 A 72 72 HIS CB C 72 29.600 28.422 1.178 1
1 965 . 4 1 1 A 72 72 HIS N N 72 119.300 113.916 5.384 1
1 966 . 4 1 1 A 73 73 HIS H H 73 8.410 8.608 -0.198 1
1 967 . 4 1 1 A 73 73 HIS HA H 73 4.610 4.170 0.440 1
1 970 . 4 1 1 A 73 73 HIS C C 73 173.700 174.272 -0.572 1
1 971 . 4 1 1 A 73 73 HIS CA C 73 55.700 56.863 -1.163 1
1 972 . 4 1 1 A 73 73 HIS CB C 73 29.600 28.354 1.246 1
1 973 . 4 1 1 A 73 73 HIS N N 73 119.410 118.049 1.361 1
1 974 . 4 1 1 A 74 74 HIS H H 74 8.310 8.034 0.276 1
1 975 . 4 1 1 A 74 74 HIS HA H 74 4.630 4.918 -0.288 1
1 978 . 4 1 1 A 74 74 HIS CA C 74 57.100 54.374 2.726 1
1 979 . 4 1 1 A 74 74 HIS CB C 74 29.800 30.011 -0.211 1
1 14 . 5 1 1 A 2 2 GLU H H 2 9.070 8.421 0.649 1
1 15 . 5 1 1 A 2 2 GLU HA H 2 4.520 4.504 0.016 1
1 20 . 5 1 1 A 2 2 GLU C C 2 176.300 178.155 -1.855 1
1 21 . 5 1 1 A 2 2 GLU CA C 2 55.800 55.910 -0.110 1
1 22 . 5 1 1 A 2 2 GLU CB C 2 31.000 30.727 0.273 1
1 24 . 5 1 1 A 2 2 GLU N N 2 123.100 125.325 -2.225 1
1 25 . 5 1 1 A 3 3 LEU H H 3 8.750 8.785 -0.035 1
1 26 . 5 1 1 A 3 3 LEU HA H 3 3.750 4.060 -0.310 1
1 36 . 5 1 1 A 3 3 LEU C C 3 177.400 178.068 -0.668 1
1 37 . 5 1 1 A 3 3 LEU CA C 3 58.300 58.280 0.020 1
1 38 . 5 1 1 A 3 3 LEU CB C 3 41.500 41.314 0.186 1
1 42 . 5 1 1 A 3 3 LEU N N 3 122.600 126.837 -4.237 1
1 43 . 5 1 1 A 4 4 SER H H 4 8.350 8.073 0.277 1
1 44 . 5 1 1 A 4 4 SER HA H 4 3.890 4.189 -0.299 1
1 47 . 5 1 1 A 4 4 SER C C 4 175.100 177.191 -2.091 1
1 48 . 5 1 1 A 4 4 SER CA C 4 61.500 61.214 0.286 1
1 49 . 5 1 1 A 4 4 SER CB C 4 62.000 63.096 -1.096 1
1 50 . 5 1 1 A 4 4 SER N N 4 112.900 114.495 -1.595 1
1 51 . 5 1 1 A 5 5 ASN H H 5 7.180 8.332 -1.152 1
1 52 . 5 1 1 A 5 5 ASN HA H 5 4.470 4.393 0.077 1
1 57 . 5 1 1 A 5 5 ASN C C 5 177.400 177.845 -0.445 1
1 58 . 5 1 1 A 5 5 ASN CA C 5 56.000 57.086 -1.086 1
1 59 . 5 1 1 A 5 5 ASN CB C 5 39.400 39.603 -0.203 1
1 61 . 5 1 1 A 5 5 ASN N N 5 116.600 119.382 -2.782 1
1 63 . 5 1 1 A 6 6 GLU H H 6 7.950 7.789 0.161 1
1 64 . 5 1 1 A 6 6 GLU HA H 6 4.070 4.048 0.022 1
1 69 . 5 1 1 A 6 6 GLU C C 6 178.500 179.203 -0.703 1
1 70 . 5 1 1 A 6 6 GLU CA C 6 58.100 59.097 -0.997 1
1 71 . 5 1 1 A 6 6 GLU CB C 6 29.300 29.375 -0.075 1
1 73 . 5 1 1 A 6 6 GLU N N 6 117.600 118.233 -0.633 1
1 74 . 5 1 1 A 7 7 LEU H H 7 8.140 8.054 0.086 1
1 75 . 5 1 1 A 7 7 LEU HA H 7 3.640 4.093 -0.453 1
1 85 . 5 1 1 A 7 7 LEU C C 7 177.700 178.635 -0.935 1
1 86 . 5 1 1 A 7 7 LEU CA C 7 58.300 57.917 0.383 1
1 87 . 5 1 1 A 7 7 LEU CB C 7 40.600 41.828 -1.228 1
1 91 . 5 1 1 A 7 7 LEU N N 7 118.500 122.512 -4.012 1
1 92 . 5 1 1 A 8 8 LYS H H 8 7.090 8.101 -1.011 1
1 93 . 5 1 1 A 8 8 LYS HA H 8 4.080 3.994 0.086 1
1 102 . 5 1 1 A 8 8 LYS C C 8 178.300 179.202 -0.902 1
1 103 . 5 1 1 A 8 8 LYS CA C 8 59.700 59.592 0.108 1
1 104 . 5 1 1 A 8 8 LYS CB C 8 32.300 32.567 -0.267 1
1 108 . 5 1 1 A 8 8 LYS N N 8 118.200 118.968 -0.768 1
1 109 . 5 1 1 A 9 9 VAL H H 9 7.940 7.789 0.151 1
1 110 . 5 1 1 A 9 9 VAL HA H 9 3.440 3.544 -0.104 1
1 118 . 5 1 1 A 9 9 VAL C C 9 179.500 177.762 1.738 1
1 119 . 5 1 1 A 9 9 VAL CA C 9 66.700 66.494 0.206 1
1 120 . 5 1 1 A 9 9 VAL CB C 9 31.600 31.434 0.166 1
1 123 . 5 1 1 A 9 9 VAL N N 9 117.600 120.390 -2.790 1
1 124 . 5 1 1 A 10 10 GLU H H 10 7.830 8.282 -0.452 1
1 125 . 5 1 1 A 10 10 GLU HA H 10 4.130 3.978 0.152 1
1 130 . 5 1 1 A 10 10 GLU C C 10 178.700 178.925 -0.225 1
1 131 . 5 1 1 A 10 10 GLU CA C 10 58.300 60.053 -1.753 1
1 132 . 5 1 1 A 10 10 GLU CB C 10 28.500 29.214 -0.714 1
1 134 . 5 1 1 A 10 10 GLU N N 10 118.300 120.122 -1.822 1
1 135 . 5 1 1 A 11 11 ARG H H 11 8.330 7.395 0.935 1
1 136 . 5 1 1 A 11 11 ARG HA H 11 3.770 4.134 -0.364 1
1 144 . 5 1 1 A 11 11 ARG C C 11 174.600 178.930 -4.330 1
1 145 . 5 1 1 A 11 11 ARG CA C 11 61.300 58.614 2.686 1
1 146 . 5 1 1 A 11 11 ARG CB C 11 28.500 30.038 -1.538 1
1 149 . 5 1 1 A 11 11 ARG N N 11 121.400 119.346 2.054 1
1 151 . 5 1 1 A 12 12 ILE H H 12 8.540 8.338 0.202 1
1 152 . 5 1 1 A 12 12 ILE HA H 12 3.780 3.728 0.052 1
1 162 . 5 1 1 A 12 12 ILE C C 12 181.400 177.772 3.628 1
1 163 . 5 1 1 A 12 12 ILE CA C 12 64.800 65.140 -0.340 1
1 164 . 5 1 1 A 12 12 ILE CB C 12 37.700 37.620 0.080 1
1 168 . 5 1 1 A 12 12 ILE N N 12 118.700 119.487 -0.787 1
1 169 . 5 1 1 A 13 13 ARG H H 13 8.470 8.703 -0.233 1
1 170 . 5 1 1 A 13 13 ARG HA H 13 4.060 3.966 0.094 1
1 178 . 5 1 1 A 13 13 ARG C C 13 178.600 178.361 0.239 1
1 179 . 5 1 1 A 13 13 ARG CA C 13 59.600 59.329 0.271 1
1 180 . 5 1 1 A 13 13 ARG CB C 13 30.000 30.117 -0.117 1
1 183 . 5 1 1 A 13 13 ARG N N 13 124.600 121.573 3.027 1
1 185 . 5 1 1 A 14 14 LEU H H 14 7.430 8.040 -0.610 1
1 186 . 5 1 1 A 14 14 LEU HA H 14 4.240 4.364 -0.124 1
1 196 . 5 1 1 A 14 14 LEU C C 14 176.000 176.397 -0.397 1
1 197 . 5 1 1 A 14 14 LEU CA C 14 55.300 54.679 0.621 1
1 198 . 5 1 1 A 14 14 LEU CB C 14 43.000 41.995 1.005 1
1 202 . 5 1 1 A 14 14 LEU N N 14 118.500 118.419 0.081 1
1 203 . 5 1 1 A 15 15 SER H H 15 8.260 8.255 0.005 1
1 204 . 5 1 1 A 15 15 SER HA H 15 4.030 4.134 -0.104 1
1 207 . 5 1 1 A 15 15 SER C C 15 174.000 174.303 -0.303 1
1 208 . 5 1 1 A 15 15 SER CA C 15 58.700 59.054 -0.354 1
1 209 . 5 1 1 A 15 15 SER CB C 15 61.300 60.954 0.346 1
1 210 . 5 1 1 A 15 15 SER N N 15 112.500 113.949 -1.449 1
1 211 . 5 1 1 A 16 16 LEU H H 16 7.310 7.659 -0.349 1
1 212 . 5 1 1 A 16 16 LEU HA H 16 4.880 4.325 0.555 1
1 222 . 5 1 1 A 16 16 LEU C C 16 177.900 175.581 2.319 1
1 223 . 5 1 1 A 16 16 LEU CA C 16 52.600 55.412 -2.812 1
1 224 . 5 1 1 A 16 16 LEU CB C 16 43.500 43.096 0.404 1
1 228 . 5 1 1 A 16 16 LEU N N 16 117.800 124.467 -6.667 1
1 229 . 5 1 1 A 17 17 THR H H 17 8.640 8.382 0.258 1
1 230 . 5 1 1 A 17 17 THR HA H 17 4.250 4.961 -0.711 1
1 235 . 5 1 1 A 17 17 THR C C 17 174.900 175.429 -0.529 1
1 236 . 5 1 1 A 17 17 THR CA C 17 60.500 59.818 0.682 1
1 237 . 5 1 1 A 17 17 THR CB C 17 70.500 70.823 -0.323 1
1 239 . 5 1 1 A 17 17 THR N N 17 115.200 114.494 0.706 1
1 240 . 5 1 1 A 18 18 ALA H H 18 8.820 9.075 -0.255 1
1 241 . 5 1 1 A 18 18 ALA HA H 18 3.680 4.003 -0.323 1
1 245 . 5 1 1 A 18 18 ALA C C 18 178.900 179.493 -0.593 1
1 246 . 5 1 1 A 18 18 ALA CA C 18 55.200 55.216 -0.016 1
1 247 . 5 1 1 A 18 18 ALA CB C 18 17.800 18.077 -0.277 1
1 248 . 5 1 1 A 18 18 ALA N N 18 125.600 126.607 -1.007 1
1 249 . 5 1 1 A 19 19 LYS H H 19 8.280 7.973 0.307 1
1 250 . 5 1 1 A 19 19 LYS HA H 19 3.740 3.988 -0.248 1
1 259 . 5 1 1 A 19 19 LYS C C 19 177.900 178.655 -0.755 1
1 260 . 5 1 1 A 19 19 LYS CA C 19 59.800 59.395 0.405 1
1 261 . 5 1 1 A 19 19 LYS CB C 19 33.300 32.422 0.878 1
1 265 . 5 1 1 A 19 19 LYS N N 19 115.800 119.160 -3.360 1
1 266 . 5 1 1 A 20 20 SER H H 20 7.860 8.360 -0.500 1
1 267 . 5 1 1 A 20 20 SER HA H 20 4.210 4.163 0.047 1
1 271 . 5 1 1 A 20 20 SER C C 20 177.200 177.431 -0.231 1
1 272 . 5 1 1 A 20 20 SER CA C 20 61.900 61.305 0.595 1
1 273 . 5 1 1 A 20 20 SER CB C 20 63.000 62.293 0.707 1
1 274 . 5 1 1 A 20 20 SER N N 20 114.600 115.181 -0.581 1
1 275 . 5 1 1 A 21 21 VAL H H 21 7.830 7.813 0.017 1
1 276 . 5 1 1 A 21 21 VAL HA H 21 3.280 3.556 -0.276 1
1 284 . 5 1 1 A 21 21 VAL C C 21 177.500 177.990 -0.490 1
1 285 . 5 1 1 A 21 21 VAL CA C 21 66.800 66.464 0.336 1
1 286 . 5 1 1 A 21 21 VAL CB C 21 31.400 31.534 -0.134 1
1 289 . 5 1 1 A 21 21 VAL N N 21 122.600 122.554 0.046 1
1 290 . 5 1 1 A 22 22 ALA H H 22 8.230 8.414 -0.184 1
1 291 . 5 1 1 A 22 22 ALA HA H 22 3.510 3.901 -0.391 1
1 295 . 5 1 1 A 22 22 ALA C C 22 179.500 179.578 -0.078 1
1 296 . 5 1 1 A 22 22 ALA CA C 22 55.500 55.903 -0.403 1
1 297 . 5 1 1 A 22 22 ALA CB C 22 16.900 18.157 -1.257 1
1 298 . 5 1 1 A 22 22 ALA N N 22 121.200 122.449 -1.249 1
1 299 . 5 1 1 A 23 23 GLU H H 23 7.900 8.144 -0.244 1
1 300 . 5 1 1 A 23 23 GLU HA H 23 3.990 4.036 -0.046 1
1 305 . 5 1 1 A 23 23 GLU C C 23 180.000 178.569 1.431 1
1 306 . 5 1 1 A 23 23 GLU CA C 23 59.300 59.583 -0.283 1
1 307 . 5 1 1 A 23 23 GLU CB C 23 29.300 29.328 -0.028 1
1 309 . 5 1 1 A 23 23 GLU N N 23 115.300 118.362 -3.062 1
1 310 . 5 1 1 A 24 24 GLU H H 24 7.950 8.174 -0.224 1
1 311 . 5 1 1 A 24 24 GLU HA H 24 4.060 4.053 0.007 1
1 316 . 5 1 1 A 24 24 GLU C C 24 179.100 178.861 0.239 1
1 317 . 5 1 1 A 24 24 GLU CA C 24 59.700 59.465 0.235 1
1 318 . 5 1 1 A 24 24 GLU CB C 24 29.500 29.277 0.223 1
1 320 . 5 1 1 A 24 24 GLU N N 24 120.100 119.953 0.147 1
1 321 . 5 1 1 A 25 25 MET H H 25 8.150 8.354 -0.204 1
1 322 . 5 1 1 A 25 25 MET HA H 25 4.110 4.337 -0.227 1
1 330 . 5 1 1 A 25 25 MET C C 25 176.600 176.537 0.063 1
1 331 . 5 1 1 A 25 25 MET CA C 25 57.100 56.381 0.719 1
1 332 . 5 1 1 A 25 25 MET CB C 25 34.900 32.758 2.142 1
1 335 . 5 1 1 A 25 25 MET N N 25 115.500 116.987 -1.487 1
1 336 . 5 1 1 A 26 26 GLY H H 26 7.940 8.011 -0.071 1
1 337 . 5 1 1 A 26 26 GLY HA2 H 26 3.860 4.009 -0.149 1
1 338 . 5 1 1 A 26 26 GLY HA3 H 26 3.960 4.010 -0.050 1
1 339 . 5 1 1 A 26 26 GLY C C 26 175.100 173.815 1.285 1
1 340 . 5 1 1 A 26 26 GLY CA C 26 46.600 45.175 1.425 1
1 341 . 5 1 1 A 26 26 GLY N N 26 109.000 106.471 2.529 1
1 342 . 5 1 1 A 27 27 ILE H H 27 7.880 7.649 0.231 1
1 343 . 5 1 1 A 27 27 ILE HA H 27 4.790 4.807 -0.017 1
1 353 . 5 1 1 A 27 27 ILE C C 27 174.300 175.152 -0.852 1
1 354 . 5 1 1 A 27 27 ILE CA C 27 59.000 58.641 0.359 1
1 355 . 5 1 1 A 27 27 ILE CB C 27 40.900 41.453 -0.553 1
1 359 . 5 1 1 A 27 27 ILE N N 27 112.700 116.114 -3.414 1
1 360 . 5 1 1 A 28 28 SER H H 28 8.570 9.046 -0.476 1
1 361 . 5 1 1 A 28 28 SER HA H 28 4.540 4.804 -0.264 1
1 364 . 5 1 1 A 28 28 SER C C 28 175.600 175.861 -0.261 1
1 365 . 5 1 1 A 28 28 SER CA C 28 56.800 57.125 -0.325 1
1 366 . 5 1 1 A 28 28 SER CB C 28 65.500 65.662 -0.162 1
1 367 . 5 1 1 A 28 28 SER N N 28 115.400 117.139 -1.739 1
1 368 . 5 1 1 A 29 29 ARG H H 29 8.980 8.980 0.000 1
1 369 . 5 1 1 A 29 29 ARG HA H 29 3.660 3.957 -0.297 1
1 377 . 5 1 1 A 29 29 ARG C C 29 178.700 178.755 -0.055 1
1 378 . 5 1 1 A 29 29 ARG CA C 29 59.500 60.238 -0.738 1
1 379 . 5 1 1 A 29 29 ARG CB C 29 29.500 29.760 -0.260 1
1 382 . 5 1 1 A 29 29 ARG N N 29 122.000 120.400 1.600 1
1 384 . 5 1 1 A 30 30 GLN H H 30 8.580 7.973 0.607 1
1 385 . 5 1 1 A 30 30 GLN HA H 30 3.860 4.000 -0.140 1
1 392 . 5 1 1 A 30 30 GLN C C 30 178.100 178.306 -0.206 1
1 393 . 5 1 1 A 30 30 GLN CA C 30 59.200 59.301 -0.101 1
1 394 . 5 1 1 A 30 30 GLN CB C 30 28.100 28.224 -0.124 1
1 397 . 5 1 1 A 30 30 GLN N N 30 118.700 119.166 -0.466 1
1 399 . 5 1 1 A 31 31 GLN H H 31 7.990 7.666 0.324 1
1 400 . 5 1 1 A 31 31 GLN HA H 31 3.980 4.032 -0.052 1
1 407 . 5 1 1 A 31 31 GLN C C 31 178.700 178.675 0.025 1
1 408 . 5 1 1 A 31 31 GLN CA C 31 59.100 58.734 0.366 1
1 409 . 5 1 1 A 31 31 GLN CB C 31 28.700 28.249 0.451 1
1 412 . 5 1 1 A 31 31 GLN N N 31 119.600 118.615 0.985 1
1 414 . 5 1 1 A 32 32 LEU H H 32 7.630 7.687 -0.057 1
1 415 . 5 1 1 A 32 32 LEU HA H 32 3.740 4.129 -0.389 1
1 425 . 5 1 1 A 32 32 LEU C C 32 178.300 178.703 -0.403 1
1 426 . 5 1 1 A 32 32 LEU CA C 32 57.700 57.638 0.062 1
1 427 . 5 1 1 A 32 32 LEU CB C 32 41.500 41.350 0.150 1
1 431 . 5 1 1 A 32 32 LEU N N 32 120.700 122.208 -1.508 1
1 432 . 5 1 1 A 33 33 CYS H H 33 8.240 8.509 -0.269 1
1 433 . 5 1 1 A 33 33 CYS HA H 33 3.990 4.085 -0.095 1
1 436 . 5 1 1 A 33 33 CYS C C 33 177.000 176.911 0.089 1
1 437 . 5 1 1 A 33 33 CYS CA C 33 63.100 63.174 -0.074 1
1 438 . 5 1 1 A 33 33 CYS CB C 33 26.100 27.145 -1.045 1
1 439 . 5 1 1 A 33 33 CYS N N 33 117.400 117.485 -0.085 1
1 440 . 5 1 1 A 34 34 ASN H H 34 8.210 7.892 0.318 1
1 441 . 5 1 1 A 34 34 ASN HA H 34 4.370 4.440 -0.070 1
1 446 . 5 1 1 A 34 34 ASN C C 34 178.700 177.836 0.864 1
1 447 . 5 1 1 A 34 34 ASN CA C 34 56.000 56.711 -0.711 1
1 448 . 5 1 1 A 34 34 ASN CB C 34 37.800 39.578 -1.778 1
1 450 . 5 1 1 A 34 34 ASN N N 34 117.300 119.875 -2.575 1
1 452 . 5 1 1 A 35 35 ILE H H 35 7.850 7.460 0.390 1
1 453 . 5 1 1 A 35 35 ILE HA H 35 3.850 3.560 0.290 1
1 463 . 5 1 1 A 35 35 ILE C C 35 178.100 177.860 0.240 1
1 464 . 5 1 1 A 35 35 ILE CA C 35 64.800 65.482 -0.682 1
1 465 . 5 1 1 A 35 35 ILE CB C 35 38.000 37.792 0.208 1
1 469 . 5 1 1 A 35 35 ILE N N 35 120.400 119.451 0.949 1
1 470 . 5 1 1 A 36 36 GLU H H 36 7.680 7.993 -0.313 1
1 471 . 5 1 1 A 36 36 GLU HA H 36 4.120 4.123 -0.003 1
1 476 . 5 1 1 A 36 36 GLU C C 36 176.300 177.519 -1.219 1
1 477 . 5 1 1 A 36 36 GLU CA C 36 58.600 58.640 -0.040 1
1 478 . 5 1 1 A 36 36 GLU CB C 36 30.000 29.415 0.585 1
1 480 . 5 1 1 A 36 36 GLU N N 36 116.500 120.970 -4.470 1
1 481 . 5 1 1 A 37 37 GLN H H 37 7.630 7.432 0.198 1
1 482 . 5 1 1 A 37 37 GLN HA H 37 4.540 4.490 0.050 1
1 489 . 5 1 1 A 37 37 GLN C C 37 176.000 175.323 0.677 1
1 490 . 5 1 1 A 37 37 GLN CA C 37 54.900 55.114 -0.214 1
1 491 . 5 1 1 A 37 37 GLN CB C 37 29.600 29.238 0.362 1
1 494 . 5 1 1 A 37 37 GLN N N 37 115.000 116.866 -1.866 1
1 496 . 5 1 1 A 38 38 SER H H 38 7.380 7.908 -0.528 1
1 497 . 5 1 1 A 38 38 SER HA H 38 4.410 4.346 0.064 1
1 500 . 5 1 1 A 38 38 SER C C 38 175.500 173.599 1.901 1
1 501 . 5 1 1 A 38 38 SER CA C 38 59.200 58.572 0.628 1
1 502 . 5 1 1 A 38 38 SER CB C 38 64.100 63.481 0.619 1
1 503 . 5 1 1 A 38 38 SER N N 38 115.200 117.001 -1.801 1
1 504 . 5 1 1 A 39 39 GLU H H 39 9.040 9.157 -0.117 1
1 505 . 5 1 1 A 39 39 GLU HA H 39 4.450 4.530 -0.080 1
1 510 . 5 1 1 A 39 39 GLU C C 39 176.300 174.933 1.367 1
1 511 . 5 1 1 A 39 39 GLU CA C 39 57.100 57.986 -0.886 1
1 512 . 5 1 1 A 39 39 GLU CB C 39 30.300 32.514 -2.214 1
1 514 . 5 1 1 A 39 39 GLU N N 39 125.400 126.655 -1.255 1
1 515 . 5 1 1 A 40 40 THR H H 40 7.920 8.048 -0.128 1
1 516 . 5 1 1 A 40 40 THR HA H 40 4.590 4.917 -0.327 1
1 521 . 5 1 1 A 40 40 THR C C 40 173.500 173.872 -0.372 1
1 522 . 5 1 1 A 40 40 THR CA C 40 60.500 61.405 -0.905 1
1 523 . 5 1 1 A 40 40 THR CB C 40 71.100 70.791 0.309 1
1 525 . 5 1 1 A 40 40 THR N N 40 112.800 112.938 -0.138 1
1 526 . 5 1 1 A 41 41 ALA H H 41 8.780 8.763 0.017 1
1 527 . 5 1 1 A 41 41 ALA HA H 41 4.870 4.724 0.146 1
1 531 . 5 1 1 A 41 41 ALA CA C 41 49.700 50.486 -0.786 1
1 532 . 5 1 1 A 41 41 ALA CB C 41 19.300 18.720 0.580 1
1 533 . 5 1 1 A 41 41 ALA N N 41 127.000 129.663 -2.663 1
1 534 . 5 1 1 A 42 42 PRO HA H 42 4.660 4.622 0.038 1
1 541 . 5 1 1 A 42 42 PRO C C 42 178.300 177.663 0.637 1
1 542 . 5 1 1 A 42 42 PRO CA C 42 62.500 62.828 -0.328 1
1 543 . 5 1 1 A 42 42 PRO CB C 42 32.600 32.750 -0.150 1
1 546 . 5 1 1 A 43 43 VAL H H 43 8.840 8.660 0.180 1
1 547 . 5 1 1 A 43 43 VAL HA H 43 3.660 3.784 -0.124 1
1 555 . 5 1 1 A 43 43 VAL CA C 43 66.800 64.760 2.040 1
1 556 . 5 1 1 A 43 43 VAL CB C 43 31.100 31.527 -0.427 1
1 559 . 5 1 1 A 43 43 VAL N N 43 123.000 123.395 -0.395 1
1 560 . 5 1 1 A 44 44 VAL HA H 44 4.030 3.688 0.342 1
1 568 . 5 1 1 A 44 44 VAL C C 44 176.700 178.513 -1.813 1
1 569 . 5 1 1 A 44 44 VAL CA C 44 65.900 66.987 -1.087 1
1 570 . 5 1 1 A 44 44 VAL CB C 44 30.900 31.529 -0.629 1
1 573 . 5 1 1 A 45 45 VAL H H 45 7.500 7.852 -0.352 1
1 574 . 5 1 1 A 45 45 VAL HA H 45 3.760 3.594 0.166 1
1 582 . 5 1 1 A 45 45 VAL C C 45 177.500 177.672 -0.172 1
1 583 . 5 1 1 A 45 45 VAL CA C 45 66.700 66.856 -0.156 1
1 584 . 5 1 1 A 45 45 VAL CB C 45 31.000 31.328 -0.328 1
1 587 . 5 1 1 A 45 45 VAL N N 45 120.100 120.079 0.021 1
1 588 . 5 1 1 A 46 46 LYS H H 46 7.610 7.882 -0.272 1
1 589 . 5 1 1 A 46 46 LYS HA H 46 4.140 4.047 0.093 1
1 598 . 5 1 1 A 46 46 LYS C C 46 179.500 178.725 0.775 1
1 599 . 5 1 1 A 46 46 LYS CA C 46 59.900 59.142 0.758 1
1 600 . 5 1 1 A 46 46 LYS CB C 46 31.500 32.115 -0.615 1
1 604 . 5 1 1 A 46 46 LYS N N 46 120.700 118.658 2.042 1
1 605 . 5 1 1 A 47 47 TYR H H 47 8.550 8.131 0.419 1
1 606 . 5 1 1 A 47 47 TYR HA H 47 5.000 4.172 0.828 1
1 613 . 5 1 1 A 47 47 TYR C C 47 177.300 177.216 0.084 1
1 614 . 5 1 1 A 47 47 TYR CA C 47 57.300 61.313 -4.013 1
1 615 . 5 1 1 A 47 47 TYR CB C 47 37.700 38.625 -0.925 1
1 620 . 5 1 1 A 47 47 TYR N N 47 122.700 121.019 1.681 1
1 621 . 5 1 1 A 48 48 ILE H H 48 8.250 8.088 0.162 1
1 622 . 5 1 1 A 48 48 ILE HA H 48 3.160 3.641 -0.481 1
1 632 . 5 1 1 A 48 48 ILE C C 48 177.100 178.025 -0.925 1
1 633 . 5 1 1 A 48 48 ILE CA C 48 67.000 65.633 1.367 1
1 634 . 5 1 1 A 48 48 ILE CB C 48 37.800 38.481 -0.681 1
1 638 . 5 1 1 A 48 48 ILE N N 48 121.200 120.831 0.369 1
1 639 . 5 1 1 A 49 49 ALA H H 49 8.310 8.096 0.214 1
1 640 . 5 1 1 A 49 49 ALA HA H 49 3.940 4.061 -0.121 1
1 644 . 5 1 1 A 49 49 ALA C C 49 179.300 179.410 -0.110 1
1 645 . 5 1 1 A 49 49 ALA CA C 49 55.500 54.942 0.558 1
1 646 . 5 1 1 A 49 49 ALA CB C 49 18.200 18.169 0.031 1
1 647 . 5 1 1 A 49 49 ALA N N 49 120.300 121.257 -0.957 1
1 648 . 5 1 1 A 50 50 PHE H H 50 8.630 8.043 0.587 1
1 649 . 5 1 1 A 50 50 PHE HA H 50 4.200 4.120 0.080 1
1 656 . 5 1 1 A 50 50 PHE C C 50 179.000 176.549 2.451 1
1 657 . 5 1 1 A 50 50 PHE CA C 50 61.300 61.357 -0.057 1
1 658 . 5 1 1 A 50 50 PHE CB C 50 39.200 39.113 0.087 1
1 663 . 5 1 1 A 50 50 PHE N N 50 121.300 120.484 0.816 1
1 664 . 5 1 1 A 51 51 LEU H H 51 8.920 8.021 0.899 1
1 665 . 5 1 1 A 51 51 LEU HA H 51 3.630 3.910 -0.280 1
1 675 . 5 1 1 A 51 51 LEU C C 51 180.000 179.208 0.792 1
1 676 . 5 1 1 A 51 51 LEU CA C 51 58.100 57.770 0.330 1
1 677 . 5 1 1 A 51 51 LEU CB C 51 39.800 41.064 -1.264 1
1 681 . 5 1 1 A 51 51 LEU N N 51 121.900 118.873 3.027 1
1 682 . 5 1 1 A 52 52 ARG H H 52 8.410 8.720 -0.310 1
1 683 . 5 1 1 A 52 52 ARG HA H 52 4.420 3.893 0.527 1
1 691 . 5 1 1 A 52 52 ARG C C 52 179.800 179.291 0.509 1
1 692 . 5 1 1 A 52 52 ARG CA C 52 57.800 59.642 -1.842 1
1 693 . 5 1 1 A 52 52 ARG CB C 52 28.200 30.090 -1.890 1
1 695 . 5 1 1 A 52 52 ARG N N 52 120.500 120.320 0.180 1
1 697 . 5 1 1 A 53 53 SER H H 53 8.480 8.253 0.227 1
1 698 . 5 1 1 A 53 53 SER HA H 53 4.300 4.175 0.125 1
1 701 . 5 1 1 A 53 53 SER C C 53 174.600 175.290 -0.690 1
1 702 . 5 1 1 A 53 53 SER CA C 53 61.500 61.768 -0.268 1
1 703 . 5 1 1 A 53 53 SER CB C 53 62.300 62.816 -0.516 1
1 704 . 5 1 1 A 53 53 SER N N 53 119.500 117.082 2.418 1
1 705 . 5 1 1 A 54 54 LYS H H 54 7.080 7.516 -0.436 1
1 706 . 5 1 1 A 54 54 LYS HA H 54 4.350 4.319 0.031 1
1 715 . 5 1 1 A 54 54 LYS C C 54 176.500 176.925 -0.425 1
1 716 . 5 1 1 A 54 54 LYS CA C 54 53.700 55.917 -2.217 1
1 717 . 5 1 1 A 54 54 LYS CB C 54 31.800 32.557 -0.757 1
1 721 . 5 1 1 A 54 54 LYS N N 54 119.200 118.278 0.922 1
1 722 . 5 1 1 A 55 55 GLY H H 55 8.040 8.495 -0.455 1
1 723 . 5 1 1 A 55 55 GLY HA2 H 55 3.540 3.896 -0.356 1
1 724 . 5 1 1 A 55 55 GLY HA3 H 55 4.300 3.902 0.398 1
1 725 . 5 1 1 A 55 55 GLY C C 55 174.500 174.770 -0.270 1
1 726 . 5 1 1 A 55 55 GLY CA C 55 44.700 45.885 -1.185 1
1 727 . 5 1 1 A 55 55 GLY N N 55 106.600 108.115 -1.515 1
1 728 . 5 1 1 A 56 56 VAL H H 56 7.580 7.600 -0.020 1
1 729 . 5 1 1 A 56 56 VAL HA H 56 3.630 3.842 -0.212 1
1 737 . 5 1 1 A 56 56 VAL C C 56 174.700 174.994 -0.294 1
1 738 . 5 1 1 A 56 56 VAL CA C 56 64.000 62.399 1.601 1
1 739 . 5 1 1 A 56 56 VAL CB C 56 31.600 31.976 -0.376 1
1 742 . 5 1 1 A 56 56 VAL N N 56 122.000 122.071 -0.071 1
1 743 . 5 1 1 A 57 57 ASP H H 57 8.440 8.763 -0.323 1
1 744 . 5 1 1 A 57 57 ASP HA H 57 4.500 4.615 -0.115 1
1 747 . 5 1 1 A 57 57 ASP C C 57 176.900 177.357 -0.457 1
1 748 . 5 1 1 A 57 57 ASP CA C 57 52.600 54.784 -2.184 1
1 749 . 5 1 1 A 57 57 ASP CB C 57 39.900 40.381 -0.481 1
1 750 . 5 1 1 A 57 57 ASP N N 57 124.100 127.161 -3.061 1
1 751 . 5 1 1 A 58 58 LEU H H 58 9.720 8.382 1.338 1
1 752 . 5 1 1 A 58 58 LEU HA H 58 4.020 4.306 -0.286 1
1 762 . 5 1 1 A 58 58 LEU C C 58 179.400 178.337 1.063 1
1 763 . 5 1 1 A 58 58 LEU CA C 58 56.300 56.771 -0.471 1
1 764 . 5 1 1 A 58 58 LEU CB C 58 43.300 41.930 1.370 1
1 768 . 5 1 1 A 58 58 LEU N N 58 127.800 123.278 4.522 1
1 769 . 5 1 1 A 59 59 ASN H H 59 7.740 8.636 -0.896 1
1 770 . 5 1 1 A 59 59 ASN HA H 59 4.340 4.335 0.005 1
1 775 . 5 1 1 A 59 59 ASN C C 59 176.300 177.423 -1.123 1
1 776 . 5 1 1 A 59 59 ASN CA C 59 56.300 55.914 0.386 1
1 777 . 5 1 1 A 59 59 ASN CB C 59 36.400 37.607 -1.207 1
1 779 . 5 1 1 A 59 59 ASN N N 59 119.500 120.506 -1.006 1
1 781 . 5 1 1 A 60 60 ALA H H 60 7.220 7.789 -0.569 1
1 782 . 5 1 1 A 60 60 ALA HA H 60 4.030 4.159 -0.129 1
1 786 . 5 1 1 A 60 60 ALA C C 60 180.100 179.956 0.144 1
1 787 . 5 1 1 A 60 60 ALA CA C 60 54.300 55.170 -0.870 1
1 788 . 5 1 1 A 60 60 ALA CB C 60 18.200 18.566 -0.366 1
1 789 . 5 1 1 A 60 60 ALA N N 60 121.400 122.062 -0.662 1
1 790 . 5 1 1 A 61 61 LEU H H 61 7.320 8.285 -0.965 1
1 791 . 5 1 1 A 61 61 LEU HA H 61 3.840 4.050 -0.210 1
1 801 . 5 1 1 A 61 61 LEU C C 61 177.200 179.029 -1.829 1
1 802 . 5 1 1 A 61 61 LEU CA C 61 58.500 57.912 0.588 1
1 803 . 5 1 1 A 61 61 LEU CB C 61 42.600 41.908 0.692 1
1 807 . 5 1 1 A 61 61 LEU N N 61 118.600 118.577 0.023 1
1 808 . 5 1 1 A 62 62 PHE H H 62 8.360 8.407 -0.047 1
1 809 . 5 1 1 A 62 62 PHE HA H 62 3.930 4.119 -0.189 1
1 817 . 5 1 1 A 62 62 PHE C C 62 178.200 178.222 -0.022 1
1 818 . 5 1 1 A 62 62 PHE CA C 62 62.800 60.496 2.304 1
1 819 . 5 1 1 A 62 62 PHE CB C 62 38.500 38.857 -0.357 1
1 825 . 5 1 1 A 62 62 PHE N N 62 114.400 118.273 -3.873 1
1 826 . 5 1 1 A 63 63 ASP H H 63 8.680 8.802 -0.122 1
1 827 . 5 1 1 A 63 63 ASP HA H 63 4.530 4.249 0.281 1
1 830 . 5 1 1 A 63 63 ASP C C 63 178.600 179.175 -0.575 1
1 831 . 5 1 1 A 63 63 ASP CA C 63 57.500 57.255 0.245 1
1 832 . 5 1 1 A 63 63 ASP CB C 63 39.600 40.095 -0.495 1
1 833 . 5 1 1 A 63 63 ASP N N 63 120.400 118.619 1.781 1
1 834 . 5 1 1 A 64 64 ARG H H 64 7.540 7.631 -0.091 1
1 835 . 5 1 1 A 64 64 ARG HA H 64 4.290 4.074 0.216 1
1 843 . 5 1 1 A 64 64 ARG C C 64 177.600 178.910 -1.310 1
1 844 . 5 1 1 A 64 64 ARG CA C 64 58.300 59.099 -0.799 1
1 845 . 5 1 1 A 64 64 ARG CB C 64 30.000 29.998 0.002 1
1 848 . 5 1 1 A 64 64 ARG N N 64 116.800 119.851 -3.051 1
1 850 . 5 1 1 A 65 65 ILE H H 65 7.260 7.170 0.090 1
1 851 . 5 1 1 A 65 65 ILE HA H 65 4.130 3.825 0.305 1
1 861 . 5 1 1 A 65 65 ILE C C 65 177.000 176.337 0.663 1
1 862 . 5 1 1 A 65 65 ILE CA C 65 62.600 65.134 -2.534 1
1 863 . 5 1 1 A 65 65 ILE CB C 65 38.700 37.897 0.803 1
1 867 . 5 1 1 A 65 65 ILE N N 65 117.000 117.763 -0.763 1
1 868 . 5 1 1 A 66 66 ILE H H 66 7.980 7.840 0.140 1
1 869 . 5 1 1 A 66 66 ILE HA H 66 4.000 4.194 -0.194 1
1 879 . 5 1 1 A 66 66 ILE C C 66 176.400 175.576 0.824 1
1 880 . 5 1 1 A 66 66 ILE CA C 66 63.100 60.745 2.355 1
1 881 . 5 1 1 A 66 66 ILE CB C 66 38.800 38.912 -0.112 1
1 885 . 5 1 1 A 66 66 ILE N N 66 120.700 119.197 1.503 1
1 886 . 5 1 1 A 67 67 VAL H H 67 8.130 8.474 -0.344 1
1 887 . 5 1 1 A 67 67 VAL HA H 67 3.980 3.934 0.046 1
1 895 . 5 1 1 A 67 67 VAL C C 67 177.300 175.427 1.873 1
1 896 . 5 1 1 A 67 67 VAL CA C 67 63.900 62.276 1.624 1
1 897 . 5 1 1 A 67 67 VAL CB C 67 32.500 31.519 0.981 1
1 900 . 5 1 1 A 67 67 VAL N N 67 121.600 119.558 2.042 1
1 901 . 5 1 1 A 68 68 ASN H H 68 8.170 8.276 -0.106 1
1 902 . 5 1 1 A 68 68 ASN HA H 68 4.680 4.750 -0.070 1
1 907 . 5 1 1 A 68 68 ASN CA C 68 54.200 53.024 1.176 1
1 908 . 5 1 1 A 68 68 ASN CB C 68 39.100 39.171 -0.071 1
1 910 . 5 1 1 A 68 68 ASN N N 68 120.500 125.356 -4.856 1
1 912 . 5 1 1 A 69 69 LYS H H 69 8.230 8.963 -0.733 1
1 913 . 5 1 1 A 69 69 LYS HA H 69 4.260 4.514 -0.254 1
1 922 . 5 1 1 A 69 69 LYS C C 69 176.900 176.937 -0.037 1
1 923 . 5 1 1 A 69 69 LYS CA C 69 57.000 55.818 1.182 1
1 924 . 5 1 1 A 69 69 LYS CB C 69 32.800 32.111 0.689 1
1 928 . 5 1 1 A 69 69 LYS N N 69 121.300 121.459 -0.159 1
1 929 . 5 1 1 A 70 70 LEU H H 70 8.150 7.861 0.289 1
1 930 . 5 1 1 A 70 70 LEU HA H 70 4.300 4.292 0.008 1
1 940 . 5 1 1 A 70 70 LEU C C 70 178.900 176.844 2.056 1
1 941 . 5 1 1 A 70 70 LEU CA C 70 55.400 55.077 0.323 1
1 942 . 5 1 1 A 70 70 LEU CB C 70 42.100 41.171 0.929 1
1 946 . 5 1 1 A 70 70 LEU N N 70 121.900 117.678 4.222 1
1 947 . 5 1 1 A 71 71 GLU H H 71 8.210 7.757 0.453 1
1 948 . 5 1 1 A 71 71 GLU HA H 71 4.180 4.374 -0.194 1
1 953 . 5 1 1 A 71 71 GLU C C 71 176.300 176.869 -0.569 1
1 954 . 5 1 1 A 71 71 GLU CA C 71 56.600 57.425 -0.825 1
1 955 . 5 1 1 A 71 71 GLU CB C 71 30.200 30.091 0.109 1
1 957 . 5 1 1 A 71 71 GLU N N 71 120.900 120.733 0.167 1
1 958 . 5 1 1 A 72 72 HIS H H 72 8.380 8.985 -0.605 1
1 959 . 5 1 1 A 72 72 HIS HA H 72 4.600 4.933 -0.333 1
1 962 . 5 1 1 A 72 72 HIS C C 72 174.600 175.138 -0.538 1
1 963 . 5 1 1 A 72 72 HIS CA C 72 55.600 54.543 1.057 1
1 964 . 5 1 1 A 72 72 HIS CB C 72 29.600 29.153 0.447 1
1 965 . 5 1 1 A 72 72 HIS N N 72 119.300 120.097 -0.797 1
1 966 . 5 1 1 A 73 73 HIS H H 73 8.410 7.936 0.474 1
1 967 . 5 1 1 A 73 73 HIS HA H 73 4.610 4.110 0.500 1
1 970 . 5 1 1 A 73 73 HIS C C 73 173.700 174.932 -1.232 1
1 971 . 5 1 1 A 73 73 HIS CA C 73 55.700 56.874 -1.174 1
1 972 . 5 1 1 A 73 73 HIS CB C 73 29.600 29.655 -0.055 1
1 973 . 5 1 1 A 73 73 HIS N N 73 119.410 121.398 -1.988 1
1 974 . 5 1 1 A 74 74 HIS H H 74 8.310 8.302 0.008 1
1 975 . 5 1 1 A 74 74 HIS HA H 74 4.630 4.079 0.551 1
1 978 . 5 1 1 A 74 74 HIS CA C 74 57.100 58.738 -1.638 1
1 979 . 5 1 1 A 74 74 HIS CB C 74 29.800 28.387 1.413 1
1 14 . 6 1 1 A 2 2 GLU H H 2 9.070 8.870 0.200 1
1 15 . 6 1 1 A 2 2 GLU HA H 2 4.520 4.006 0.514 1
1 20 . 6 1 1 A 2 2 GLU C C 2 176.300 176.563 -0.263 1
1 21 . 6 1 1 A 2 2 GLU CA C 2 55.800 57.066 -1.266 1
1 22 . 6 1 1 A 2 2 GLU CB C 2 31.000 28.271 2.729 1
1 24 . 6 1 1 A 2 2 GLU N N 2 123.100 126.105 -3.005 1
1 25 . 6 1 1 A 3 3 LEU H H 3 8.750 8.083 0.667 1
1 26 . 6 1 1 A 3 3 LEU HA H 3 3.750 4.067 -0.317 1
1 36 . 6 1 1 A 3 3 LEU C C 3 177.400 178.952 -1.552 1
1 37 . 6 1 1 A 3 3 LEU CA C 3 58.300 57.824 0.476 1
1 38 . 6 1 1 A 3 3 LEU CB C 3 41.500 41.975 -0.475 1
1 42 . 6 1 1 A 3 3 LEU N N 3 122.600 127.712 -5.112 1
1 43 . 6 1 1 A 4 4 SER H H 4 8.350 8.313 0.037 1
1 44 . 6 1 1 A 4 4 SER HA H 4 3.890 4.160 -0.270 1
1 47 . 6 1 1 A 4 4 SER C C 4 175.100 176.563 -1.463 1
1 48 . 6 1 1 A 4 4 SER CA C 4 61.500 61.681 -0.181 1
1 49 . 6 1 1 A 4 4 SER CB C 4 62.000 61.917 0.083 1
1 50 . 6 1 1 A 4 4 SER N N 4 112.900 113.101 -0.201 1
1 51 . 6 1 1 A 5 5 ASN H H 5 7.180 8.137 -0.957 1
1 52 . 6 1 1 A 5 5 ASN HA H 5 4.470 4.380 0.090 1
1 57 . 6 1 1 A 5 5 ASN C C 5 177.400 177.754 -0.354 1
1 58 . 6 1 1 A 5 5 ASN CA C 5 56.000 56.814 -0.814 1
1 59 . 6 1 1 A 5 5 ASN CB C 5 39.400 39.080 0.320 1
1 61 . 6 1 1 A 5 5 ASN N N 5 116.600 120.057 -3.457 1
1 63 . 6 1 1 A 6 6 GLU H H 6 7.950 8.152 -0.202 1
1 64 . 6 1 1 A 6 6 GLU HA H 6 4.070 4.027 0.043 1
1 69 . 6 1 1 A 6 6 GLU C C 6 178.500 178.485 0.015 1
1 70 . 6 1 1 A 6 6 GLU CA C 6 58.100 59.159 -1.059 1
1 71 . 6 1 1 A 6 6 GLU CB C 6 29.300 29.550 -0.250 1
1 73 . 6 1 1 A 6 6 GLU N N 6 117.600 119.096 -1.496 1
1 74 . 6 1 1 A 7 7 LEU H H 7 8.140 8.362 -0.222 1
1 75 . 6 1 1 A 7 7 LEU HA H 7 3.640 4.110 -0.470 1
1 85 . 6 1 1 A 7 7 LEU C C 7 177.700 178.335 -0.635 1
1 86 . 6 1 1 A 7 7 LEU CA C 7 58.300 57.780 0.520 1
1 87 . 6 1 1 A 7 7 LEU CB C 7 40.600 41.630 -1.030 1
1 91 . 6 1 1 A 7 7 LEU N N 7 118.500 121.408 -2.908 1
1 92 . 6 1 1 A 8 8 LYS H H 8 7.090 8.558 -1.468 1
1 93 . 6 1 1 A 8 8 LYS HA H 8 4.080 4.041 0.039 1
1 102 . 6 1 1 A 8 8 LYS C C 8 178.300 178.836 -0.536 1
1 103 . 6 1 1 A 8 8 LYS CA C 8 59.700 59.125 0.575 1
1 104 . 6 1 1 A 8 8 LYS CB C 8 32.300 32.218 0.082 1
1 108 . 6 1 1 A 8 8 LYS N N 8 118.200 119.181 -0.981 1
1 109 . 6 1 1 A 9 9 VAL H H 9 7.940 8.379 -0.439 1
1 110 . 6 1 1 A 9 9 VAL HA H 9 3.440 3.526 -0.086 1
1 118 . 6 1 1 A 9 9 VAL C C 9 179.500 177.466 2.034 1
1 119 . 6 1 1 A 9 9 VAL CA C 9 66.700 66.574 0.126 1
1 120 . 6 1 1 A 9 9 VAL CB C 9 31.600 31.332 0.268 1
1 123 . 6 1 1 A 9 9 VAL N N 9 117.600 119.393 -1.793 1
1 124 . 6 1 1 A 10 10 GLU H H 10 7.830 7.935 -0.105 1
1 125 . 6 1 1 A 10 10 GLU HA H 10 4.130 3.957 0.173 1
1 130 . 6 1 1 A 10 10 GLU C C 10 178.700 179.172 -0.472 1
1 131 . 6 1 1 A 10 10 GLU CA C 10 58.300 59.552 -1.252 1
1 132 . 6 1 1 A 10 10 GLU CB C 10 28.500 28.857 -0.357 1
1 134 . 6 1 1 A 10 10 GLU N N 10 118.300 118.441 -0.141 1
1 135 . 6 1 1 A 11 11 ARG H H 11 8.330 7.787 0.543 1
1 136 . 6 1 1 A 11 11 ARG HA H 11 3.770 4.087 -0.317 1
1 144 . 6 1 1 A 11 11 ARG C C 11 174.600 178.892 -4.292 1
1 145 . 6 1 1 A 11 11 ARG CA C 11 61.300 58.954 2.346 1
1 146 . 6 1 1 A 11 11 ARG CB C 11 28.500 29.967 -1.467 1
1 149 . 6 1 1 A 11 11 ARG N N 11 121.400 120.310 1.090 1
1 151 . 6 1 1 A 12 12 ILE H H 12 8.540 8.179 0.361 1
1 152 . 6 1 1 A 12 12 ILE HA H 12 3.780 3.743 0.037 1
1 162 . 6 1 1 A 12 12 ILE C C 12 181.400 177.627 3.773 1
1 163 . 6 1 1 A 12 12 ILE CA C 12 64.800 65.233 -0.433 1
1 164 . 6 1 1 A 12 12 ILE CB C 12 37.700 37.261 0.439 1
1 168 . 6 1 1 A 12 12 ILE N N 12 118.700 119.684 -0.984 1
1 169 . 6 1 1 A 13 13 ARG H H 13 8.470 8.482 -0.012 1
1 170 . 6 1 1 A 13 13 ARG HA H 13 4.060 4.022 0.038 1
1 178 . 6 1 1 A 13 13 ARG C C 13 178.600 178.189 0.411 1
1 179 . 6 1 1 A 13 13 ARG CA C 13 59.600 59.406 0.194 1
1 180 . 6 1 1 A 13 13 ARG CB C 13 30.000 29.785 0.215 1
1 183 . 6 1 1 A 13 13 ARG N N 13 124.600 121.425 3.175 1
1 185 . 6 1 1 A 14 14 LEU H H 14 7.430 7.975 -0.545 1
1 186 . 6 1 1 A 14 14 LEU HA H 14 4.240 4.369 -0.129 1
1 196 . 6 1 1 A 14 14 LEU C C 14 176.000 176.368 -0.368 1
1 197 . 6 1 1 A 14 14 LEU CA C 14 55.300 54.489 0.811 1
1 198 . 6 1 1 A 14 14 LEU CB C 14 43.000 41.965 1.035 1
1 202 . 6 1 1 A 14 14 LEU N N 14 118.500 118.379 0.121 1
1 203 . 6 1 1 A 15 15 SER H H 15 8.260 8.006 0.254 1
1 204 . 6 1 1 A 15 15 SER HA H 15 4.030 4.179 -0.149 1
1 207 . 6 1 1 A 15 15 SER C C 15 174.000 173.643 0.357 1
1 208 . 6 1 1 A 15 15 SER CA C 15 58.700 58.940 -0.240 1
1 209 . 6 1 1 A 15 15 SER CB C 15 61.300 60.756 0.544 1
1 210 . 6 1 1 A 15 15 SER N N 15 112.500 114.119 -1.619 1
1 211 . 6 1 1 A 16 16 LEU H H 16 7.310 7.866 -0.556 1
1 212 . 6 1 1 A 16 16 LEU HA H 16 4.880 4.532 0.348 1
1 222 . 6 1 1 A 16 16 LEU C C 16 177.900 177.446 0.454 1
1 223 . 6 1 1 A 16 16 LEU CA C 16 52.600 54.108 -1.508 1
1 224 . 6 1 1 A 16 16 LEU CB C 16 43.500 43.120 0.380 1
1 228 . 6 1 1 A 16 16 LEU N N 16 117.800 121.840 -4.040 1
1 229 . 6 1 1 A 17 17 THR H H 17 8.640 8.471 0.169 1
1 230 . 6 1 1 A 17 17 THR HA H 17 4.250 4.927 -0.677 1
1 235 . 6 1 1 A 17 17 THR C C 17 174.900 175.475 -0.575 1
1 236 . 6 1 1 A 17 17 THR CA C 17 60.500 60.265 0.235 1
1 237 . 6 1 1 A 17 17 THR CB C 17 70.500 70.439 0.061 1
1 239 . 6 1 1 A 17 17 THR N N 17 115.200 113.167 2.033 1
1 240 . 6 1 1 A 18 18 ALA H H 18 8.820 9.178 -0.358 1
1 241 . 6 1 1 A 18 18 ALA HA H 18 3.680 3.998 -0.318 1
1 245 . 6 1 1 A 18 18 ALA C C 18 178.900 179.745 -0.845 1
1 246 . 6 1 1 A 18 18 ALA CA C 18 55.200 55.234 -0.034 1
1 247 . 6 1 1 A 18 18 ALA CB C 18 17.800 18.108 -0.308 1
1 248 . 6 1 1 A 18 18 ALA N N 18 125.600 126.986 -1.386 1
1 249 . 6 1 1 A 19 19 LYS H H 19 8.280 8.140 0.140 1
1 250 . 6 1 1 A 19 19 LYS HA H 19 3.740 4.004 -0.264 1
1 259 . 6 1 1 A 19 19 LYS C C 19 177.900 178.814 -0.914 1
1 260 . 6 1 1 A 19 19 LYS CA C 19 59.800 59.241 0.559 1
1 261 . 6 1 1 A 19 19 LYS CB C 19 33.300 32.156 1.144 1
1 265 . 6 1 1 A 19 19 LYS N N 19 115.800 118.019 -2.219 1
1 266 . 6 1 1 A 20 20 SER H H 20 7.860 7.725 0.135 1
1 267 . 6 1 1 A 20 20 SER HA H 20 4.210 4.241 -0.031 1
1 271 . 6 1 1 A 20 20 SER C C 20 177.200 177.498 -0.298 1
1 272 . 6 1 1 A 20 20 SER CA C 20 61.900 61.606 0.294 1
1 273 . 6 1 1 A 20 20 SER CB C 20 63.000 62.973 0.027 1
1 274 . 6 1 1 A 20 20 SER N N 20 114.600 114.596 0.004 1
1 275 . 6 1 1 A 21 21 VAL H H 21 7.830 7.993 -0.163 1
1 276 . 6 1 1 A 21 21 VAL HA H 21 3.280 3.602 -0.322 1
1 284 . 6 1 1 A 21 21 VAL C C 21 177.500 178.416 -0.916 1
1 285 . 6 1 1 A 21 21 VAL CA C 21 66.800 66.639 0.161 1
1 286 . 6 1 1 A 21 21 VAL CB C 21 31.400 31.559 -0.159 1
1 289 . 6 1 1 A 21 21 VAL N N 21 122.600 121.247 1.353 1
1 290 . 6 1 1 A 22 22 ALA H H 22 8.230 8.277 -0.047 1
1 291 . 6 1 1 A 22 22 ALA HA H 22 3.510 3.966 -0.456 1
1 295 . 6 1 1 A 22 22 ALA C C 22 179.500 179.240 0.260 1
1 296 . 6 1 1 A 22 22 ALA CA C 22 55.500 55.397 0.103 1
1 297 . 6 1 1 A 22 22 ALA CB C 22 16.900 17.697 -0.797 1
1 298 . 6 1 1 A 22 22 ALA N N 22 121.200 121.928 -0.728 1
1 299 . 6 1 1 A 23 23 GLU H H 23 7.900 8.253 -0.353 1
1 300 . 6 1 1 A 23 23 GLU HA H 23 3.990 4.022 -0.032 1
1 305 . 6 1 1 A 23 23 GLU C C 23 180.000 179.073 0.927 1
1 306 . 6 1 1 A 23 23 GLU CA C 23 59.300 59.674 -0.374 1
1 307 . 6 1 1 A 23 23 GLU CB C 23 29.300 29.216 0.084 1
1 309 . 6 1 1 A 23 23 GLU N N 23 115.300 118.939 -3.639 1
1 310 . 6 1 1 A 24 24 GLU H H 24 7.950 7.933 0.017 1
1 311 . 6 1 1 A 24 24 GLU HA H 24 4.060 4.080 -0.020 1
1 316 . 6 1 1 A 24 24 GLU C C 24 179.100 179.655 -0.555 1
1 317 . 6 1 1 A 24 24 GLU CA C 24 59.700 59.219 0.481 1
1 318 . 6 1 1 A 24 24 GLU CB C 24 29.500 29.806 -0.306 1
1 320 . 6 1 1 A 24 24 GLU N N 24 120.100 119.753 0.347 1
1 321 . 6 1 1 A 25 25 MET H H 25 8.150 8.261 -0.111 1
1 322 . 6 1 1 A 25 25 MET HA H 25 4.110 4.331 -0.221 1
1 330 . 6 1 1 A 25 25 MET C C 25 176.600 176.692 -0.092 1
1 331 . 6 1 1 A 25 25 MET CA C 25 57.100 56.896 0.204 1
1 332 . 6 1 1 A 25 25 MET CB C 25 34.900 32.689 2.211 1
1 335 . 6 1 1 A 25 25 MET N N 25 115.500 117.595 -2.095 1
1 336 . 6 1 1 A 26 26 GLY H H 26 7.940 8.919 -0.979 1
1 337 . 6 1 1 A 26 26 GLY HA2 H 26 3.860 3.939 -0.079 1
1 338 . 6 1 1 A 26 26 GLY HA3 H 26 3.960 3.946 0.014 1
1 339 . 6 1 1 A 26 26 GLY C C 26 175.100 173.912 1.188 1
1 340 . 6 1 1 A 26 26 GLY CA C 26 46.600 46.129 0.471 1
1 341 . 6 1 1 A 26 26 GLY N N 26 109.000 106.980 2.020 1
1 342 . 6 1 1 A 27 27 ILE H H 27 7.880 7.348 0.532 1
1 343 . 6 1 1 A 27 27 ILE HA H 27 4.790 4.843 -0.053 1
1 353 . 6 1 1 A 27 27 ILE C C 27 174.300 174.963 -0.663 1
1 354 . 6 1 1 A 27 27 ILE CA C 27 59.000 58.600 0.400 1
1 355 . 6 1 1 A 27 27 ILE CB C 27 40.900 41.502 -0.602 1
1 359 . 6 1 1 A 27 27 ILE N N 27 112.700 115.707 -3.007 1
1 360 . 6 1 1 A 28 28 SER H H 28 8.570 8.734 -0.164 1
1 361 . 6 1 1 A 28 28 SER HA H 28 4.540 4.520 0.020 1
1 364 . 6 1 1 A 28 28 SER C C 28 175.600 175.621 -0.021 1
1 365 . 6 1 1 A 28 28 SER CA C 28 56.800 58.066 -1.266 1
1 366 . 6 1 1 A 28 28 SER CB C 28 65.500 63.990 1.510 1
1 367 . 6 1 1 A 28 28 SER N N 28 115.400 119.547 -4.147 1
1 368 . 6 1 1 A 29 29 ARG H H 29 8.980 9.085 -0.105 1
1 369 . 6 1 1 A 29 29 ARG HA H 29 3.660 3.957 -0.297 1
1 377 . 6 1 1 A 29 29 ARG C C 29 178.700 178.757 -0.057 1
1 378 . 6 1 1 A 29 29 ARG CA C 29 59.500 60.255 -0.755 1
1 379 . 6 1 1 A 29 29 ARG CB C 29 29.500 29.771 -0.271 1
1 382 . 6 1 1 A 29 29 ARG N N 29 122.000 124.858 -2.858 1
1 384 . 6 1 1 A 30 30 GLN H H 30 8.580 8.018 0.562 1
1 385 . 6 1 1 A 30 30 GLN HA H 30 3.860 4.041 -0.181 1
1 392 . 6 1 1 A 30 30 GLN C C 30 178.100 178.256 -0.156 1
1 393 . 6 1 1 A 30 30 GLN CA C 30 59.200 59.256 -0.056 1
1 394 . 6 1 1 A 30 30 GLN CB C 30 28.100 28.210 -0.110 1
1 397 . 6 1 1 A 30 30 GLN N N 30 118.700 119.214 -0.514 1
1 399 . 6 1 1 A 31 31 GLN H H 31 7.990 7.882 0.108 1
1 400 . 6 1 1 A 31 31 GLN HA H 31 3.980 4.243 -0.263 1
1 407 . 6 1 1 A 31 31 GLN C C 31 178.700 178.637 0.063 1
1 408 . 6 1 1 A 31 31 GLN CA C 31 59.100 58.770 0.330 1
1 409 . 6 1 1 A 31 31 GLN CB C 31 28.700 28.241 0.459 1
1 412 . 6 1 1 A 31 31 GLN N N 31 119.600 118.608 0.992 1
1 414 . 6 1 1 A 32 32 LEU H H 32 7.630 7.757 -0.127 1
1 415 . 6 1 1 A 32 32 LEU HA H 32 3.740 4.110 -0.370 1
1 425 . 6 1 1 A 32 32 LEU C C 32 178.300 178.652 -0.352 1
1 426 . 6 1 1 A 32 32 LEU CA C 32 57.700 57.777 -0.077 1
1 427 . 6 1 1 A 32 32 LEU CB C 32 41.500 41.414 0.086 1
1 431 . 6 1 1 A 32 32 LEU N N 32 120.700 122.311 -1.611 1
1 432 . 6 1 1 A 33 33 CYS H H 33 8.240 8.507 -0.267 1
1 433 . 6 1 1 A 33 33 CYS HA H 33 3.990 4.129 -0.139 1
1 436 . 6 1 1 A 33 33 CYS C C 33 177.000 177.107 -0.107 1
1 437 . 6 1 1 A 33 33 CYS CA C 33 63.100 63.291 -0.191 1
1 438 . 6 1 1 A 33 33 CYS CB C 33 26.100 27.022 -0.922 1
1 439 . 6 1 1 A 33 33 CYS N N 33 117.400 117.369 0.031 1
1 440 . 6 1 1 A 34 34 ASN H H 34 8.210 7.990 0.220 1
1 441 . 6 1 1 A 34 34 ASN HA H 34 4.370 4.463 -0.093 1
1 446 . 6 1 1 A 34 34 ASN C C 34 178.700 178.314 0.386 1
1 447 . 6 1 1 A 34 34 ASN CA C 34 56.000 56.607 -0.607 1
1 448 . 6 1 1 A 34 34 ASN CB C 34 37.800 37.921 -0.121 1
1 450 . 6 1 1 A 34 34 ASN N N 34 117.300 118.390 -1.090 1
1 452 . 6 1 1 A 35 35 ILE H H 35 7.850 7.538 0.312 1
1 453 . 6 1 1 A 35 35 ILE HA H 35 3.850 3.761 0.089 1
1 463 . 6 1 1 A 35 35 ILE C C 35 178.100 177.980 0.120 1
1 464 . 6 1 1 A 35 35 ILE CA C 35 64.800 65.486 -0.686 1
1 465 . 6 1 1 A 35 35 ILE CB C 35 38.000 37.786 0.214 1
1 469 . 6 1 1 A 35 35 ILE N N 35 120.400 120.544 -0.144 1
1 470 . 6 1 1 A 36 36 GLU H H 36 7.680 7.939 -0.259 1
1 471 . 6 1 1 A 36 36 GLU HA H 36 4.120 4.087 0.033 1
1 476 . 6 1 1 A 36 36 GLU C C 36 176.300 177.594 -1.294 1
1 477 . 6 1 1 A 36 36 GLU CA C 36 58.600 58.644 -0.044 1
1 478 . 6 1 1 A 36 36 GLU CB C 36 30.000 29.423 0.577 1
1 480 . 6 1 1 A 36 36 GLU N N 36 116.500 120.784 -4.284 1
1 481 . 6 1 1 A 37 37 GLN H H 37 7.630 7.592 0.038 1
1 482 . 6 1 1 A 37 37 GLN HA H 37 4.540 4.328 0.212 1
1 489 . 6 1 1 A 37 37 GLN C C 37 176.000 175.800 0.200 1
1 490 . 6 1 1 A 37 37 GLN CA C 37 54.900 56.429 -1.529 1
1 491 . 6 1 1 A 37 37 GLN CB C 37 29.600 29.609 -0.009 1
1 494 . 6 1 1 A 37 37 GLN N N 37 115.000 116.492 -1.492 1
1 496 . 6 1 1 A 38 38 SER H H 38 7.380 7.818 -0.438 1
1 497 . 6 1 1 A 38 38 SER HA H 38 4.410 4.902 -0.492 1
1 500 . 6 1 1 A 38 38 SER C C 38 175.500 172.150 3.350 1
1 501 . 6 1 1 A 38 38 SER CA C 38 59.200 57.861 1.339 1
1 502 . 6 1 1 A 38 38 SER CB C 38 64.100 66.030 -1.930 1
1 503 . 6 1 1 A 38 38 SER N N 38 115.200 113.043 2.157 1
1 504 . 6 1 1 A 39 39 GLU H H 39 9.040 9.140 -0.100 1
1 505 . 6 1 1 A 39 39 GLU HA H 39 4.450 5.154 -0.704 1
1 510 . 6 1 1 A 39 39 GLU C C 39 176.300 175.775 0.525 1
1 511 . 6 1 1 A 39 39 GLU CA C 39 57.100 54.798 2.302 1
1 512 . 6 1 1 A 39 39 GLU CB C 39 30.300 33.105 -2.805 1
1 514 . 6 1 1 A 39 39 GLU N N 39 125.400 127.366 -1.966 1
1 515 . 6 1 1 A 40 40 THR H H 40 7.920 8.678 -0.758 1
1 516 . 6 1 1 A 40 40 THR HA H 40 4.590 5.028 -0.438 1
1 521 . 6 1 1 A 40 40 THR C C 40 173.500 173.847 -0.347 1
1 522 . 6 1 1 A 40 40 THR CA C 40 60.500 60.267 0.233 1
1 523 . 6 1 1 A 40 40 THR CB C 40 71.100 70.264 0.836 1
1 525 . 6 1 1 A 40 40 THR N N 40 112.800 116.986 -4.186 1
1 526 . 6 1 1 A 41 41 ALA H H 41 8.780 8.703 0.077 1
1 527 . 6 1 1 A 41 41 ALA HA H 41 4.870 4.993 -0.123 1
1 531 . 6 1 1 A 41 41 ALA CA C 41 49.700 49.298 0.402 1
1 532 . 6 1 1 A 41 41 ALA CB C 41 19.300 20.144 -0.844 1
1 533 . 6 1 1 A 41 41 ALA N N 41 127.000 125.855 1.145 1
1 534 . 6 1 1 A 42 42 PRO HA H 42 4.660 4.677 -0.017 1
1 541 . 6 1 1 A 42 42 PRO C C 42 178.300 177.710 0.590 1
1 542 . 6 1 1 A 42 42 PRO CA C 42 62.500 62.585 -0.085 1
1 543 . 6 1 1 A 42 42 PRO CB C 42 32.600 32.865 -0.265 1
1 546 . 6 1 1 A 43 43 VAL H H 43 8.840 8.665 0.175 1
1 547 . 6 1 1 A 43 43 VAL HA H 43 3.660 3.787 -0.127 1
1 555 . 6 1 1 A 43 43 VAL CA C 43 66.800 65.219 1.581 1
1 556 . 6 1 1 A 43 43 VAL CB C 43 31.100 31.456 -0.356 1
1 559 . 6 1 1 A 43 43 VAL N N 43 123.000 122.535 0.465 1
1 560 . 6 1 1 A 44 44 VAL HA H 44 4.030 3.588 0.442 1
1 568 . 6 1 1 A 44 44 VAL C C 44 176.700 178.534 -1.834 1
1 569 . 6 1 1 A 44 44 VAL CA C 44 65.900 66.966 -1.066 1
1 570 . 6 1 1 A 44 44 VAL CB C 44 30.900 31.552 -0.652 1
1 573 . 6 1 1 A 45 45 VAL H H 45 7.500 7.962 -0.462 1
1 574 . 6 1 1 A 45 45 VAL HA H 45 3.760 3.543 0.217 1
1 582 . 6 1 1 A 45 45 VAL C C 45 177.500 177.558 -0.058 1
1 583 . 6 1 1 A 45 45 VAL CA C 45 66.700 66.842 -0.142 1
1 584 . 6 1 1 A 45 45 VAL CB C 45 31.000 31.323 -0.323 1
1 587 . 6 1 1 A 45 45 VAL N N 45 120.100 120.086 0.014 1
1 588 . 6 1 1 A 46 46 LYS H H 46 7.610 7.382 0.228 1
1 589 . 6 1 1 A 46 46 LYS HA H 46 4.140 4.065 0.075 1
1 598 . 6 1 1 A 46 46 LYS C C 46 179.500 178.501 0.999 1
1 599 . 6 1 1 A 46 46 LYS CA C 46 59.900 58.978 0.922 1
1 600 . 6 1 1 A 46 46 LYS CB C 46 31.500 32.028 -0.528 1
1 604 . 6 1 1 A 46 46 LYS N N 46 120.700 118.674 2.026 1
1 605 . 6 1 1 A 47 47 TYR H H 47 8.550 8.146 0.404 1
1 606 . 6 1 1 A 47 47 TYR HA H 47 5.000 4.173 0.827 1
1 613 . 6 1 1 A 47 47 TYR C C 47 177.300 177.210 0.090 1
1 614 . 6 1 1 A 47 47 TYR CA C 47 57.300 61.333 -4.033 1
1 615 . 6 1 1 A 47 47 TYR CB C 47 37.700 38.618 -0.918 1
1 620 . 6 1 1 A 47 47 TYR N N 47 122.700 120.844 1.856 1
1 621 . 6 1 1 A 48 48 ILE H H 48 8.250 8.080 0.170 1
1 622 . 6 1 1 A 48 48 ILE HA H 48 3.160 3.771 -0.611 1
1 632 . 6 1 1 A 48 48 ILE C C 48 177.100 177.961 -0.861 1
1 633 . 6 1 1 A 48 48 ILE CA C 48 67.000 65.624 1.376 1
1 634 . 6 1 1 A 48 48 ILE CB C 48 37.800 38.582 -0.782 1
1 638 . 6 1 1 A 48 48 ILE N N 48 121.200 120.797 0.403 1
1 639 . 6 1 1 A 49 49 ALA H H 49 8.310 7.998 0.312 1
1 640 . 6 1 1 A 49 49 ALA HA H 49 3.940 4.080 -0.140 1
1 644 . 6 1 1 A 49 49 ALA C C 49 179.300 179.583 -0.283 1
1 645 . 6 1 1 A 49 49 ALA CA C 49 55.500 54.856 0.644 1
1 646 . 6 1 1 A 49 49 ALA CB C 49 18.200 18.208 -0.008 1
1 647 . 6 1 1 A 49 49 ALA N N 49 120.300 121.266 -0.966 1
1 648 . 6 1 1 A 50 50 PHE H H 50 8.630 8.150 0.480 1
1 649 . 6 1 1 A 50 50 PHE HA H 50 4.200 4.154 0.046 1
1 656 . 6 1 1 A 50 50 PHE C C 50 179.000 176.687 2.313 1
1 657 . 6 1 1 A 50 50 PHE CA C 50 61.300 61.374 -0.074 1
1 658 . 6 1 1 A 50 50 PHE CB C 50 39.200 39.174 0.026 1
1 663 . 6 1 1 A 50 50 PHE N N 50 121.300 120.445 0.855 1
1 664 . 6 1 1 A 51 51 LEU H H 51 8.920 8.186 0.734 1
1 665 . 6 1 1 A 51 51 LEU HA H 51 3.630 3.860 -0.230 1
1 675 . 6 1 1 A 51 51 LEU C C 51 180.000 179.261 0.739 1
1 676 . 6 1 1 A 51 51 LEU CA C 51 58.100 57.653 0.447 1
1 677 . 6 1 1 A 51 51 LEU CB C 51 39.800 41.378 -1.578 1
1 681 . 6 1 1 A 51 51 LEU N N 51 121.900 118.728 3.172 1
1 682 . 6 1 1 A 52 52 ARG H H 52 8.410 8.071 0.339 1
1 683 . 6 1 1 A 52 52 ARG HA H 52 4.420 4.041 0.379 1
1 691 . 6 1 1 A 52 52 ARG C C 52 179.800 178.987 0.813 1
1 692 . 6 1 1 A 52 52 ARG CA C 52 57.800 59.723 -1.923 1
1 693 . 6 1 1 A 52 52 ARG CB C 52 28.200 30.021 -1.821 1
1 695 . 6 1 1 A 52 52 ARG N N 52 120.500 119.427 1.073 1
1 697 . 6 1 1 A 53 53 SER H H 53 8.480 7.649 0.831 1
1 698 . 6 1 1 A 53 53 SER HA H 53 4.300 3.997 0.303 1
1 701 . 6 1 1 A 53 53 SER C C 53 174.600 175.565 -0.965 1
1 702 . 6 1 1 A 53 53 SER CA C 53 61.500 62.204 -0.704 1
1 703 . 6 1 1 A 53 53 SER CB C 53 62.300 62.692 -0.392 1
1 704 . 6 1 1 A 53 53 SER N N 53 119.500 116.716 2.784 1
1 705 . 6 1 1 A 54 54 LYS H H 54 7.080 7.278 -0.198 1
1 706 . 6 1 1 A 54 54 LYS HA H 54 4.350 4.271 0.079 1
1 715 . 6 1 1 A 54 54 LYS C C 54 176.500 176.878 -0.378 1
1 716 . 6 1 1 A 54 54 LYS CA C 54 53.700 55.727 -2.027 1
1 717 . 6 1 1 A 54 54 LYS CB C 54 31.800 32.726 -0.926 1
1 721 . 6 1 1 A 54 54 LYS N N 54 119.200 117.963 1.237 1
1 722 . 6 1 1 A 55 55 GLY H H 55 8.040 8.357 -0.317 1
1 723 . 6 1 1 A 55 55 GLY HA2 H 55 3.540 3.871 -0.331 1
1 724 . 6 1 1 A 55 55 GLY HA3 H 55 4.300 3.875 0.425 1
1 725 . 6 1 1 A 55 55 GLY C C 55 174.500 174.858 -0.358 1
1 726 . 6 1 1 A 55 55 GLY CA C 55 44.700 45.996 -1.296 1
1 727 . 6 1 1 A 55 55 GLY N N 55 106.600 108.305 -1.705 1
1 728 . 6 1 1 A 56 56 VAL H H 56 7.580 7.593 -0.013 1
1 729 . 6 1 1 A 56 56 VAL HA H 56 3.630 3.849 -0.219 1
1 737 . 6 1 1 A 56 56 VAL C C 56 174.700 175.243 -0.543 1
1 738 . 6 1 1 A 56 56 VAL CA C 56 64.000 62.389 1.611 1
1 739 . 6 1 1 A 56 56 VAL CB C 56 31.600 32.016 -0.416 1
1 742 . 6 1 1 A 56 56 VAL N N 56 122.000 121.903 0.097 1
1 743 . 6 1 1 A 57 57 ASP H H 57 8.440 8.823 -0.383 1
1 744 . 6 1 1 A 57 57 ASP HA H 57 4.500 4.694 -0.194 1
1 747 . 6 1 1 A 57 57 ASP C C 57 176.900 176.935 -0.035 1
1 748 . 6 1 1 A 57 57 ASP CA C 57 52.600 53.640 -1.040 1
1 749 . 6 1 1 A 57 57 ASP CB C 57 39.900 39.261 0.639 1
1 750 . 6 1 1 A 57 57 ASP N N 57 124.100 127.826 -3.726 1
1 751 . 6 1 1 A 58 58 LEU H H 58 9.720 8.053 1.667 1
1 752 . 6 1 1 A 58 58 LEU HA H 58 4.020 4.291 -0.271 1
1 762 . 6 1 1 A 58 58 LEU C C 58 179.400 178.770 0.630 1
1 763 . 6 1 1 A 58 58 LEU CA C 58 56.300 57.377 -1.077 1
1 764 . 6 1 1 A 58 58 LEU CB C 58 43.300 41.559 1.741 1
1 768 . 6 1 1 A 58 58 LEU N N 58 127.800 122.250 5.550 1
1 769 . 6 1 1 A 59 59 ASN H H 59 7.740 8.236 -0.496 1
1 770 . 6 1 1 A 59 59 ASN HA H 59 4.340 4.400 -0.060 1
1 775 . 6 1 1 A 59 59 ASN C C 59 176.300 178.075 -1.775 1
1 776 . 6 1 1 A 59 59 ASN CA C 59 56.300 56.255 0.045 1
1 777 . 6 1 1 A 59 59 ASN CB C 59 36.400 37.694 -1.294 1
1 779 . 6 1 1 A 59 59 ASN N N 59 119.500 117.724 1.776 1
1 781 . 6 1 1 A 60 60 ALA H H 60 7.220 7.896 -0.676 1
1 782 . 6 1 1 A 60 60 ALA HA H 60 4.030 4.142 -0.112 1
1 786 . 6 1 1 A 60 60 ALA C C 60 180.100 180.131 -0.031 1
1 787 . 6 1 1 A 60 60 ALA CA C 60 54.300 55.181 -0.881 1
1 788 . 6 1 1 A 60 60 ALA CB C 60 18.200 18.559 -0.359 1
1 789 . 6 1 1 A 60 60 ALA N N 60 121.400 122.647 -1.247 1
1 790 . 6 1 1 A 61 61 LEU H H 61 7.320 8.314 -0.994 1
1 791 . 6 1 1 A 61 61 LEU HA H 61 3.840 4.051 -0.211 1
1 801 . 6 1 1 A 61 61 LEU C C 61 177.200 179.286 -2.086 1
1 802 . 6 1 1 A 61 61 LEU CA C 61 58.500 57.953 0.547 1
1 803 . 6 1 1 A 61 61 LEU CB C 61 42.600 42.385 0.215 1
1 807 . 6 1 1 A 61 61 LEU N N 61 118.600 118.211 0.389 1
1 808 . 6 1 1 A 62 62 PHE H H 62 8.360 8.560 -0.200 1
1 809 . 6 1 1 A 62 62 PHE HA H 62 3.930 4.255 -0.325 1
1 817 . 6 1 1 A 62 62 PHE C C 62 178.200 178.297 -0.097 1
1 818 . 6 1 1 A 62 62 PHE CA C 62 62.800 60.211 2.589 1
1 819 . 6 1 1 A 62 62 PHE CB C 62 38.500 38.238 0.262 1
1 825 . 6 1 1 A 62 62 PHE N N 62 114.400 118.201 -3.801 1
1 826 . 6 1 1 A 63 63 ASP H H 63 8.680 8.703 -0.023 1
1 827 . 6 1 1 A 63 63 ASP HA H 63 4.530 4.322 0.208 1
1 830 . 6 1 1 A 63 63 ASP C C 63 178.600 178.789 -0.189 1
1 831 . 6 1 1 A 63 63 ASP CA C 63 57.500 57.074 0.426 1
1 832 . 6 1 1 A 63 63 ASP CB C 63 39.600 40.214 -0.614 1
1 833 . 6 1 1 A 63 63 ASP N N 63 120.400 118.987 1.413 1
1 834 . 6 1 1 A 64 64 ARG H H 64 7.540 8.076 -0.536 1
1 835 . 6 1 1 A 64 64 ARG HA H 64 4.290 4.175 0.115 1
1 843 . 6 1 1 A 64 64 ARG C C 64 177.600 178.801 -1.201 1
1 844 . 6 1 1 A 64 64 ARG CA C 64 58.300 58.790 -0.490 1
1 845 . 6 1 1 A 64 64 ARG CB C 64 30.000 30.012 -0.012 1
1 848 . 6 1 1 A 64 64 ARG N N 64 116.800 120.627 -3.827 1
1 850 . 6 1 1 A 65 65 ILE H H 65 7.260 7.620 -0.360 1
1 851 . 6 1 1 A 65 65 ILE HA H 65 4.130 3.632 0.498 1
1 861 . 6 1 1 A 65 65 ILE C C 65 177.000 176.053 0.947 1
1 862 . 6 1 1 A 65 65 ILE CA C 65 62.600 65.034 -2.434 1
1 863 . 6 1 1 A 65 65 ILE CB C 65 38.700 37.423 1.277 1
1 867 . 6 1 1 A 65 65 ILE N N 65 117.000 118.911 -1.911 1
1 868 . 6 1 1 A 66 66 ILE H H 66 7.980 7.699 0.281 1
1 869 . 6 1 1 A 66 66 ILE HA H 66 4.000 3.638 0.362 1
1 879 . 6 1 1 A 66 66 ILE C C 66 176.400 174.295 2.105 1
1 880 . 6 1 1 A 66 66 ILE CA C 66 63.100 62.229 0.871 1
1 881 . 6 1 1 A 66 66 ILE CB C 66 38.800 36.563 2.237 1
1 885 . 6 1 1 A 66 66 ILE N N 66 120.700 119.477 1.223 1
1 886 . 6 1 1 A 67 67 VAL H H 67 8.130 7.792 0.338 1
1 887 . 6 1 1 A 67 67 VAL HA H 67 3.980 4.629 -0.649 1
1 895 . 6 1 1 A 67 67 VAL C C 67 177.300 175.039 2.261 1
1 896 . 6 1 1 A 67 67 VAL CA C 67 63.900 60.124 3.776 1
1 897 . 6 1 1 A 67 67 VAL CB C 67 32.500 33.856 -1.356 1
1 900 . 6 1 1 A 67 67 VAL N N 67 121.600 120.564 1.036 1
1 901 . 6 1 1 A 68 68 ASN H H 68 8.170 8.704 -0.534 1
1 902 . 6 1 1 A 68 68 ASN HA H 68 4.680 4.879 -0.199 1
1 907 . 6 1 1 A 68 68 ASN CA C 68 54.200 52.962 1.238 1
1 908 . 6 1 1 A 68 68 ASN CB C 68 39.100 39.421 -0.321 1
1 910 . 6 1 1 A 68 68 ASN N N 68 120.500 125.769 -5.269 1
1 912 . 6 1 1 A 69 69 LYS H H 69 8.230 8.825 -0.595 1
1 913 . 6 1 1 A 69 69 LYS HA H 69 4.260 3.928 0.332 1
1 922 . 6 1 1 A 69 69 LYS C C 69 176.900 176.642 0.258 1
1 923 . 6 1 1 A 69 69 LYS CA C 69 57.000 59.709 -2.709 1
1 924 . 6 1 1 A 69 69 LYS CB C 69 32.800 32.587 0.213 1
1 928 . 6 1 1 A 69 69 LYS N N 69 121.300 122.902 -1.602 1
1 929 . 6 1 1 A 70 70 LEU H H 70 8.150 8.014 0.136 1
1 930 . 6 1 1 A 70 70 LEU HA H 70 4.300 4.018 0.282 1
1 940 . 6 1 1 A 70 70 LEU C C 70 178.900 175.985 2.915 1
1 941 . 6 1 1 A 70 70 LEU CA C 70 55.400 55.927 -0.527 1
1 942 . 6 1 1 A 70 70 LEU CB C 70 42.100 40.985 1.115 1
1 946 . 6 1 1 A 70 70 LEU N N 70 121.900 119.810 2.090 1
1 947 . 6 1 1 A 71 71 GLU H H 71 8.210 8.563 -0.353 1
1 948 . 6 1 1 A 71 71 GLU HA H 71 4.180 3.969 0.211 1
1 953 . 6 1 1 A 71 71 GLU C C 71 176.300 175.405 0.895 1
1 954 . 6 1 1 A 71 71 GLU CA C 71 56.600 57.202 -0.602 1
1 955 . 6 1 1 A 71 71 GLU CB C 71 30.200 28.309 1.891 1
1 957 . 6 1 1 A 71 71 GLU N N 71 120.900 119.447 1.453 1
1 958 . 6 1 1 A 72 72 HIS H H 72 8.380 7.813 0.567 1
1 959 . 6 1 1 A 72 72 HIS HA H 72 4.600 5.176 -0.576 1
1 962 . 6 1 1 A 72 72 HIS C C 72 174.600 174.089 0.511 1
1 963 . 6 1 1 A 72 72 HIS CA C 72 55.600 54.427 1.173 1
1 964 . 6 1 1 A 72 72 HIS CB C 72 29.600 32.160 -2.560 1
1 965 . 6 1 1 A 72 72 HIS N N 72 119.300 120.610 -1.310 1
1 966 . 6 1 1 A 73 73 HIS H H 73 8.410 8.737 -0.327 1
1 967 . 6 1 1 A 73 73 HIS HA H 73 4.610 4.675 -0.065 1
1 970 . 6 1 1 A 73 73 HIS C C 73 173.700 175.565 -1.865 1
1 971 . 6 1 1 A 73 73 HIS CA C 73 55.700 54.726 0.974 1
1 972 . 6 1 1 A 73 73 HIS CB C 73 29.600 31.307 -1.707 1
1 973 . 6 1 1 A 73 73 HIS N N 73 119.410 119.850 -0.440 1
1 974 . 6 1 1 A 74 74 HIS H H 74 8.310 8.067 0.243 1
1 975 . 6 1 1 A 74 74 HIS HA H 74 4.630 4.413 0.217 1
1 978 . 6 1 1 A 74 74 HIS CA C 74 57.100 57.559 -0.459 1
1 979 . 6 1 1 A 74 74 HIS CB C 74 29.800 30.531 -0.731 1
1 14 . 7 1 1 A 2 2 GLU H H 2 9.070 8.640 0.430 1
1 15 . 7 1 1 A 2 2 GLU HA H 2 4.520 4.435 0.085 1
1 20 . 7 1 1 A 2 2 GLU C C 2 176.300 177.393 -1.093 1
1 21 . 7 1 1 A 2 2 GLU CA C 2 55.800 55.483 0.317 1
1 22 . 7 1 1 A 2 2 GLU CB C 2 31.000 31.202 -0.202 1
1 24 . 7 1 1 A 2 2 GLU N N 2 123.100 123.332 -0.232 1
1 25 . 7 1 1 A 3 3 LEU H H 3 8.750 8.823 -0.073 1
1 26 . 7 1 1 A 3 3 LEU HA H 3 3.750 3.975 -0.225 1
1 36 . 7 1 1 A 3 3 LEU C C 3 177.400 179.267 -1.867 1
1 37 . 7 1 1 A 3 3 LEU CA C 3 58.300 57.900 0.400 1
1 38 . 7 1 1 A 3 3 LEU CB C 3 41.500 41.509 -0.009 1
1 42 . 7 1 1 A 3 3 LEU N N 3 122.600 126.302 -3.702 1
1 43 . 7 1 1 A 4 4 SER H H 4 8.350 8.195 0.155 1
1 44 . 7 1 1 A 4 4 SER HA H 4 3.890 4.219 -0.329 1
1 47 . 7 1 1 A 4 4 SER C C 4 175.100 176.859 -1.759 1
1 48 . 7 1 1 A 4 4 SER CA C 4 61.500 61.081 0.419 1
1 49 . 7 1 1 A 4 4 SER CB C 4 62.000 63.070 -1.070 1
1 50 . 7 1 1 A 4 4 SER N N 4 112.900 114.130 -1.230 1
1 51 . 7 1 1 A 5 5 ASN H H 5 7.180 8.160 -0.980 1
1 52 . 7 1 1 A 5 5 ASN HA H 5 4.470 4.397 0.073 1
1 57 . 7 1 1 A 5 5 ASN C C 5 177.400 178.064 -0.664 1
1 58 . 7 1 1 A 5 5 ASN CA C 5 56.000 56.988 -0.988 1
1 59 . 7 1 1 A 5 5 ASN CB C 5 39.400 39.092 0.308 1
1 61 . 7 1 1 A 5 5 ASN N N 5 116.600 119.833 -3.233 1
1 63 . 7 1 1 A 6 6 GLU H H 6 7.950 8.261 -0.311 1
1 64 . 7 1 1 A 6 6 GLU HA H 6 4.070 4.157 -0.087 1
1 69 . 7 1 1 A 6 6 GLU C C 6 178.500 178.744 -0.244 1
1 70 . 7 1 1 A 6 6 GLU CA C 6 58.100 58.787 -0.687 1
1 71 . 7 1 1 A 6 6 GLU CB C 6 29.300 29.600 -0.300 1
1 73 . 7 1 1 A 6 6 GLU N N 6 117.600 119.514 -1.914 1
1 74 . 7 1 1 A 7 7 LEU H H 7 8.140 8.093 0.047 1
1 75 . 7 1 1 A 7 7 LEU HA H 7 3.640 4.122 -0.482 1
1 85 . 7 1 1 A 7 7 LEU C C 7 177.700 178.322 -0.622 1
1 86 . 7 1 1 A 7 7 LEU CA C 7 58.300 57.803 0.497 1
1 87 . 7 1 1 A 7 7 LEU CB C 7 40.600 41.704 -1.104 1
1 91 . 7 1 1 A 7 7 LEU N N 7 118.500 121.224 -2.724 1
1 92 . 7 1 1 A 8 8 LYS H H 8 7.090 8.228 -1.138 1
1 93 . 7 1 1 A 8 8 LYS HA H 8 4.080 4.023 0.057 1
1 102 . 7 1 1 A 8 8 LYS C C 8 178.300 178.787 -0.487 1
1 103 . 7 1 1 A 8 8 LYS CA C 8 59.700 59.273 0.427 1
1 104 . 7 1 1 A 8 8 LYS CB C 8 32.300 32.186 0.114 1
1 108 . 7 1 1 A 8 8 LYS N N 8 118.200 119.174 -0.974 1
1 109 . 7 1 1 A 9 9 VAL H H 9 7.940 7.776 0.164 1
1 110 . 7 1 1 A 9 9 VAL HA H 9 3.440 3.527 -0.087 1
1 118 . 7 1 1 A 9 9 VAL C C 9 179.500 177.828 1.672 1
1 119 . 7 1 1 A 9 9 VAL CA C 9 66.700 66.475 0.225 1
1 120 . 7 1 1 A 9 9 VAL CB C 9 31.600 31.418 0.182 1
1 123 . 7 1 1 A 9 9 VAL N N 9 117.600 119.686 -2.086 1
1 124 . 7 1 1 A 10 10 GLU H H 10 7.830 8.321 -0.491 1
1 125 . 7 1 1 A 10 10 GLU HA H 10 4.130 3.964 0.166 1
1 130 . 7 1 1 A 10 10 GLU C C 10 178.700 179.232 -0.532 1
1 131 . 7 1 1 A 10 10 GLU CA C 10 58.300 59.807 -1.507 1
1 132 . 7 1 1 A 10 10 GLU CB C 10 28.500 29.421 -0.921 1
1 134 . 7 1 1 A 10 10 GLU N N 10 118.300 118.474 -0.174 1
1 135 . 7 1 1 A 11 11 ARG H H 11 8.330 7.410 0.920 1
1 136 . 7 1 1 A 11 11 ARG HA H 11 3.770 4.082 -0.312 1
1 144 . 7 1 1 A 11 11 ARG C C 11 174.600 179.039 -4.439 1
1 145 . 7 1 1 A 11 11 ARG CA C 11 61.300 58.988 2.312 1
1 146 . 7 1 1 A 11 11 ARG CB C 11 28.500 29.722 -1.222 1
1 149 . 7 1 1 A 11 11 ARG N N 11 121.400 120.117 1.283 1
1 151 . 7 1 1 A 12 12 ILE H H 12 8.540 8.062 0.478 1
1 152 . 7 1 1 A 12 12 ILE HA H 12 3.780 3.726 0.054 1
1 162 . 7 1 1 A 12 12 ILE C C 12 181.400 177.830 3.570 1
1 163 . 7 1 1 A 12 12 ILE CA C 12 64.800 64.982 -0.182 1
1 164 . 7 1 1 A 12 12 ILE CB C 12 37.700 37.624 0.076 1
1 168 . 7 1 1 A 12 12 ILE N N 12 118.700 120.062 -1.362 1
1 169 . 7 1 1 A 13 13 ARG H H 13 8.470 8.606 -0.136 1
1 170 . 7 1 1 A 13 13 ARG HA H 13 4.060 4.067 -0.007 1
1 178 . 7 1 1 A 13 13 ARG C C 13 178.600 178.614 -0.014 1
1 179 . 7 1 1 A 13 13 ARG CA C 13 59.600 58.975 0.625 1
1 180 . 7 1 1 A 13 13 ARG CB C 13 30.000 30.012 -0.012 1
1 183 . 7 1 1 A 13 13 ARG N N 13 124.600 121.496 3.104 1
1 185 . 7 1 1 A 14 14 LEU H H 14 7.430 8.562 -1.132 1
1 186 . 7 1 1 A 14 14 LEU HA H 14 4.240 4.317 -0.077 1
1 196 . 7 1 1 A 14 14 LEU C C 14 176.000 176.434 -0.434 1
1 197 . 7 1 1 A 14 14 LEU CA C 14 55.300 54.797 0.503 1
1 198 . 7 1 1 A 14 14 LEU CB C 14 43.000 42.000 1.000 1
1 202 . 7 1 1 A 14 14 LEU N N 14 118.500 118.293 0.207 1
1 203 . 7 1 1 A 15 15 SER H H 15 8.260 7.863 0.397 1
1 204 . 7 1 1 A 15 15 SER HA H 15 4.030 4.159 -0.129 1
1 207 . 7 1 1 A 15 15 SER C C 15 174.000 173.420 0.580 1
1 208 . 7 1 1 A 15 15 SER CA C 15 58.700 58.978 -0.278 1
1 209 . 7 1 1 A 15 15 SER CB C 15 61.300 60.734 0.566 1
1 210 . 7 1 1 A 15 15 SER N N 15 112.500 114.114 -1.614 1
1 211 . 7 1 1 A 16 16 LEU H H 16 7.310 7.519 -0.209 1
1 212 . 7 1 1 A 16 16 LEU HA H 16 4.880 4.739 0.141 1
1 222 . 7 1 1 A 16 16 LEU C C 16 177.900 177.033 0.867 1
1 223 . 7 1 1 A 16 16 LEU CA C 16 52.600 53.427 -0.827 1
1 224 . 7 1 1 A 16 16 LEU CB C 16 43.500 44.258 -0.758 1
1 228 . 7 1 1 A 16 16 LEU N N 16 117.800 121.334 -3.534 1
1 229 . 7 1 1 A 17 17 THR H H 17 8.640 8.708 -0.068 1
1 230 . 7 1 1 A 17 17 THR HA H 17 4.250 4.936 -0.686 1
1 235 . 7 1 1 A 17 17 THR C C 17 174.900 175.525 -0.625 1
1 236 . 7 1 1 A 17 17 THR CA C 17 60.500 60.278 0.222 1
1 237 . 7 1 1 A 17 17 THR CB C 17 70.500 70.542 -0.042 1
1 239 . 7 1 1 A 17 17 THR N N 17 115.200 113.571 1.629 1
1 240 . 7 1 1 A 18 18 ALA H H 18 8.820 9.140 -0.320 1
1 241 . 7 1 1 A 18 18 ALA HA H 18 3.680 3.968 -0.288 1
1 245 . 7 1 1 A 18 18 ALA C C 18 178.900 179.515 -0.615 1
1 246 . 7 1 1 A 18 18 ALA CA C 18 55.200 55.257 -0.057 1
1 247 . 7 1 1 A 18 18 ALA CB C 18 17.800 18.174 -0.374 1
1 248 . 7 1 1 A 18 18 ALA N N 18 125.600 126.743 -1.143 1
1 249 . 7 1 1 A 19 19 LYS H H 19 8.280 7.986 0.294 1
1 250 . 7 1 1 A 19 19 LYS HA H 19 3.740 3.947 -0.207 1
1 259 . 7 1 1 A 19 19 LYS C C 19 177.900 178.443 -0.543 1
1 260 . 7 1 1 A 19 19 LYS CA C 19 59.800 59.493 0.307 1
1 261 . 7 1 1 A 19 19 LYS CB C 19 33.300 32.376 0.924 1
1 265 . 7 1 1 A 19 19 LYS N N 19 115.800 119.053 -3.253 1
1 266 . 7 1 1 A 20 20 SER H H 20 7.860 7.774 0.086 1
1 267 . 7 1 1 A 20 20 SER HA H 20 4.210 4.210 0.000 1
1 271 . 7 1 1 A 20 20 SER C C 20 177.200 177.514 -0.314 1
1 272 . 7 1 1 A 20 20 SER CA C 20 61.900 61.720 0.180 1
1 273 . 7 1 1 A 20 20 SER CB C 20 63.000 63.069 -0.069 1
1 274 . 7 1 1 A 20 20 SER N N 20 114.600 114.452 0.148 1
1 275 . 7 1 1 A 21 21 VAL H H 21 7.830 7.832 -0.002 1
1 276 . 7 1 1 A 21 21 VAL HA H 21 3.280 3.537 -0.257 1
1 284 . 7 1 1 A 21 21 VAL C C 21 177.500 177.999 -0.499 1
1 285 . 7 1 1 A 21 21 VAL CA C 21 66.800 66.489 0.311 1
1 286 . 7 1 1 A 21 21 VAL CB C 21 31.400 31.550 -0.150 1
1 289 . 7 1 1 A 21 21 VAL N N 21 122.600 120.997 1.603 1
1 290 . 7 1 1 A 22 22 ALA H H 22 8.230 8.457 -0.227 1
1 291 . 7 1 1 A 22 22 ALA HA H 22 3.510 3.908 -0.398 1
1 295 . 7 1 1 A 22 22 ALA C C 22 179.500 179.863 -0.363 1
1 296 . 7 1 1 A 22 22 ALA CA C 22 55.500 55.925 -0.425 1
1 297 . 7 1 1 A 22 22 ALA CB C 22 16.900 18.537 -1.637 1
1 298 . 7 1 1 A 22 22 ALA N N 22 121.200 122.278 -1.078 1
1 299 . 7 1 1 A 23 23 GLU H H 23 7.900 8.057 -0.157 1
1 300 . 7 1 1 A 23 23 GLU HA H 23 3.990 3.986 0.004 1
1 305 . 7 1 1 A 23 23 GLU C C 23 180.000 179.094 0.906 1
1 306 . 7 1 1 A 23 23 GLU CA C 23 59.300 59.606 -0.306 1
1 307 . 7 1 1 A 23 23 GLU CB C 23 29.300 29.592 -0.292 1
1 309 . 7 1 1 A 23 23 GLU N N 23 115.300 117.762 -2.462 1
1 310 . 7 1 1 A 24 24 GLU H H 24 7.950 7.862 0.088 1
1 311 . 7 1 1 A 24 24 GLU HA H 24 4.060 4.087 -0.027 1
1 316 . 7 1 1 A 24 24 GLU C C 24 179.100 178.931 0.169 1
1 317 . 7 1 1 A 24 24 GLU CA C 24 59.700 59.125 0.575 1
1 318 . 7 1 1 A 24 24 GLU CB C 24 29.500 29.425 0.075 1
1 320 . 7 1 1 A 24 24 GLU N N 24 120.100 120.190 -0.090 1
1 321 . 7 1 1 A 25 25 MET H H 25 8.150 8.441 -0.291 1
1 322 . 7 1 1 A 25 25 MET HA H 25 4.110 4.318 -0.208 1
1 330 . 7 1 1 A 25 25 MET C C 25 176.600 176.605 -0.005 1
1 331 . 7 1 1 A 25 25 MET CA C 25 57.100 56.856 0.244 1
1 332 . 7 1 1 A 25 25 MET CB C 25 34.900 32.677 2.223 1
1 335 . 7 1 1 A 25 25 MET N N 25 115.500 117.098 -1.598 1
1 336 . 7 1 1 A 26 26 GLY H H 26 7.940 8.898 -0.958 1
1 337 . 7 1 1 A 26 26 GLY HA2 H 26 3.860 3.919 -0.059 1
1 338 . 7 1 1 A 26 26 GLY HA3 H 26 3.960 3.920 0.040 1
1 339 . 7 1 1 A 26 26 GLY C C 26 175.100 173.857 1.243 1
1 340 . 7 1 1 A 26 26 GLY CA C 26 46.600 45.989 0.611 1
1 341 . 7 1 1 A 26 26 GLY N N 26 109.000 106.971 2.029 1
1 342 . 7 1 1 A 27 27 ILE H H 27 7.880 7.390 0.490 1
1 343 . 7 1 1 A 27 27 ILE HA H 27 4.790 4.808 -0.018 1
1 353 . 7 1 1 A 27 27 ILE C C 27 174.300 175.062 -0.762 1
1 354 . 7 1 1 A 27 27 ILE CA C 27 59.000 58.519 0.481 1
1 355 . 7 1 1 A 27 27 ILE CB C 27 40.900 41.571 -0.671 1
1 359 . 7 1 1 A 27 27 ILE N N 27 112.700 115.636 -2.936 1
1 360 . 7 1 1 A 28 28 SER H H 28 8.570 9.255 -0.685 1
1 361 . 7 1 1 A 28 28 SER HA H 28 4.540 4.766 -0.226 1
1 364 . 7 1 1 A 28 28 SER C C 28 175.600 175.919 -0.319 1
1 365 . 7 1 1 A 28 28 SER CA C 28 56.800 57.295 -0.495 1
1 366 . 7 1 1 A 28 28 SER CB C 28 65.500 65.551 -0.051 1
1 367 . 7 1 1 A 28 28 SER N N 28 115.400 117.327 -1.927 1
1 368 . 7 1 1 A 29 29 ARG H H 29 8.980 9.003 -0.023 1
1 369 . 7 1 1 A 29 29 ARG HA H 29 3.660 3.977 -0.317 1
1 377 . 7 1 1 A 29 29 ARG C C 29 178.700 178.733 -0.033 1
1 378 . 7 1 1 A 29 29 ARG CA C 29 59.500 60.188 -0.688 1
1 379 . 7 1 1 A 29 29 ARG CB C 29 29.500 29.764 -0.264 1
1 382 . 7 1 1 A 29 29 ARG N N 29 122.000 120.521 1.479 1
1 384 . 7 1 1 A 30 30 GLN H H 30 8.580 8.161 0.419 1
1 385 . 7 1 1 A 30 30 GLN HA H 30 3.860 4.040 -0.180 1
1 392 . 7 1 1 A 30 30 GLN C C 30 178.100 178.182 -0.082 1
1 393 . 7 1 1 A 30 30 GLN CA C 30 59.200 59.244 -0.044 1
1 394 . 7 1 1 A 30 30 GLN CB C 30 28.100 28.460 -0.360 1
1 397 . 7 1 1 A 30 30 GLN N N 30 118.700 119.287 -0.587 1
1 399 . 7 1 1 A 31 31 GLN H H 31 7.990 7.805 0.185 1
1 400 . 7 1 1 A 31 31 GLN HA H 31 3.980 4.027 -0.047 1
1 407 . 7 1 1 A 31 31 GLN C C 31 178.700 178.626 0.074 1
1 408 . 7 1 1 A 31 31 GLN CA C 31 59.100 58.786 0.314 1
1 409 . 7 1 1 A 31 31 GLN CB C 31 28.700 28.038 0.662 1
1 412 . 7 1 1 A 31 31 GLN N N 31 119.600 118.344 1.256 1
1 414 . 7 1 1 A 32 32 LEU H H 32 7.630 7.676 -0.046 1
1 415 . 7 1 1 A 32 32 LEU HA H 32 3.740 4.116 -0.376 1
1 425 . 7 1 1 A 32 32 LEU C C 32 178.300 178.485 -0.185 1
1 426 . 7 1 1 A 32 32 LEU CA C 32 57.700 57.725 -0.025 1
1 427 . 7 1 1 A 32 32 LEU CB C 32 41.500 41.455 0.045 1
1 431 . 7 1 1 A 32 32 LEU N N 32 120.700 122.054 -1.354 1
1 432 . 7 1 1 A 33 33 CYS H H 33 8.240 8.387 -0.147 1
1 433 . 7 1 1 A 33 33 CYS HA H 33 3.990 4.107 -0.117 1
1 436 . 7 1 1 A 33 33 CYS C C 33 177.000 177.241 -0.241 1
1 437 . 7 1 1 A 33 33 CYS CA C 33 63.100 63.259 -0.159 1
1 438 . 7 1 1 A 33 33 CYS CB C 33 26.100 27.019 -0.919 1
1 439 . 7 1 1 A 33 33 CYS N N 33 117.400 117.197 0.203 1
1 440 . 7 1 1 A 34 34 ASN H H 34 8.210 8.215 -0.005 1
1 441 . 7 1 1 A 34 34 ASN HA H 34 4.370 4.421 -0.051 1
1 446 . 7 1 1 A 34 34 ASN C C 34 178.700 178.209 0.491 1
1 447 . 7 1 1 A 34 34 ASN CA C 34 56.000 56.607 -0.607 1
1 448 . 7 1 1 A 34 34 ASN CB C 34 37.800 37.922 -0.122 1
1 450 . 7 1 1 A 34 34 ASN N N 34 117.300 118.432 -1.132 1
1 452 . 7 1 1 A 35 35 ILE H H 35 7.850 7.665 0.185 1
1 453 . 7 1 1 A 35 35 ILE HA H 35 3.850 3.585 0.265 1
1 463 . 7 1 1 A 35 35 ILE C C 35 178.100 178.374 -0.274 1
1 464 . 7 1 1 A 35 35 ILE CA C 35 64.800 65.416 -0.616 1
1 465 . 7 1 1 A 35 35 ILE CB C 35 38.000 38.045 -0.045 1
1 469 . 7 1 1 A 35 35 ILE N N 35 120.400 120.607 -0.207 1
1 470 . 7 1 1 A 36 36 GLU H H 36 7.680 8.069 -0.389 1
1 471 . 7 1 1 A 36 36 GLU HA H 36 4.120 4.244 -0.124 1
1 476 . 7 1 1 A 36 36 GLU C C 36 176.300 177.130 -0.830 1
1 477 . 7 1 1 A 36 36 GLU CA C 36 58.600 58.381 0.219 1
1 478 . 7 1 1 A 36 36 GLU CB C 36 30.000 29.116 0.884 1
1 480 . 7 1 1 A 36 36 GLU N N 36 116.500 118.039 -1.539 1
1 481 . 7 1 1 A 37 37 GLN H H 37 7.630 7.785 -0.155 1
1 482 . 7 1 1 A 37 37 GLN HA H 37 4.540 4.484 0.056 1
1 489 . 7 1 1 A 37 37 GLN C C 37 176.000 175.959 0.041 1
1 490 . 7 1 1 A 37 37 GLN CA C 37 54.900 56.595 -1.695 1
1 491 . 7 1 1 A 37 37 GLN CB C 37 29.600 29.958 -0.358 1
1 494 . 7 1 1 A 37 37 GLN N N 37 115.000 119.100 -4.100 1
1 496 . 7 1 1 A 38 38 SER H H 38 7.380 8.237 -0.857 1
1 497 . 7 1 1 A 38 38 SER HA H 38 4.410 4.592 -0.182 1
1 500 . 7 1 1 A 38 38 SER C C 38 175.500 175.133 0.367 1
1 501 . 7 1 1 A 38 38 SER CA C 38 59.200 57.520 1.680 1
1 502 . 7 1 1 A 38 38 SER CB C 38 64.100 64.206 -0.106 1
1 503 . 7 1 1 A 38 38 SER N N 38 115.200 115.881 -0.681 1
1 504 . 7 1 1 A 39 39 GLU H H 39 9.040 8.548 0.492 1
1 505 . 7 1 1 A 39 39 GLU HA H 39 4.450 4.399 0.051 1
1 510 . 7 1 1 A 39 39 GLU C C 39 176.300 177.223 -0.923 1
1 511 . 7 1 1 A 39 39 GLU CA C 39 57.100 56.407 0.693 1
1 512 . 7 1 1 A 39 39 GLU CB C 39 30.300 29.646 0.654 1
1 514 . 7 1 1 A 39 39 GLU N N 39 125.400 121.353 4.047 1
1 515 . 7 1 1 A 40 40 THR H H 40 7.920 8.072 -0.152 1
1 516 . 7 1 1 A 40 40 THR HA H 40 4.590 3.972 0.618 1
1 521 . 7 1 1 A 40 40 THR C C 40 173.500 173.391 0.109 1
1 522 . 7 1 1 A 40 40 THR CA C 40 60.500 64.424 -3.924 1
1 523 . 7 1 1 A 40 40 THR CB C 40 71.100 67.054 4.046 1
1 525 . 7 1 1 A 40 40 THR N N 40 112.800 110.501 2.299 1
1 526 . 7 1 1 A 41 41 ALA H H 41 8.780 7.746 1.034 1
1 527 . 7 1 1 A 41 41 ALA HA H 41 4.870 4.748 0.122 1
1 531 . 7 1 1 A 41 41 ALA CA C 41 49.700 49.428 0.272 1
1 532 . 7 1 1 A 41 41 ALA CB C 41 19.300 19.101 0.199 1
1 533 . 7 1 1 A 41 41 ALA N N 41 127.000 123.213 3.787 1
1 534 . 7 1 1 A 42 42 PRO HA H 42 4.660 4.686 -0.026 1
1 541 . 7 1 1 A 42 42 PRO C C 42 178.300 177.846 0.454 1
1 542 . 7 1 1 A 42 42 PRO CA C 42 62.500 62.886 -0.386 1
1 543 . 7 1 1 A 42 42 PRO CB C 42 32.600 32.914 -0.314 1
1 546 . 7 1 1 A 43 43 VAL H H 43 8.840 8.679 0.161 1
1 547 . 7 1 1 A 43 43 VAL HA H 43 3.660 3.756 -0.096 1
1 555 . 7 1 1 A 43 43 VAL CA C 43 66.800 65.111 1.689 1
1 556 . 7 1 1 A 43 43 VAL CB C 43 31.100 31.402 -0.302 1
1 559 . 7 1 1 A 43 43 VAL N N 43 123.000 122.974 0.026 1
1 560 . 7 1 1 A 44 44 VAL HA H 44 4.030 3.693 0.337 1
1 568 . 7 1 1 A 44 44 VAL C C 44 176.700 178.515 -1.815 1
1 569 . 7 1 1 A 44 44 VAL CA C 44 65.900 66.957 -1.057 1
1 570 . 7 1 1 A 44 44 VAL CB C 44 30.900 31.488 -0.588 1
1 573 . 7 1 1 A 45 45 VAL H H 45 7.500 8.126 -0.626 1
1 574 . 7 1 1 A 45 45 VAL HA H 45 3.760 3.645 0.115 1
1 582 . 7 1 1 A 45 45 VAL C C 45 177.500 177.711 -0.211 1
1 583 . 7 1 1 A 45 45 VAL CA C 45 66.700 66.875 -0.175 1
1 584 . 7 1 1 A 45 45 VAL CB C 45 31.000 31.326 -0.326 1
1 587 . 7 1 1 A 45 45 VAL N N 45 120.100 120.457 -0.357 1
1 588 . 7 1 1 A 46 46 LYS H H 46 7.610 7.777 -0.167 1
1 589 . 7 1 1 A 46 46 LYS HA H 46 4.140 4.043 0.097 1
1 598 . 7 1 1 A 46 46 LYS C C 46 179.500 178.686 0.814 1
1 599 . 7 1 1 A 46 46 LYS CA C 46 59.900 59.119 0.781 1
1 600 . 7 1 1 A 46 46 LYS CB C 46 31.500 32.003 -0.503 1
1 604 . 7 1 1 A 46 46 LYS N N 46 120.700 118.537 2.163 1
1 605 . 7 1 1 A 47 47 TYR H H 47 8.550 7.928 0.622 1
1 606 . 7 1 1 A 47 47 TYR HA H 47 5.000 4.276 0.724 1
1 613 . 7 1 1 A 47 47 TYR C C 47 177.300 177.246 0.054 1
1 614 . 7 1 1 A 47 47 TYR CA C 47 57.300 61.291 -3.991 1
1 615 . 7 1 1 A 47 47 TYR CB C 47 37.700 38.748 -1.048 1
1 620 . 7 1 1 A 47 47 TYR N N 47 122.700 120.938 1.762 1
1 621 . 7 1 1 A 48 48 ILE H H 48 8.250 8.124 0.126 1
1 622 . 7 1 1 A 48 48 ILE HA H 48 3.160 3.744 -0.584 1
1 632 . 7 1 1 A 48 48 ILE C C 48 177.100 178.083 -0.983 1
1 633 . 7 1 1 A 48 48 ILE CA C 48 67.000 65.674 1.326 1
1 634 . 7 1 1 A 48 48 ILE CB C 48 37.800 38.572 -0.772 1
1 638 . 7 1 1 A 48 48 ILE N N 48 121.200 120.783 0.417 1
1 639 . 7 1 1 A 49 49 ALA H H 49 8.310 8.583 -0.273 1
1 640 . 7 1 1 A 49 49 ALA HA H 49 3.940 4.042 -0.102 1
1 644 . 7 1 1 A 49 49 ALA C C 49 179.300 179.333 -0.033 1
1 645 . 7 1 1 A 49 49 ALA CA C 49 55.500 55.366 0.134 1
1 646 . 7 1 1 A 49 49 ALA CB C 49 18.200 18.567 -0.367 1
1 647 . 7 1 1 A 49 49 ALA N N 49 120.300 120.334 -0.034 1
1 648 . 7 1 1 A 50 50 PHE H H 50 8.630 8.543 0.087 1
1 649 . 7 1 1 A 50 50 PHE HA H 50 4.200 4.415 -0.215 1
1 656 . 7 1 1 A 50 50 PHE C C 50 179.000 176.924 2.076 1
1 657 . 7 1 1 A 50 50 PHE CA C 50 61.300 61.532 -0.232 1
1 658 . 7 1 1 A 50 50 PHE CB C 50 39.200 39.360 -0.160 1
1 663 . 7 1 1 A 50 50 PHE N N 50 121.300 120.195 1.105 1
1 664 . 7 1 1 A 51 51 LEU H H 51 8.920 8.543 0.377 1
1 665 . 7 1 1 A 51 51 LEU HA H 51 3.630 3.972 -0.342 1
1 675 . 7 1 1 A 51 51 LEU C C 51 180.000 179.374 0.626 1
1 676 . 7 1 1 A 51 51 LEU CA C 51 58.100 57.691 0.409 1
1 677 . 7 1 1 A 51 51 LEU CB C 51 39.800 41.401 -1.601 1
1 681 . 7 1 1 A 51 51 LEU N N 51 121.900 118.898 3.002 1
1 682 . 7 1 1 A 52 52 ARG H H 52 8.410 7.934 0.476 1
1 683 . 7 1 1 A 52 52 ARG HA H 52 4.420 3.959 0.461 1
1 691 . 7 1 1 A 52 52 ARG C C 52 179.800 178.954 0.846 1
1 692 . 7 1 1 A 52 52 ARG CA C 52 57.800 59.692 -1.892 1
1 693 . 7 1 1 A 52 52 ARG CB C 52 28.200 29.866 -1.666 1
1 695 . 7 1 1 A 52 52 ARG N N 52 120.500 120.766 -0.266 1
1 697 . 7 1 1 A 53 53 SER H H 53 8.480 7.745 0.735 1
1 698 . 7 1 1 A 53 53 SER HA H 53 4.300 4.190 0.110 1
1 701 . 7 1 1 A 53 53 SER C C 53 174.600 175.542 -0.942 1
1 702 . 7 1 1 A 53 53 SER CA C 53 61.500 61.176 0.324 1
1 703 . 7 1 1 A 53 53 SER CB C 53 62.300 62.417 -0.117 1
1 704 . 7 1 1 A 53 53 SER N N 53 119.500 115.339 4.161 1
1 705 . 7 1 1 A 54 54 LYS H H 54 7.080 7.497 -0.417 1
1 706 . 7 1 1 A 54 54 LYS HA H 54 4.350 4.318 0.032 1
1 715 . 7 1 1 A 54 54 LYS C C 54 176.500 176.932 -0.432 1
1 716 . 7 1 1 A 54 54 LYS CA C 54 53.700 55.862 -2.162 1
1 717 . 7 1 1 A 54 54 LYS CB C 54 31.800 33.001 -1.201 1
1 721 . 7 1 1 A 54 54 LYS N N 54 119.200 119.094 0.106 1
1 722 . 7 1 1 A 55 55 GLY H H 55 8.040 8.515 -0.475 1
1 723 . 7 1 1 A 55 55 GLY HA2 H 55 3.540 3.896 -0.356 1
1 724 . 7 1 1 A 55 55 GLY HA3 H 55 4.300 3.900 0.400 1
1 725 . 7 1 1 A 55 55 GLY C C 55 174.500 174.953 -0.453 1
1 726 . 7 1 1 A 55 55 GLY CA C 55 44.700 45.865 -1.165 1
1 727 . 7 1 1 A 55 55 GLY N N 55 106.600 108.098 -1.498 1
1 728 . 7 1 1 A 56 56 VAL H H 56 7.580 7.542 0.038 1
1 729 . 7 1 1 A 56 56 VAL HA H 56 3.630 3.859 -0.229 1
1 737 . 7 1 1 A 56 56 VAL C C 56 174.700 175.294 -0.594 1
1 738 . 7 1 1 A 56 56 VAL CA C 56 64.000 62.421 1.579 1
1 739 . 7 1 1 A 56 56 VAL CB C 56 31.600 32.083 -0.483 1
1 742 . 7 1 1 A 56 56 VAL N N 56 122.000 121.927 0.073 1
1 743 . 7 1 1 A 57 57 ASP H H 57 8.440 8.947 -0.507 1
1 744 . 7 1 1 A 57 57 ASP HA H 57 4.500 4.779 -0.279 1
1 747 . 7 1 1 A 57 57 ASP C C 57 176.900 175.795 1.105 1
1 748 . 7 1 1 A 57 57 ASP CA C 57 52.600 53.674 -1.074 1
1 749 . 7 1 1 A 57 57 ASP CB C 57 39.900 40.292 -0.392 1
1 750 . 7 1 1 A 57 57 ASP N N 57 124.100 127.678 -3.578 1
1 751 . 7 1 1 A 58 58 LEU H H 58 9.720 7.983 1.737 1
1 752 . 7 1 1 A 58 58 LEU HA H 58 4.020 4.419 -0.399 1
1 762 . 7 1 1 A 58 58 LEU C C 58 179.400 177.978 1.422 1
1 763 . 7 1 1 A 58 58 LEU CA C 58 56.300 55.050 1.250 1
1 764 . 7 1 1 A 58 58 LEU CB C 58 43.300 42.415 0.885 1
1 768 . 7 1 1 A 58 58 LEU N N 58 127.800 125.804 1.996 1
1 769 . 7 1 1 A 59 59 ASN H H 59 7.740 8.229 -0.489 1
1 770 . 7 1 1 A 59 59 ASN HA H 59 4.340 4.408 -0.068 1
1 775 . 7 1 1 A 59 59 ASN C C 59 176.300 177.832 -1.532 1
1 776 . 7 1 1 A 59 59 ASN CA C 59 56.300 56.555 -0.255 1
1 777 . 7 1 1 A 59 59 ASN CB C 59 36.400 38.310 -1.910 1
1 779 . 7 1 1 A 59 59 ASN N N 59 119.500 117.924 1.576 1
1 781 . 7 1 1 A 60 60 ALA H H 60 7.220 7.639 -0.419 1
1 782 . 7 1 1 A 60 60 ALA HA H 60 4.030 4.178 -0.148 1
1 786 . 7 1 1 A 60 60 ALA C C 60 180.100 179.987 0.113 1
1 787 . 7 1 1 A 60 60 ALA CA C 60 54.300 55.090 -0.790 1
1 788 . 7 1 1 A 60 60 ALA CB C 60 18.200 18.202 -0.002 1
1 789 . 7 1 1 A 60 60 ALA N N 60 121.400 122.012 -0.612 1
1 790 . 7 1 1 A 61 61 LEU H H 61 7.320 8.151 -0.831 1
1 791 . 7 1 1 A 61 61 LEU HA H 61 3.840 4.094 -0.254 1
1 801 . 7 1 1 A 61 61 LEU C C 61 177.200 178.439 -1.239 1
1 802 . 7 1 1 A 61 61 LEU CA C 61 58.500 58.046 0.454 1
1 803 . 7 1 1 A 61 61 LEU CB C 61 42.600 41.910 0.690 1
1 807 . 7 1 1 A 61 61 LEU N N 61 118.600 120.381 -1.781 1
1 808 . 7 1 1 A 62 62 PHE H H 62 8.360 8.638 -0.278 1
1 809 . 7 1 1 A 62 62 PHE HA H 62 3.930 4.146 -0.216 1
1 817 . 7 1 1 A 62 62 PHE C C 62 178.200 178.160 0.040 1
1 818 . 7 1 1 A 62 62 PHE CA C 62 62.800 60.451 2.349 1
1 819 . 7 1 1 A 62 62 PHE CB C 62 38.500 38.662 -0.162 1
1 825 . 7 1 1 A 62 62 PHE N N 62 114.400 117.943 -3.543 1
1 826 . 7 1 1 A 63 63 ASP H H 63 8.680 8.697 -0.017 1
1 827 . 7 1 1 A 63 63 ASP HA H 63 4.530 4.333 0.197 1
1 830 . 7 1 1 A 63 63 ASP C C 63 178.600 178.804 -0.204 1
1 831 . 7 1 1 A 63 63 ASP CA C 63 57.500 57.052 0.448 1
1 832 . 7 1 1 A 63 63 ASP CB C 63 39.600 40.182 -0.582 1
1 833 . 7 1 1 A 63 63 ASP N N 63 120.400 118.954 1.446 1
1 834 . 7 1 1 A 64 64 ARG H H 64 7.540 8.181 -0.641 1
1 835 . 7 1 1 A 64 64 ARG HA H 64 4.290 4.229 0.061 1
1 843 . 7 1 1 A 64 64 ARG C C 64 177.600 178.876 -1.276 1
1 844 . 7 1 1 A 64 64 ARG CA C 64 58.300 58.793 -0.493 1
1 845 . 7 1 1 A 64 64 ARG CB C 64 30.000 30.024 -0.024 1
1 848 . 7 1 1 A 64 64 ARG N N 64 116.800 120.746 -3.946 1
1 850 . 7 1 1 A 65 65 ILE H H 65 7.260 7.823 -0.563 1
1 851 . 7 1 1 A 65 65 ILE HA H 65 4.130 3.860 0.270 1
1 861 . 7 1 1 A 65 65 ILE C C 65 177.000 176.313 0.687 1
1 862 . 7 1 1 A 65 65 ILE CA C 65 62.600 64.956 -2.356 1
1 863 . 7 1 1 A 65 65 ILE CB C 65 38.700 38.313 0.387 1
1 867 . 7 1 1 A 65 65 ILE N N 65 117.000 118.378 -1.378 1
1 868 . 7 1 1 A 66 66 ILE H H 66 7.980 8.736 -0.756 1
1 869 . 7 1 1 A 66 66 ILE HA H 66 4.000 4.405 -0.405 1
1 879 . 7 1 1 A 66 66 ILE C C 66 176.400 174.613 1.787 1
1 880 . 7 1 1 A 66 66 ILE CA C 66 63.100 60.202 2.898 1
1 881 . 7 1 1 A 66 66 ILE CB C 66 38.800 38.485 0.315 1
1 885 . 7 1 1 A 66 66 ILE N N 66 120.700 120.578 0.122 1
1 886 . 7 1 1 A 67 67 VAL H H 67 8.130 8.910 -0.780 1
1 887 . 7 1 1 A 67 67 VAL HA H 67 3.980 4.675 -0.695 1
1 895 . 7 1 1 A 67 67 VAL C C 67 177.300 174.439 2.861 1
1 896 . 7 1 1 A 67 67 VAL CA C 67 63.900 60.871 3.029 1
1 897 . 7 1 1 A 67 67 VAL CB C 67 32.500 32.668 -0.168 1
1 900 . 7 1 1 A 67 67 VAL N N 67 121.600 128.795 -7.195 1
1 901 . 7 1 1 A 68 68 ASN H H 68 8.170 8.914 -0.744 1
1 902 . 7 1 1 A 68 68 ASN HA H 68 4.680 5.090 -0.410 1
1 907 . 7 1 1 A 68 68 ASN CA C 68 54.200 51.906 2.294 1
1 908 . 7 1 1 A 68 68 ASN CB C 68 39.100 41.185 -2.085 1
1 910 . 7 1 1 A 68 68 ASN N N 68 120.500 126.083 -5.583 1
1 912 . 7 1 1 A 69 69 LYS H H 69 8.230 8.198 0.032 1
1 913 . 7 1 1 A 69 69 LYS HA H 69 4.260 4.284 -0.024 1
1 922 . 7 1 1 A 69 69 LYS C C 69 176.900 176.131 0.769 1
1 923 . 7 1 1 A 69 69 LYS CA C 69 57.000 56.736 0.264 1
1 924 . 7 1 1 A 69 69 LYS CB C 69 32.800 33.095 -0.295 1
1 928 . 7 1 1 A 69 69 LYS N N 69 121.300 121.383 -0.083 1
1 929 . 7 1 1 A 70 70 LEU H H 70 8.150 8.512 -0.362 1
1 930 . 7 1 1 A 70 70 LEU HA H 70 4.300 4.859 -0.559 1
1 940 . 7 1 1 A 70 70 LEU C C 70 178.900 175.668 3.232 1
1 941 . 7 1 1 A 70 70 LEU CA C 70 55.400 54.124 1.276 1
1 942 . 7 1 1 A 70 70 LEU CB C 70 42.100 43.723 -1.623 1
1 946 . 7 1 1 A 70 70 LEU N N 70 121.900 128.353 -6.453 1
1 947 . 7 1 1 A 71 71 GLU H H 71 8.210 8.802 -0.592 1
1 948 . 7 1 1 A 71 71 GLU HA H 71 4.180 4.762 -0.582 1
1 953 . 7 1 1 A 71 71 GLU C C 71 176.300 176.437 -0.137 1
1 954 . 7 1 1 A 71 71 GLU CA C 71 56.600 55.167 1.433 1
1 955 . 7 1 1 A 71 71 GLU CB C 71 30.200 31.059 -0.859 1
1 957 . 7 1 1 A 71 71 GLU N N 71 120.900 127.905 -7.005 1
1 958 . 7 1 1 A 72 72 HIS H H 72 8.380 8.631 -0.251 1
1 959 . 7 1 1 A 72 72 HIS HA H 72 4.600 4.534 0.066 1
1 962 . 7 1 1 A 72 72 HIS C C 72 174.600 174.589 0.011 1
1 963 . 7 1 1 A 72 72 HIS CA C 72 55.600 56.350 -0.750 1
1 964 . 7 1 1 A 72 72 HIS CB C 72 29.600 30.783 -1.183 1
1 965 . 7 1 1 A 72 72 HIS N N 72 119.300 127.328 -8.028 1
1 966 . 7 1 1 A 73 73 HIS H H 73 8.410 7.425 0.985 1
1 967 . 7 1 1 A 73 73 HIS HA H 73 4.610 3.896 0.714 1
1 970 . 7 1 1 A 73 73 HIS C C 73 173.700 174.292 -0.592 1
1 971 . 7 1 1 A 73 73 HIS CA C 73 55.700 56.047 -0.347 1
1 972 . 7 1 1 A 73 73 HIS CB C 73 29.600 27.834 1.766 1
1 973 . 7 1 1 A 73 73 HIS N N 73 119.410 117.446 1.964 1
1 974 . 7 1 1 A 74 74 HIS H H 74 8.310 8.301 0.009 1
1 975 . 7 1 1 A 74 74 HIS HA H 74 4.630 4.861 -0.231 1
1 978 . 7 1 1 A 74 74 HIS CA C 74 57.100 54.666 2.434 1
1 979 . 7 1 1 A 74 74 HIS CB C 74 29.800 32.101 -2.301 1
1 14 . 8 1 1 A 2 2 GLU H H 2 9.070 8.663 0.407 1
1 15 . 8 1 1 A 2 2 GLU HA H 2 4.520 4.457 0.063 1
1 20 . 8 1 1 A 2 2 GLU C C 2 176.300 177.796 -1.496 1
1 21 . 8 1 1 A 2 2 GLU CA C 2 55.800 56.205 -0.405 1
1 22 . 8 1 1 A 2 2 GLU CB C 2 31.000 30.448 0.552 1
1 24 . 8 1 1 A 2 2 GLU N N 2 123.100 125.826 -2.726 1
1 25 . 8 1 1 A 3 3 LEU H H 3 8.750 8.638 0.112 1
1 26 . 8 1 1 A 3 3 LEU HA H 3 3.750 4.081 -0.331 1
1 36 . 8 1 1 A 3 3 LEU C C 3 177.400 178.164 -0.764 1
1 37 . 8 1 1 A 3 3 LEU CA C 3 58.300 58.493 -0.193 1
1 38 . 8 1 1 A 3 3 LEU CB C 3 41.500 41.269 0.231 1
1 42 . 8 1 1 A 3 3 LEU N N 3 122.600 126.742 -4.142 1
1 43 . 8 1 1 A 4 4 SER H H 4 8.350 7.919 0.431 1
1 44 . 8 1 1 A 4 4 SER HA H 4 3.890 4.171 -0.281 1
1 47 . 8 1 1 A 4 4 SER C C 4 175.100 176.792 -1.692 1
1 48 . 8 1 1 A 4 4 SER CA C 4 61.500 61.527 -0.027 1
1 49 . 8 1 1 A 4 4 SER CB C 4 62.000 62.245 -0.245 1
1 50 . 8 1 1 A 4 4 SER N N 4 112.900 115.310 -2.410 1
1 51 . 8 1 1 A 5 5 ASN H H 5 7.180 8.186 -1.006 1
1 52 . 8 1 1 A 5 5 ASN HA H 5 4.470 4.457 0.013 1
1 57 . 8 1 1 A 5 5 ASN C C 5 177.400 177.729 -0.329 1
1 58 . 8 1 1 A 5 5 ASN CA C 5 56.000 56.670 -0.670 1
1 59 . 8 1 1 A 5 5 ASN CB C 5 39.400 38.798 0.602 1
1 61 . 8 1 1 A 5 5 ASN N N 5 116.600 120.309 -3.709 1
1 63 . 8 1 1 A 6 6 GLU H H 6 7.950 7.828 0.122 1
1 64 . 8 1 1 A 6 6 GLU HA H 6 4.070 4.045 0.025 1
1 69 . 8 1 1 A 6 6 GLU C C 6 178.500 179.170 -0.670 1
1 70 . 8 1 1 A 6 6 GLU CA C 6 58.100 59.270 -1.170 1
1 71 . 8 1 1 A 6 6 GLU CB C 6 29.300 29.389 -0.089 1
1 73 . 8 1 1 A 6 6 GLU N N 6 117.600 119.065 -1.465 1
1 74 . 8 1 1 A 7 7 LEU H H 7 8.140 8.051 0.089 1
1 75 . 8 1 1 A 7 7 LEU HA H 7 3.640 3.994 -0.354 1
1 85 . 8 1 1 A 7 7 LEU C C 7 177.700 179.250 -1.550 1
1 86 . 8 1 1 A 7 7 LEU CA C 7 58.300 58.007 0.293 1
1 87 . 8 1 1 A 7 7 LEU CB C 7 40.600 41.525 -0.925 1
1 91 . 8 1 1 A 7 7 LEU N N 7 118.500 120.326 -1.826 1
1 92 . 8 1 1 A 8 8 LYS H H 8 7.090 8.064 -0.974 1
1 93 . 8 1 1 A 8 8 LYS HA H 8 4.080 4.167 -0.087 1
1 102 . 8 1 1 A 8 8 LYS C C 8 178.300 178.663 -0.363 1
1 103 . 8 1 1 A 8 8 LYS CA C 8 59.700 59.519 0.181 1
1 104 . 8 1 1 A 8 8 LYS CB C 8 32.300 32.205 0.095 1
1 108 . 8 1 1 A 8 8 LYS N N 8 118.200 120.502 -2.302 1
1 109 . 8 1 1 A 9 9 VAL H H 9 7.940 7.806 0.134 1
1 110 . 8 1 1 A 9 9 VAL HA H 9 3.440 3.514 -0.074 1
1 118 . 8 1 1 A 9 9 VAL C C 9 179.500 177.732 1.768 1
1 119 . 8 1 1 A 9 9 VAL CA C 9 66.700 66.272 0.428 1
1 120 . 8 1 1 A 9 9 VAL CB C 9 31.600 31.641 -0.041 1
1 123 . 8 1 1 A 9 9 VAL N N 9 117.600 118.704 -1.104 1
1 124 . 8 1 1 A 10 10 GLU H H 10 7.830 8.188 -0.358 1
1 125 . 8 1 1 A 10 10 GLU HA H 10 4.130 3.898 0.232 1
1 130 . 8 1 1 A 10 10 GLU C C 10 178.700 179.185 -0.485 1
1 131 . 8 1 1 A 10 10 GLU CA C 10 58.300 59.598 -1.298 1
1 132 . 8 1 1 A 10 10 GLU CB C 10 28.500 29.375 -0.875 1
1 134 . 8 1 1 A 10 10 GLU N N 10 118.300 118.334 -0.034 1
1 135 . 8 1 1 A 11 11 ARG H H 11 8.330 7.713 0.617 1
1 136 . 8 1 1 A 11 11 ARG HA H 11 3.770 4.107 -0.337 1
1 144 . 8 1 1 A 11 11 ARG C C 11 174.600 178.636 -4.036 1
1 145 . 8 1 1 A 11 11 ARG CA C 11 61.300 59.088 2.212 1
1 146 . 8 1 1 A 11 11 ARG CB C 11 28.500 29.743 -1.243 1
1 149 . 8 1 1 A 11 11 ARG N N 11 121.400 119.585 1.815 1
1 151 . 8 1 1 A 12 12 ILE H H 12 8.540 7.900 0.640 1
1 152 . 8 1 1 A 12 12 ILE HA H 12 3.780 3.752 0.028 1
1 162 . 8 1 1 A 12 12 ILE C C 12 181.400 177.704 3.696 1
1 163 . 8 1 1 A 12 12 ILE CA C 12 64.800 65.040 -0.240 1
1 164 . 8 1 1 A 12 12 ILE CB C 12 37.700 37.599 0.101 1
1 168 . 8 1 1 A 12 12 ILE N N 12 118.700 120.696 -1.996 1
1 169 . 8 1 1 A 13 13 ARG H H 13 8.470 8.230 0.240 1
1 170 . 8 1 1 A 13 13 ARG HA H 13 4.060 3.958 0.102 1
1 178 . 8 1 1 A 13 13 ARG C C 13 178.600 178.348 0.252 1
1 179 . 8 1 1 A 13 13 ARG CA C 13 59.600 59.340 0.260 1
1 180 . 8 1 1 A 13 13 ARG CB C 13 30.000 30.079 -0.079 1
1 183 . 8 1 1 A 13 13 ARG N N 13 124.600 121.500 3.100 1
1 185 . 8 1 1 A 14 14 LEU H H 14 7.430 8.315 -0.885 1
1 186 . 8 1 1 A 14 14 LEU HA H 14 4.240 4.357 -0.117 1
1 196 . 8 1 1 A 14 14 LEU C C 14 176.000 176.127 -0.127 1
1 197 . 8 1 1 A 14 14 LEU CA C 14 55.300 54.616 0.684 1
1 198 . 8 1 1 A 14 14 LEU CB C 14 43.000 41.986 1.014 1
1 202 . 8 1 1 A 14 14 LEU N N 14 118.500 118.410 0.090 1
1 203 . 8 1 1 A 15 15 SER H H 15 8.260 8.029 0.231 1
1 204 . 8 1 1 A 15 15 SER HA H 15 4.030 4.342 -0.312 1
1 207 . 8 1 1 A 15 15 SER C C 15 174.000 173.160 0.840 1
1 208 . 8 1 1 A 15 15 SER CA C 15 58.700 58.916 -0.216 1
1 209 . 8 1 1 A 15 15 SER CB C 15 61.300 61.391 -0.091 1
1 210 . 8 1 1 A 15 15 SER N N 15 112.500 115.138 -2.638 1
1 211 . 8 1 1 A 16 16 LEU H H 16 7.310 7.467 -0.157 1
1 212 . 8 1 1 A 16 16 LEU HA H 16 4.880 4.696 0.184 1
1 222 . 8 1 1 A 16 16 LEU C C 16 177.900 177.116 0.784 1
1 223 . 8 1 1 A 16 16 LEU CA C 16 52.600 53.105 -0.505 1
1 224 . 8 1 1 A 16 16 LEU CB C 16 43.500 43.296 0.204 1
1 228 . 8 1 1 A 16 16 LEU N N 16 117.800 120.763 -2.963 1
1 229 . 8 1 1 A 17 17 THR H H 17 8.640 8.869 -0.229 1
1 230 . 8 1 1 A 17 17 THR HA H 17 4.250 4.651 -0.401 1
1 235 . 8 1 1 A 17 17 THR C C 17 174.900 175.676 -0.776 1
1 236 . 8 1 1 A 17 17 THR CA C 17 60.500 60.768 -0.268 1
1 237 . 8 1 1 A 17 17 THR CB C 17 70.500 71.117 -0.617 1
1 239 . 8 1 1 A 17 17 THR N N 17 115.200 115.497 -0.297 1
1 240 . 8 1 1 A 18 18 ALA H H 18 8.820 9.037 -0.217 1
1 241 . 8 1 1 A 18 18 ALA HA H 18 3.680 3.975 -0.295 1
1 245 . 8 1 1 A 18 18 ALA C C 18 178.900 179.483 -0.583 1
1 246 . 8 1 1 A 18 18 ALA CA C 18 55.200 55.114 0.086 1
1 247 . 8 1 1 A 18 18 ALA CB C 18 17.800 17.988 -0.188 1
1 248 . 8 1 1 A 18 18 ALA N N 18 125.600 124.754 0.846 1
1 249 . 8 1 1 A 19 19 LYS H H 19 8.280 7.955 0.325 1
1 250 . 8 1 1 A 19 19 LYS HA H 19 3.740 3.960 -0.220 1
1 259 . 8 1 1 A 19 19 LYS C C 19 177.900 178.517 -0.617 1
1 260 . 8 1 1 A 19 19 LYS CA C 19 59.800 59.419 0.381 1
1 261 . 8 1 1 A 19 19 LYS CB C 19 33.300 32.413 0.887 1
1 265 . 8 1 1 A 19 19 LYS N N 19 115.800 119.119 -3.319 1
1 266 . 8 1 1 A 20 20 SER H H 20 7.860 7.756 0.104 1
1 267 . 8 1 1 A 20 20 SER HA H 20 4.210 4.212 -0.002 1
1 271 . 8 1 1 A 20 20 SER C C 20 177.200 177.523 -0.323 1
1 272 . 8 1 1 A 20 20 SER CA C 20 61.900 61.697 0.203 1
1 273 . 8 1 1 A 20 20 SER CB C 20 63.000 63.110 -0.110 1
1 274 . 8 1 1 A 20 20 SER N N 20 114.600 114.466 0.134 1
1 275 . 8 1 1 A 21 21 VAL H H 21 7.830 7.829 0.001 1
1 276 . 8 1 1 A 21 21 VAL HA H 21 3.280 3.547 -0.267 1
1 284 . 8 1 1 A 21 21 VAL C C 21 177.500 178.114 -0.614 1
1 285 . 8 1 1 A 21 21 VAL CA C 21 66.800 66.492 0.308 1
1 286 . 8 1 1 A 21 21 VAL CB C 21 31.400 31.534 -0.134 1
1 289 . 8 1 1 A 21 21 VAL N N 21 122.600 121.053 1.547 1
1 290 . 8 1 1 A 22 22 ALA H H 22 8.230 8.559 -0.329 1
1 291 . 8 1 1 A 22 22 ALA HA H 22 3.510 3.892 -0.382 1
1 295 . 8 1 1 A 22 22 ALA C C 22 179.500 179.831 -0.331 1
1 296 . 8 1 1 A 22 22 ALA CA C 22 55.500 55.645 -0.145 1
1 297 . 8 1 1 A 22 22 ALA CB C 22 16.900 18.207 -1.307 1
1 298 . 8 1 1 A 22 22 ALA N N 22 121.200 121.788 -0.588 1
1 299 . 8 1 1 A 23 23 GLU H H 23 7.900 8.182 -0.282 1
1 300 . 8 1 1 A 23 23 GLU HA H 23 3.990 3.963 0.027 1
1 305 . 8 1 1 A 23 23 GLU C C 23 180.000 179.054 0.946 1
1 306 . 8 1 1 A 23 23 GLU CA C 23 59.300 59.673 -0.373 1
1 307 . 8 1 1 A 23 23 GLU CB C 23 29.300 29.441 -0.141 1
1 309 . 8 1 1 A 23 23 GLU N N 23 115.300 117.767 -2.467 1
1 310 . 8 1 1 A 24 24 GLU H H 24 7.950 7.815 0.135 1
1 311 . 8 1 1 A 24 24 GLU HA H 24 4.060 4.088 -0.028 1
1 316 . 8 1 1 A 24 24 GLU C C 24 179.100 178.993 0.107 1
1 317 . 8 1 1 A 24 24 GLU CA C 24 59.700 59.142 0.558 1
1 318 . 8 1 1 A 24 24 GLU CB C 24 29.500 29.042 0.458 1
1 320 . 8 1 1 A 24 24 GLU N N 24 120.100 120.261 -0.161 1
1 321 . 8 1 1 A 25 25 MET H H 25 8.150 8.477 -0.327 1
1 322 . 8 1 1 A 25 25 MET HA H 25 4.110 4.301 -0.191 1
1 330 . 8 1 1 A 25 25 MET C C 25 176.600 176.788 -0.188 1
1 331 . 8 1 1 A 25 25 MET CA C 25 57.100 56.871 0.229 1
1 332 . 8 1 1 A 25 25 MET CB C 25 34.900 32.652 2.248 1
1 335 . 8 1 1 A 25 25 MET N N 25 115.500 117.372 -1.872 1
1 336 . 8 1 1 A 26 26 GLY H H 26 7.940 9.079 -1.139 1
1 337 . 8 1 1 A 26 26 GLY HA2 H 26 3.860 3.893 -0.033 1
1 338 . 8 1 1 A 26 26 GLY HA3 H 26 3.960 3.902 0.058 1
1 339 . 8 1 1 A 26 26 GLY C C 26 175.100 173.867 1.233 1
1 340 . 8 1 1 A 26 26 GLY CA C 26 46.600 46.205 0.395 1
1 341 . 8 1 1 A 26 26 GLY N N 26 109.000 106.938 2.062 1
1 342 . 8 1 1 A 27 27 ILE H H 27 7.880 7.247 0.633 1
1 343 . 8 1 1 A 27 27 ILE HA H 27 4.790 4.758 0.032 1
1 353 . 8 1 1 A 27 27 ILE C C 27 174.300 174.970 -0.670 1
1 354 . 8 1 1 A 27 27 ILE CA C 27 59.000 58.483 0.517 1
1 355 . 8 1 1 A 27 27 ILE CB C 27 40.900 41.455 -0.555 1
1 359 . 8 1 1 A 27 27 ILE N N 27 112.700 115.585 -2.885 1
1 360 . 8 1 1 A 28 28 SER H H 28 8.570 8.631 -0.061 1
1 361 . 8 1 1 A 28 28 SER HA H 28 4.540 4.699 -0.159 1
1 364 . 8 1 1 A 28 28 SER C C 28 175.600 175.787 -0.187 1
1 365 . 8 1 1 A 28 28 SER CA C 28 56.800 57.360 -0.560 1
1 366 . 8 1 1 A 28 28 SER CB C 28 65.500 65.350 0.150 1
1 367 . 8 1 1 A 28 28 SER N N 28 115.400 117.558 -2.158 1
1 368 . 8 1 1 A 29 29 ARG H H 29 8.980 9.016 -0.036 1
1 369 . 8 1 1 A 29 29 ARG HA H 29 3.660 3.936 -0.276 1
1 377 . 8 1 1 A 29 29 ARG C C 29 178.700 178.722 -0.022 1
1 378 . 8 1 1 A 29 29 ARG CA C 29 59.500 60.033 -0.533 1
1 379 . 8 1 1 A 29 29 ARG CB C 29 29.500 29.878 -0.378 1
1 382 . 8 1 1 A 29 29 ARG N N 29 122.000 120.712 1.288 1
1 384 . 8 1 1 A 30 30 GLN H H 30 8.580 8.032 0.548 1
1 385 . 8 1 1 A 30 30 GLN HA H 30 3.860 4.023 -0.163 1
1 392 . 8 1 1 A 30 30 GLN C C 30 178.100 178.172 -0.072 1
1 393 . 8 1 1 A 30 30 GLN CA C 30 59.200 59.159 0.041 1
1 394 . 8 1 1 A 30 30 GLN CB C 30 28.100 28.384 -0.284 1
1 397 . 8 1 1 A 30 30 GLN N N 30 118.700 119.305 -0.605 1
1 399 . 8 1 1 A 31 31 GLN H H 31 7.990 7.479 0.511 1
1 400 . 8 1 1 A 31 31 GLN HA H 31 3.980 3.968 0.012 1
1 407 . 8 1 1 A 31 31 GLN C C 31 178.700 177.983 0.717 1
1 408 . 8 1 1 A 31 31 GLN CA C 31 59.100 58.643 0.457 1
1 409 . 8 1 1 A 31 31 GLN CB C 31 28.700 28.026 0.674 1
1 412 . 8 1 1 A 31 31 GLN N N 31 119.600 119.191 0.409 1
1 414 . 8 1 1 A 32 32 LEU H H 32 7.630 7.510 0.120 1
1 415 . 8 1 1 A 32 32 LEU HA H 32 3.740 4.111 -0.371 1
1 425 . 8 1 1 A 32 32 LEU C C 32 178.300 178.882 -0.582 1
1 426 . 8 1 1 A 32 32 LEU CA C 32 57.700 57.514 0.186 1
1 427 . 8 1 1 A 32 32 LEU CB C 32 41.500 41.339 0.161 1
1 431 . 8 1 1 A 32 32 LEU N N 32 120.700 120.716 -0.016 1
1 432 . 8 1 1 A 33 33 CYS H H 33 8.240 8.173 0.067 1
1 433 . 8 1 1 A 33 33 CYS HA H 33 3.990 4.030 -0.040 1
1 436 . 8 1 1 A 33 33 CYS C C 33 177.000 177.068 -0.068 1
1 437 . 8 1 1 A 33 33 CYS CA C 33 63.100 63.288 -0.188 1
1 438 . 8 1 1 A 33 33 CYS CB C 33 26.100 26.698 -0.598 1
1 439 . 8 1 1 A 33 33 CYS N N 33 117.400 117.894 -0.494 1
1 440 . 8 1 1 A 34 34 ASN H H 34 8.210 8.007 0.203 1
1 441 . 8 1 1 A 34 34 ASN HA H 34 4.370 4.442 -0.072 1
1 446 . 8 1 1 A 34 34 ASN C C 34 178.700 177.882 0.818 1
1 447 . 8 1 1 A 34 34 ASN CA C 34 56.000 56.472 -0.472 1
1 448 . 8 1 1 A 34 34 ASN CB C 34 37.800 39.626 -1.826 1
1 450 . 8 1 1 A 34 34 ASN N N 34 117.300 119.667 -2.367 1
1 452 . 8 1 1 A 35 35 ILE H H 35 7.850 7.461 0.389 1
1 453 . 8 1 1 A 35 35 ILE HA H 35 3.850 3.608 0.242 1
1 463 . 8 1 1 A 35 35 ILE C C 35 178.100 177.995 0.105 1
1 464 . 8 1 1 A 35 35 ILE CA C 35 64.800 65.367 -0.567 1
1 465 . 8 1 1 A 35 35 ILE CB C 35 38.000 37.829 0.171 1
1 469 . 8 1 1 A 35 35 ILE N N 35 120.400 119.675 0.725 1
1 470 . 8 1 1 A 36 36 GLU H H 36 7.680 7.845 -0.165 1
1 471 . 8 1 1 A 36 36 GLU HA H 36 4.120 3.987 0.133 1
1 476 . 8 1 1 A 36 36 GLU C C 36 176.300 178.020 -1.720 1
1 477 . 8 1 1 A 36 36 GLU CA C 36 58.600 59.159 -0.559 1
1 478 . 8 1 1 A 36 36 GLU CB C 36 30.000 29.667 0.333 1
1 480 . 8 1 1 A 36 36 GLU N N 36 116.500 121.477 -4.977 1
1 481 . 8 1 1 A 37 37 GLN H H 37 7.630 7.896 -0.266 1
1 482 . 8 1 1 A 37 37 GLN HA H 37 4.540 4.454 0.086 1
1 489 . 8 1 1 A 37 37 GLN C C 37 176.000 177.187 -1.187 1
1 490 . 8 1 1 A 37 37 GLN CA C 37 54.900 54.976 -0.076 1
1 491 . 8 1 1 A 37 37 GLN CB C 37 29.600 28.180 1.420 1
1 494 . 8 1 1 A 37 37 GLN N N 37 115.000 115.859 -0.859 1
1 496 . 8 1 1 A 38 38 SER H H 38 7.380 7.922 -0.542 1
1 497 . 8 1 1 A 38 38 SER HA H 38 4.410 4.129 0.281 1
1 500 . 8 1 1 A 38 38 SER C C 38 175.500 174.441 1.059 1
1 501 . 8 1 1 A 38 38 SER CA C 38 59.200 61.546 -2.346 1
1 502 . 8 1 1 A 38 38 SER CB C 38 64.100 63.050 1.050 1
1 503 . 8 1 1 A 38 38 SER N N 38 115.200 116.701 -1.501 1
1 504 . 8 1 1 A 39 39 GLU H H 39 9.040 8.127 0.913 1
1 505 . 8 1 1 A 39 39 GLU HA H 39 4.450 4.192 0.258 1
1 510 . 8 1 1 A 39 39 GLU C C 39 176.300 175.967 0.333 1
1 511 . 8 1 1 A 39 39 GLU CA C 39 57.100 59.650 -2.550 1
1 512 . 8 1 1 A 39 39 GLU CB C 39 30.300 29.049 1.251 1
1 514 . 8 1 1 A 39 39 GLU N N 39 125.400 120.337 5.063 1
1 515 . 8 1 1 A 40 40 THR H H 40 7.920 8.302 -0.382 1
1 516 . 8 1 1 A 40 40 THR HA H 40 4.590 4.206 0.384 1
1 521 . 8 1 1 A 40 40 THR C C 40 173.500 173.694 -0.194 1
1 522 . 8 1 1 A 40 40 THR CA C 40 60.500 63.970 -3.470 1
1 523 . 8 1 1 A 40 40 THR CB C 40 71.100 68.509 2.591 1
1 525 . 8 1 1 A 40 40 THR N N 40 112.800 116.082 -3.282 1
1 526 . 8 1 1 A 41 41 ALA H H 41 8.780 8.132 0.648 1
1 527 . 8 1 1 A 41 41 ALA HA H 41 4.870 4.526 0.344 1
1 531 . 8 1 1 A 41 41 ALA CA C 41 49.700 50.796 -1.096 1
1 532 . 8 1 1 A 41 41 ALA CB C 41 19.300 18.247 1.053 1
1 533 . 8 1 1 A 41 41 ALA N N 41 127.000 129.696 -2.696 1
1 534 . 8 1 1 A 42 42 PRO HA H 42 4.660 4.594 0.066 1
1 541 . 8 1 1 A 42 42 PRO C C 42 178.300 177.764 0.536 1
1 542 . 8 1 1 A 42 42 PRO CA C 42 62.500 62.909 -0.409 1
1 543 . 8 1 1 A 42 42 PRO CB C 42 32.600 32.704 -0.104 1
1 546 . 8 1 1 A 43 43 VAL H H 43 8.840 8.882 -0.042 1
1 547 . 8 1 1 A 43 43 VAL HA H 43 3.660 3.945 -0.285 1
1 555 . 8 1 1 A 43 43 VAL CA C 43 66.800 64.476 2.324 1
1 556 . 8 1 1 A 43 43 VAL CB C 43 31.100 31.869 -0.769 1
1 559 . 8 1 1 A 43 43 VAL N N 43 123.000 124.180 -1.180 1
1 560 . 8 1 1 A 44 44 VAL HA H 44 4.030 3.767 0.263 1
1 568 . 8 1 1 A 44 44 VAL C C 44 176.700 177.306 -0.606 1
1 569 . 8 1 1 A 44 44 VAL CA C 44 65.900 65.191 0.709 1
1 570 . 8 1 1 A 44 44 VAL CB C 44 30.900 31.148 -0.248 1
1 573 . 8 1 1 A 45 45 VAL H H 45 7.500 7.956 -0.456 1
1 574 . 8 1 1 A 45 45 VAL HA H 45 3.760 3.589 0.171 1
1 582 . 8 1 1 A 45 45 VAL C C 45 177.500 177.854 -0.354 1
1 583 . 8 1 1 A 45 45 VAL CA C 45 66.700 66.767 -0.067 1
1 584 . 8 1 1 A 45 45 VAL CB C 45 31.000 31.356 -0.356 1
1 587 . 8 1 1 A 45 45 VAL N N 45 120.100 121.118 -1.018 1
1 588 . 8 1 1 A 46 46 LYS H H 46 7.610 7.683 -0.073 1
1 589 . 8 1 1 A 46 46 LYS HA H 46 4.140 4.041 0.099 1
1 598 . 8 1 1 A 46 46 LYS C C 46 179.500 178.734 0.766 1
1 599 . 8 1 1 A 46 46 LYS CA C 46 59.900 59.225 0.675 1
1 600 . 8 1 1 A 46 46 LYS CB C 46 31.500 32.151 -0.651 1
1 604 . 8 1 1 A 46 46 LYS N N 46 120.700 118.716 1.984 1
1 605 . 8 1 1 A 47 47 TYR H H 47 8.550 8.008 0.542 1
1 606 . 8 1 1 A 47 47 TYR HA H 47 5.000 4.156 0.844 1
1 613 . 8 1 1 A 47 47 TYR C C 47 177.300 177.426 -0.126 1
1 614 . 8 1 1 A 47 47 TYR CA C 47 57.300 61.504 -4.204 1
1 615 . 8 1 1 A 47 47 TYR CB C 47 37.700 38.752 -1.052 1
1 620 . 8 1 1 A 47 47 TYR N N 47 122.700 120.834 1.866 1
1 621 . 8 1 1 A 48 48 ILE H H 48 8.250 8.248 0.002 1
1 622 . 8 1 1 A 48 48 ILE HA H 48 3.160 3.726 -0.566 1
1 632 . 8 1 1 A 48 48 ILE C C 48 177.100 178.164 -1.064 1
1 633 . 8 1 1 A 48 48 ILE CA C 48 67.000 65.767 1.233 1
1 634 . 8 1 1 A 48 48 ILE CB C 48 37.800 38.514 -0.714 1
1 638 . 8 1 1 A 48 48 ILE N N 48 121.200 120.805 0.395 1
1 639 . 8 1 1 A 49 49 ALA H H 49 8.310 8.168 0.142 1
1 640 . 8 1 1 A 49 49 ALA HA H 49 3.940 4.136 -0.196 1
1 644 . 8 1 1 A 49 49 ALA C C 49 179.300 179.786 -0.486 1
1 645 . 8 1 1 A 49 49 ALA CA C 49 55.500 54.811 0.689 1
1 646 . 8 1 1 A 49 49 ALA CB C 49 18.200 18.284 -0.084 1
1 647 . 8 1 1 A 49 49 ALA N N 49 120.300 121.436 -1.136 1
1 648 . 8 1 1 A 50 50 PHE H H 50 8.630 7.909 0.721 1
1 649 . 8 1 1 A 50 50 PHE HA H 50 4.200 4.195 0.005 1
1 656 . 8 1 1 A 50 50 PHE C C 50 179.000 176.963 2.037 1
1 657 . 8 1 1 A 50 50 PHE CA C 50 61.300 61.340 -0.040 1
1 658 . 8 1 1 A 50 50 PHE CB C 50 39.200 39.306 -0.106 1
1 663 . 8 1 1 A 50 50 PHE N N 50 121.300 120.441 0.859 1
1 664 . 8 1 1 A 51 51 LEU H H 51 8.920 7.922 0.998 1
1 665 . 8 1 1 A 51 51 LEU HA H 51 3.630 3.915 -0.285 1
1 675 . 8 1 1 A 51 51 LEU C C 51 180.000 179.194 0.806 1
1 676 . 8 1 1 A 51 51 LEU CA C 51 58.100 57.096 1.004 1
1 677 . 8 1 1 A 51 51 LEU CB C 51 39.800 41.783 -1.983 1
1 681 . 8 1 1 A 51 51 LEU N N 51 121.900 118.568 3.332 1
1 682 . 8 1 1 A 52 52 ARG H H 52 8.410 8.313 0.097 1
1 683 . 8 1 1 A 52 52 ARG HA H 52 4.420 3.971 0.449 1
1 691 . 8 1 1 A 52 52 ARG C C 52 179.800 178.728 1.072 1
1 692 . 8 1 1 A 52 52 ARG CA C 52 57.800 59.624 -1.824 1
1 693 . 8 1 1 A 52 52 ARG CB C 52 28.200 29.944 -1.744 1
1 695 . 8 1 1 A 52 52 ARG N N 52 120.500 121.287 -0.787 1
1 697 . 8 1 1 A 53 53 SER H H 53 8.480 7.827 0.653 1
1 698 . 8 1 1 A 53 53 SER HA H 53 4.300 4.021 0.279 1
1 701 . 8 1 1 A 53 53 SER C C 53 174.600 175.839 -1.239 1
1 702 . 8 1 1 A 53 53 SER CA C 53 61.500 62.164 -0.664 1
1 703 . 8 1 1 A 53 53 SER CB C 53 62.300 62.690 -0.390 1
1 704 . 8 1 1 A 53 53 SER N N 53 119.500 117.244 2.256 1
1 705 . 8 1 1 A 54 54 LYS H H 54 7.080 7.561 -0.481 1
1 706 . 8 1 1 A 54 54 LYS HA H 54 4.350 4.252 0.098 1
1 715 . 8 1 1 A 54 54 LYS C C 54 176.500 176.737 -0.237 1
1 716 . 8 1 1 A 54 54 LYS CA C 54 53.700 55.730 -2.030 1
1 717 . 8 1 1 A 54 54 LYS CB C 54 31.800 32.748 -0.948 1
1 721 . 8 1 1 A 54 54 LYS N N 54 119.200 118.475 0.725 1
1 722 . 8 1 1 A 55 55 GLY H H 55 8.040 8.111 -0.071 1
1 723 . 8 1 1 A 55 55 GLY HA2 H 55 3.540 3.894 -0.354 1
1 724 . 8 1 1 A 55 55 GLY HA3 H 55 4.300 3.898 0.402 1
1 725 . 8 1 1 A 55 55 GLY C C 55 174.500 175.079 -0.579 1
1 726 . 8 1 1 A 55 55 GLY CA C 55 44.700 46.675 -1.975 1
1 727 . 8 1 1 A 55 55 GLY N N 55 106.600 108.035 -1.435 1
1 728 . 8 1 1 A 56 56 VAL H H 56 7.580 7.620 -0.040 1
1 729 . 8 1 1 A 56 56 VAL HA H 56 3.630 3.990 -0.360 1
1 737 . 8 1 1 A 56 56 VAL C C 56 174.700 175.533 -0.833 1
1 738 . 8 1 1 A 56 56 VAL CA C 56 64.000 65.497 -1.497 1
1 739 . 8 1 1 A 56 56 VAL CB C 56 31.600 31.925 -0.325 1
1 742 . 8 1 1 A 56 56 VAL N N 56 122.000 117.667 4.333 1
1 743 . 8 1 1 A 57 57 ASP H H 57 8.440 8.163 0.277 1
1 744 . 8 1 1 A 57 57 ASP HA H 57 4.500 4.350 0.150 1
1 747 . 8 1 1 A 57 57 ASP C C 57 176.900 176.364 0.536 1
1 748 . 8 1 1 A 57 57 ASP CA C 57 52.600 54.875 -2.275 1
1 749 . 8 1 1 A 57 57 ASP CB C 57 39.900 39.181 0.719 1
1 750 . 8 1 1 A 57 57 ASP N N 57 124.100 121.216 2.884 1
1 751 . 8 1 1 A 58 58 LEU H H 58 9.720 8.111 1.609 1
1 752 . 8 1 1 A 58 58 LEU HA H 58 4.020 4.196 -0.176 1
1 762 . 8 1 1 A 58 58 LEU C C 58 179.400 178.580 0.820 1
1 763 . 8 1 1 A 58 58 LEU CA C 58 56.300 55.836 0.464 1
1 764 . 8 1 1 A 58 58 LEU CB C 58 43.300 41.934 1.366 1
1 768 . 8 1 1 A 58 58 LEU N N 58 127.800 122.640 5.160 1
1 769 . 8 1 1 A 59 59 ASN H H 59 7.740 8.524 -0.784 1
1 770 . 8 1 1 A 59 59 ASN HA H 59 4.340 4.603 -0.263 1
1 775 . 8 1 1 A 59 59 ASN C C 59 176.300 177.426 -1.126 1
1 776 . 8 1 1 A 59 59 ASN CA C 59 56.300 55.942 0.358 1
1 777 . 8 1 1 A 59 59 ASN CB C 59 36.400 38.226 -1.826 1
1 779 . 8 1 1 A 59 59 ASN N N 59 119.500 117.509 1.991 1
1 781 . 8 1 1 A 60 60 ALA H H 60 7.220 7.401 -0.181 1
1 782 . 8 1 1 A 60 60 ALA HA H 60 4.030 4.105 -0.075 1
1 786 . 8 1 1 A 60 60 ALA C C 60 180.100 180.223 -0.123 1
1 787 . 8 1 1 A 60 60 ALA CA C 60 54.300 54.913 -0.613 1
1 788 . 8 1 1 A 60 60 ALA CB C 60 18.200 18.066 0.134 1
1 789 . 8 1 1 A 60 60 ALA N N 60 121.400 122.222 -0.822 1
1 790 . 8 1 1 A 61 61 LEU H H 61 7.320 8.044 -0.724 1
1 791 . 8 1 1 A 61 61 LEU HA H 61 3.840 4.005 -0.165 1
1 801 . 8 1 1 A 61 61 LEU C C 61 177.200 178.528 -1.328 1
1 802 . 8 1 1 A 61 61 LEU CA C 61 58.500 58.025 0.475 1
1 803 . 8 1 1 A 61 61 LEU CB C 61 42.600 41.661 0.939 1
1 807 . 8 1 1 A 61 61 LEU N N 61 118.600 120.649 -2.049 1
1 808 . 8 1 1 A 62 62 PHE H H 62 8.360 8.676 -0.316 1
1 809 . 8 1 1 A 62 62 PHE HA H 62 3.930 4.341 -0.411 1
1 817 . 8 1 1 A 62 62 PHE C C 62 178.200 177.759 0.441 1
1 818 . 8 1 1 A 62 62 PHE CA C 62 62.800 60.231 2.569 1
1 819 . 8 1 1 A 62 62 PHE CB C 62 38.500 38.512 -0.012 1
1 825 . 8 1 1 A 62 62 PHE N N 62 114.400 117.600 -3.200 1
1 826 . 8 1 1 A 63 63 ASP H H 63 8.680 8.439 0.241 1
1 827 . 8 1 1 A 63 63 ASP HA H 63 4.530 4.397 0.133 1
1 830 . 8 1 1 A 63 63 ASP C C 63 178.600 178.519 0.081 1
1 831 . 8 1 1 A 63 63 ASP CA C 63 57.500 57.584 -0.084 1
1 832 . 8 1 1 A 63 63 ASP CB C 63 39.600 42.039 -2.439 1
1 833 . 8 1 1 A 63 63 ASP N N 63 120.400 120.028 0.372 1
1 834 . 8 1 1 A 64 64 ARG H H 64 7.540 7.644 -0.104 1
1 835 . 8 1 1 A 64 64 ARG HA H 64 4.290 4.203 0.087 1
1 843 . 8 1 1 A 64 64 ARG C C 64 177.600 176.963 0.637 1
1 844 . 8 1 1 A 64 64 ARG CA C 64 58.300 58.221 0.079 1
1 845 . 8 1 1 A 64 64 ARG CB C 64 30.000 30.098 -0.098 1
1 848 . 8 1 1 A 64 64 ARG N N 64 116.800 117.993 -1.193 1
1 850 . 8 1 1 A 65 65 ILE H H 65 7.260 8.470 -1.210 1
1 851 . 8 1 1 A 65 65 ILE HA H 65 4.130 4.027 0.103 1
1 861 . 8 1 1 A 65 65 ILE C C 65 177.000 178.151 -1.151 1
1 862 . 8 1 1 A 65 65 ILE CA C 65 62.600 63.766 -1.166 1
1 863 . 8 1 1 A 65 65 ILE CB C 65 38.700 38.359 0.341 1
1 867 . 8 1 1 A 65 65 ILE N N 65 117.000 117.603 -0.603 1
1 868 . 8 1 1 A 66 66 ILE H H 66 7.980 7.972 0.008 1
1 869 . 8 1 1 A 66 66 ILE HA H 66 4.000 3.694 0.306 1
1 879 . 8 1 1 A 66 66 ILE C C 66 176.400 176.350 0.050 1
1 880 . 8 1 1 A 66 66 ILE CA C 66 63.100 65.269 -2.169 1
1 881 . 8 1 1 A 66 66 ILE CB C 66 38.800 37.762 1.038 1
1 885 . 8 1 1 A 66 66 ILE N N 66 120.700 119.777 0.923 1
1 886 . 8 1 1 A 67 67 VAL H H 67 8.130 7.241 0.889 1
1 887 . 8 1 1 A 67 67 VAL HA H 67 3.980 4.077 -0.097 1
1 895 . 8 1 1 A 67 67 VAL C C 67 177.300 175.565 1.735 1
1 896 . 8 1 1 A 67 67 VAL CA C 67 63.900 62.268 1.632 1
1 897 . 8 1 1 A 67 67 VAL CB C 67 32.500 32.313 0.187 1
1 900 . 8 1 1 A 67 67 VAL N N 67 121.600 120.457 1.143 1
1 901 . 8 1 1 A 68 68 ASN H H 68 8.170 8.599 -0.429 1
1 902 . 8 1 1 A 68 68 ASN HA H 68 4.680 4.730 -0.050 1
1 907 . 8 1 1 A 68 68 ASN CA C 68 54.200 53.318 0.882 1
1 908 . 8 1 1 A 68 68 ASN CB C 68 39.100 38.916 0.184 1
1 910 . 8 1 1 A 68 68 ASN N N 68 120.500 123.476 -2.976 1
1 912 . 8 1 1 A 69 69 LYS H H 69 8.230 8.718 -0.488 1
1 913 . 8 1 1 A 69 69 LYS HA H 69 4.260 4.571 -0.311 1
1 922 . 8 1 1 A 69 69 LYS C C 69 176.900 176.272 0.628 1
1 923 . 8 1 1 A 69 69 LYS CA C 69 57.000 56.380 0.620 1
1 924 . 8 1 1 A 69 69 LYS CB C 69 32.800 35.667 -2.867 1
1 928 . 8 1 1 A 69 69 LYS N N 69 121.300 127.971 -6.671 1
1 929 . 8 1 1 A 70 70 LEU H H 70 8.150 8.107 0.043 1
1 930 . 8 1 1 A 70 70 LEU HA H 70 4.300 3.923 0.377 1
1 940 . 8 1 1 A 70 70 LEU C C 70 178.900 176.613 2.287 1
1 941 . 8 1 1 A 70 70 LEU CA C 70 55.400 55.371 0.029 1
1 942 . 8 1 1 A 70 70 LEU CB C 70 42.100 40.576 1.524 1
1 946 . 8 1 1 A 70 70 LEU N N 70 121.900 118.889 3.011 1
1 947 . 8 1 1 A 71 71 GLU H H 71 8.210 8.427 -0.217 1
1 948 . 8 1 1 A 71 71 GLU HA H 71 4.180 4.652 -0.472 1
1 953 . 8 1 1 A 71 71 GLU C C 71 176.300 176.145 0.155 1
1 954 . 8 1 1 A 71 71 GLU CA C 71 56.600 57.782 -1.182 1
1 955 . 8 1 1 A 71 71 GLU CB C 71 30.200 32.393 -2.193 1
1 957 . 8 1 1 A 71 71 GLU N N 71 120.900 124.465 -3.565 1
1 958 . 8 1 1 A 72 72 HIS H H 72 8.380 7.677 0.703 1
1 959 . 8 1 1 A 72 72 HIS HA H 72 4.600 4.759 -0.159 1
1 962 . 8 1 1 A 72 72 HIS C C 72 174.600 172.368 2.232 1
1 963 . 8 1 1 A 72 72 HIS CA C 72 55.600 54.815 0.785 1
1 964 . 8 1 1 A 72 72 HIS CB C 72 29.600 31.040 -1.440 1
1 965 . 8 1 1 A 72 72 HIS N N 72 119.300 115.212 4.088 1
1 966 . 8 1 1 A 73 73 HIS H H 73 8.410 8.312 0.098 1
1 967 . 8 1 1 A 73 73 HIS HA H 73 4.610 4.809 -0.199 1
1 970 . 8 1 1 A 73 73 HIS C C 73 173.700 173.733 -0.033 1
1 971 . 8 1 1 A 73 73 HIS CA C 73 55.700 54.210 1.490 1
1 972 . 8 1 1 A 73 73 HIS CB C 73 29.600 33.150 -3.550 1
1 973 . 8 1 1 A 73 73 HIS N N 73 119.410 114.750 4.660 1
1 974 . 8 1 1 A 74 74 HIS H H 74 8.310 8.923 -0.613 1
1 975 . 8 1 1 A 74 74 HIS HA H 74 4.630 5.295 -0.665 1
1 978 . 8 1 1 A 74 74 HIS CA C 74 57.100 54.422 2.678 1
1 979 . 8 1 1 A 74 74 HIS CB C 74 29.800 31.731 -1.931 1
1 14 . 9 1 1 A 2 2 GLU H H 2 9.070 8.245 0.825 1
1 15 . 9 1 1 A 2 2 GLU HA H 2 4.520 4.301 0.219 1
1 20 . 9 1 1 A 2 2 GLU C C 2 176.300 176.428 -0.128 1
1 21 . 9 1 1 A 2 2 GLU CA C 2 55.800 58.432 -2.632 1
1 22 . 9 1 1 A 2 2 GLU CB C 2 31.000 28.690 2.310 1
1 24 . 9 1 1 A 2 2 GLU N N 2 123.100 111.489 11.611 1
1 25 . 9 1 1 A 3 3 LEU H H 3 8.750 8.762 -0.012 1
1 26 . 9 1 1 A 3 3 LEU HA H 3 3.750 4.108 -0.358 1
1 36 . 9 1 1 A 3 3 LEU C C 3 177.400 178.180 -0.780 1
1 37 . 9 1 1 A 3 3 LEU CA C 3 58.300 58.099 0.201 1
1 38 . 9 1 1 A 3 3 LEU CB C 3 41.500 41.590 -0.090 1
1 42 . 9 1 1 A 3 3 LEU N N 3 122.600 125.642 -3.042 1
1 43 . 9 1 1 A 4 4 SER H H 4 8.350 8.104 0.246 1
1 44 . 9 1 1 A 4 4 SER HA H 4 3.890 4.171 -0.281 1
1 47 . 9 1 1 A 4 4 SER C C 4 175.100 176.755 -1.655 1
1 48 . 9 1 1 A 4 4 SER CA C 4 61.500 61.417 0.083 1
1 49 . 9 1 1 A 4 4 SER CB C 4 62.000 62.370 -0.370 1
1 50 . 9 1 1 A 4 4 SER N N 4 112.900 114.899 -1.999 1
1 51 . 9 1 1 A 5 5 ASN H H 5 7.180 8.276 -1.096 1
1 52 . 9 1 1 A 5 5 ASN HA H 5 4.470 4.420 0.050 1
1 57 . 9 1 1 A 5 5 ASN C C 5 177.400 177.926 -0.526 1
1 58 . 9 1 1 A 5 5 ASN CA C 5 56.000 56.936 -0.936 1
1 59 . 9 1 1 A 5 5 ASN CB C 5 39.400 39.091 0.309 1
1 61 . 9 1 1 A 5 5 ASN N N 5 116.600 120.346 -3.746 1
1 63 . 9 1 1 A 6 6 GLU H H 6 7.950 7.613 0.337 1
1 64 . 9 1 1 A 6 6 GLU HA H 6 4.070 4.155 -0.085 1
1 69 . 9 1 1 A 6 6 GLU C C 6 178.500 178.716 -0.216 1
1 70 . 9 1 1 A 6 6 GLU CA C 6 58.100 58.895 -0.795 1
1 71 . 9 1 1 A 6 6 GLU CB C 6 29.300 29.488 -0.188 1
1 73 . 9 1 1 A 6 6 GLU N N 6 117.600 119.441 -1.841 1
1 74 . 9 1 1 A 7 7 LEU H H 7 8.140 8.785 -0.645 1
1 75 . 9 1 1 A 7 7 LEU HA H 7 3.640 4.129 -0.489 1
1 85 . 9 1 1 A 7 7 LEU C C 7 177.700 178.306 -0.606 1
1 86 . 9 1 1 A 7 7 LEU CA C 7 58.300 57.778 0.522 1
1 87 . 9 1 1 A 7 7 LEU CB C 7 40.600 41.478 -0.878 1
1 91 . 9 1 1 A 7 7 LEU N N 7 118.500 121.322 -2.822 1
1 92 . 9 1 1 A 8 8 LYS H H 8 7.090 8.590 -1.500 1
1 93 . 9 1 1 A 8 8 LYS HA H 8 4.080 3.989 0.091 1
1 102 . 9 1 1 A 8 8 LYS C C 8 178.300 178.708 -0.408 1
1 103 . 9 1 1 A 8 8 LYS CA C 8 59.700 59.486 0.214 1
1 104 . 9 1 1 A 8 8 LYS CB C 8 32.300 32.230 0.070 1
1 108 . 9 1 1 A 8 8 LYS N N 8 118.200 119.383 -1.183 1
1 109 . 9 1 1 A 9 9 VAL H H 9 7.940 7.843 0.097 1
1 110 . 9 1 1 A 9 9 VAL HA H 9 3.440 3.537 -0.097 1
1 118 . 9 1 1 A 9 9 VAL C C 9 179.500 177.719 1.781 1
1 119 . 9 1 1 A 9 9 VAL CA C 9 66.700 66.489 0.211 1
1 120 . 9 1 1 A 9 9 VAL CB C 9 31.600 31.309 0.291 1
1 123 . 9 1 1 A 9 9 VAL N N 9 117.600 119.416 -1.816 1
1 124 . 9 1 1 A 10 10 GLU H H 10 7.830 8.233 -0.403 1
1 125 . 9 1 1 A 10 10 GLU HA H 10 4.130 3.942 0.188 1
1 130 . 9 1 1 A 10 10 GLU C C 10 178.700 179.281 -0.581 1
1 131 . 9 1 1 A 10 10 GLU CA C 10 58.300 59.837 -1.537 1
1 132 . 9 1 1 A 10 10 GLU CB C 10 28.500 29.395 -0.895 1
1 134 . 9 1 1 A 10 10 GLU N N 10 118.300 118.413 -0.113 1
1 135 . 9 1 1 A 11 11 ARG H H 11 8.330 7.552 0.778 1
1 136 . 9 1 1 A 11 11 ARG HA H 11 3.770 4.097 -0.327 1
1 144 . 9 1 1 A 11 11 ARG C C 11 174.600 178.925 -4.325 1
1 145 . 9 1 1 A 11 11 ARG CA C 11 61.300 58.922 2.378 1
1 146 . 9 1 1 A 11 11 ARG CB C 11 28.500 29.968 -1.468 1
1 149 . 9 1 1 A 11 11 ARG N N 11 121.400 119.967 1.433 1
1 151 . 9 1 1 A 12 12 ILE H H 12 8.540 7.914 0.626 1
1 152 . 9 1 1 A 12 12 ILE HA H 12 3.780 3.822 -0.042 1
1 162 . 9 1 1 A 12 12 ILE C C 12 181.400 178.066 3.334 1
1 163 . 9 1 1 A 12 12 ILE CA C 12 64.800 64.657 0.143 1
1 164 . 9 1 1 A 12 12 ILE CB C 12 37.700 36.900 0.800 1
1 168 . 9 1 1 A 12 12 ILE N N 12 118.700 119.777 -1.077 1
1 169 . 9 1 1 A 13 13 ARG H H 13 8.470 8.447 0.023 1
1 170 . 9 1 1 A 13 13 ARG HA H 13 4.060 3.975 0.085 1
1 178 . 9 1 1 A 13 13 ARG C C 13 178.600 178.000 0.600 1
1 179 . 9 1 1 A 13 13 ARG CA C 13 59.600 59.254 0.346 1
1 180 . 9 1 1 A 13 13 ARG CB C 13 30.000 29.938 0.062 1
1 183 . 9 1 1 A 13 13 ARG N N 13 124.600 121.879 2.721 1
1 185 . 9 1 1 A 14 14 LEU H H 14 7.430 7.534 -0.104 1
1 186 . 9 1 1 A 14 14 LEU HA H 14 4.240 4.380 -0.140 1
1 196 . 9 1 1 A 14 14 LEU C C 14 176.000 176.393 -0.393 1
1 197 . 9 1 1 A 14 14 LEU CA C 14 55.300 54.404 0.896 1
1 198 . 9 1 1 A 14 14 LEU CB C 14 43.000 42.322 0.678 1
1 202 . 9 1 1 A 14 14 LEU N N 14 118.500 118.274 0.226 1
1 203 . 9 1 1 A 15 15 SER H H 15 8.260 7.860 0.400 1
1 204 . 9 1 1 A 15 15 SER HA H 15 4.030 4.168 -0.138 1
1 207 . 9 1 1 A 15 15 SER C C 15 174.000 173.532 0.468 1
1 208 . 9 1 1 A 15 15 SER CA C 15 58.700 58.946 -0.246 1
1 209 . 9 1 1 A 15 15 SER CB C 15 61.300 60.741 0.559 1
1 210 . 9 1 1 A 15 15 SER N N 15 112.500 114.079 -1.579 1
1 211 . 9 1 1 A 16 16 LEU H H 16 7.310 7.765 -0.455 1
1 212 . 9 1 1 A 16 16 LEU HA H 16 4.880 4.742 0.138 1
1 222 . 9 1 1 A 16 16 LEU C C 16 177.900 177.066 0.834 1
1 223 . 9 1 1 A 16 16 LEU CA C 16 52.600 53.772 -1.172 1
1 224 . 9 1 1 A 16 16 LEU CB C 16 43.500 43.738 -0.238 1
1 228 . 9 1 1 A 16 16 LEU N N 16 117.800 121.563 -3.763 1
1 229 . 9 1 1 A 17 17 THR H H 17 8.640 8.473 0.167 1
1 230 . 9 1 1 A 17 17 THR HA H 17 4.250 4.911 -0.661 1
1 235 . 9 1 1 A 17 17 THR C C 17 174.900 175.495 -0.595 1
1 236 . 9 1 1 A 17 17 THR CA C 17 60.500 60.069 0.431 1
1 237 . 9 1 1 A 17 17 THR CB C 17 70.500 70.654 -0.154 1
1 239 . 9 1 1 A 17 17 THR N N 17 115.200 112.561 2.639 1
1 240 . 9 1 1 A 18 18 ALA H H 18 8.820 9.128 -0.308 1
1 241 . 9 1 1 A 18 18 ALA HA H 18 3.680 3.997 -0.317 1
1 245 . 9 1 1 A 18 18 ALA C C 18 178.900 179.430 -0.530 1
1 246 . 9 1 1 A 18 18 ALA CA C 18 55.200 55.280 -0.080 1
1 247 . 9 1 1 A 18 18 ALA CB C 18 17.800 18.082 -0.282 1
1 248 . 9 1 1 A 18 18 ALA N N 18 125.600 126.754 -1.154 1
1 249 . 9 1 1 A 19 19 LYS H H 19 8.280 7.978 0.302 1
1 250 . 9 1 1 A 19 19 LYS HA H 19 3.740 3.963 -0.223 1
1 259 . 9 1 1 A 19 19 LYS C C 19 177.900 178.873 -0.973 1
1 260 . 9 1 1 A 19 19 LYS CA C 19 59.800 59.492 0.308 1
1 261 . 9 1 1 A 19 19 LYS CB C 19 33.300 32.390 0.910 1
1 265 . 9 1 1 A 19 19 LYS N N 19 115.800 119.022 -3.222 1
1 266 . 9 1 1 A 20 20 SER H H 20 7.860 8.036 -0.176 1
1 267 . 9 1 1 A 20 20 SER HA H 20 4.210 4.156 0.054 1
1 271 . 9 1 1 A 20 20 SER C C 20 177.200 176.263 0.937 1
1 272 . 9 1 1 A 20 20 SER CA C 20 61.900 62.647 -0.747 1
1 273 . 9 1 1 A 20 20 SER CB C 20 63.000 63.056 -0.056 1
1 274 . 9 1 1 A 20 20 SER N N 20 114.600 116.982 -2.382 1
1 275 . 9 1 1 A 21 21 VAL H H 21 7.830 7.925 -0.095 1
1 276 . 9 1 1 A 21 21 VAL HA H 21 3.280 3.594 -0.314 1
1 284 . 9 1 1 A 21 21 VAL C C 21 177.500 178.145 -0.645 1
1 285 . 9 1 1 A 21 21 VAL CA C 21 66.800 66.602 0.198 1
1 286 . 9 1 1 A 21 21 VAL CB C 21 31.400 31.605 -0.205 1
1 289 . 9 1 1 A 21 21 VAL N N 21 122.600 122.026 0.574 1
1 290 . 9 1 1 A 22 22 ALA H H 22 8.230 8.096 0.134 1
1 291 . 9 1 1 A 22 22 ALA HA H 22 3.510 3.987 -0.477 1
1 295 . 9 1 1 A 22 22 ALA C C 22 179.500 179.898 -0.398 1
1 296 . 9 1 1 A 22 22 ALA CA C 22 55.500 55.786 -0.286 1
1 297 . 9 1 1 A 22 22 ALA CB C 22 16.900 18.177 -1.277 1
1 298 . 9 1 1 A 22 22 ALA N N 22 121.200 122.182 -0.982 1
1 299 . 9 1 1 A 23 23 GLU H H 23 7.900 8.149 -0.249 1
1 300 . 9 1 1 A 23 23 GLU HA H 23 3.990 4.076 -0.086 1
1 305 . 9 1 1 A 23 23 GLU C C 23 180.000 179.079 0.921 1
1 306 . 9 1 1 A 23 23 GLU CA C 23 59.300 59.460 -0.160 1
1 307 . 9 1 1 A 23 23 GLU CB C 23 29.300 29.576 -0.276 1
1 309 . 9 1 1 A 23 23 GLU N N 23 115.300 117.821 -2.521 1
1 310 . 9 1 1 A 24 24 GLU H H 24 7.950 8.612 -0.662 1
1 311 . 9 1 1 A 24 24 GLU HA H 24 4.060 4.071 -0.011 1
1 316 . 9 1 1 A 24 24 GLU C C 24 179.100 179.616 -0.516 1
1 317 . 9 1 1 A 24 24 GLU CA C 24 59.700 59.225 0.475 1
1 318 . 9 1 1 A 24 24 GLU CB C 24 29.500 29.769 -0.269 1
1 320 . 9 1 1 A 24 24 GLU N N 24 120.100 120.160 -0.060 1
1 321 . 9 1 1 A 25 25 MET H H 25 8.150 8.452 -0.302 1
1 322 . 9 1 1 A 25 25 MET HA H 25 4.110 4.333 -0.223 1
1 330 . 9 1 1 A 25 25 MET C C 25 176.600 176.606 -0.006 1
1 331 . 9 1 1 A 25 25 MET CA C 25 57.100 56.686 0.414 1
1 332 . 9 1 1 A 25 25 MET CB C 25 34.900 32.708 2.192 1
1 335 . 9 1 1 A 25 25 MET N N 25 115.500 117.319 -1.819 1
1 336 . 9 1 1 A 26 26 GLY H H 26 7.940 8.449 -0.509 1
1 337 . 9 1 1 A 26 26 GLY HA2 H 26 3.860 3.994 -0.134 1
1 338 . 9 1 1 A 26 26 GLY HA3 H 26 3.960 3.995 -0.035 1
1 339 . 9 1 1 A 26 26 GLY C C 26 175.100 173.816 1.284 1
1 340 . 9 1 1 A 26 26 GLY CA C 26 46.600 45.486 1.114 1
1 341 . 9 1 1 A 26 26 GLY N N 26 109.000 106.808 2.192 1
1 342 . 9 1 1 A 27 27 ILE H H 27 7.880 7.542 0.338 1
1 343 . 9 1 1 A 27 27 ILE HA H 27 4.790 4.817 -0.027 1
1 353 . 9 1 1 A 27 27 ILE C C 27 174.300 174.985 -0.685 1
1 354 . 9 1 1 A 27 27 ILE CA C 27 59.000 58.526 0.474 1
1 355 . 9 1 1 A 27 27 ILE CB C 27 40.900 41.519 -0.619 1
1 359 . 9 1 1 A 27 27 ILE N N 27 112.700 115.825 -3.125 1
1 360 . 9 1 1 A 28 28 SER H H 28 8.570 8.360 0.210 1
1 361 . 9 1 1 A 28 28 SER HA H 28 4.540 4.739 -0.199 1
1 364 . 9 1 1 A 28 28 SER C C 28 175.600 175.800 -0.200 1
1 365 . 9 1 1 A 28 28 SER CA C 28 56.800 57.358 -0.558 1
1 366 . 9 1 1 A 28 28 SER CB C 28 65.500 65.309 0.191 1
1 367 . 9 1 1 A 28 28 SER N N 28 115.400 117.449 -2.049 1
1 368 . 9 1 1 A 29 29 ARG H H 29 8.980 9.051 -0.071 1
1 369 . 9 1 1 A 29 29 ARG HA H 29 3.660 4.021 -0.361 1
1 377 . 9 1 1 A 29 29 ARG C C 29 178.700 178.289 0.411 1
1 378 . 9 1 1 A 29 29 ARG CA C 29 59.500 59.837 -0.337 1
1 379 . 9 1 1 A 29 29 ARG CB C 29 29.500 29.653 -0.153 1
1 382 . 9 1 1 A 29 29 ARG N N 29 122.000 121.134 0.866 1
1 384 . 9 1 1 A 30 30 GLN H H 30 8.580 8.109 0.471 1
1 385 . 9 1 1 A 30 30 GLN HA H 30 3.860 4.105 -0.245 1
1 392 . 9 1 1 A 30 30 GLN C C 30 178.100 178.940 -0.840 1
1 393 . 9 1 1 A 30 30 GLN CA C 30 59.200 59.067 0.133 1
1 394 . 9 1 1 A 30 30 GLN CB C 30 28.100 28.522 -0.422 1
1 397 . 9 1 1 A 30 30 GLN N N 30 118.700 119.305 -0.605 1
1 399 . 9 1 1 A 31 31 GLN H H 31 7.990 7.621 0.369 1
1 400 . 9 1 1 A 31 31 GLN HA H 31 3.980 4.042 -0.062 1
1 407 . 9 1 1 A 31 31 GLN C C 31 178.700 178.664 0.036 1
1 408 . 9 1 1 A 31 31 GLN CA C 31 59.100 58.734 0.366 1
1 409 . 9 1 1 A 31 31 GLN CB C 31 28.700 28.393 0.307 1
1 412 . 9 1 1 A 31 31 GLN N N 31 119.600 118.958 0.642 1
1 414 . 9 1 1 A 32 32 LEU H H 32 7.630 7.657 -0.027 1
1 415 . 9 1 1 A 32 32 LEU HA H 32 3.740 4.136 -0.396 1
1 425 . 9 1 1 A 32 32 LEU C C 32 178.300 178.617 -0.317 1
1 426 . 9 1 1 A 32 32 LEU CA C 32 57.700 57.636 0.064 1
1 427 . 9 1 1 A 32 32 LEU CB C 32 41.500 41.359 0.141 1
1 431 . 9 1 1 A 32 32 LEU N N 32 120.700 122.236 -1.536 1
1 432 . 9 1 1 A 33 33 CYS H H 33 8.240 8.940 -0.700 1
1 433 . 9 1 1 A 33 33 CYS HA H 33 3.990 4.098 -0.108 1
1 436 . 9 1 1 A 33 33 CYS C C 33 177.000 177.125 -0.125 1
1 437 . 9 1 1 A 33 33 CYS CA C 33 63.100 63.221 -0.121 1
1 438 . 9 1 1 A 33 33 CYS CB C 33 26.100 27.079 -0.979 1
1 439 . 9 1 1 A 33 33 CYS N N 33 117.400 117.404 -0.004 1
1 440 . 9 1 1 A 34 34 ASN H H 34 8.210 7.885 0.325 1
1 441 . 9 1 1 A 34 34 ASN HA H 34 4.370 4.443 -0.073 1
1 446 . 9 1 1 A 34 34 ASN C C 34 178.700 178.198 0.502 1
1 447 . 9 1 1 A 34 34 ASN CA C 34 56.000 56.584 -0.584 1
1 448 . 9 1 1 A 34 34 ASN CB C 34 37.800 37.824 -0.024 1
1 450 . 9 1 1 A 34 34 ASN N N 34 117.300 118.369 -1.069 1
1 452 . 9 1 1 A 35 35 ILE H H 35 7.850 7.474 0.376 1
1 453 . 9 1 1 A 35 35 ILE HA H 35 3.850 3.574 0.276 1
1 463 . 9 1 1 A 35 35 ILE C C 35 178.100 178.100 0.000 1
1 464 . 9 1 1 A 35 35 ILE CA C 35 64.800 65.495 -0.695 1
1 465 . 9 1 1 A 35 35 ILE CB C 35 38.000 37.871 0.129 1
1 469 . 9 1 1 A 35 35 ILE N N 35 120.400 120.473 -0.073 1
1 470 . 9 1 1 A 36 36 GLU H H 36 7.680 7.821 -0.141 1
1 471 . 9 1 1 A 36 36 GLU HA H 36 4.120 4.000 0.120 1
1 476 . 9 1 1 A 36 36 GLU C C 36 176.300 177.902 -1.602 1
1 477 . 9 1 1 A 36 36 GLU CA C 36 58.600 59.065 -0.465 1
1 478 . 9 1 1 A 36 36 GLU CB C 36 30.000 29.526 0.474 1
1 480 . 9 1 1 A 36 36 GLU N N 36 116.500 120.864 -4.364 1
1 481 . 9 1 1 A 37 37 GLN H H 37 7.630 8.166 -0.536 1
1 482 . 9 1 1 A 37 37 GLN HA H 37 4.540 4.451 0.089 1
1 489 . 9 1 1 A 37 37 GLN C C 37 176.000 174.512 1.488 1
1 490 . 9 1 1 A 37 37 GLN CA C 37 54.900 55.596 -0.696 1
1 491 . 9 1 1 A 37 37 GLN CB C 37 29.600 29.124 0.476 1
1 494 . 9 1 1 A 37 37 GLN N N 37 115.000 116.659 -1.659 1
1 496 . 9 1 1 A 38 38 SER H H 38 7.380 7.683 -0.303 1
1 497 . 9 1 1 A 38 38 SER HA H 38 4.410 4.657 -0.247 1
1 500 . 9 1 1 A 38 38 SER C C 38 175.500 174.228 1.272 1
1 501 . 9 1 1 A 38 38 SER CA C 38 59.200 57.109 2.091 1
1 502 . 9 1 1 A 38 38 SER CB C 38 64.100 65.481 -1.381 1
1 503 . 9 1 1 A 38 38 SER N N 38 115.200 116.123 -0.923 1
1 504 . 9 1 1 A 39 39 GLU H H 39 9.040 8.726 0.314 1
1 505 . 9 1 1 A 39 39 GLU HA H 39 4.450 4.343 0.107 1
1 510 . 9 1 1 A 39 39 GLU C C 39 176.300 176.376 -0.076 1
1 511 . 9 1 1 A 39 39 GLU CA C 39 57.100 58.248 -1.148 1
1 512 . 9 1 1 A 39 39 GLU CB C 39 30.300 30.613 -0.313 1
1 514 . 9 1 1 A 39 39 GLU N N 39 125.400 126.576 -1.176 1
1 515 . 9 1 1 A 40 40 THR H H 40 7.920 7.612 0.308 1
1 516 . 9 1 1 A 40 40 THR HA H 40 4.590 4.295 0.295 1
1 521 . 9 1 1 A 40 40 THR C C 40 173.500 174.513 -1.013 1
1 522 . 9 1 1 A 40 40 THR CA C 40 60.500 62.553 -2.053 1
1 523 . 9 1 1 A 40 40 THR CB C 40 71.100 69.132 1.968 1
1 525 . 9 1 1 A 40 40 THR N N 40 112.800 111.346 1.454 1
1 526 . 9 1 1 A 41 41 ALA H H 41 8.780 8.423 0.357 1
1 527 . 9 1 1 A 41 41 ALA HA H 41 4.870 4.749 0.121 1
1 531 . 9 1 1 A 41 41 ALA CA C 41 49.700 50.329 -0.629 1
1 532 . 9 1 1 A 41 41 ALA CB C 41 19.300 19.263 0.037 1
1 533 . 9 1 1 A 41 41 ALA N N 41 127.000 129.808 -2.808 1
1 534 . 9 1 1 A 42 42 PRO HA H 42 4.660 4.579 0.081 1
1 541 . 9 1 1 A 42 42 PRO C C 42 178.300 177.549 0.751 1
1 542 . 9 1 1 A 42 42 PRO CA C 42 62.500 62.881 -0.381 1
1 543 . 9 1 1 A 42 42 PRO CB C 42 32.600 32.646 -0.046 1
1 546 . 9 1 1 A 43 43 VAL H H 43 8.840 8.650 0.190 1
1 547 . 9 1 1 A 43 43 VAL HA H 43 3.660 3.763 -0.103 1
1 555 . 9 1 1 A 43 43 VAL CA C 43 66.800 65.114 1.686 1
1 556 . 9 1 1 A 43 43 VAL CB C 43 31.100 31.592 -0.492 1
1 559 . 9 1 1 A 43 43 VAL N N 43 123.000 123.246 -0.246 1
1 560 . 9 1 1 A 44 44 VAL HA H 44 4.030 3.732 0.298 1
1 568 . 9 1 1 A 44 44 VAL C C 44 176.700 177.781 -1.081 1
1 569 . 9 1 1 A 44 44 VAL CA C 44 65.900 65.307 0.593 1
1 570 . 9 1 1 A 44 44 VAL CB C 44 30.900 31.214 -0.314 1
1 573 . 9 1 1 A 45 45 VAL H H 45 7.500 7.877 -0.377 1
1 574 . 9 1 1 A 45 45 VAL HA H 45 3.760 3.619 0.141 1
1 582 . 9 1 1 A 45 45 VAL C C 45 177.500 177.595 -0.095 1
1 583 . 9 1 1 A 45 45 VAL CA C 45 66.700 66.754 -0.054 1
1 584 . 9 1 1 A 45 45 VAL CB C 45 31.000 31.416 -0.416 1
1 587 . 9 1 1 A 45 45 VAL N N 45 120.100 121.784 -1.684 1
1 588 . 9 1 1 A 46 46 LYS H H 46 7.610 7.960 -0.350 1
1 589 . 9 1 1 A 46 46 LYS HA H 46 4.140 4.064 0.076 1
1 598 . 9 1 1 A 46 46 LYS C C 46 179.500 178.592 0.908 1
1 599 . 9 1 1 A 46 46 LYS CA C 46 59.900 58.931 0.969 1
1 600 . 9 1 1 A 46 46 LYS CB C 46 31.500 32.092 -0.592 1
1 604 . 9 1 1 A 46 46 LYS N N 46 120.700 118.658 2.042 1
1 605 . 9 1 1 A 47 47 TYR H H 47 8.550 8.213 0.337 1
1 606 . 9 1 1 A 47 47 TYR HA H 47 5.000 4.198 0.802 1
1 613 . 9 1 1 A 47 47 TYR C C 47 177.300 177.311 -0.011 1
1 614 . 9 1 1 A 47 47 TYR CA C 47 57.300 61.475 -4.175 1
1 615 . 9 1 1 A 47 47 TYR CB C 47 37.700 38.626 -0.926 1
1 620 . 9 1 1 A 47 47 TYR N N 47 122.700 120.825 1.875 1
1 621 . 9 1 1 A 48 48 ILE H H 48 8.250 8.129 0.121 1
1 622 . 9 1 1 A 48 48 ILE HA H 48 3.160 3.626 -0.466 1
1 632 . 9 1 1 A 48 48 ILE C C 48 177.100 177.994 -0.894 1
1 633 . 9 1 1 A 48 48 ILE CA C 48 67.000 65.621 1.379 1
1 634 . 9 1 1 A 48 48 ILE CB C 48 37.800 38.510 -0.710 1
1 638 . 9 1 1 A 48 48 ILE N N 48 121.200 120.786 0.414 1
1 639 . 9 1 1 A 49 49 ALA H H 49 8.310 8.155 0.155 1
1 640 . 9 1 1 A 49 49 ALA HA H 49 3.940 4.023 -0.083 1
1 644 . 9 1 1 A 49 49 ALA C C 49 179.300 179.147 0.153 1
1 645 . 9 1 1 A 49 49 ALA CA C 49 55.500 55.020 0.480 1
1 646 . 9 1 1 A 49 49 ALA CB C 49 18.200 18.323 -0.123 1
1 647 . 9 1 1 A 49 49 ALA N N 49 120.300 120.474 -0.174 1
1 648 . 9 1 1 A 50 50 PHE H H 50 8.630 8.094 0.536 1
1 649 . 9 1 1 A 50 50 PHE HA H 50 4.200 4.141 0.059 1
1 656 . 9 1 1 A 50 50 PHE C C 50 179.000 176.656 2.344 1
1 657 . 9 1 1 A 50 50 PHE CA C 50 61.300 61.376 -0.076 1
1 658 . 9 1 1 A 50 50 PHE CB C 50 39.200 39.198 0.002 1
1 663 . 9 1 1 A 50 50 PHE N N 50 121.300 120.352 0.948 1
1 664 . 9 1 1 A 51 51 LEU H H 51 8.920 8.128 0.792 1
1 665 . 9 1 1 A 51 51 LEU HA H 51 3.630 3.806 -0.176 1
1 675 . 9 1 1 A 51 51 LEU C C 51 180.000 179.076 0.924 1
1 676 . 9 1 1 A 51 51 LEU CA C 51 58.100 57.706 0.394 1
1 677 . 9 1 1 A 51 51 LEU CB C 51 39.800 41.334 -1.534 1
1 681 . 9 1 1 A 51 51 LEU N N 51 121.900 118.610 3.290 1
1 682 . 9 1 1 A 52 52 ARG H H 52 8.410 8.001 0.409 1
1 683 . 9 1 1 A 52 52 ARG HA H 52 4.420 3.925 0.495 1
1 691 . 9 1 1 A 52 52 ARG C C 52 179.800 178.724 1.076 1
1 692 . 9 1 1 A 52 52 ARG CA C 52 57.800 59.593 -1.793 1
1 693 . 9 1 1 A 52 52 ARG CB C 52 28.200 29.968 -1.768 1
1 695 . 9 1 1 A 52 52 ARG N N 52 120.500 120.592 -0.092 1
1 697 . 9 1 1 A 53 53 SER H H 53 8.480 8.139 0.341 1
1 698 . 9 1 1 A 53 53 SER HA H 53 4.300 4.206 0.094 1
1 701 . 9 1 1 A 53 53 SER C C 53 174.600 175.272 -0.672 1
1 702 . 9 1 1 A 53 53 SER CA C 53 61.500 60.710 0.790 1
1 703 . 9 1 1 A 53 53 SER CB C 53 62.300 62.679 -0.379 1
1 704 . 9 1 1 A 53 53 SER N N 53 119.500 114.274 5.226 1
1 705 . 9 1 1 A 54 54 LYS H H 54 7.080 7.468 -0.388 1
1 706 . 9 1 1 A 54 54 LYS HA H 54 4.350 4.269 0.081 1
1 715 . 9 1 1 A 54 54 LYS C C 54 176.500 176.786 -0.286 1
1 716 . 9 1 1 A 54 54 LYS CA C 54 53.700 55.858 -2.158 1
1 717 . 9 1 1 A 54 54 LYS CB C 54 31.800 32.632 -0.832 1
1 721 . 9 1 1 A 54 54 LYS N N 54 119.200 117.975 1.225 1
1 722 . 9 1 1 A 55 55 GLY H H 55 8.040 8.470 -0.430 1
1 723 . 9 1 1 A 55 55 GLY HA2 H 55 3.540 3.927 -0.387 1
1 724 . 9 1 1 A 55 55 GLY HA3 H 55 4.300 3.933 0.367 1
1 725 . 9 1 1 A 55 55 GLY C C 55 174.500 174.571 -0.071 1
1 726 . 9 1 1 A 55 55 GLY CA C 55 44.700 45.384 -0.684 1
1 727 . 9 1 1 A 55 55 GLY N N 55 106.600 107.595 -0.995 1
1 728 . 9 1 1 A 56 56 VAL H H 56 7.580 7.408 0.172 1
1 729 . 9 1 1 A 56 56 VAL HA H 56 3.630 3.844 -0.214 1
1 737 . 9 1 1 A 56 56 VAL C C 56 174.700 174.975 -0.275 1
1 738 . 9 1 1 A 56 56 VAL CA C 56 64.000 62.267 1.733 1
1 739 . 9 1 1 A 56 56 VAL CB C 56 31.600 31.980 -0.380 1
1 742 . 9 1 1 A 56 56 VAL N N 56 122.000 122.348 -0.348 1
1 743 . 9 1 1 A 57 57 ASP H H 57 8.440 8.688 -0.248 1
1 744 . 9 1 1 A 57 57 ASP HA H 57 4.500 4.738 -0.238 1
1 747 . 9 1 1 A 57 57 ASP C C 57 176.900 176.182 0.718 1
1 748 . 9 1 1 A 57 57 ASP CA C 57 52.600 54.189 -1.589 1
1 749 . 9 1 1 A 57 57 ASP CB C 57 39.900 40.985 -1.085 1
1 750 . 9 1 1 A 57 57 ASP N N 57 124.100 127.442 -3.342 1
1 751 . 9 1 1 A 58 58 LEU H H 58 9.720 8.425 1.295 1
1 752 . 9 1 1 A 58 58 LEU HA H 58 4.020 4.349 -0.329 1
1 762 . 9 1 1 A 58 58 LEU C C 58 179.400 178.294 1.106 1
1 763 . 9 1 1 A 58 58 LEU CA C 58 56.300 54.961 1.339 1
1 764 . 9 1 1 A 58 58 LEU CB C 58 43.300 42.196 1.104 1
1 768 . 9 1 1 A 58 58 LEU N N 58 127.800 125.390 2.410 1
1 769 . 9 1 1 A 59 59 ASN H H 59 7.740 8.566 -0.826 1
1 770 . 9 1 1 A 59 59 ASN HA H 59 4.340 4.384 -0.044 1
1 775 . 9 1 1 A 59 59 ASN C C 59 176.300 177.287 -0.987 1
1 776 . 9 1 1 A 59 59 ASN CA C 59 56.300 55.924 0.376 1
1 777 . 9 1 1 A 59 59 ASN CB C 59 36.400 37.502 -1.102 1
1 779 . 9 1 1 A 59 59 ASN N N 59 119.500 117.652 1.848 1
1 781 . 9 1 1 A 60 60 ALA H H 60 7.220 7.888 -0.668 1
1 782 . 9 1 1 A 60 60 ALA HA H 60 4.030 4.171 -0.141 1
1 786 . 9 1 1 A 60 60 ALA C C 60 180.100 180.089 0.011 1
1 787 . 9 1 1 A 60 60 ALA CA C 60 54.300 55.162 -0.862 1
1 788 . 9 1 1 A 60 60 ALA CB C 60 18.200 18.471 -0.271 1
1 789 . 9 1 1 A 60 60 ALA N N 60 121.400 122.023 -0.623 1
1 790 . 9 1 1 A 61 61 LEU H H 61 7.320 8.300 -0.980 1
1 791 . 9 1 1 A 61 61 LEU HA H 61 3.840 4.028 -0.188 1
1 801 . 9 1 1 A 61 61 LEU C C 61 177.200 179.112 -1.912 1
1 802 . 9 1 1 A 61 61 LEU CA C 61 58.500 58.002 0.498 1
1 803 . 9 1 1 A 61 61 LEU CB C 61 42.600 42.435 0.165 1
1 807 . 9 1 1 A 61 61 LEU N N 61 118.600 118.381 0.219 1
1 808 . 9 1 1 A 62 62 PHE H H 62 8.360 8.556 -0.196 1
1 809 . 9 1 1 A 62 62 PHE HA H 62 3.930 4.181 -0.251 1
1 817 . 9 1 1 A 62 62 PHE C C 62 178.200 178.080 0.120 1
1 818 . 9 1 1 A 62 62 PHE CA C 62 62.800 60.444 2.356 1
1 819 . 9 1 1 A 62 62 PHE CB C 62 38.500 38.648 -0.148 1
1 825 . 9 1 1 A 62 62 PHE N N 62 114.400 117.953 -3.553 1
1 826 . 9 1 1 A 63 63 ASP H H 63 8.680 8.732 -0.052 1
1 827 . 9 1 1 A 63 63 ASP HA H 63 4.530 4.257 0.273 1
1 830 . 9 1 1 A 63 63 ASP C C 63 178.600 178.664 -0.064 1
1 831 . 9 1 1 A 63 63 ASP CA C 63 57.500 57.110 0.390 1
1 832 . 9 1 1 A 63 63 ASP CB C 63 39.600 40.131 -0.531 1
1 833 . 9 1 1 A 63 63 ASP N N 63 120.400 118.923 1.477 1
1 834 . 9 1 1 A 64 64 ARG H H 64 7.540 8.172 -0.632 1
1 835 . 9 1 1 A 64 64 ARG HA H 64 4.290 4.113 0.177 1
1 843 . 9 1 1 A 64 64 ARG C C 64 177.600 178.761 -1.161 1
1 844 . 9 1 1 A 64 64 ARG CA C 64 58.300 58.979 -0.679 1
1 845 . 9 1 1 A 64 64 ARG CB C 64 30.000 30.001 -0.001 1
1 848 . 9 1 1 A 64 64 ARG N N 64 116.800 120.272 -3.472 1
1 850 . 9 1 1 A 65 65 ILE H H 65 7.260 7.485 -0.225 1
1 851 . 9 1 1 A 65 65 ILE HA H 65 4.130 3.836 0.294 1
1 861 . 9 1 1 A 65 65 ILE C C 65 177.000 176.451 0.549 1
1 862 . 9 1 1 A 65 65 ILE CA C 65 62.600 65.076 -2.476 1
1 863 . 9 1 1 A 65 65 ILE CB C 65 38.700 37.804 0.896 1
1 867 . 9 1 1 A 65 65 ILE N N 65 117.000 118.712 -1.712 1
1 868 . 9 1 1 A 66 66 ILE H H 66 7.980 7.481 0.499 1
1 869 . 9 1 1 A 66 66 ILE HA H 66 4.000 4.315 -0.315 1
1 879 . 9 1 1 A 66 66 ILE C C 66 176.400 175.178 1.222 1
1 880 . 9 1 1 A 66 66 ILE CA C 66 63.100 60.562 2.538 1
1 881 . 9 1 1 A 66 66 ILE CB C 66 38.800 39.045 -0.245 1
1 885 . 9 1 1 A 66 66 ILE N N 66 120.700 118.576 2.124 1
1 886 . 9 1 1 A 67 67 VAL H H 67 8.130 9.001 -0.871 1
1 887 . 9 1 1 A 67 67 VAL HA H 67 3.980 4.460 -0.480 1
1 895 . 9 1 1 A 67 67 VAL C C 67 177.300 175.406 1.894 1
1 896 . 9 1 1 A 67 67 VAL CA C 67 63.900 60.733 3.167 1
1 897 . 9 1 1 A 67 67 VAL CB C 67 32.500 34.616 -2.116 1
1 900 . 9 1 1 A 67 67 VAL N N 67 121.600 125.355 -3.755 1
1 901 . 9 1 1 A 68 68 ASN H H 68 8.170 8.812 -0.642 1
1 902 . 9 1 1 A 68 68 ASN HA H 68 4.680 4.774 -0.094 1
1 907 . 9 1 1 A 68 68 ASN CA C 68 54.200 52.950 1.250 1
1 908 . 9 1 1 A 68 68 ASN CB C 68 39.100 39.441 -0.341 1
1 910 . 9 1 1 A 68 68 ASN N N 68 120.500 124.396 -3.896 1
1 912 . 9 1 1 A 69 69 LYS H H 69 8.230 8.964 -0.734 1
1 913 . 9 1 1 A 69 69 LYS HA H 69 4.260 3.965 0.295 1
1 922 . 9 1 1 A 69 69 LYS C C 69 176.900 176.519 0.381 1
1 923 . 9 1 1 A 69 69 LYS CA C 69 57.000 57.051 -0.051 1
1 924 . 9 1 1 A 69 69 LYS CB C 69 32.800 30.919 1.881 1
1 928 . 9 1 1 A 69 69 LYS N N 69 121.300 121.937 -0.637 1
1 929 . 9 1 1 A 70 70 LEU H H 70 8.150 7.995 0.155 1
1 930 . 9 1 1 A 70 70 LEU HA H 70 4.300 4.324 -0.024 1
1 940 . 9 1 1 A 70 70 LEU C C 70 178.900 176.372 2.528 1
1 941 . 9 1 1 A 70 70 LEU CA C 70 55.400 57.800 -2.400 1
1 942 . 9 1 1 A 70 70 LEU CB C 70 42.100 42.818 -0.718 1
1 946 . 9 1 1 A 70 70 LEU N N 70 121.900 124.676 -2.776 1
1 947 . 9 1 1 A 71 71 GLU H H 71 8.210 8.104 0.106 1
1 948 . 9 1 1 A 71 71 GLU HA H 71 4.180 4.354 -0.174 1
1 953 . 9 1 1 A 71 71 GLU C C 71 176.300 175.077 1.223 1
1 954 . 9 1 1 A 71 71 GLU CA C 71 56.600 58.678 -2.078 1
1 955 . 9 1 1 A 71 71 GLU CB C 71 30.200 28.581 1.619 1
1 957 . 9 1 1 A 71 71 GLU N N 71 120.900 117.845 3.055 1
1 958 . 9 1 1 A 72 72 HIS H H 72 8.380 8.659 -0.279 1
1 959 . 9 1 1 A 72 72 HIS HA H 72 4.600 5.385 -0.785 1
1 962 . 9 1 1 A 72 72 HIS C C 72 174.600 174.020 0.580 1
1 963 . 9 1 1 A 72 72 HIS CA C 72 55.600 54.282 1.318 1
1 964 . 9 1 1 A 72 72 HIS CB C 72 29.600 32.522 -2.922 1
1 965 . 9 1 1 A 72 72 HIS N N 72 119.300 121.061 -1.761 1
1 966 . 9 1 1 A 73 73 HIS H H 73 8.410 9.028 -0.618 1
1 967 . 9 1 1 A 73 73 HIS HA H 73 4.610 4.557 0.053 1
1 970 . 9 1 1 A 73 73 HIS C C 73 173.700 174.340 -0.640 1
1 971 . 9 1 1 A 73 73 HIS CA C 73 55.700 56.820 -1.120 1
1 972 . 9 1 1 A 73 73 HIS CB C 73 29.600 31.336 -1.736 1
1 973 . 9 1 1 A 73 73 HIS N N 73 119.410 123.305 -3.895 1
1 974 . 9 1 1 A 74 74 HIS H H 74 8.310 8.346 -0.036 1
1 975 . 9 1 1 A 74 74 HIS HA H 74 4.630 4.859 -0.229 1
1 978 . 9 1 1 A 74 74 HIS CA C 74 57.100 55.341 1.759 1
1 979 . 9 1 1 A 74 74 HIS CB C 74 29.800 31.558 -1.758 1
1 14 . 10 1 1 A 2 2 GLU H H 2 9.070 8.988 0.082 1
1 15 . 10 1 1 A 2 2 GLU HA H 2 4.520 4.012 0.508 1
1 20 . 10 1 1 A 2 2 GLU C C 2 176.300 176.876 -0.576 1
1 21 . 10 1 1 A 2 2 GLU CA C 2 55.800 58.782 -2.982 1
1 22 . 10 1 1 A 2 2 GLU CB C 2 31.000 28.553 2.447 1
1 24 . 10 1 1 A 2 2 GLU N N 2 123.100 117.983 5.117 1
1 25 . 10 1 1 A 3 3 LEU H H 3 8.750 8.595 0.155 1
1 26 . 10 1 1 A 3 3 LEU HA H 3 3.750 4.154 -0.404 1
1 36 . 10 1 1 A 3 3 LEU C C 3 177.400 178.426 -1.026 1
1 37 . 10 1 1 A 3 3 LEU CA C 3 58.300 57.733 0.567 1
1 38 . 10 1 1 A 3 3 LEU CB C 3 41.500 41.472 0.028 1
1 42 . 10 1 1 A 3 3 LEU N N 3 122.600 123.775 -1.175 1
1 43 . 10 1 1 A 4 4 SER H H 4 8.350 7.840 0.510 1
1 44 . 10 1 1 A 4 4 SER HA H 4 3.890 4.137 -0.247 1
1 47 . 10 1 1 A 4 4 SER C C 4 175.100 177.316 -2.216 1
1 48 . 10 1 1 A 4 4 SER CA C 4 61.500 61.548 -0.048 1
1 49 . 10 1 1 A 4 4 SER CB C 4 62.000 62.774 -0.774 1
1 50 . 10 1 1 A 4 4 SER N N 4 112.900 114.577 -1.677 1
1 51 . 10 1 1 A 5 5 ASN H H 5 7.180 8.378 -1.198 1
1 52 . 10 1 1 A 5 5 ASN HA H 5 4.470 4.526 -0.056 1
1 57 . 10 1 1 A 5 5 ASN C C 5 177.400 177.812 -0.412 1
1 58 . 10 1 1 A 5 5 ASN CA C 5 56.000 56.733 -0.733 1
1 59 . 10 1 1 A 5 5 ASN CB C 5 39.400 39.191 0.209 1
1 61 . 10 1 1 A 5 5 ASN N N 5 116.600 119.334 -2.734 1
1 63 . 10 1 1 A 6 6 GLU H H 6 7.950 8.192 -0.242 1
1 64 . 10 1 1 A 6 6 GLU HA H 6 4.070 4.063 0.007 1
1 69 . 10 1 1 A 6 6 GLU C C 6 178.500 179.314 -0.814 1
1 70 . 10 1 1 A 6 6 GLU CA C 6 58.100 59.240 -1.140 1
1 71 . 10 1 1 A 6 6 GLU CB C 6 29.300 29.392 -0.092 1
1 73 . 10 1 1 A 6 6 GLU N N 6 117.600 118.981 -1.381 1
1 74 . 10 1 1 A 7 7 LEU H H 7 8.140 8.112 0.028 1
1 75 . 10 1 1 A 7 7 LEU HA H 7 3.640 4.027 -0.387 1
1 85 . 10 1 1 A 7 7 LEU C C 7 177.700 179.376 -1.676 1
1 86 . 10 1 1 A 7 7 LEU CA C 7 58.300 58.020 0.280 1
1 87 . 10 1 1 A 7 7 LEU CB C 7 40.600 41.247 -0.647 1
1 91 . 10 1 1 A 7 7 LEU N N 7 118.500 120.429 -1.929 1
1 92 . 10 1 1 A 8 8 LYS H H 8 7.090 8.138 -1.048 1
1 93 . 10 1 1 A 8 8 LYS HA H 8 4.080 3.959 0.121 1
1 102 . 10 1 1 A 8 8 LYS C C 8 178.300 178.796 -0.496 1
1 103 . 10 1 1 A 8 8 LYS CA C 8 59.700 59.657 0.043 1
1 104 . 10 1 1 A 8 8 LYS CB C 8 32.300 32.368 -0.068 1
1 108 . 10 1 1 A 8 8 LYS N N 8 118.200 120.554 -2.354 1
1 109 . 10 1 1 A 9 9 VAL H H 9 7.940 8.359 -0.419 1
1 110 . 10 1 1 A 9 9 VAL HA H 9 3.440 3.527 -0.087 1
1 118 . 10 1 1 A 9 9 VAL C C 9 179.500 177.703 1.797 1
1 119 . 10 1 1 A 9 9 VAL CA C 9 66.700 66.384 0.316 1
1 120 . 10 1 1 A 9 9 VAL CB C 9 31.600 31.527 0.073 1
1 123 . 10 1 1 A 9 9 VAL N N 9 117.600 119.155 -1.555 1
1 124 . 10 1 1 A 10 10 GLU H H 10 7.830 8.248 -0.418 1
1 125 . 10 1 1 A 10 10 GLU HA H 10 4.130 3.960 0.170 1
1 130 . 10 1 1 A 10 10 GLU C C 10 178.700 179.214 -0.514 1
1 131 . 10 1 1 A 10 10 GLU CA C 10 58.300 59.596 -1.296 1
1 132 . 10 1 1 A 10 10 GLU CB C 10 28.500 29.184 -0.684 1
1 134 . 10 1 1 A 10 10 GLU N N 10 118.300 118.345 -0.045 1
1 135 . 10 1 1 A 11 11 ARG H H 11 8.330 7.651 0.679 1
1 136 . 10 1 1 A 11 11 ARG HA H 11 3.770 4.095 -0.325 1
1 144 . 10 1 1 A 11 11 ARG C C 11 174.600 178.857 -4.257 1
1 145 . 10 1 1 A 11 11 ARG CA C 11 61.300 58.762 2.538 1
1 146 . 10 1 1 A 11 11 ARG CB C 11 28.500 30.053 -1.553 1
1 149 . 10 1 1 A 11 11 ARG N N 11 121.400 120.048 1.352 1
1 151 . 10 1 1 A 12 12 ILE H H 12 8.540 7.989 0.551 1
1 152 . 10 1 1 A 12 12 ILE HA H 12 3.780 3.762 0.018 1
1 162 . 10 1 1 A 12 12 ILE C C 12 181.400 177.818 3.582 1
1 163 . 10 1 1 A 12 12 ILE CA C 12 64.800 65.337 -0.537 1
1 164 . 10 1 1 A 12 12 ILE CB C 12 37.700 37.402 0.298 1
1 168 . 10 1 1 A 12 12 ILE N N 12 118.700 119.676 -0.976 1
1 169 . 10 1 1 A 13 13 ARG H H 13 8.470 8.403 0.067 1
1 170 . 10 1 1 A 13 13 ARG HA H 13 4.060 3.963 0.097 1
1 178 . 10 1 1 A 13 13 ARG C C 13 178.600 178.312 0.288 1
1 179 . 10 1 1 A 13 13 ARG CA C 13 59.600 59.921 -0.321 1
1 180 . 10 1 1 A 13 13 ARG CB C 13 30.000 29.701 0.299 1
1 183 . 10 1 1 A 13 13 ARG N N 13 124.600 120.121 4.479 1
1 185 . 10 1 1 A 14 14 LEU H H 14 7.430 7.704 -0.274 1
1 186 . 10 1 1 A 14 14 LEU HA H 14 4.240 4.322 -0.082 1
1 196 . 10 1 1 A 14 14 LEU C C 14 176.000 176.184 -0.184 1
1 197 . 10 1 1 A 14 14 LEU CA C 14 55.300 54.758 0.542 1
1 198 . 10 1 1 A 14 14 LEU CB C 14 43.000 42.059 0.941 1
1 202 . 10 1 1 A 14 14 LEU N N 14 118.500 118.170 0.330 1
1 203 . 10 1 1 A 15 15 SER H H 15 8.260 8.110 0.150 1
1 204 . 10 1 1 A 15 15 SER HA H 15 4.030 4.120 -0.090 1
1 207 . 10 1 1 A 15 15 SER C C 15 174.000 173.203 0.797 1
1 208 . 10 1 1 A 15 15 SER CA C 15 58.700 59.022 -0.322 1
1 209 . 10 1 1 A 15 15 SER CB C 15 61.300 61.560 -0.260 1
1 210 . 10 1 1 A 15 15 SER N N 15 112.500 115.103 -2.603 1
1 211 . 10 1 1 A 16 16 LEU H H 16 7.310 7.488 -0.178 1
1 212 . 10 1 1 A 16 16 LEU HA H 16 4.880 4.736 0.144 1
1 222 . 10 1 1 A 16 16 LEU C C 16 177.900 176.954 0.946 1
1 223 . 10 1 1 A 16 16 LEU CA C 16 52.600 53.233 -0.633 1
1 224 . 10 1 1 A 16 16 LEU CB C 16 43.500 43.974 -0.474 1
1 228 . 10 1 1 A 16 16 LEU N N 16 117.800 121.118 -3.318 1
1 229 . 10 1 1 A 17 17 THR H H 17 8.640 8.823 -0.183 1
1 230 . 10 1 1 A 17 17 THR HA H 17 4.250 4.696 -0.446 1
1 235 . 10 1 1 A 17 17 THR C C 17 174.900 175.768 -0.868 1
1 236 . 10 1 1 A 17 17 THR CA C 17 60.500 60.671 -0.171 1
1 237 . 10 1 1 A 17 17 THR CB C 17 70.500 71.267 -0.767 1
1 239 . 10 1 1 A 17 17 THR N N 17 115.200 115.516 -0.316 1
1 240 . 10 1 1 A 18 18 ALA H H 18 8.820 9.056 -0.236 1
1 241 . 10 1 1 A 18 18 ALA HA H 18 3.680 3.986 -0.306 1
1 245 . 10 1 1 A 18 18 ALA C C 18 178.900 179.559 -0.659 1
1 246 . 10 1 1 A 18 18 ALA CA C 18 55.200 55.121 0.079 1
1 247 . 10 1 1 A 18 18 ALA CB C 18 17.800 17.955 -0.155 1
1 248 . 10 1 1 A 18 18 ALA N N 18 125.600 124.752 0.848 1
1 249 . 10 1 1 A 19 19 LYS H H 19 8.280 7.967 0.313 1
1 250 . 10 1 1 A 19 19 LYS HA H 19 3.740 3.972 -0.232 1
1 259 . 10 1 1 A 19 19 LYS C C 19 177.900 178.918 -1.018 1
1 260 . 10 1 1 A 19 19 LYS CA C 19 59.800 59.435 0.365 1
1 261 . 10 1 1 A 19 19 LYS CB C 19 33.300 32.448 0.852 1
1 265 . 10 1 1 A 19 19 LYS N N 19 115.800 119.077 -3.277 1
1 266 . 10 1 1 A 20 20 SER H H 20 7.860 7.866 -0.006 1
1 267 . 10 1 1 A 20 20 SER HA H 20 4.210 4.147 0.063 1
1 271 . 10 1 1 A 20 20 SER C C 20 177.200 176.412 0.788 1
1 272 . 10 1 1 A 20 20 SER CA C 20 61.900 62.551 -0.651 1
1 273 . 10 1 1 A 20 20 SER CB C 20 63.000 63.142 -0.142 1
1 274 . 10 1 1 A 20 20 SER N N 20 114.600 117.076 -2.476 1
1 275 . 10 1 1 A 21 21 VAL H H 21 7.830 7.797 0.033 1
1 276 . 10 1 1 A 21 21 VAL HA H 21 3.280 3.564 -0.284 1
1 284 . 10 1 1 A 21 21 VAL C C 21 177.500 178.140 -0.640 1
1 285 . 10 1 1 A 21 21 VAL CA C 21 66.800 66.528 0.272 1
1 286 . 10 1 1 A 21 21 VAL CB C 21 31.400 31.551 -0.151 1
1 289 . 10 1 1 A 21 21 VAL N N 21 122.600 121.768 0.832 1
1 290 . 10 1 1 A 22 22 ALA H H 22 8.230 8.402 -0.172 1
1 291 . 10 1 1 A 22 22 ALA HA H 22 3.510 3.959 -0.449 1
1 295 . 10 1 1 A 22 22 ALA C C 22 179.500 179.392 0.108 1
1 296 . 10 1 1 A 22 22 ALA CA C 22 55.500 55.401 0.099 1
1 297 . 10 1 1 A 22 22 ALA CB C 22 16.900 17.686 -0.786 1
1 298 . 10 1 1 A 22 22 ALA N N 22 121.200 121.797 -0.597 1
1 299 . 10 1 1 A 23 23 GLU H H 23 7.900 8.682 -0.782 1
1 300 . 10 1 1 A 23 23 GLU HA H 23 3.990 4.065 -0.075 1
1 305 . 10 1 1 A 23 23 GLU C C 23 180.000 178.892 1.108 1
1 306 . 10 1 1 A 23 23 GLU CA C 23 59.300 59.492 -0.192 1
1 307 . 10 1 1 A 23 23 GLU CB C 23 29.300 29.346 -0.046 1
1 309 . 10 1 1 A 23 23 GLU N N 23 115.300 118.864 -3.564 1
1 310 . 10 1 1 A 24 24 GLU H H 24 7.950 8.053 -0.103 1
1 311 . 10 1 1 A 24 24 GLU HA H 24 4.060 4.096 -0.036 1
1 316 . 10 1 1 A 24 24 GLU C C 24 179.100 179.209 -0.109 1
1 317 . 10 1 1 A 24 24 GLU CA C 24 59.700 59.117 0.583 1
1 318 . 10 1 1 A 24 24 GLU CB C 24 29.500 29.772 -0.272 1
1 320 . 10 1 1 A 24 24 GLU N N 24 120.100 119.703 0.397 1
1 321 . 10 1 1 A 25 25 MET H H 25 8.150 8.521 -0.371 1
1 322 . 10 1 1 A 25 25 MET HA H 25 4.110 4.320 -0.210 1
1 330 . 10 1 1 A 25 25 MET C C 25 176.600 176.930 -0.330 1
1 331 . 10 1 1 A 25 25 MET CA C 25 57.100 56.921 0.179 1
1 332 . 10 1 1 A 25 25 MET CB C 25 34.900 32.726 2.174 1
1 335 . 10 1 1 A 25 25 MET N N 25 115.500 117.654 -2.154 1
1 336 . 10 1 1 A 26 26 GLY H H 26 7.940 9.299 -1.359 1
1 337 . 10 1 1 A 26 26 GLY HA2 H 26 3.860 3.946 -0.086 1
1 338 . 10 1 1 A 26 26 GLY HA3 H 26 3.960 3.947 0.013 1
1 339 . 10 1 1 A 26 26 GLY C C 26 175.100 173.894 1.206 1
1 340 . 10 1 1 A 26 26 GLY CA C 26 46.600 46.401 0.199 1
1 341 . 10 1 1 A 26 26 GLY N N 26 109.000 106.945 2.055 1
1 342 . 10 1 1 A 27 27 ILE H H 27 7.880 7.289 0.591 1
1 343 . 10 1 1 A 27 27 ILE HA H 27 4.790 4.817 -0.027 1
1 353 . 10 1 1 A 27 27 ILE C C 27 174.300 174.900 -0.600 1
1 354 . 10 1 1 A 27 27 ILE CA C 27 59.000 58.622 0.378 1
1 355 . 10 1 1 A 27 27 ILE CB C 27 40.900 41.487 -0.587 1
1 359 . 10 1 1 A 27 27 ILE N N 27 112.700 115.171 -2.471 1
1 360 . 10 1 1 A 28 28 SER H H 28 8.570 8.547 0.023 1
1 361 . 10 1 1 A 28 28 SER HA H 28 4.540 4.551 -0.011 1
1 364 . 10 1 1 A 28 28 SER C C 28 175.600 175.749 -0.149 1
1 365 . 10 1 1 A 28 28 SER CA C 28 56.800 58.685 -1.885 1
1 366 . 10 1 1 A 28 28 SER CB C 28 65.500 63.505 1.995 1
1 367 . 10 1 1 A 28 28 SER N N 28 115.400 117.701 -2.301 1
1 368 . 10 1 1 A 29 29 ARG H H 29 8.980 9.080 -0.100 1
1 369 . 10 1 1 A 29 29 ARG HA H 29 3.660 3.952 -0.292 1
1 377 . 10 1 1 A 29 29 ARG C C 29 178.700 178.732 -0.032 1
1 378 . 10 1 1 A 29 29 ARG CA C 29 59.500 60.189 -0.689 1
1 379 . 10 1 1 A 29 29 ARG CB C 29 29.500 29.850 -0.350 1
1 382 . 10 1 1 A 29 29 ARG N N 29 122.000 127.340 -5.340 1
1 384 . 10 1 1 A 30 30 GLN H H 30 8.580 7.616 0.964 1
1 385 . 10 1 1 A 30 30 GLN HA H 30 3.860 4.002 -0.142 1
1 392 . 10 1 1 A 30 30 GLN C C 30 178.100 178.318 -0.218 1
1 393 . 10 1 1 A 30 30 GLN CA C 30 59.200 59.258 -0.058 1
1 394 . 10 1 1 A 30 30 GLN CB C 30 28.100 28.236 -0.136 1
1 397 . 10 1 1 A 30 30 GLN N N 30 118.700 119.271 -0.571 1
1 399 . 10 1 1 A 31 31 GLN H H 31 7.990 7.899 0.091 1
1 400 . 10 1 1 A 31 31 GLN HA H 31 3.980 4.035 -0.055 1
1 407 . 10 1 1 A 31 31 GLN C C 31 178.700 178.725 -0.025 1
1 408 . 10 1 1 A 31 31 GLN CA C 31 59.100 58.774 0.326 1
1 409 . 10 1 1 A 31 31 GLN CB C 31 28.700 28.011 0.689 1
1 412 . 10 1 1 A 31 31 GLN N N 31 119.600 118.606 0.994 1
1 414 . 10 1 1 A 32 32 LEU H H 32 7.630 7.566 0.064 1
1 415 . 10 1 1 A 32 32 LEU HA H 32 3.740 4.135 -0.395 1
1 425 . 10 1 1 A 32 32 LEU C C 32 178.300 179.250 -0.950 1
1 426 . 10 1 1 A 32 32 LEU CA C 32 57.700 57.593 0.107 1
1 427 . 10 1 1 A 32 32 LEU CB C 32 41.500 41.356 0.144 1
1 431 . 10 1 1 A 32 32 LEU N N 32 120.700 122.283 -1.583 1
1 432 . 10 1 1 A 33 33 CYS H H 33 8.240 8.254 -0.014 1
1 433 . 10 1 1 A 33 33 CYS HA H 33 3.990 4.291 -0.301 1
1 436 . 10 1 1 A 33 33 CYS C C 33 177.000 177.041 -0.041 1
1 437 . 10 1 1 A 33 33 CYS CA C 33 63.100 63.312 -0.212 1
1 438 . 10 1 1 A 33 33 CYS CB C 33 26.100 26.362 -0.262 1
1 439 . 10 1 1 A 33 33 CYS N N 33 117.400 118.056 -0.656 1
1 440 . 10 1 1 A 34 34 ASN H H 34 8.210 7.927 0.283 1
1 441 . 10 1 1 A 34 34 ASN HA H 34 4.370 4.489 -0.119 1
1 446 . 10 1 1 A 34 34 ASN C C 34 178.700 177.811 0.889 1
1 447 . 10 1 1 A 34 34 ASN CA C 34 56.000 56.779 -0.779 1
1 448 . 10 1 1 A 34 34 ASN CB C 34 37.800 39.041 -1.241 1
1 450 . 10 1 1 A 34 34 ASN N N 34 117.300 119.382 -2.082 1
1 452 . 10 1 1 A 35 35 ILE H H 35 7.850 7.727 0.123 1
1 453 . 10 1 1 A 35 35 ILE HA H 35 3.850 3.606 0.244 1
1 463 . 10 1 1 A 35 35 ILE C C 35 178.100 177.876 0.224 1
1 464 . 10 1 1 A 35 35 ILE CA C 35 64.800 65.439 -0.639 1
1 465 . 10 1 1 A 35 35 ILE CB C 35 38.000 37.601 0.399 1
1 469 . 10 1 1 A 35 35 ILE N N 35 120.400 119.520 0.880 1
1 470 . 10 1 1 A 36 36 GLU H H 36 7.680 8.535 -0.855 1
1 471 . 10 1 1 A 36 36 GLU HA H 36 4.120 3.937 0.183 1
1 476 . 10 1 1 A 36 36 GLU C C 36 176.300 178.426 -2.126 1
1 477 . 10 1 1 A 36 36 GLU CA C 36 58.600 60.001 -1.401 1
1 478 . 10 1 1 A 36 36 GLU CB C 36 30.000 29.499 0.501 1
1 480 . 10 1 1 A 36 36 GLU N N 36 116.500 120.066 -3.566 1
1 481 . 10 1 1 A 37 37 GLN H H 37 7.630 7.884 -0.254 1
1 482 . 10 1 1 A 37 37 GLN HA H 37 4.540 4.482 0.058 1
1 489 . 10 1 1 A 37 37 GLN C C 37 176.000 176.022 -0.022 1
1 490 . 10 1 1 A 37 37 GLN CA C 37 54.900 55.111 -0.211 1
1 491 . 10 1 1 A 37 37 GLN CB C 37 29.600 27.888 1.712 1
1 494 . 10 1 1 A 37 37 GLN N N 37 115.000 115.557 -0.557 1
1 496 . 10 1 1 A 38 38 SER H H 38 7.380 7.946 -0.566 1
1 497 . 10 1 1 A 38 38 SER HA H 38 4.410 4.335 0.075 1
1 500 . 10 1 1 A 38 38 SER C C 38 175.500 174.755 0.745 1
1 501 . 10 1 1 A 38 38 SER CA C 38 59.200 59.177 0.023 1
1 502 . 10 1 1 A 38 38 SER CB C 38 64.100 63.151 0.949 1
1 503 . 10 1 1 A 38 38 SER N N 38 115.200 115.708 -0.508 1
1 504 . 10 1 1 A 39 39 GLU H H 39 9.040 8.668 0.372 1
1 505 . 10 1 1 A 39 39 GLU HA H 39 4.450 4.051 0.399 1
1 510 . 10 1 1 A 39 39 GLU C C 39 176.300 176.254 0.046 1
1 511 . 10 1 1 A 39 39 GLU CA C 39 57.100 59.429 -2.329 1
1 512 . 10 1 1 A 39 39 GLU CB C 39 30.300 30.398 -0.098 1
1 514 . 10 1 1 A 39 39 GLU N N 39 125.400 125.909 -0.509 1
1 515 . 10 1 1 A 40 40 THR H H 40 7.920 8.034 -0.114 1
1 516 . 10 1 1 A 40 40 THR HA H 40 4.590 4.795 -0.205 1
1 521 . 10 1 1 A 40 40 THR C C 40 173.500 174.074 -0.574 1
1 522 . 10 1 1 A 40 40 THR CA C 40 60.500 59.541 0.959 1
1 523 . 10 1 1 A 40 40 THR CB C 40 71.100 71.083 0.017 1
1 525 . 10 1 1 A 40 40 THR N N 40 112.800 114.071 -1.271 1
1 526 . 10 1 1 A 41 41 ALA H H 41 8.780 8.523 0.257 1
1 527 . 10 1 1 A 41 41 ALA HA H 41 4.870 4.625 0.245 1
1 531 . 10 1 1 A 41 41 ALA CA C 41 49.700 50.500 -0.800 1
1 532 . 10 1 1 A 41 41 ALA CB C 41 19.300 18.603 0.697 1
1 533 . 10 1 1 A 41 41 ALA N N 41 127.000 128.243 -1.243 1
1 534 . 10 1 1 A 42 42 PRO HA H 42 4.660 4.597 0.063 1
1 541 . 10 1 1 A 42 42 PRO C C 42 178.300 177.759 0.541 1
1 542 . 10 1 1 A 42 42 PRO CA C 42 62.500 62.660 -0.160 1
1 543 . 10 1 1 A 42 42 PRO CB C 42 32.600 32.864 -0.264 1
1 546 . 10 1 1 A 43 43 VAL H H 43 8.840 8.675 0.165 1
1 547 . 10 1 1 A 43 43 VAL HA H 43 3.660 3.786 -0.126 1
1 555 . 10 1 1 A 43 43 VAL CA C 43 66.800 65.396 1.404 1
1 556 . 10 1 1 A 43 43 VAL CB C 43 31.100 31.459 -0.359 1
1 559 . 10 1 1 A 43 43 VAL N N 43 123.000 122.529 0.471 1
1 560 . 10 1 1 A 44 44 VAL HA H 44 4.030 3.654 0.376 1
1 568 . 10 1 1 A 44 44 VAL C C 44 176.700 178.645 -1.945 1
1 569 . 10 1 1 A 44 44 VAL CA C 44 65.900 67.079 -1.179 1
1 570 . 10 1 1 A 44 44 VAL CB C 44 30.900 31.590 -0.690 1
1 573 . 10 1 1 A 45 45 VAL H H 45 7.500 8.229 -0.729 1
1 574 . 10 1 1 A 45 45 VAL HA H 45 3.760 3.592 0.168 1
1 582 . 10 1 1 A 45 45 VAL C C 45 177.500 178.099 -0.599 1
1 583 . 10 1 1 A 45 45 VAL CA C 45 66.700 66.675 0.025 1
1 584 . 10 1 1 A 45 45 VAL CB C 45 31.000 31.482 -0.482 1
1 587 . 10 1 1 A 45 45 VAL N N 45 120.100 120.296 -0.196 1
1 588 . 10 1 1 A 46 46 LYS H H 46 7.610 7.511 0.099 1
1 589 . 10 1 1 A 46 46 LYS HA H 46 4.140 4.010 0.130 1
1 598 . 10 1 1 A 46 46 LYS C C 46 179.500 178.820 0.680 1
1 599 . 10 1 1 A 46 46 LYS CA C 46 59.900 59.349 0.551 1
1 600 . 10 1 1 A 46 46 LYS CB C 46 31.500 32.093 -0.593 1
1 604 . 10 1 1 A 46 46 LYS N N 46 120.700 118.508 2.192 1
1 605 . 10 1 1 A 47 47 TYR H H 47 8.550 8.054 0.496 1
1 606 . 10 1 1 A 47 47 TYR HA H 47 5.000 4.175 0.825 1
1 613 . 10 1 1 A 47 47 TYR C C 47 177.300 177.375 -0.075 1
1 614 . 10 1 1 A 47 47 TYR CA C 47 57.300 61.480 -4.180 1
1 615 . 10 1 1 A 47 47 TYR CB C 47 37.700 38.673 -0.973 1
1 620 . 10 1 1 A 47 47 TYR N N 47 122.700 120.510 2.190 1
1 621 . 10 1 1 A 48 48 ILE H H 48 8.250 8.120 0.130 1
1 622 . 10 1 1 A 48 48 ILE HA H 48 3.160 3.370 -0.210 1
1 632 . 10 1 1 A 48 48 ILE C C 48 177.100 177.894 -0.794 1
1 633 . 10 1 1 A 48 48 ILE CA C 48 67.000 65.454 1.546 1
1 634 . 10 1 1 A 48 48 ILE CB C 48 37.800 38.367 -0.567 1
1 638 . 10 1 1 A 48 48 ILE N N 48 121.200 120.629 0.571 1
1 639 . 10 1 1 A 49 49 ALA H H 49 8.310 8.452 -0.142 1
1 640 . 10 1 1 A 49 49 ALA HA H 49 3.940 4.005 -0.065 1
1 644 . 10 1 1 A 49 49 ALA C C 49 179.300 179.313 -0.013 1
1 645 . 10 1 1 A 49 49 ALA CA C 49 55.500 54.940 0.560 1
1 646 . 10 1 1 A 49 49 ALA CB C 49 18.200 18.204 -0.004 1
1 647 . 10 1 1 A 49 49 ALA N N 49 120.300 120.709 -0.409 1
1 648 . 10 1 1 A 50 50 PHE H H 50 8.630 8.114 0.516 1
1 649 . 10 1 1 A 50 50 PHE HA H 50 4.200 4.170 0.030 1
1 656 . 10 1 1 A 50 50 PHE C C 50 179.000 176.656 2.344 1
1 657 . 10 1 1 A 50 50 PHE CA C 50 61.300 61.414 -0.114 1
1 658 . 10 1 1 A 50 50 PHE CB C 50 39.200 39.312 -0.112 1
1 663 . 10 1 1 A 50 50 PHE N N 50 121.300 120.451 0.849 1
1 664 . 10 1 1 A 51 51 LEU H H 51 8.920 8.163 0.757 1
1 665 . 10 1 1 A 51 51 LEU HA H 51 3.630 3.841 -0.211 1
1 675 . 10 1 1 A 51 51 LEU C C 51 180.000 179.284 0.716 1
1 676 . 10 1 1 A 51 51 LEU CA C 51 58.100 57.652 0.448 1
1 677 . 10 1 1 A 51 51 LEU CB C 51 39.800 41.210 -1.410 1
1 681 . 10 1 1 A 51 51 LEU N N 51 121.900 118.695 3.205 1
1 682 . 10 1 1 A 52 52 ARG H H 52 8.410 8.165 0.245 1
1 683 . 10 1 1 A 52 52 ARG HA H 52 4.420 3.961 0.459 1
1 691 . 10 1 1 A 52 52 ARG C C 52 179.800 179.342 0.458 1
1 692 . 10 1 1 A 52 52 ARG CA C 52 57.800 59.736 -1.936 1
1 693 . 10 1 1 A 52 52 ARG CB C 52 28.200 29.877 -1.677 1
1 695 . 10 1 1 A 52 52 ARG N N 52 120.500 119.464 1.036 1
1 697 . 10 1 1 A 53 53 SER H H 53 8.480 7.939 0.541 1
1 698 . 10 1 1 A 53 53 SER HA H 53 4.300 4.154 0.146 1
1 701 . 10 1 1 A 53 53 SER C C 53 174.600 175.022 -0.422 1
1 702 . 10 1 1 A 53 53 SER CA C 53 61.500 61.574 -0.074 1
1 703 . 10 1 1 A 53 53 SER CB C 53 62.300 62.851 -0.551 1
1 704 . 10 1 1 A 53 53 SER N N 53 119.500 116.816 2.684 1
1 705 . 10 1 1 A 54 54 LYS H H 54 7.080 7.508 -0.428 1
1 706 . 10 1 1 A 54 54 LYS HA H 54 4.350 4.294 0.056 1
1 715 . 10 1 1 A 54 54 LYS C C 54 176.500 176.836 -0.336 1
1 716 . 10 1 1 A 54 54 LYS CA C 54 53.700 55.852 -2.152 1
1 717 . 10 1 1 A 54 54 LYS CB C 54 31.800 32.864 -1.064 1
1 721 . 10 1 1 A 54 54 LYS N N 54 119.200 118.262 0.938 1
1 722 . 10 1 1 A 55 55 GLY H H 55 8.040 8.156 -0.116 1
1 723 . 10 1 1 A 55 55 GLY HA2 H 55 3.540 3.957 -0.417 1
1 724 . 10 1 1 A 55 55 GLY HA3 H 55 4.300 3.964 0.336 1
1 725 . 10 1 1 A 55 55 GLY C C 55 174.500 175.017 -0.517 1
1 726 . 10 1 1 A 55 55 GLY CA C 55 44.700 46.089 -1.389 1
1 727 . 10 1 1 A 55 55 GLY N N 55 106.600 107.819 -1.219 1
1 728 . 10 1 1 A 56 56 VAL H H 56 7.580 7.646 -0.066 1
1 729 . 10 1 1 A 56 56 VAL HA H 56 3.630 3.997 -0.367 1
1 737 . 10 1 1 A 56 56 VAL C C 56 174.700 175.074 -0.374 1
1 738 . 10 1 1 A 56 56 VAL CA C 56 64.000 65.325 -1.325 1
1 739 . 10 1 1 A 56 56 VAL CB C 56 31.600 32.089 -0.489 1
1 742 . 10 1 1 A 56 56 VAL N N 56 122.000 117.837 4.163 1
1 743 . 10 1 1 A 57 57 ASP H H 57 8.440 8.013 0.427 1
1 744 . 10 1 1 A 57 57 ASP HA H 57 4.500 4.240 0.260 1
1 747 . 10 1 1 A 57 57 ASP C C 57 176.900 175.972 0.928 1
1 748 . 10 1 1 A 57 57 ASP CA C 57 52.600 55.098 -2.498 1
1 749 . 10 1 1 A 57 57 ASP CB C 57 39.900 38.930 0.970 1
1 750 . 10 1 1 A 57 57 ASP N N 57 124.100 118.642 5.458 1
1 751 . 10 1 1 A 58 58 LEU H H 58 9.720 7.803 1.917 1
1 752 . 10 1 1 A 58 58 LEU HA H 58 4.020 3.951 0.069 1
1 762 . 10 1 1 A 58 58 LEU C C 58 179.400 178.391 1.009 1
1 763 . 10 1 1 A 58 58 LEU CA C 58 56.300 57.721 -1.421 1
1 764 . 10 1 1 A 58 58 LEU CB C 58 43.300 41.762 1.538 1
1 768 . 10 1 1 A 58 58 LEU N N 58 127.800 120.469 7.331 1
1 769 . 10 1 1 A 59 59 ASN H H 59 7.740 8.438 -0.698 1
1 770 . 10 1 1 A 59 59 ASN HA H 59 4.340 4.351 -0.011 1
1 775 . 10 1 1 A 59 59 ASN C C 59 176.300 177.785 -1.485 1
1 776 . 10 1 1 A 59 59 ASN CA C 59 56.300 56.484 -0.184 1
1 777 . 10 1 1 A 59 59 ASN CB C 59 36.400 38.034 -1.634 1
1 779 . 10 1 1 A 59 59 ASN N N 59 119.500 116.457 3.043 1
1 781 . 10 1 1 A 60 60 ALA H H 60 7.220 8.000 -0.780 1
1 782 . 10 1 1 A 60 60 ALA HA H 60 4.030 4.152 -0.122 1
1 786 . 10 1 1 A 60 60 ALA C C 60 180.100 180.237 -0.137 1
1 787 . 10 1 1 A 60 60 ALA CA C 60 54.300 54.892 -0.592 1
1 788 . 10 1 1 A 60 60 ALA CB C 60 18.200 18.248 -0.048 1
1 789 . 10 1 1 A 60 60 ALA N N 60 121.400 121.685 -0.285 1
1 790 . 10 1 1 A 61 61 LEU H H 61 7.320 8.225 -0.905 1
1 791 . 10 1 1 A 61 61 LEU HA H 61 3.840 4.164 -0.324 1
1 801 . 10 1 1 A 61 61 LEU C C 61 177.200 178.463 -1.263 1
1 802 . 10 1 1 A 61 61 LEU CA C 61 58.500 58.318 0.182 1
1 803 . 10 1 1 A 61 61 LEU CB C 61 42.600 41.914 0.686 1
1 807 . 10 1 1 A 61 61 LEU N N 61 118.600 120.716 -2.116 1
1 808 . 10 1 1 A 62 62 PHE H H 62 8.360 8.220 0.140 1
1 809 . 10 1 1 A 62 62 PHE HA H 62 3.930 4.138 -0.208 1
1 817 . 10 1 1 A 62 62 PHE C C 62 178.200 178.098 0.102 1
1 818 . 10 1 1 A 62 62 PHE CA C 62 62.800 60.743 2.057 1
1 819 . 10 1 1 A 62 62 PHE CB C 62 38.500 38.733 -0.233 1
1 825 . 10 1 1 A 62 62 PHE N N 62 114.400 116.892 -2.492 1
1 826 . 10 1 1 A 63 63 ASP H H 63 8.680 8.280 0.400 1
1 827 . 10 1 1 A 63 63 ASP HA H 63 4.530 4.383 0.147 1
1 830 . 10 1 1 A 63 63 ASP C C 63 178.600 178.737 -0.137 1
1 831 . 10 1 1 A 63 63 ASP CA C 63 57.500 57.012 0.488 1
1 832 . 10 1 1 A 63 63 ASP CB C 63 39.600 40.411 -0.811 1
1 833 . 10 1 1 A 63 63 ASP N N 63 120.400 118.833 1.567 1
1 834 . 10 1 1 A 64 64 ARG H H 64 7.540 7.554 -0.014 1
1 835 . 10 1 1 A 64 64 ARG HA H 64 4.290 4.149 0.141 1
1 843 . 10 1 1 A 64 64 ARG C C 64 177.600 177.978 -0.378 1
1 844 . 10 1 1 A 64 64 ARG CA C 64 58.300 58.610 -0.310 1
1 845 . 10 1 1 A 64 64 ARG CB C 64 30.000 30.100 -0.100 1
1 848 . 10 1 1 A 64 64 ARG N N 64 116.800 120.269 -3.469 1
1 850 . 10 1 1 A 65 65 ILE H H 65 7.260 8.026 -0.766 1
1 851 . 10 1 1 A 65 65 ILE HA H 65 4.130 3.991 0.139 1
1 861 . 10 1 1 A 65 65 ILE C C 65 177.000 178.354 -1.354 1
1 862 . 10 1 1 A 65 65 ILE CA C 65 62.600 63.683 -1.083 1
1 863 . 10 1 1 A 65 65 ILE CB C 65 38.700 37.542 1.158 1
1 867 . 10 1 1 A 65 65 ILE N N 65 117.000 118.569 -1.569 1
1 868 . 10 1 1 A 66 66 ILE H H 66 7.980 7.570 0.410 1
1 869 . 10 1 1 A 66 66 ILE HA H 66 4.000 4.025 -0.025 1
1 879 . 10 1 1 A 66 66 ILE C C 66 176.400 175.899 0.501 1
1 880 . 10 1 1 A 66 66 ILE CA C 66 63.100 63.031 0.069 1
1 881 . 10 1 1 A 66 66 ILE CB C 66 38.800 38.587 0.213 1
1 885 . 10 1 1 A 66 66 ILE N N 66 120.700 115.083 5.617 1
1 886 . 10 1 1 A 67 67 VAL H H 67 8.130 7.883 0.247 1
1 887 . 10 1 1 A 67 67 VAL HA H 67 3.980 4.244 -0.264 1
1 895 . 10 1 1 A 67 67 VAL C C 67 177.300 175.250 2.050 1
1 896 . 10 1 1 A 67 67 VAL CA C 67 63.900 62.843 1.057 1
1 897 . 10 1 1 A 67 67 VAL CB C 67 32.500 30.898 1.602 1
1 900 . 10 1 1 A 67 67 VAL N N 67 121.600 118.600 3.000 1
1 901 . 10 1 1 A 68 68 ASN H H 68 8.170 8.272 -0.102 1
1 902 . 10 1 1 A 68 68 ASN HA H 68 4.680 4.624 0.056 1
1 907 . 10 1 1 A 68 68 ASN CA C 68 54.200 53.898 0.302 1
1 908 . 10 1 1 A 68 68 ASN CB C 68 39.100 38.928 0.172 1
1 910 . 10 1 1 A 68 68 ASN N N 68 120.500 124.930 -4.430 1
1 912 . 10 1 1 A 69 69 LYS H H 69 8.230 8.746 -0.516 1
1 913 . 10 1 1 A 69 69 LYS HA H 69 4.260 4.738 -0.478 1
1 922 . 10 1 1 A 69 69 LYS C C 69 176.900 175.587 1.313 1
1 923 . 10 1 1 A 69 69 LYS CA C 69 57.000 55.921 1.079 1
1 924 . 10 1 1 A 69 69 LYS CB C 69 32.800 33.226 -0.426 1
1 928 . 10 1 1 A 69 69 LYS N N 69 121.300 123.612 -2.312 1
1 929 . 10 1 1 A 70 70 LEU H H 70 8.150 8.643 -0.493 1
1 930 . 10 1 1 A 70 70 LEU HA H 70 4.300 4.629 -0.329 1
1 940 . 10 1 1 A 70 70 LEU C C 70 178.900 175.680 3.220 1
1 941 . 10 1 1 A 70 70 LEU CA C 70 55.400 54.118 1.282 1
1 942 . 10 1 1 A 70 70 LEU CB C 70 42.100 42.279 -0.179 1
1 946 . 10 1 1 A 70 70 LEU N N 70 121.900 120.966 0.934 1
1 947 . 10 1 1 A 71 71 GLU H H 71 8.210 8.490 -0.280 1
1 948 . 10 1 1 A 71 71 GLU HA H 71 4.180 3.820 0.360 1
1 953 . 10 1 1 A 71 71 GLU C C 71 176.300 175.988 0.312 1
1 954 . 10 1 1 A 71 71 GLU CA C 71 56.600 57.217 -0.617 1
1 955 . 10 1 1 A 71 71 GLU CB C 71 30.200 28.025 2.175 1
1 957 . 10 1 1 A 71 71 GLU N N 71 120.900 119.450 1.450 1
1 958 . 10 1 1 A 72 72 HIS H H 72 8.380 7.511 0.869 1
1 959 . 10 1 1 A 72 72 HIS HA H 72 4.600 4.894 -0.294 1
1 962 . 10 1 1 A 72 72 HIS C C 72 174.600 174.550 0.050 1
1 963 . 10 1 1 A 72 72 HIS CA C 72 55.600 54.322 1.278 1
1 964 . 10 1 1 A 72 72 HIS CB C 72 29.600 30.791 -1.191 1
1 965 . 10 1 1 A 72 72 HIS N N 72 119.300 120.628 -1.328 1
1 966 . 10 1 1 A 73 73 HIS H H 73 8.410 8.332 0.078 1
1 967 . 10 1 1 A 73 73 HIS HA H 73 4.610 4.543 0.067 1
1 970 . 10 1 1 A 73 73 HIS C C 73 173.700 176.174 -2.474 1
1 971 . 10 1 1 A 73 73 HIS CA C 73 55.700 55.236 0.464 1
1 972 . 10 1 1 A 73 73 HIS CB C 73 29.600 29.228 0.372 1
1 973 . 10 1 1 A 73 73 HIS N N 73 119.410 122.162 -2.752 1
1 974 . 10 1 1 A 74 74 HIS H H 74 8.310 7.739 0.571 1
1 975 . 10 1 1 A 74 74 HIS HA H 74 4.630 3.747 0.883 1
1 978 . 10 1 1 A 74 74 HIS CA C 74 57.100 59.923 -2.823 1
1 979 . 10 1 1 A 74 74 HIS CB C 74 29.800 29.947 -0.147 1
1 14 . 11 1 1 A 2 2 GLU H H 2 9.070 8.864 0.206 1
1 15 . 11 1 1 A 2 2 GLU HA H 2 4.520 4.250 0.270 1
1 20 . 11 1 1 A 2 2 GLU C C 2 176.300 177.628 -1.328 1
1 21 . 11 1 1 A 2 2 GLU CA C 2 55.800 57.404 -1.604 1
1 22 . 11 1 1 A 2 2 GLU CB C 2 31.000 29.761 1.239 1
1 24 . 11 1 1 A 2 2 GLU N N 2 123.100 122.165 0.935 1
1 25 . 11 1 1 A 3 3 LEU H H 3 8.750 8.637 0.113 1
1 26 . 11 1 1 A 3 3 LEU HA H 3 3.750 4.087 -0.337 1
1 36 . 11 1 1 A 3 3 LEU C C 3 177.400 178.682 -1.282 1
1 37 . 11 1 1 A 3 3 LEU CA C 3 58.300 58.493 -0.193 1
1 38 . 11 1 1 A 3 3 LEU CB C 3 41.500 41.306 0.194 1
1 42 . 11 1 1 A 3 3 LEU N N 3 122.600 126.990 -4.390 1
1 43 . 11 1 1 A 4 4 SER H H 4 8.350 8.034 0.316 1
1 44 . 11 1 1 A 4 4 SER HA H 4 3.890 4.078 -0.188 1
1 47 . 11 1 1 A 4 4 SER C C 4 175.100 176.076 -0.976 1
1 48 . 11 1 1 A 4 4 SER CA C 4 61.500 62.134 -0.634 1
1 49 . 11 1 1 A 4 4 SER CB C 4 62.000 62.772 -0.772 1
1 50 . 11 1 1 A 4 4 SER N N 4 112.900 116.952 -4.052 1
1 51 . 11 1 1 A 5 5 ASN H H 5 7.180 8.320 -1.140 1
1 52 . 11 1 1 A 5 5 ASN HA H 5 4.470 4.414 0.056 1
1 57 . 11 1 1 A 5 5 ASN C C 5 177.400 177.945 -0.545 1
1 58 . 11 1 1 A 5 5 ASN CA C 5 56.000 57.005 -1.005 1
1 59 . 11 1 1 A 5 5 ASN CB C 5 39.400 39.277 0.123 1
1 61 . 11 1 1 A 5 5 ASN N N 5 116.600 119.698 -3.098 1
1 63 . 11 1 1 A 6 6 GLU H H 6 7.950 7.824 0.126 1
1 64 . 11 1 1 A 6 6 GLU HA H 6 4.070 4.154 -0.084 1
1 69 . 11 1 1 A 6 6 GLU C C 6 178.500 178.659 -0.159 1
1 70 . 11 1 1 A 6 6 GLU CA C 6 58.100 58.890 -0.790 1
1 71 . 11 1 1 A 6 6 GLU CB C 6 29.300 29.494 -0.194 1
1 73 . 11 1 1 A 6 6 GLU N N 6 117.600 119.392 -1.792 1
1 74 . 11 1 1 A 7 7 LEU H H 7 8.140 8.418 -0.278 1
1 75 . 11 1 1 A 7 7 LEU HA H 7 3.640 4.090 -0.450 1
1 85 . 11 1 1 A 7 7 LEU C C 7 177.700 178.619 -0.919 1
1 86 . 11 1 1 A 7 7 LEU CA C 7 58.300 57.984 0.316 1
1 87 . 11 1 1 A 7 7 LEU CB C 7 40.600 41.815 -1.215 1
1 91 . 11 1 1 A 7 7 LEU N N 7 118.500 121.399 -2.899 1
1 92 . 11 1 1 A 8 8 LYS H H 8 7.090 8.320 -1.230 1
1 93 . 11 1 1 A 8 8 LYS HA H 8 4.080 4.018 0.062 1
1 102 . 11 1 1 A 8 8 LYS C C 8 178.300 179.387 -1.087 1
1 103 . 11 1 1 A 8 8 LYS CA C 8 59.700 59.139 0.561 1
1 104 . 11 1 1 A 8 8 LYS CB C 8 32.300 31.929 0.371 1
1 108 . 11 1 1 A 8 8 LYS N N 8 118.200 117.765 0.435 1
1 109 . 11 1 1 A 9 9 VAL H H 9 7.940 7.741 0.199 1
1 110 . 11 1 1 A 9 9 VAL HA H 9 3.440 3.520 -0.080 1
1 118 . 11 1 1 A 9 9 VAL C C 9 179.500 177.452 2.048 1
1 119 . 11 1 1 A 9 9 VAL CA C 9 66.700 66.687 0.013 1
1 120 . 11 1 1 A 9 9 VAL CB C 9 31.600 31.204 0.396 1
1 123 . 11 1 1 A 9 9 VAL N N 9 117.600 120.821 -3.221 1
1 124 . 11 1 1 A 10 10 GLU H H 10 7.830 7.971 -0.141 1
1 125 . 11 1 1 A 10 10 GLU HA H 10 4.130 3.952 0.178 1
1 130 . 11 1 1 A 10 10 GLU C C 10 178.700 179.277 -0.577 1
1 131 . 11 1 1 A 10 10 GLU CA C 10 58.300 59.579 -1.279 1
1 132 . 11 1 1 A 10 10 GLU CB C 10 28.500 29.704 -1.204 1
1 134 . 11 1 1 A 10 10 GLU N N 10 118.300 118.354 -0.054 1
1 135 . 11 1 1 A 11 11 ARG H H 11 8.330 7.389 0.941 1
1 136 . 11 1 1 A 11 11 ARG HA H 11 3.770 4.084 -0.314 1
1 144 . 11 1 1 A 11 11 ARG C C 11 174.600 178.907 -4.307 1
1 145 . 11 1 1 A 11 11 ARG CA C 11 61.300 58.989 2.311 1
1 146 . 11 1 1 A 11 11 ARG CB C 11 28.500 29.926 -1.426 1
1 149 . 11 1 1 A 11 11 ARG N N 11 121.400 120.109 1.291 1
1 151 . 11 1 1 A 12 12 ILE H H 12 8.540 8.562 -0.022 1
1 152 . 11 1 1 A 12 12 ILE HA H 12 3.780 3.754 0.026 1
1 162 . 11 1 1 A 12 12 ILE C C 12 181.400 177.769 3.631 1
1 163 . 11 1 1 A 12 12 ILE CA C 12 64.800 65.116 -0.316 1
1 164 . 11 1 1 A 12 12 ILE CB C 12 37.700 37.583 0.117 1
1 168 . 11 1 1 A 12 12 ILE N N 12 118.700 119.710 -1.010 1
1 169 . 11 1 1 A 13 13 ARG H H 13 8.470 8.357 0.113 1
1 170 . 11 1 1 A 13 13 ARG HA H 13 4.060 3.990 0.070 1
1 178 . 11 1 1 A 13 13 ARG C C 13 178.600 178.431 0.169 1
1 179 . 11 1 1 A 13 13 ARG CA C 13 59.600 59.275 0.325 1
1 180 . 11 1 1 A 13 13 ARG CB C 13 30.000 30.081 -0.081 1
1 183 . 11 1 1 A 13 13 ARG N N 13 124.600 121.499 3.101 1
1 185 . 11 1 1 A 14 14 LEU H H 14 7.430 8.033 -0.603 1
1 186 . 11 1 1 A 14 14 LEU HA H 14 4.240 4.340 -0.100 1
1 196 . 11 1 1 A 14 14 LEU C C 14 176.000 176.378 -0.378 1
1 197 . 11 1 1 A 14 14 LEU CA C 14 55.300 54.651 0.649 1
1 198 . 11 1 1 A 14 14 LEU CB C 14 43.000 41.948 1.052 1
1 202 . 11 1 1 A 14 14 LEU N N 14 118.500 118.385 0.115 1
1 203 . 11 1 1 A 15 15 SER H H 15 8.260 8.006 0.254 1
1 204 . 11 1 1 A 15 15 SER HA H 15 4.030 4.167 -0.137 1
1 207 . 11 1 1 A 15 15 SER C C 15 174.000 173.456 0.544 1
1 208 . 11 1 1 A 15 15 SER CA C 15 58.700 58.944 -0.244 1
1 209 . 11 1 1 A 15 15 SER CB C 15 61.300 60.751 0.549 1
1 210 . 11 1 1 A 15 15 SER N N 15 112.500 114.145 -1.645 1
1 211 . 11 1 1 A 16 16 LEU H H 16 7.310 7.602 -0.292 1
1 212 . 11 1 1 A 16 16 LEU HA H 16 4.880 4.752 0.128 1
1 222 . 11 1 1 A 16 16 LEU C C 16 177.900 176.907 0.993 1
1 223 . 11 1 1 A 16 16 LEU CA C 16 52.600 53.282 -0.682 1
1 224 . 11 1 1 A 16 16 LEU CB C 16 43.500 43.198 0.302 1
1 228 . 11 1 1 A 16 16 LEU N N 16 117.800 121.824 -4.024 1
1 229 . 11 1 1 A 17 17 THR H H 17 8.640 8.830 -0.190 1
1 230 . 11 1 1 A 17 17 THR HA H 17 4.250 4.857 -0.607 1
1 235 . 11 1 1 A 17 17 THR C C 17 174.900 175.748 -0.848 1
1 236 . 11 1 1 A 17 17 THR CA C 17 60.500 60.383 0.117 1
1 237 . 11 1 1 A 17 17 THR CB C 17 70.500 70.470 0.030 1
1 239 . 11 1 1 A 17 17 THR N N 17 115.200 115.940 -0.740 1
1 240 . 11 1 1 A 18 18 ALA H H 18 8.820 9.064 -0.244 1
1 241 . 11 1 1 A 18 18 ALA HA H 18 3.680 3.966 -0.286 1
1 245 . 11 1 1 A 18 18 ALA C C 18 178.900 179.558 -0.658 1
1 246 . 11 1 1 A 18 18 ALA CA C 18 55.200 55.233 -0.033 1
1 247 . 11 1 1 A 18 18 ALA CB C 18 17.800 18.113 -0.313 1
1 248 . 11 1 1 A 18 18 ALA N N 18 125.600 126.620 -1.020 1
1 249 . 11 1 1 A 19 19 LYS H H 19 8.280 7.980 0.300 1
1 250 . 11 1 1 A 19 19 LYS HA H 19 3.740 3.955 -0.215 1
1 259 . 11 1 1 A 19 19 LYS C C 19 177.900 178.874 -0.974 1
1 260 . 11 1 1 A 19 19 LYS CA C 19 59.800 59.492 0.308 1
1 261 . 11 1 1 A 19 19 LYS CB C 19 33.300 32.385 0.915 1
1 265 . 11 1 1 A 19 19 LYS N N 19 115.800 119.083 -3.283 1
1 266 . 11 1 1 A 20 20 SER H H 20 7.860 8.034 -0.174 1
1 267 . 11 1 1 A 20 20 SER HA H 20 4.210 4.142 0.068 1
1 271 . 11 1 1 A 20 20 SER C C 20 177.200 176.353 0.847 1
1 272 . 11 1 1 A 20 20 SER CA C 20 61.900 62.618 -0.718 1
1 273 . 11 1 1 A 20 20 SER CB C 20 63.000 63.075 -0.075 1
1 274 . 11 1 1 A 20 20 SER N N 20 114.600 117.069 -2.469 1
1 275 . 11 1 1 A 21 21 VAL H H 21 7.830 7.867 -0.037 1
1 276 . 11 1 1 A 21 21 VAL HA H 21 3.280 3.549 -0.269 1
1 284 . 11 1 1 A 21 21 VAL C C 21 177.500 177.994 -0.494 1
1 285 . 11 1 1 A 21 21 VAL CA C 21 66.800 66.496 0.304 1
1 286 . 11 1 1 A 21 21 VAL CB C 21 31.400 31.544 -0.144 1
1 289 . 11 1 1 A 21 21 VAL N N 21 122.600 121.784 0.816 1
1 290 . 11 1 1 A 22 22 ALA H H 22 8.230 8.509 -0.279 1
1 291 . 11 1 1 A 22 22 ALA HA H 22 3.510 3.911 -0.401 1
1 295 . 11 1 1 A 22 22 ALA C C 22 179.500 180.109 -0.609 1
1 296 . 11 1 1 A 22 22 ALA CA C 22 55.500 55.933 -0.433 1
1 297 . 11 1 1 A 22 22 ALA CB C 22 16.900 18.590 -1.690 1
1 298 . 11 1 1 A 22 22 ALA N N 22 121.200 122.246 -1.046 1
1 299 . 11 1 1 A 23 23 GLU H H 23 7.900 8.209 -0.309 1
1 300 . 11 1 1 A 23 23 GLU HA H 23 3.990 4.025 -0.035 1
1 305 . 11 1 1 A 23 23 GLU C C 23 180.000 179.171 0.829 1
1 306 . 11 1 1 A 23 23 GLU CA C 23 59.300 59.489 -0.189 1
1 307 . 11 1 1 A 23 23 GLU CB C 23 29.300 29.233 0.067 1
1 309 . 11 1 1 A 23 23 GLU N N 23 115.300 117.742 -2.442 1
1 310 . 11 1 1 A 24 24 GLU H H 24 7.950 7.732 0.218 1
1 311 . 11 1 1 A 24 24 GLU HA H 24 4.060 4.077 -0.017 1
1 316 . 11 1 1 A 24 24 GLU C C 24 179.100 179.028 0.072 1
1 317 . 11 1 1 A 24 24 GLU CA C 24 59.700 59.021 0.679 1
1 318 . 11 1 1 A 24 24 GLU CB C 24 29.500 29.734 -0.234 1
1 320 . 11 1 1 A 24 24 GLU N N 24 120.100 120.010 0.090 1
1 321 . 11 1 1 A 25 25 MET H H 25 8.150 8.593 -0.443 1
1 322 . 11 1 1 A 25 25 MET HA H 25 4.110 4.310 -0.200 1
1 330 . 11 1 1 A 25 25 MET C C 25 176.600 176.604 -0.004 1
1 331 . 11 1 1 A 25 25 MET CA C 25 57.100 56.700 0.400 1
1 332 . 11 1 1 A 25 25 MET CB C 25 34.900 32.684 2.216 1
1 335 . 11 1 1 A 25 25 MET N N 25 115.500 117.629 -2.129 1
1 336 . 11 1 1 A 26 26 GLY H H 26 7.940 8.778 -0.838 1
1 337 . 11 1 1 A 26 26 GLY HA2 H 26 3.860 3.952 -0.092 1
1 338 . 11 1 1 A 26 26 GLY HA3 H 26 3.960 3.953 0.007 1
1 339 . 11 1 1 A 26 26 GLY C C 26 175.100 173.826 1.274 1
1 340 . 11 1 1 A 26 26 GLY CA C 26 46.600 45.758 0.842 1
1 341 . 11 1 1 A 26 26 GLY N N 26 109.000 106.785 2.215 1
1 342 . 11 1 1 A 27 27 ILE H H 27 7.880 7.392 0.488 1
1 343 . 11 1 1 A 27 27 ILE HA H 27 4.790 4.809 -0.019 1
1 353 . 11 1 1 A 27 27 ILE C C 27 174.300 174.857 -0.557 1
1 354 . 11 1 1 A 27 27 ILE CA C 27 59.000 58.614 0.386 1
1 355 . 11 1 1 A 27 27 ILE CB C 27 40.900 41.408 -0.508 1
1 359 . 11 1 1 A 27 27 ILE N N 27 112.700 115.683 -2.983 1
1 360 . 11 1 1 A 28 28 SER H H 28 8.570 8.755 -0.185 1
1 361 . 11 1 1 A 28 28 SER HA H 28 4.540 4.701 -0.161 1
1 364 . 11 1 1 A 28 28 SER C C 28 175.600 175.322 0.278 1
1 365 . 11 1 1 A 28 28 SER CA C 28 56.800 57.465 -0.665 1
1 366 . 11 1 1 A 28 28 SER CB C 28 65.500 65.079 0.421 1
1 367 . 11 1 1 A 28 28 SER N N 28 115.400 117.661 -2.261 1
1 368 . 11 1 1 A 29 29 ARG H H 29 8.980 8.844 0.136 1
1 369 . 11 1 1 A 29 29 ARG HA H 29 3.660 3.991 -0.331 1
1 377 . 11 1 1 A 29 29 ARG C C 29 178.700 177.685 1.015 1
1 378 . 11 1 1 A 29 29 ARG CA C 29 59.500 59.841 -0.341 1
1 379 . 11 1 1 A 29 29 ARG CB C 29 29.500 29.902 -0.402 1
1 382 . 11 1 1 A 29 29 ARG N N 29 122.000 122.492 -0.492 1
1 384 . 11 1 1 A 30 30 GLN H H 30 8.580 8.135 0.445 1
1 385 . 11 1 1 A 30 30 GLN HA H 30 3.860 3.996 -0.136 1
1 392 . 11 1 1 A 30 30 GLN C C 30 178.100 178.312 -0.212 1
1 393 . 11 1 1 A 30 30 GLN CA C 30 59.200 59.329 -0.129 1
1 394 . 11 1 1 A 30 30 GLN CB C 30 28.100 28.177 -0.077 1
1 397 . 11 1 1 A 30 30 GLN N N 30 118.700 118.593 0.107 1
1 399 . 11 1 1 A 31 31 GLN H H 31 7.990 7.868 0.122 1
1 400 . 11 1 1 A 31 31 GLN HA H 31 3.980 4.029 -0.049 1
1 407 . 11 1 1 A 31 31 GLN C C 31 178.700 178.606 0.094 1
1 408 . 11 1 1 A 31 31 GLN CA C 31 59.100 58.785 0.315 1
1 409 . 11 1 1 A 31 31 GLN CB C 31 28.700 27.990 0.710 1
1 412 . 11 1 1 A 31 31 GLN N N 31 119.600 118.672 0.928 1
1 414 . 11 1 1 A 32 32 LEU H H 32 7.630 7.635 -0.005 1
1 415 . 11 1 1 A 32 32 LEU HA H 32 3.740 4.084 -0.344 1
1 425 . 11 1 1 A 32 32 LEU C C 32 178.300 178.682 -0.382 1
1 426 . 11 1 1 A 32 32 LEU CA C 32 57.700 57.865 -0.165 1
1 427 . 11 1 1 A 32 32 LEU CB C 32 41.500 41.308 0.192 1
1 431 . 11 1 1 A 32 32 LEU N N 32 120.700 122.143 -1.443 1
1 432 . 11 1 1 A 33 33 CYS H H 33 8.240 8.343 -0.103 1
1 433 . 11 1 1 A 33 33 CYS HA H 33 3.990 4.286 -0.296 1
1 436 . 11 1 1 A 33 33 CYS C C 33 177.000 177.167 -0.167 1
1 437 . 11 1 1 A 33 33 CYS CA C 33 63.100 63.172 -0.072 1
1 438 . 11 1 1 A 33 33 CYS CB C 33 26.100 27.060 -0.960 1
1 439 . 11 1 1 A 33 33 CYS N N 33 117.400 117.440 -0.040 1
1 440 . 11 1 1 A 34 34 ASN H H 34 8.210 7.722 0.488 1
1 441 . 11 1 1 A 34 34 ASN HA H 34 4.370 4.484 -0.114 1
1 446 . 11 1 1 A 34 34 ASN C C 34 178.700 178.290 0.410 1
1 447 . 11 1 1 A 34 34 ASN CA C 34 56.000 56.551 -0.551 1
1 448 . 11 1 1 A 34 34 ASN CB C 34 37.800 37.928 -0.128 1
1 450 . 11 1 1 A 34 34 ASN N N 34 117.300 118.364 -1.064 1
1 452 . 11 1 1 A 35 35 ILE H H 35 7.850 7.584 0.266 1
1 453 . 11 1 1 A 35 35 ILE HA H 35 3.850 3.656 0.194 1
1 463 . 11 1 1 A 35 35 ILE C C 35 178.100 177.986 0.114 1
1 464 . 11 1 1 A 35 35 ILE CA C 35 64.800 65.477 -0.677 1
1 465 . 11 1 1 A 35 35 ILE CB C 35 38.000 37.932 0.068 1
1 469 . 11 1 1 A 35 35 ILE N N 35 120.400 120.605 -0.205 1
1 470 . 11 1 1 A 36 36 GLU H H 36 7.680 8.233 -0.553 1
1 471 . 11 1 1 A 36 36 GLU HA H 36 4.120 4.018 0.102 1
1 476 . 11 1 1 A 36 36 GLU C C 36 176.300 177.708 -1.408 1
1 477 . 11 1 1 A 36 36 GLU CA C 36 58.600 58.704 -0.104 1
1 478 . 11 1 1 A 36 36 GLU CB C 36 30.000 29.243 0.757 1
1 480 . 11 1 1 A 36 36 GLU N N 36 116.500 120.598 -4.098 1
1 481 . 11 1 1 A 37 37 GLN H H 37 7.630 7.795 -0.165 1
1 482 . 11 1 1 A 37 37 GLN HA H 37 4.540 4.375 0.165 1
1 489 . 11 1 1 A 37 37 GLN C C 37 176.000 176.416 -0.416 1
1 490 . 11 1 1 A 37 37 GLN CA C 37 54.900 56.172 -1.272 1
1 491 . 11 1 1 A 37 37 GLN CB C 37 29.600 28.989 0.611 1
1 494 . 11 1 1 A 37 37 GLN N N 37 115.000 118.465 -3.465 1
1 496 . 11 1 1 A 38 38 SER H H 38 7.380 7.543 -0.163 1
1 497 . 11 1 1 A 38 38 SER HA H 38 4.410 4.464 -0.054 1
1 500 . 11 1 1 A 38 38 SER C C 38 175.500 174.559 0.941 1
1 501 . 11 1 1 A 38 38 SER CA C 38 59.200 58.907 0.293 1
1 502 . 11 1 1 A 38 38 SER CB C 38 64.100 63.206 0.894 1
1 503 . 11 1 1 A 38 38 SER N N 38 115.200 115.943 -0.743 1
1 504 . 11 1 1 A 39 39 GLU H H 39 9.040 7.979 1.061 1
1 505 . 11 1 1 A 39 39 GLU HA H 39 4.450 4.202 0.248 1
1 510 . 11 1 1 A 39 39 GLU C C 39 176.300 175.926 0.374 1
1 511 . 11 1 1 A 39 39 GLU CA C 39 57.100 58.823 -1.723 1
1 512 . 11 1 1 A 39 39 GLU CB C 39 30.300 28.293 2.007 1
1 514 . 11 1 1 A 39 39 GLU N N 39 125.400 118.067 7.333 1
1 515 . 11 1 1 A 40 40 THR H H 40 7.920 8.078 -0.158 1
1 516 . 11 1 1 A 40 40 THR HA H 40 4.590 4.763 -0.173 1
1 521 . 11 1 1 A 40 40 THR C C 40 173.500 174.311 -0.811 1
1 522 . 11 1 1 A 40 40 THR CA C 40 60.500 60.963 -0.463 1
1 523 . 11 1 1 A 40 40 THR CB C 40 71.100 69.891 1.209 1
1 525 . 11 1 1 A 40 40 THR N N 40 112.800 114.231 -1.431 1
1 526 . 11 1 1 A 41 41 ALA H H 41 8.780 8.563 0.217 1
1 527 . 11 1 1 A 41 41 ALA HA H 41 4.870 4.510 0.360 1
1 531 . 11 1 1 A 41 41 ALA CA C 41 49.700 50.909 -1.209 1
1 532 . 11 1 1 A 41 41 ALA CB C 41 19.300 17.849 1.451 1
1 533 . 11 1 1 A 41 41 ALA N N 41 127.000 130.093 -3.093 1
1 534 . 11 1 1 A 42 42 PRO HA H 42 4.660 4.594 0.066 1
1 541 . 11 1 1 A 42 42 PRO C C 42 178.300 177.791 0.509 1
1 542 . 11 1 1 A 42 42 PRO CA C 42 62.500 62.748 -0.248 1
1 543 . 11 1 1 A 42 42 PRO CB C 42 32.600 32.634 -0.034 1
1 546 . 11 1 1 A 43 43 VAL H H 43 8.840 8.662 0.178 1
1 547 . 11 1 1 A 43 43 VAL HA H 43 3.660 3.755 -0.095 1
1 555 . 11 1 1 A 43 43 VAL CA C 43 66.800 65.214 1.586 1
1 556 . 11 1 1 A 43 43 VAL CB C 43 31.100 31.447 -0.347 1
1 559 . 11 1 1 A 43 43 VAL N N 43 123.000 122.775 0.225 1
1 560 . 11 1 1 A 44 44 VAL HA H 44 4.030 3.616 0.414 1
1 568 . 11 1 1 A 44 44 VAL C C 44 176.700 178.604 -1.904 1
1 569 . 11 1 1 A 44 44 VAL CA C 44 65.900 66.988 -1.088 1
1 570 . 11 1 1 A 44 44 VAL CB C 44 30.900 31.569 -0.669 1
1 573 . 11 1 1 A 45 45 VAL H H 45 7.500 7.968 -0.468 1
1 574 . 11 1 1 A 45 45 VAL HA H 45 3.760 3.585 0.175 1
1 582 . 11 1 1 A 45 45 VAL C C 45 177.500 177.653 -0.153 1
1 583 . 11 1 1 A 45 45 VAL CA C 45 66.700 66.743 -0.043 1
1 584 . 11 1 1 A 45 45 VAL CB C 45 31.000 31.449 -0.449 1
1 587 . 11 1 1 A 45 45 VAL N N 45 120.100 120.290 -0.190 1
1 588 . 11 1 1 A 46 46 LYS H H 46 7.610 7.484 0.126 1
1 589 . 11 1 1 A 46 46 LYS HA H 46 4.140 4.051 0.089 1
1 598 . 11 1 1 A 46 46 LYS C C 46 179.500 178.753 0.747 1
1 599 . 11 1 1 A 46 46 LYS CA C 46 59.900 58.949 0.951 1
1 600 . 11 1 1 A 46 46 LYS CB C 46 31.500 32.077 -0.577 1
1 604 . 11 1 1 A 46 46 LYS N N 46 120.700 118.685 2.015 1
1 605 . 11 1 1 A 47 47 TYR H H 47 8.550 8.361 0.189 1
1 606 . 11 1 1 A 47 47 TYR HA H 47 5.000 4.160 0.840 1
1 613 . 11 1 1 A 47 47 TYR C C 47 177.300 177.211 0.089 1
1 614 . 11 1 1 A 47 47 TYR CA C 47 57.300 61.450 -4.150 1
1 615 . 11 1 1 A 47 47 TYR CB C 47 37.700 38.645 -0.945 1
1 620 . 11 1 1 A 47 47 TYR N N 47 122.700 120.759 1.941 1
1 621 . 11 1 1 A 48 48 ILE H H 48 8.250 8.104 0.146 1
1 622 . 11 1 1 A 48 48 ILE HA H 48 3.160 3.584 -0.424 1
1 632 . 11 1 1 A 48 48 ILE C C 48 177.100 177.963 -0.863 1
1 633 . 11 1 1 A 48 48 ILE CA C 48 67.000 65.557 1.443 1
1 634 . 11 1 1 A 48 48 ILE CB C 48 37.800 38.445 -0.645 1
1 638 . 11 1 1 A 48 48 ILE N N 48 121.200 120.714 0.486 1
1 639 . 11 1 1 A 49 49 ALA H H 49 8.310 8.113 0.197 1
1 640 . 11 1 1 A 49 49 ALA HA H 49 3.940 4.038 -0.098 1
1 644 . 11 1 1 A 49 49 ALA C C 49 179.300 179.579 -0.279 1
1 645 . 11 1 1 A 49 49 ALA CA C 49 55.500 54.918 0.582 1
1 646 . 11 1 1 A 49 49 ALA CB C 49 18.200 18.047 0.153 1
1 647 . 11 1 1 A 49 49 ALA N N 49 120.300 121.615 -1.315 1
1 648 . 11 1 1 A 50 50 PHE H H 50 8.630 7.838 0.792 1
1 649 . 11 1 1 A 50 50 PHE HA H 50 4.200 4.142 0.058 1
1 656 . 11 1 1 A 50 50 PHE C C 50 179.000 176.596 2.404 1
1 657 . 11 1 1 A 50 50 PHE CA C 50 61.300 61.362 -0.062 1
1 658 . 11 1 1 A 50 50 PHE CB C 50 39.200 39.120 0.080 1
1 663 . 11 1 1 A 50 50 PHE N N 50 121.300 120.452 0.848 1
1 664 . 11 1 1 A 51 51 LEU H H 51 8.920 7.992 0.928 1
1 665 . 11 1 1 A 51 51 LEU HA H 51 3.630 3.824 -0.194 1
1 675 . 11 1 1 A 51 51 LEU C C 51 180.000 178.769 1.231 1
1 676 . 11 1 1 A 51 51 LEU CA C 51 58.100 57.515 0.585 1
1 677 . 11 1 1 A 51 51 LEU CB C 51 39.800 41.145 -1.345 1
1 681 . 11 1 1 A 51 51 LEU N N 51 121.900 119.057 2.843 1
1 682 . 11 1 1 A 52 52 ARG H H 52 8.410 8.137 0.273 1
1 683 . 11 1 1 A 52 52 ARG HA H 52 4.420 3.802 0.618 1
1 691 . 11 1 1 A 52 52 ARG C C 52 179.800 178.629 1.171 1
1 692 . 11 1 1 A 52 52 ARG CA C 52 57.800 59.518 -1.718 1
1 693 . 11 1 1 A 52 52 ARG CB C 52 28.200 30.018 -1.818 1
1 695 . 11 1 1 A 52 52 ARG N N 52 120.500 120.253 0.247 1
1 697 . 11 1 1 A 53 53 SER H H 53 8.480 8.233 0.247 1
1 698 . 11 1 1 A 53 53 SER HA H 53 4.300 3.971 0.329 1
1 701 . 11 1 1 A 53 53 SER C C 53 174.600 175.835 -1.235 1
1 702 . 11 1 1 A 53 53 SER CA C 53 61.500 62.132 -0.632 1
1 703 . 11 1 1 A 53 53 SER CB C 53 62.300 62.678 -0.378 1
1 704 . 11 1 1 A 53 53 SER N N 53 119.500 116.994 2.506 1
1 705 . 11 1 1 A 54 54 LYS H H 54 7.080 7.321 -0.241 1
1 706 . 11 1 1 A 54 54 LYS HA H 54 4.350 4.171 0.179 1
1 715 . 11 1 1 A 54 54 LYS C C 54 176.500 176.810 -0.310 1
1 716 . 11 1 1 A 54 54 LYS CA C 54 53.700 55.780 -2.080 1
1 717 . 11 1 1 A 54 54 LYS CB C 54 31.800 32.593 -0.793 1
1 721 . 11 1 1 A 54 54 LYS N N 54 119.200 118.382 0.818 1
1 722 . 11 1 1 A 55 55 GLY H H 55 8.040 8.068 -0.028 1
1 723 . 11 1 1 A 55 55 GLY HA2 H 55 3.540 3.884 -0.344 1
1 724 . 11 1 1 A 55 55 GLY HA3 H 55 4.300 3.889 0.411 1
1 725 . 11 1 1 A 55 55 GLY C C 55 174.500 174.861 -0.361 1
1 726 . 11 1 1 A 55 55 GLY CA C 55 44.700 45.884 -1.184 1
1 727 . 11 1 1 A 55 55 GLY N N 55 106.600 108.080 -1.480 1
1 728 . 11 1 1 A 56 56 VAL H H 56 7.580 7.561 0.019 1
1 729 . 11 1 1 A 56 56 VAL HA H 56 3.630 3.849 -0.219 1
1 737 . 11 1 1 A 56 56 VAL C C 56 174.700 175.678 -0.978 1
1 738 . 11 1 1 A 56 56 VAL CA C 56 64.000 62.472 1.528 1
1 739 . 11 1 1 A 56 56 VAL CB C 56 31.600 32.187 -0.587 1
1 742 . 11 1 1 A 56 56 VAL N N 56 122.000 122.027 -0.027 1
1 743 . 11 1 1 A 57 57 ASP H H 57 8.440 9.023 -0.583 1
1 744 . 11 1 1 A 57 57 ASP HA H 57 4.500 4.643 -0.143 1
1 747 . 11 1 1 A 57 57 ASP C C 57 176.900 176.234 0.666 1
1 748 . 11 1 1 A 57 57 ASP CA C 57 52.600 54.021 -1.421 1
1 749 . 11 1 1 A 57 57 ASP CB C 57 39.900 39.587 0.313 1
1 750 . 11 1 1 A 57 57 ASP N N 57 124.100 127.318 -3.218 1
1 751 . 11 1 1 A 58 58 LEU H H 58 9.720 8.397 1.323 1
1 752 . 11 1 1 A 58 58 LEU HA H 58 4.020 4.063 -0.043 1
1 762 . 11 1 1 A 58 58 LEU C C 58 179.400 178.410 0.990 1
1 763 . 11 1 1 A 58 58 LEU CA C 58 56.300 57.655 -1.355 1
1 764 . 11 1 1 A 58 58 LEU CB C 58 43.300 41.579 1.721 1
1 768 . 11 1 1 A 58 58 LEU N N 58 127.800 122.419 5.381 1
1 769 . 11 1 1 A 59 59 ASN H H 59 7.740 8.491 -0.751 1
1 770 . 11 1 1 A 59 59 ASN HA H 59 4.340 4.354 -0.014 1
1 775 . 11 1 1 A 59 59 ASN C C 59 176.300 177.902 -1.602 1
1 776 . 11 1 1 A 59 59 ASN CA C 59 56.300 56.370 -0.070 1
1 777 . 11 1 1 A 59 59 ASN CB C 59 36.400 37.851 -1.451 1
1 779 . 11 1 1 A 59 59 ASN N N 59 119.500 116.660 2.840 1
1 781 . 11 1 1 A 60 60 ALA H H 60 7.220 7.633 -0.413 1
1 782 . 11 1 1 A 60 60 ALA HA H 60 4.030 4.169 -0.139 1
1 786 . 11 1 1 A 60 60 ALA C C 60 180.100 180.203 -0.103 1
1 787 . 11 1 1 A 60 60 ALA CA C 60 54.300 55.102 -0.802 1
1 788 . 11 1 1 A 60 60 ALA CB C 60 18.200 18.267 -0.067 1
1 789 . 11 1 1 A 60 60 ALA N N 60 121.400 122.696 -1.296 1
1 790 . 11 1 1 A 61 61 LEU H H 61 7.320 7.812 -0.492 1
1 791 . 11 1 1 A 61 61 LEU HA H 61 3.840 4.153 -0.313 1
1 801 . 11 1 1 A 61 61 LEU C C 61 177.200 178.365 -1.165 1
1 802 . 11 1 1 A 61 61 LEU CA C 61 58.500 58.260 0.240 1
1 803 . 11 1 1 A 61 61 LEU CB C 61 42.600 41.986 0.614 1
1 807 . 11 1 1 A 61 61 LEU N N 61 118.600 120.649 -2.049 1
1 808 . 11 1 1 A 62 62 PHE H H 62 8.360 8.603 -0.243 1
1 809 . 11 1 1 A 62 62 PHE HA H 62 3.930 4.107 -0.177 1
1 817 . 11 1 1 A 62 62 PHE C C 62 178.200 177.650 0.550 1
1 818 . 11 1 1 A 62 62 PHE CA C 62 62.800 60.503 2.297 1
1 819 . 11 1 1 A 62 62 PHE CB C 62 38.500 38.991 -0.491 1
1 825 . 11 1 1 A 62 62 PHE N N 62 114.400 117.741 -3.341 1
1 826 . 11 1 1 A 63 63 ASP H H 63 8.680 8.792 -0.112 1
1 827 . 11 1 1 A 63 63 ASP HA H 63 4.530 4.370 0.160 1
1 830 . 11 1 1 A 63 63 ASP C C 63 178.600 178.826 -0.226 1
1 831 . 11 1 1 A 63 63 ASP CA C 63 57.500 57.721 -0.221 1
1 832 . 11 1 1 A 63 63 ASP CB C 63 39.600 41.601 -2.001 1
1 833 . 11 1 1 A 63 63 ASP N N 63 120.400 119.899 0.501 1
1 834 . 11 1 1 A 64 64 ARG H H 64 7.540 7.656 -0.116 1
1 835 . 11 1 1 A 64 64 ARG HA H 64 4.290 4.074 0.216 1
1 843 . 11 1 1 A 64 64 ARG C C 64 177.600 178.546 -0.946 1
1 844 . 11 1 1 A 64 64 ARG CA C 64 58.300 59.122 -0.822 1
1 845 . 11 1 1 A 64 64 ARG CB C 64 30.000 30.100 -0.100 1
1 848 . 11 1 1 A 64 64 ARG N N 64 116.800 118.471 -1.671 1
1 850 . 11 1 1 A 65 65 ILE H H 65 7.260 7.490 -0.230 1
1 851 . 11 1 1 A 65 65 ILE HA H 65 4.130 3.787 0.343 1
1 861 . 11 1 1 A 65 65 ILE C C 65 177.000 176.585 0.415 1
1 862 . 11 1 1 A 65 65 ILE CA C 65 62.600 65.129 -2.529 1
1 863 . 11 1 1 A 65 65 ILE CB C 65 38.700 38.024 0.676 1
1 867 . 11 1 1 A 65 65 ILE N N 65 117.000 118.410 -1.410 1
1 868 . 11 1 1 A 66 66 ILE H H 66 7.980 8.250 -0.270 1
1 869 . 11 1 1 A 66 66 ILE HA H 66 4.000 4.260 -0.260 1
1 879 . 11 1 1 A 66 66 ILE C C 66 176.400 175.199 1.201 1
1 880 . 11 1 1 A 66 66 ILE CA C 66 63.100 60.760 2.340 1
1 881 . 11 1 1 A 66 66 ILE CB C 66 38.800 37.626 1.174 1
1 885 . 11 1 1 A 66 66 ILE N N 66 120.700 120.512 0.188 1
1 886 . 11 1 1 A 67 67 VAL H H 67 8.130 9.071 -0.941 1
1 887 . 11 1 1 A 67 67 VAL HA H 67 3.980 4.959 -0.979 1
1 895 . 11 1 1 A 67 67 VAL C C 67 177.300 175.603 1.697 1
1 896 . 11 1 1 A 67 67 VAL CA C 67 63.900 60.174 3.726 1
1 897 . 11 1 1 A 67 67 VAL CB C 67 32.500 34.183 -1.683 1
1 900 . 11 1 1 A 67 67 VAL N N 67 121.600 123.197 -1.597 1
1 901 . 11 1 1 A 68 68 ASN H H 68 8.170 8.574 -0.404 1
1 902 . 11 1 1 A 68 68 ASN HA H 68 4.680 5.056 -0.376 1
1 907 . 11 1 1 A 68 68 ASN CA C 68 54.200 52.418 1.782 1
1 908 . 11 1 1 A 68 68 ASN CB C 68 39.100 40.178 -1.078 1
1 910 . 11 1 1 A 68 68 ASN N N 68 120.500 124.164 -3.664 1
1 912 . 11 1 1 A 69 69 LYS H H 69 8.230 8.360 -0.130 1
1 913 . 11 1 1 A 69 69 LYS HA H 69 4.260 4.467 -0.207 1
1 922 . 11 1 1 A 69 69 LYS C C 69 176.900 175.829 1.071 1
1 923 . 11 1 1 A 69 69 LYS CA C 69 57.000 56.176 0.824 1
1 924 . 11 1 1 A 69 69 LYS CB C 69 32.800 32.849 -0.049 1
1 928 . 11 1 1 A 69 69 LYS N N 69 121.300 121.687 -0.387 1
1 929 . 11 1 1 A 70 70 LEU H H 70 8.150 8.219 -0.069 1
1 930 . 11 1 1 A 70 70 LEU HA H 70 4.300 5.037 -0.737 1
1 940 . 11 1 1 A 70 70 LEU C C 70 178.900 175.824 3.076 1
1 941 . 11 1 1 A 70 70 LEU CA C 70 55.400 53.533 1.867 1
1 942 . 11 1 1 A 70 70 LEU CB C 70 42.100 45.594 -3.494 1
1 946 . 11 1 1 A 70 70 LEU N N 70 121.900 124.239 -2.339 1
1 947 . 11 1 1 A 71 71 GLU H H 71 8.210 8.943 -0.733 1
1 948 . 11 1 1 A 71 71 GLU HA H 71 4.180 4.701 -0.521 1
1 953 . 11 1 1 A 71 71 GLU C C 71 176.300 175.805 0.495 1
1 954 . 11 1 1 A 71 71 GLU CA C 71 56.600 56.608 -0.008 1
1 955 . 11 1 1 A 71 71 GLU CB C 71 30.200 30.904 -0.704 1
1 957 . 11 1 1 A 71 71 GLU N N 71 120.900 120.180 0.720 1
1 958 . 11 1 1 A 72 72 HIS H H 72 8.380 7.925 0.455 1
1 959 . 11 1 1 A 72 72 HIS HA H 72 4.600 4.893 -0.293 1
1 962 . 11 1 1 A 72 72 HIS C C 72 174.600 174.395 0.205 1
1 963 . 11 1 1 A 72 72 HIS CA C 72 55.600 54.808 0.792 1
1 964 . 11 1 1 A 72 72 HIS CB C 72 29.600 31.803 -2.203 1
1 965 . 11 1 1 A 72 72 HIS N N 72 119.300 114.762 4.538 1
1 966 . 11 1 1 A 73 73 HIS H H 73 8.410 8.639 -0.229 1
1 967 . 11 1 1 A 73 73 HIS HA H 73 4.610 4.027 0.583 1
1 970 . 11 1 1 A 73 73 HIS C C 73 173.700 174.441 -0.741 1
1 971 . 11 1 1 A 73 73 HIS CA C 73 55.700 56.499 -0.799 1
1 972 . 11 1 1 A 73 73 HIS CB C 73 29.600 27.725 1.875 1
1 973 . 11 1 1 A 73 73 HIS N N 73 119.410 118.690 0.720 1
1 974 . 11 1 1 A 74 74 HIS H H 74 8.310 8.373 -0.063 1
1 975 . 11 1 1 A 74 74 HIS HA H 74 4.630 4.702 -0.072 1
1 978 . 11 1 1 A 74 74 HIS CA C 74 57.100 56.088 1.012 1
1 979 . 11 1 1 A 74 74 HIS CB C 74 29.800 30.967 -1.167 1
1 14 . 12 1 1 A 2 2 GLU H H 2 9.070 8.871 0.199 1
1 15 . 12 1 1 A 2 2 GLU HA H 2 4.520 4.446 0.074 1
1 20 . 12 1 1 A 2 2 GLU C C 2 176.300 176.640 -0.340 1
1 21 . 12 1 1 A 2 2 GLU CA C 2 55.800 56.477 -0.677 1
1 22 . 12 1 1 A 2 2 GLU CB C 2 31.000 30.509 0.491 1
1 24 . 12 1 1 A 2 2 GLU N N 2 123.100 125.522 -2.422 1
1 25 . 12 1 1 A 3 3 LEU H H 3 8.750 8.641 0.109 1
1 26 . 12 1 1 A 3 3 LEU HA H 3 3.750 4.121 -0.371 1
1 36 . 12 1 1 A 3 3 LEU C C 3 177.400 177.857 -0.457 1
1 37 . 12 1 1 A 3 3 LEU CA C 3 58.300 58.229 0.071 1
1 38 . 12 1 1 A 3 3 LEU CB C 3 41.500 41.235 0.265 1
1 42 . 12 1 1 A 3 3 LEU N N 3 122.600 123.535 -0.935 1
1 43 . 12 1 1 A 4 4 SER H H 4 8.350 8.082 0.268 1
1 44 . 12 1 1 A 4 4 SER HA H 4 3.890 4.066 -0.176 1
1 47 . 12 1 1 A 4 4 SER C C 4 175.100 177.280 -2.180 1
1 48 . 12 1 1 A 4 4 SER CA C 4 61.500 61.614 -0.114 1
1 49 . 12 1 1 A 4 4 SER CB C 4 62.000 62.808 -0.808 1
1 50 . 12 1 1 A 4 4 SER N N 4 112.900 114.582 -1.682 1
1 51 . 12 1 1 A 5 5 ASN H H 5 7.180 8.330 -1.150 1
1 52 . 12 1 1 A 5 5 ASN HA H 5 4.470 4.479 -0.009 1
1 57 . 12 1 1 A 5 5 ASN C C 5 177.400 177.726 -0.326 1
1 58 . 12 1 1 A 5 5 ASN CA C 5 56.000 56.650 -0.650 1
1 59 . 12 1 1 A 5 5 ASN CB C 5 39.400 38.752 0.648 1
1 61 . 12 1 1 A 5 5 ASN N N 5 116.600 119.126 -2.526 1
1 63 . 12 1 1 A 6 6 GLU H H 6 7.950 8.071 -0.121 1
1 64 . 12 1 1 A 6 6 GLU HA H 6 4.070 4.119 -0.049 1
1 69 . 12 1 1 A 6 6 GLU C C 6 178.500 179.387 -0.887 1
1 70 . 12 1 1 A 6 6 GLU CA C 6 58.100 59.044 -0.944 1
1 71 . 12 1 1 A 6 6 GLU CB C 6 29.300 29.576 -0.276 1
1 73 . 12 1 1 A 6 6 GLU N N 6 117.600 119.451 -1.851 1
1 74 . 12 1 1 A 7 7 LEU H H 7 8.140 8.997 -0.857 1
1 75 . 12 1 1 A 7 7 LEU HA H 7 3.640 3.976 -0.336 1
1 85 . 12 1 1 A 7 7 LEU C C 7 177.700 179.305 -1.605 1
1 86 . 12 1 1 A 7 7 LEU CA C 7 58.300 58.089 0.211 1
1 87 . 12 1 1 A 7 7 LEU CB C 7 40.600 41.529 -0.929 1
1 91 . 12 1 1 A 7 7 LEU N N 7 118.500 120.241 -1.741 1
1 92 . 12 1 1 A 8 8 LYS H H 8 7.090 8.065 -0.975 1
1 93 . 12 1 1 A 8 8 LYS HA H 8 4.080 3.997 0.083 1
1 102 . 12 1 1 A 8 8 LYS C C 8 178.300 178.766 -0.466 1
1 103 . 12 1 1 A 8 8 LYS CA C 8 59.700 59.746 -0.046 1
1 104 . 12 1 1 A 8 8 LYS CB C 8 32.300 32.214 0.086 1
1 108 . 12 1 1 A 8 8 LYS N N 8 118.200 120.521 -2.321 1
1 109 . 12 1 1 A 9 9 VAL H H 9 7.940 7.784 0.156 1
1 110 . 12 1 1 A 9 9 VAL HA H 9 3.440 3.534 -0.094 1
1 118 . 12 1 1 A 9 9 VAL C C 9 179.500 177.777 1.723 1
1 119 . 12 1 1 A 9 9 VAL CA C 9 66.700 66.486 0.214 1
1 120 . 12 1 1 A 9 9 VAL CB C 9 31.600 31.404 0.196 1
1 123 . 12 1 1 A 9 9 VAL N N 9 117.600 119.317 -1.717 1
1 124 . 12 1 1 A 10 10 GLU H H 10 7.830 8.158 -0.328 1
1 125 . 12 1 1 A 10 10 GLU HA H 10 4.130 4.009 0.121 1
1 130 . 12 1 1 A 10 10 GLU C C 10 178.700 179.425 -0.725 1
1 131 . 12 1 1 A 10 10 GLU CA C 10 58.300 59.447 -1.147 1
1 132 . 12 1 1 A 10 10 GLU CB C 10 28.500 29.000 -0.500 1
1 134 . 12 1 1 A 10 10 GLU N N 10 118.300 118.528 -0.228 1
1 135 . 12 1 1 A 11 11 ARG H H 11 8.330 7.721 0.609 1
1 136 . 12 1 1 A 11 11 ARG HA H 11 3.770 4.178 -0.408 1
1 144 . 12 1 1 A 11 11 ARG C C 11 174.600 178.903 -4.303 1
1 145 . 12 1 1 A 11 11 ARG CA C 11 61.300 58.497 2.803 1
1 146 . 12 1 1 A 11 11 ARG CB C 11 28.500 29.919 -1.419 1
1 149 . 12 1 1 A 11 11 ARG N N 11 121.400 120.673 0.727 1
1 151 . 12 1 1 A 12 12 ILE H H 12 8.540 8.324 0.216 1
1 152 . 12 1 1 A 12 12 ILE HA H 12 3.780 3.655 0.125 1
1 162 . 12 1 1 A 12 12 ILE C C 12 181.400 178.075 3.325 1
1 163 . 12 1 1 A 12 12 ILE CA C 12 64.800 65.204 -0.404 1
1 164 . 12 1 1 A 12 12 ILE CB C 12 37.700 37.713 -0.013 1
1 168 . 12 1 1 A 12 12 ILE N N 12 118.700 119.888 -1.188 1
1 169 . 12 1 1 A 13 13 ARG H H 13 8.470 8.177 0.293 1
1 170 . 12 1 1 A 13 13 ARG HA H 13 4.060 4.068 -0.008 1
1 178 . 12 1 1 A 13 13 ARG C C 13 178.600 177.223 1.377 1
1 179 . 12 1 1 A 13 13 ARG CA C 13 59.600 58.649 0.951 1
1 180 . 12 1 1 A 13 13 ARG CB C 13 30.000 29.969 0.031 1
1 183 . 12 1 1 A 13 13 ARG N N 13 124.600 120.669 3.931 1
1 185 . 12 1 1 A 14 14 LEU H H 14 7.430 7.562 -0.132 1
1 186 . 12 1 1 A 14 14 LEU HA H 14 4.240 4.290 -0.050 1
1 196 . 12 1 1 A 14 14 LEU C C 14 176.000 176.163 -0.163 1
1 197 . 12 1 1 A 14 14 LEU CA C 14 55.300 54.867 0.433 1
1 198 . 12 1 1 A 14 14 LEU CB C 14 43.000 41.989 1.011 1
1 202 . 12 1 1 A 14 14 LEU N N 14 118.500 118.828 -0.328 1
1 203 . 12 1 1 A 15 15 SER H H 15 8.260 8.017 0.243 1
1 204 . 12 1 1 A 15 15 SER HA H 15 4.030 4.124 -0.094 1
1 207 . 12 1 1 A 15 15 SER C C 15 174.000 173.192 0.808 1
1 208 . 12 1 1 A 15 15 SER CA C 15 58.700 59.019 -0.319 1
1 209 . 12 1 1 A 15 15 SER CB C 15 61.300 61.448 -0.148 1
1 210 . 12 1 1 A 15 15 SER N N 15 112.500 115.202 -2.702 1
1 211 . 12 1 1 A 16 16 LEU H H 16 7.310 7.486 -0.176 1
1 212 . 12 1 1 A 16 16 LEU HA H 16 4.880 4.698 0.182 1
1 222 . 12 1 1 A 16 16 LEU C C 16 177.900 177.057 0.843 1
1 223 . 12 1 1 A 16 16 LEU CA C 16 52.600 53.414 -0.814 1
1 224 . 12 1 1 A 16 16 LEU CB C 16 43.500 43.266 0.234 1
1 228 . 12 1 1 A 16 16 LEU N N 16 117.800 120.927 -3.127 1
1 229 . 12 1 1 A 17 17 THR H H 17 8.640 8.424 0.216 1
1 230 . 12 1 1 A 17 17 THR HA H 17 4.250 4.693 -0.443 1
1 235 . 12 1 1 A 17 17 THR C C 17 174.900 175.771 -0.871 1
1 236 . 12 1 1 A 17 17 THR CA C 17 60.500 60.649 -0.149 1
1 237 . 12 1 1 A 17 17 THR CB C 17 70.500 71.282 -0.782 1
1 239 . 12 1 1 A 17 17 THR N N 17 115.200 116.258 -1.058 1
1 240 . 12 1 1 A 18 18 ALA H H 18 8.820 9.059 -0.239 1
1 241 . 12 1 1 A 18 18 ALA HA H 18 3.680 4.012 -0.332 1
1 245 . 12 1 1 A 18 18 ALA C C 18 178.900 179.832 -0.932 1
1 246 . 12 1 1 A 18 18 ALA CA C 18 55.200 55.207 -0.007 1
1 247 . 12 1 1 A 18 18 ALA CB C 18 17.800 17.990 -0.190 1
1 248 . 12 1 1 A 18 18 ALA N N 18 125.600 124.758 0.842 1
1 249 . 12 1 1 A 19 19 LYS H H 19 8.280 8.084 0.196 1
1 250 . 12 1 1 A 19 19 LYS HA H 19 3.740 4.027 -0.287 1
1 259 . 12 1 1 A 19 19 LYS C C 19 177.900 179.299 -1.399 1
1 260 . 12 1 1 A 19 19 LYS CA C 19 59.800 59.238 0.562 1
1 261 . 12 1 1 A 19 19 LYS CB C 19 33.300 32.147 1.153 1
1 265 . 12 1 1 A 19 19 LYS N N 19 115.800 118.070 -2.270 1
1 266 . 12 1 1 A 20 20 SER H H 20 7.860 8.150 -0.290 1
1 267 . 12 1 1 A 20 20 SER HA H 20 4.210 4.164 0.046 1
1 271 . 12 1 1 A 20 20 SER C C 20 177.200 177.445 -0.245 1
1 272 . 12 1 1 A 20 20 SER CA C 20 61.900 61.312 0.588 1
1 273 . 12 1 1 A 20 20 SER CB C 20 63.000 62.349 0.651 1
1 274 . 12 1 1 A 20 20 SER N N 20 114.600 114.484 0.116 1
1 275 . 12 1 1 A 21 21 VAL H H 21 7.830 7.764 0.066 1
1 276 . 12 1 1 A 21 21 VAL HA H 21 3.280 3.557 -0.277 1
1 284 . 12 1 1 A 21 21 VAL C C 21 177.500 178.224 -0.724 1
1 285 . 12 1 1 A 21 21 VAL CA C 21 66.800 66.527 0.273 1
1 286 . 12 1 1 A 21 21 VAL CB C 21 31.400 31.573 -0.173 1
1 289 . 12 1 1 A 21 21 VAL N N 21 122.600 122.148 0.452 1
1 290 . 12 1 1 A 22 22 ALA H H 22 8.230 7.971 0.259 1
1 291 . 12 1 1 A 22 22 ALA HA H 22 3.510 3.924 -0.414 1
1 295 . 12 1 1 A 22 22 ALA C C 22 179.500 178.931 0.569 1
1 296 . 12 1 1 A 22 22 ALA CA C 22 55.500 55.448 0.052 1
1 297 . 12 1 1 A 22 22 ALA CB C 22 16.900 18.161 -1.261 1
1 298 . 12 1 1 A 22 22 ALA N N 22 121.200 121.958 -0.758 1
1 299 . 12 1 1 A 23 23 GLU H H 23 7.900 8.392 -0.492 1
1 300 . 12 1 1 A 23 23 GLU HA H 23 3.990 3.996 -0.006 1
1 305 . 12 1 1 A 23 23 GLU C C 23 180.000 178.911 1.089 1
1 306 . 12 1 1 A 23 23 GLU CA C 23 59.300 59.706 -0.406 1
1 307 . 12 1 1 A 23 23 GLU CB C 23 29.300 28.975 0.325 1
1 309 . 12 1 1 A 23 23 GLU N N 23 115.300 118.451 -3.151 1
1 310 . 12 1 1 A 24 24 GLU H H 24 7.950 7.953 -0.003 1
1 311 . 12 1 1 A 24 24 GLU HA H 24 4.060 4.093 -0.033 1
1 316 . 12 1 1 A 24 24 GLU C C 24 179.100 178.810 0.290 1
1 317 . 12 1 1 A 24 24 GLU CA C 24 59.700 59.150 0.550 1
1 318 . 12 1 1 A 24 24 GLU CB C 24 29.500 29.018 0.482 1
1 320 . 12 1 1 A 24 24 GLU N N 24 120.100 119.506 0.594 1
1 321 . 12 1 1 A 25 25 MET H H 25 8.150 8.470 -0.320 1
1 322 . 12 1 1 A 25 25 MET HA H 25 4.110 4.326 -0.216 1
1 330 . 12 1 1 A 25 25 MET C C 25 176.600 176.897 -0.297 1
1 331 . 12 1 1 A 25 25 MET CA C 25 57.100 57.053 0.047 1
1 332 . 12 1 1 A 25 25 MET CB C 25 34.900 32.661 2.239 1
1 335 . 12 1 1 A 25 25 MET N N 25 115.500 117.476 -1.976 1
1 336 . 12 1 1 A 26 26 GLY H H 26 7.940 9.299 -1.359 1
1 337 . 12 1 1 A 26 26 GLY HA2 H 26 3.860 3.938 -0.078 1
1 338 . 12 1 1 A 26 26 GLY HA3 H 26 3.960 3.939 0.021 1
1 339 . 12 1 1 A 26 26 GLY C C 26 175.100 173.931 1.169 1
1 340 . 12 1 1 A 26 26 GLY CA C 26 46.600 46.322 0.278 1
1 341 . 12 1 1 A 26 26 GLY N N 26 109.000 106.953 2.047 1
1 342 . 12 1 1 A 27 27 ILE H H 27 7.880 7.293 0.587 1
1 343 . 12 1 1 A 27 27 ILE HA H 27 4.790 4.793 -0.003 1
1 353 . 12 1 1 A 27 27 ILE C C 27 174.300 174.873 -0.573 1
1 354 . 12 1 1 A 27 27 ILE CA C 27 59.000 58.524 0.476 1
1 355 . 12 1 1 A 27 27 ILE CB C 27 40.900 41.315 -0.415 1
1 359 . 12 1 1 A 27 27 ILE N N 27 112.700 115.824 -3.124 1
1 360 . 12 1 1 A 28 28 SER H H 28 8.570 8.815 -0.245 1
1 361 . 12 1 1 A 28 28 SER HA H 28 4.540 4.511 0.029 1
1 364 . 12 1 1 A 28 28 SER C C 28 175.600 175.598 0.002 1
1 365 . 12 1 1 A 28 28 SER CA C 28 56.800 58.120 -1.320 1
1 366 . 12 1 1 A 28 28 SER CB C 28 65.500 63.942 1.558 1
1 367 . 12 1 1 A 28 28 SER N N 28 115.400 119.203 -3.803 1
1 368 . 12 1 1 A 29 29 ARG H H 29 8.980 9.081 -0.101 1
1 369 . 12 1 1 A 29 29 ARG HA H 29 3.660 3.950 -0.290 1
1 377 . 12 1 1 A 29 29 ARG C C 29 178.700 178.324 0.376 1
1 378 . 12 1 1 A 29 29 ARG CA C 29 59.500 60.176 -0.676 1
1 379 . 12 1 1 A 29 29 ARG CB C 29 29.500 29.858 -0.358 1
1 382 . 12 1 1 A 29 29 ARG N N 29 122.000 124.842 -2.842 1
1 384 . 12 1 1 A 30 30 GLN H H 30 8.580 7.990 0.590 1
1 385 . 12 1 1 A 30 30 GLN HA H 30 3.860 4.078 -0.218 1
1 392 . 12 1 1 A 30 30 GLN C C 30 178.100 178.954 -0.854 1
1 393 . 12 1 1 A 30 30 GLN CA C 30 59.200 58.954 0.246 1
1 394 . 12 1 1 A 30 30 GLN CB C 30 28.100 28.545 -0.445 1
1 397 . 12 1 1 A 30 30 GLN N N 30 118.700 119.053 -0.353 1
1 399 . 12 1 1 A 31 31 GLN H H 31 7.990 7.927 0.063 1
1 400 . 12 1 1 A 31 31 GLN HA H 31 3.980 3.985 -0.005 1
1 407 . 12 1 1 A 31 31 GLN C C 31 178.700 178.545 0.155 1
1 408 . 12 1 1 A 31 31 GLN CA C 31 59.100 58.844 0.256 1
1 409 . 12 1 1 A 31 31 GLN CB C 31 28.700 28.078 0.622 1
1 412 . 12 1 1 A 31 31 GLN N N 31 119.600 119.113 0.487 1
1 414 . 12 1 1 A 32 32 LEU H H 32 7.630 7.733 -0.103 1
1 415 . 12 1 1 A 32 32 LEU HA H 32 3.740 4.091 -0.351 1
1 425 . 12 1 1 A 32 32 LEU C C 32 178.300 178.528 -0.228 1
1 426 . 12 1 1 A 32 32 LEU CA C 32 57.700 57.923 -0.223 1
1 427 . 12 1 1 A 32 32 LEU CB C 32 41.500 41.260 0.240 1
1 431 . 12 1 1 A 32 32 LEU N N 32 120.700 122.146 -1.446 1
1 432 . 12 1 1 A 33 33 CYS H H 33 8.240 8.445 -0.205 1
1 433 . 12 1 1 A 33 33 CYS HA H 33 3.990 4.084 -0.094 1
1 436 . 12 1 1 A 33 33 CYS C C 33 177.000 176.835 0.165 1
1 437 . 12 1 1 A 33 33 CYS CA C 33 63.100 62.457 0.643 1
1 438 . 12 1 1 A 33 33 CYS CB C 33 26.100 27.336 -1.236 1
1 439 . 12 1 1 A 33 33 CYS N N 33 117.400 118.164 -0.764 1
1 440 . 12 1 1 A 34 34 ASN H H 34 8.210 8.044 0.166 1
1 441 . 12 1 1 A 34 34 ASN HA H 34 4.370 4.442 -0.072 1
1 446 . 12 1 1 A 34 34 ASN C C 34 178.700 177.811 0.889 1
1 447 . 12 1 1 A 34 34 ASN CA C 34 56.000 56.866 -0.866 1
1 448 . 12 1 1 A 34 34 ASN CB C 34 37.800 39.254 -1.454 1
1 450 . 12 1 1 A 34 34 ASN N N 34 117.300 118.596 -1.296 1
1 452 . 12 1 1 A 35 35 ILE H H 35 7.850 7.378 0.472 1
1 453 . 12 1 1 A 35 35 ILE HA H 35 3.850 3.528 0.322 1
1 463 . 12 1 1 A 35 35 ILE C C 35 178.100 177.973 0.127 1
1 464 . 12 1 1 A 35 35 ILE CA C 35 64.800 65.472 -0.672 1
1 465 . 12 1 1 A 35 35 ILE CB C 35 38.000 37.836 0.164 1
1 469 . 12 1 1 A 35 35 ILE N N 35 120.400 119.418 0.982 1
1 470 . 12 1 1 A 36 36 GLU H H 36 7.680 8.086 -0.406 1
1 471 . 12 1 1 A 36 36 GLU HA H 36 4.120 4.031 0.089 1
1 476 . 12 1 1 A 36 36 GLU C C 36 176.300 178.313 -2.013 1
1 477 . 12 1 1 A 36 36 GLU CA C 36 58.600 59.211 -0.611 1
1 478 . 12 1 1 A 36 36 GLU CB C 36 30.000 29.346 0.654 1
1 480 . 12 1 1 A 36 36 GLU N N 36 116.500 121.037 -4.537 1
1 481 . 12 1 1 A 37 37 GLN H H 37 7.630 8.222 -0.592 1
1 482 . 12 1 1 A 37 37 GLN HA H 37 4.540 4.329 0.211 1
1 489 . 12 1 1 A 37 37 GLN C C 37 176.000 175.543 0.457 1
1 490 . 12 1 1 A 37 37 GLN CA C 37 54.900 56.276 -1.376 1
1 491 . 12 1 1 A 37 37 GLN CB C 37 29.600 29.009 0.591 1
1 494 . 12 1 1 A 37 37 GLN N N 37 115.000 117.648 -2.648 1
1 496 . 12 1 1 A 38 38 SER H H 38 7.380 7.539 -0.159 1
1 497 . 12 1 1 A 38 38 SER HA H 38 4.410 4.610 -0.200 1
1 500 . 12 1 1 A 38 38 SER C C 38 175.500 174.829 0.671 1
1 501 . 12 1 1 A 38 38 SER CA C 38 59.200 56.981 2.219 1
1 502 . 12 1 1 A 38 38 SER CB C 38 64.100 64.305 -0.205 1
1 503 . 12 1 1 A 38 38 SER N N 38 115.200 116.907 -1.707 1
1 504 . 12 1 1 A 39 39 GLU H H 39 9.040 9.107 -0.067 1
1 505 . 12 1 1 A 39 39 GLU HA H 39 4.450 4.473 -0.023 1
1 510 . 12 1 1 A 39 39 GLU C C 39 176.300 176.009 0.291 1
1 511 . 12 1 1 A 39 39 GLU CA C 39 57.100 57.538 -0.438 1
1 512 . 12 1 1 A 39 39 GLU CB C 39 30.300 30.713 -0.413 1
1 514 . 12 1 1 A 39 39 GLU N N 39 125.400 128.204 -2.804 1
1 515 . 12 1 1 A 40 40 THR H H 40 7.920 7.761 0.159 1
1 516 . 12 1 1 A 40 40 THR HA H 40 4.590 4.952 -0.362 1
1 521 . 12 1 1 A 40 40 THR C C 40 173.500 173.750 -0.250 1
1 522 . 12 1 1 A 40 40 THR CA C 40 60.500 61.189 -0.689 1
1 523 . 12 1 1 A 40 40 THR CB C 40 71.100 71.281 -0.181 1
1 525 . 12 1 1 A 40 40 THR N N 40 112.800 113.149 -0.349 1
1 526 . 12 1 1 A 41 41 ALA H H 41 8.780 8.674 0.106 1
1 527 . 12 1 1 A 41 41 ALA HA H 41 4.870 4.568 0.302 1
1 531 . 12 1 1 A 41 41 ALA CA C 41 49.700 50.767 -1.067 1
1 532 . 12 1 1 A 41 41 ALA CB C 41 19.300 18.127 1.173 1
1 533 . 12 1 1 A 41 41 ALA N N 41 127.000 129.479 -2.479 1
1 534 . 12 1 1 A 42 42 PRO HA H 42 4.660 4.612 0.048 1
1 541 . 12 1 1 A 42 42 PRO C C 42 178.300 177.589 0.711 1
1 542 . 12 1 1 A 42 42 PRO CA C 42 62.500 62.814 -0.314 1
1 543 . 12 1 1 A 42 42 PRO CB C 42 32.600 32.627 -0.027 1
1 546 . 12 1 1 A 43 43 VAL H H 43 8.840 8.892 -0.052 1
1 547 . 12 1 1 A 43 43 VAL HA H 43 3.660 3.928 -0.268 1
1 555 . 12 1 1 A 43 43 VAL CA C 43 66.800 64.590 2.210 1
1 556 . 12 1 1 A 43 43 VAL CB C 43 31.100 31.690 -0.590 1
1 559 . 12 1 1 A 43 43 VAL N N 43 123.000 123.689 -0.689 1
1 560 . 12 1 1 A 44 44 VAL HA H 44 4.030 3.892 0.138 1
1 568 . 12 1 1 A 44 44 VAL C C 44 176.700 178.260 -1.560 1
1 569 . 12 1 1 A 44 44 VAL CA C 44 65.900 65.606 0.294 1
1 570 . 12 1 1 A 44 44 VAL CB C 44 30.900 31.480 -0.580 1
1 573 . 12 1 1 A 45 45 VAL H H 45 7.500 8.223 -0.723 1
1 574 . 12 1 1 A 45 45 VAL HA H 45 3.760 3.626 0.134 1
1 582 . 12 1 1 A 45 45 VAL C C 45 177.500 177.931 -0.431 1
1 583 . 12 1 1 A 45 45 VAL CA C 45 66.700 66.619 0.081 1
1 584 . 12 1 1 A 45 45 VAL CB C 45 31.000 31.505 -0.505 1
1 587 . 12 1 1 A 45 45 VAL N N 45 120.100 121.593 -1.493 1
1 588 . 12 1 1 A 46 46 LYS H H 46 7.610 7.372 0.238 1
1 589 . 12 1 1 A 46 46 LYS HA H 46 4.140 4.053 0.087 1
1 598 . 12 1 1 A 46 46 LYS C C 46 179.500 178.660 0.840 1
1 599 . 12 1 1 A 46 46 LYS CA C 46 59.900 58.974 0.926 1
1 600 . 12 1 1 A 46 46 LYS CB C 46 31.500 32.011 -0.511 1
1 604 . 12 1 1 A 46 46 LYS N N 46 120.700 118.649 2.051 1
1 605 . 12 1 1 A 47 47 TYR H H 47 8.550 8.404 0.146 1
1 606 . 12 1 1 A 47 47 TYR HA H 47 5.000 4.183 0.817 1
1 613 . 12 1 1 A 47 47 TYR C C 47 177.300 177.350 -0.050 1
1 614 . 12 1 1 A 47 47 TYR CA C 47 57.300 61.500 -4.200 1
1 615 . 12 1 1 A 47 47 TYR CB C 47 37.700 38.663 -0.963 1
1 620 . 12 1 1 A 47 47 TYR N N 47 122.700 120.839 1.861 1
1 621 . 12 1 1 A 48 48 ILE H H 48 8.250 7.988 0.262 1
1 622 . 12 1 1 A 48 48 ILE HA H 48 3.160 3.702 -0.542 1
1 632 . 12 1 1 A 48 48 ILE C C 48 177.100 177.973 -0.873 1
1 633 . 12 1 1 A 48 48 ILE CA C 48 67.000 65.709 1.291 1
1 634 . 12 1 1 A 48 48 ILE CB C 48 37.800 38.478 -0.678 1
1 638 . 12 1 1 A 48 48 ILE N N 48 121.200 120.823 0.377 1
1 639 . 12 1 1 A 49 49 ALA H H 49 8.310 8.106 0.204 1
1 640 . 12 1 1 A 49 49 ALA HA H 49 3.940 4.042 -0.102 1
1 644 . 12 1 1 A 49 49 ALA C C 49 179.300 179.411 -0.111 1
1 645 . 12 1 1 A 49 49 ALA CA C 49 55.500 54.915 0.585 1
1 646 . 12 1 1 A 49 49 ALA CB C 49 18.200 18.325 -0.125 1
1 647 . 12 1 1 A 49 49 ALA N N 49 120.300 120.852 -0.552 1
1 648 . 12 1 1 A 50 50 PHE H H 50 8.630 8.085 0.545 1
1 649 . 12 1 1 A 50 50 PHE HA H 50 4.200 4.114 0.086 1
1 656 . 12 1 1 A 50 50 PHE C C 50 179.000 176.498 2.502 1
1 657 . 12 1 1 A 50 50 PHE CA C 50 61.300 61.407 -0.107 1
1 658 . 12 1 1 A 50 50 PHE CB C 50 39.200 39.128 0.072 1
1 663 . 12 1 1 A 50 50 PHE N N 50 121.300 120.490 0.810 1
1 664 . 12 1 1 A 51 51 LEU H H 51 8.920 8.197 0.723 1
1 665 . 12 1 1 A 51 51 LEU HA H 51 3.630 3.799 -0.169 1
1 675 . 12 1 1 A 51 51 LEU C C 51 180.000 179.339 0.661 1
1 676 . 12 1 1 A 51 51 LEU CA C 51 58.100 57.756 0.344 1
1 677 . 12 1 1 A 51 51 LEU CB C 51 39.800 41.387 -1.587 1
1 681 . 12 1 1 A 51 51 LEU N N 51 121.900 119.543 2.357 1
1 682 . 12 1 1 A 52 52 ARG H H 52 8.410 8.227 0.183 1
1 683 . 12 1 1 A 52 52 ARG HA H 52 4.420 4.039 0.381 1
1 691 . 12 1 1 A 52 52 ARG C C 52 179.800 179.735 0.065 1
1 692 . 12 1 1 A 52 52 ARG CA C 52 57.800 59.614 -1.814 1
1 693 . 12 1 1 A 52 52 ARG CB C 52 28.200 29.828 -1.628 1
1 695 . 12 1 1 A 52 52 ARG N N 52 120.500 119.530 0.970 1
1 697 . 12 1 1 A 53 53 SER H H 53 8.480 8.316 0.164 1
1 698 . 12 1 1 A 53 53 SER HA H 53 4.300 4.209 0.091 1
1 701 . 12 1 1 A 53 53 SER C C 53 174.600 175.339 -0.739 1
1 702 . 12 1 1 A 53 53 SER CA C 53 61.500 60.730 0.770 1
1 703 . 12 1 1 A 53 53 SER CB C 53 62.300 62.866 -0.566 1
1 704 . 12 1 1 A 53 53 SER N N 53 119.500 115.619 3.881 1
1 705 . 12 1 1 A 54 54 LYS H H 54 7.080 7.338 -0.258 1
1 706 . 12 1 1 A 54 54 LYS HA H 54 4.350 4.264 0.086 1
1 715 . 12 1 1 A 54 54 LYS C C 54 176.500 176.851 -0.351 1
1 716 . 12 1 1 A 54 54 LYS CA C 54 53.700 55.810 -2.110 1
1 717 . 12 1 1 A 54 54 LYS CB C 54 31.800 32.749 -0.949 1
1 721 . 12 1 1 A 54 54 LYS N N 54 119.200 117.768 1.432 1
1 722 . 12 1 1 A 55 55 GLY H H 55 8.040 8.487 -0.447 1
1 723 . 12 1 1 A 55 55 GLY HA2 H 55 3.540 3.855 -0.315 1
1 724 . 12 1 1 A 55 55 GLY HA3 H 55 4.300 3.858 0.442 1
1 725 . 12 1 1 A 55 55 GLY C C 55 174.500 174.960 -0.460 1
1 726 . 12 1 1 A 55 55 GLY CA C 55 44.700 45.962 -1.262 1
1 727 . 12 1 1 A 55 55 GLY N N 55 106.600 108.328 -1.728 1
1 728 . 12 1 1 A 56 56 VAL H H 56 7.580 7.484 0.096 1
1 729 . 12 1 1 A 56 56 VAL HA H 56 3.630 3.857 -0.227 1
1 737 . 12 1 1 A 56 56 VAL C C 56 174.700 175.896 -1.196 1
1 738 . 12 1 1 A 56 56 VAL CA C 56 64.000 62.490 1.510 1
1 739 . 12 1 1 A 56 56 VAL CB C 56 31.600 32.026 -0.426 1
1 742 . 12 1 1 A 56 56 VAL N N 56 122.000 121.828 0.172 1
1 743 . 12 1 1 A 57 57 ASP H H 57 8.440 9.015 -0.575 1
1 744 . 12 1 1 A 57 57 ASP HA H 57 4.500 4.766 -0.266 1
1 747 . 12 1 1 A 57 57 ASP C C 57 176.900 176.033 0.867 1
1 748 . 12 1 1 A 57 57 ASP CA C 57 52.600 53.649 -1.049 1
1 749 . 12 1 1 A 57 57 ASP CB C 57 39.900 38.681 1.219 1
1 750 . 12 1 1 A 57 57 ASP N N 57 124.100 127.431 -3.331 1
1 751 . 12 1 1 A 58 58 LEU H H 58 9.720 8.413 1.307 1
1 752 . 12 1 1 A 58 58 LEU HA H 58 4.020 4.364 -0.344 1
1 762 . 12 1 1 A 58 58 LEU C C 58 179.400 178.753 0.647 1
1 763 . 12 1 1 A 58 58 LEU CA C 58 56.300 56.884 -0.584 1
1 764 . 12 1 1 A 58 58 LEU CB C 58 43.300 42.047 1.253 1
1 768 . 12 1 1 A 58 58 LEU N N 58 127.800 121.410 6.390 1
1 769 . 12 1 1 A 59 59 ASN H H 59 7.740 8.199 -0.459 1
1 770 . 12 1 1 A 59 59 ASN HA H 59 4.340 4.517 -0.177 1
1 775 . 12 1 1 A 59 59 ASN C C 59 176.300 178.025 -1.725 1
1 776 . 12 1 1 A 59 59 ASN CA C 59 56.300 56.065 0.235 1
1 777 . 12 1 1 A 59 59 ASN CB C 59 36.400 37.961 -1.561 1
1 779 . 12 1 1 A 59 59 ASN N N 59 119.500 117.492 2.008 1
1 781 . 12 1 1 A 60 60 ALA H H 60 7.220 8.069 -0.849 1
1 782 . 12 1 1 A 60 60 ALA HA H 60 4.030 4.150 -0.120 1
1 786 . 12 1 1 A 60 60 ALA C C 60 180.100 180.154 -0.054 1
1 787 . 12 1 1 A 60 60 ALA CA C 60 54.300 55.182 -0.882 1
1 788 . 12 1 1 A 60 60 ALA CB C 60 18.200 18.262 -0.062 1
1 789 . 12 1 1 A 60 60 ALA N N 60 121.400 123.314 -1.914 1
1 790 . 12 1 1 A 61 61 LEU H H 61 7.320 8.311 -0.991 1
1 791 . 12 1 1 A 61 61 LEU HA H 61 3.840 4.011 -0.171 1
1 801 . 12 1 1 A 61 61 LEU C C 61 177.200 179.034 -1.834 1
1 802 . 12 1 1 A 61 61 LEU CA C 61 58.500 57.800 0.700 1
1 803 . 12 1 1 A 61 61 LEU CB C 61 42.600 41.874 0.726 1
1 807 . 12 1 1 A 61 61 LEU N N 61 118.600 118.590 0.010 1
1 808 . 12 1 1 A 62 62 PHE H H 62 8.360 8.071 0.289 1
1 809 . 12 1 1 A 62 62 PHE HA H 62 3.930 4.222 -0.292 1
1 817 . 12 1 1 A 62 62 PHE C C 62 178.200 178.210 -0.010 1
1 818 . 12 1 1 A 62 62 PHE CA C 62 62.800 60.345 2.455 1
1 819 . 12 1 1 A 62 62 PHE CB C 62 38.500 38.450 0.050 1
1 825 . 12 1 1 A 62 62 PHE N N 62 114.400 118.669 -4.269 1
1 826 . 12 1 1 A 63 63 ASP H H 63 8.680 9.185 -0.505 1
1 827 . 12 1 1 A 63 63 ASP HA H 63 4.530 4.280 0.250 1
1 830 . 12 1 1 A 63 63 ASP C C 63 178.600 178.910 -0.310 1
1 831 . 12 1 1 A 63 63 ASP CA C 63 57.500 57.276 0.224 1
1 832 . 12 1 1 A 63 63 ASP CB C 63 39.600 40.125 -0.525 1
1 833 . 12 1 1 A 63 63 ASP N N 63 120.400 118.776 1.624 1
1 834 . 12 1 1 A 64 64 ARG H H 64 7.540 7.838 -0.298 1
1 835 . 12 1 1 A 64 64 ARG HA H 64 4.290 4.089 0.201 1
1 843 . 12 1 1 A 64 64 ARG C C 64 177.600 178.931 -1.331 1
1 844 . 12 1 1 A 64 64 ARG CA C 64 58.300 59.349 -1.049 1
1 845 . 12 1 1 A 64 64 ARG CB C 64 30.000 29.763 0.237 1
1 848 . 12 1 1 A 64 64 ARG N N 64 116.800 120.356 -3.556 1
1 850 . 12 1 1 A 65 65 ILE H H 65 7.260 7.808 -0.548 1
1 851 . 12 1 1 A 65 65 ILE HA H 65 4.130 3.639 0.491 1
1 861 . 12 1 1 A 65 65 ILE C C 65 177.000 178.212 -1.212 1
1 862 . 12 1 1 A 65 65 ILE CA C 65 62.600 65.268 -2.668 1
1 863 . 12 1 1 A 65 65 ILE CB C 65 38.700 37.607 1.093 1
1 867 . 12 1 1 A 65 65 ILE N N 65 117.000 118.914 -1.914 1
1 868 . 12 1 1 A 66 66 ILE H H 66 7.980 8.719 -0.739 1
1 869 . 12 1 1 A 66 66 ILE HA H 66 4.000 3.705 0.295 1
1 879 . 12 1 1 A 66 66 ILE C C 66 176.400 176.838 -0.438 1
1 880 . 12 1 1 A 66 66 ILE CA C 66 63.100 65.027 -1.927 1
1 881 . 12 1 1 A 66 66 ILE CB C 66 38.800 37.660 1.140 1
1 885 . 12 1 1 A 66 66 ILE N N 66 120.700 120.387 0.313 1
1 886 . 12 1 1 A 67 67 VAL H H 67 8.130 7.946 0.184 1
1 887 . 12 1 1 A 67 67 VAL HA H 67 3.980 4.170 -0.190 1
1 895 . 12 1 1 A 67 67 VAL C C 67 177.300 175.220 2.080 1
1 896 . 12 1 1 A 67 67 VAL CA C 67 63.900 62.520 1.380 1
1 897 . 12 1 1 A 67 67 VAL CB C 67 32.500 32.423 0.077 1
1 900 . 12 1 1 A 67 67 VAL N N 67 121.600 120.253 1.347 1
1 901 . 12 1 1 A 68 68 ASN H H 68 8.170 9.158 -0.988 1
1 902 . 12 1 1 A 68 68 ASN HA H 68 4.680 5.053 -0.373 1
1 907 . 12 1 1 A 68 68 ASN CA C 68 54.200 54.064 0.136 1
1 908 . 12 1 1 A 68 68 ASN CB C 68 39.100 41.217 -2.117 1
1 910 . 12 1 1 A 68 68 ASN N N 68 120.500 125.939 -5.439 1
1 912 . 12 1 1 A 69 69 LYS H H 69 8.230 7.821 0.409 1
1 913 . 12 1 1 A 69 69 LYS HA H 69 4.260 4.872 -0.612 1
1 922 . 12 1 1 A 69 69 LYS C C 69 176.900 175.798 1.102 1
1 923 . 12 1 1 A 69 69 LYS CA C 69 57.000 55.180 1.820 1
1 924 . 12 1 1 A 69 69 LYS CB C 69 32.800 33.294 -0.494 1
1 928 . 12 1 1 A 69 69 LYS N N 69 121.300 117.191 4.109 1
1 929 . 12 1 1 A 70 70 LEU H H 70 8.150 8.709 -0.559 1
1 930 . 12 1 1 A 70 70 LEU HA H 70 4.300 4.394 -0.094 1
1 940 . 12 1 1 A 70 70 LEU C C 70 178.900 176.014 2.886 1
1 941 . 12 1 1 A 70 70 LEU CA C 70 55.400 53.712 1.688 1
1 942 . 12 1 1 A 70 70 LEU CB C 70 42.100 43.501 -1.401 1
1 946 . 12 1 1 A 70 70 LEU N N 70 121.900 124.823 -2.923 1
1 947 . 12 1 1 A 71 71 GLU H H 71 8.210 8.514 -0.304 1
1 948 . 12 1 1 A 71 71 GLU HA H 71 4.180 4.681 -0.501 1
1 953 . 12 1 1 A 71 71 GLU C C 71 176.300 175.441 0.859 1
1 954 . 12 1 1 A 71 71 GLU CA C 71 56.600 55.848 0.752 1
1 955 . 12 1 1 A 71 71 GLU CB C 71 30.200 29.799 0.401 1
1 957 . 12 1 1 A 71 71 GLU N N 71 120.900 120.717 0.183 1
1 958 . 12 1 1 A 72 72 HIS H H 72 8.380 8.298 0.082 1
1 959 . 12 1 1 A 72 72 HIS HA H 72 4.600 5.026 -0.426 1
1 962 . 12 1 1 A 72 72 HIS C C 72 174.600 172.911 1.689 1
1 963 . 12 1 1 A 72 72 HIS CA C 72 55.600 54.526 1.074 1
1 964 . 12 1 1 A 72 72 HIS CB C 72 29.600 32.258 -2.658 1
1 965 . 12 1 1 A 72 72 HIS N N 72 119.300 120.726 -1.426 1
1 966 . 12 1 1 A 73 73 HIS H H 73 8.410 8.586 -0.176 1
1 967 . 12 1 1 A 73 73 HIS HA H 73 4.610 5.236 -0.626 1
1 970 . 12 1 1 A 73 73 HIS C C 73 173.700 172.666 1.034 1
1 971 . 12 1 1 A 73 73 HIS CA C 73 55.700 54.912 0.788 1
1 972 . 12 1 1 A 73 73 HIS CB C 73 29.600 31.995 -2.395 1
1 973 . 12 1 1 A 73 73 HIS N N 73 119.410 115.288 4.122 1
1 974 . 12 1 1 A 74 74 HIS H H 74 8.310 9.462 -1.152 1
1 975 . 12 1 1 A 74 74 HIS HA H 74 4.630 4.761 -0.131 1
1 978 . 12 1 1 A 74 74 HIS CA C 74 57.100 56.065 1.035 1
1 979 . 12 1 1 A 74 74 HIS CB C 74 29.800 31.114 -1.314 1
1 14 . 13 1 1 A 2 2 GLU H H 2 9.070 8.661 0.409 1
1 15 . 13 1 1 A 2 2 GLU HA H 2 4.520 4.490 0.030 1
1 20 . 13 1 1 A 2 2 GLU C C 2 176.300 176.858 -0.558 1
1 21 . 13 1 1 A 2 2 GLU CA C 2 55.800 56.727 -0.927 1
1 22 . 13 1 1 A 2 2 GLU CB C 2 31.000 30.333 0.667 1
1 24 . 13 1 1 A 2 2 GLU N N 2 123.100 119.149 3.951 1
1 25 . 13 1 1 A 3 3 LEU H H 3 8.750 8.106 0.644 1
1 26 . 13 1 1 A 3 3 LEU HA H 3 3.750 4.123 -0.373 1
1 36 . 13 1 1 A 3 3 LEU C C 3 177.400 178.391 -0.991 1
1 37 . 13 1 1 A 3 3 LEU CA C 3 58.300 57.866 0.434 1
1 38 . 13 1 1 A 3 3 LEU CB C 3 41.500 41.519 -0.019 1
1 42 . 13 1 1 A 3 3 LEU N N 3 122.600 122.358 0.242 1
1 43 . 13 1 1 A 4 4 SER H H 4 8.350 8.190 0.160 1
1 44 . 13 1 1 A 4 4 SER HA H 4 3.890 4.245 -0.355 1
1 47 . 13 1 1 A 4 4 SER C C 4 175.100 176.961 -1.861 1
1 48 . 13 1 1 A 4 4 SER CA C 4 61.500 60.844 0.656 1
1 49 . 13 1 1 A 4 4 SER CB C 4 62.000 62.627 -0.627 1
1 50 . 13 1 1 A 4 4 SER N N 4 112.900 114.915 -2.015 1
1 51 . 13 1 1 A 5 5 ASN H H 5 7.180 8.200 -1.020 1
1 52 . 13 1 1 A 5 5 ASN HA H 5 4.470 4.371 0.099 1
1 57 . 13 1 1 A 5 5 ASN C C 5 177.400 177.927 -0.527 1
1 58 . 13 1 1 A 5 5 ASN CA C 5 56.000 56.890 -0.890 1
1 59 . 13 1 1 A 5 5 ASN CB C 5 39.400 39.433 -0.033 1
1 61 . 13 1 1 A 5 5 ASN N N 5 116.600 120.805 -4.205 1
1 63 . 13 1 1 A 6 6 GLU H H 6 7.950 7.677 0.273 1
1 64 . 13 1 1 A 6 6 GLU HA H 6 4.070 4.062 0.008 1
1 69 . 13 1 1 A 6 6 GLU C C 6 178.500 179.119 -0.619 1
1 70 . 13 1 1 A 6 6 GLU CA C 6 58.100 59.181 -1.081 1
1 71 . 13 1 1 A 6 6 GLU CB C 6 29.300 29.302 -0.002 1
1 73 . 13 1 1 A 6 6 GLU N N 6 117.600 118.081 -0.481 1
1 74 . 13 1 1 A 7 7 LEU H H 7 8.140 7.890 0.250 1
1 75 . 13 1 1 A 7 7 LEU HA H 7 3.640 4.057 -0.417 1
1 85 . 13 1 1 A 7 7 LEU C C 7 177.700 178.516 -0.816 1
1 86 . 13 1 1 A 7 7 LEU CA C 7 58.300 58.066 0.234 1
1 87 . 13 1 1 A 7 7 LEU CB C 7 40.600 41.790 -1.190 1
1 91 . 13 1 1 A 7 7 LEU N N 7 118.500 122.499 -3.999 1
1 92 . 13 1 1 A 8 8 LYS H H 8 7.090 8.000 -0.910 1
1 93 . 13 1 1 A 8 8 LYS HA H 8 4.080 4.000 0.080 1
1 102 . 13 1 1 A 8 8 LYS C C 8 178.300 179.198 -0.898 1
1 103 . 13 1 1 A 8 8 LYS CA C 8 59.700 59.585 0.115 1
1 104 . 13 1 1 A 8 8 LYS CB C 8 32.300 32.510 -0.210 1
1 108 . 13 1 1 A 8 8 LYS N N 8 118.200 118.802 -0.602 1
1 109 . 13 1 1 A 9 9 VAL H H 9 7.940 7.819 0.121 1
1 110 . 13 1 1 A 9 9 VAL HA H 9 3.440 3.528 -0.088 1
1 118 . 13 1 1 A 9 9 VAL C C 9 179.500 177.767 1.733 1
1 119 . 13 1 1 A 9 9 VAL CA C 9 66.700 66.501 0.199 1
1 120 . 13 1 1 A 9 9 VAL CB C 9 31.600 31.398 0.202 1
1 123 . 13 1 1 A 9 9 VAL N N 9 117.600 120.252 -2.652 1
1 124 . 13 1 1 A 10 10 GLU H H 10 7.830 8.847 -1.017 1
1 125 . 13 1 1 A 10 10 GLU HA H 10 4.130 3.908 0.222 1
1 130 . 13 1 1 A 10 10 GLU C C 10 178.700 179.270 -0.570 1
1 131 . 13 1 1 A 10 10 GLU CA C 10 58.300 59.696 -1.396 1
1 132 . 13 1 1 A 10 10 GLU CB C 10 28.500 29.509 -1.009 1
1 134 . 13 1 1 A 10 10 GLU N N 10 118.300 118.306 -0.006 1
1 135 . 13 1 1 A 11 11 ARG H H 11 8.330 7.427 0.903 1
1 136 . 13 1 1 A 11 11 ARG HA H 11 3.770 4.091 -0.321 1
1 144 . 13 1 1 A 11 11 ARG C C 11 174.600 178.831 -4.231 1
1 145 . 13 1 1 A 11 11 ARG CA C 11 61.300 58.728 2.572 1
1 146 . 13 1 1 A 11 11 ARG CB C 11 28.500 30.064 -1.564 1
1 149 . 13 1 1 A 11 11 ARG N N 11 121.400 119.985 1.415 1
1 151 . 13 1 1 A 12 12 ILE H H 12 8.540 8.061 0.479 1
1 152 . 13 1 1 A 12 12 ILE HA H 12 3.780 3.738 0.042 1
1 162 . 13 1 1 A 12 12 ILE C C 12 181.400 177.961 3.439 1
1 163 . 13 1 1 A 12 12 ILE CA C 12 64.800 64.873 -0.073 1
1 164 . 13 1 1 A 12 12 ILE CB C 12 37.700 37.624 0.076 1
1 168 . 13 1 1 A 12 12 ILE N N 12 118.700 119.611 -0.911 1
1 169 . 13 1 1 A 13 13 ARG H H 13 8.470 8.287 0.183 1
1 170 . 13 1 1 A 13 13 ARG HA H 13 4.060 4.039 0.021 1
1 178 . 13 1 1 A 13 13 ARG C C 13 178.600 178.439 0.161 1
1 179 . 13 1 1 A 13 13 ARG CA C 13 59.600 59.756 -0.156 1
1 180 . 13 1 1 A 13 13 ARG CB C 13 30.000 29.978 0.022 1
1 183 . 13 1 1 A 13 13 ARG N N 13 124.600 120.175 4.425 1
1 185 . 13 1 1 A 14 14 LEU H H 14 7.430 8.071 -0.641 1
1 186 . 13 1 1 A 14 14 LEU HA H 14 4.240 4.319 -0.079 1
1 196 . 13 1 1 A 14 14 LEU C C 14 176.000 176.435 -0.435 1
1 197 . 13 1 1 A 14 14 LEU CA C 14 55.300 54.764 0.536 1
1 198 . 13 1 1 A 14 14 LEU CB C 14 43.000 42.104 0.896 1
1 202 . 13 1 1 A 14 14 LEU N N 14 118.500 118.352 0.148 1
1 203 . 13 1 1 A 15 15 SER H H 15 8.260 8.122 0.138 1
1 204 . 13 1 1 A 15 15 SER HA H 15 4.030 4.164 -0.134 1
1 207 . 13 1 1 A 15 15 SER C C 15 174.000 173.571 0.429 1
1 208 . 13 1 1 A 15 15 SER CA C 15 58.700 58.949 -0.249 1
1 209 . 13 1 1 A 15 15 SER CB C 15 61.300 60.812 0.488 1
1 210 . 13 1 1 A 15 15 SER N N 15 112.500 114.098 -1.598 1
1 211 . 13 1 1 A 16 16 LEU H H 16 7.310 7.720 -0.410 1
1 212 . 13 1 1 A 16 16 LEU HA H 16 4.880 4.319 0.561 1
1 222 . 13 1 1 A 16 16 LEU C C 16 177.900 177.211 0.689 1
1 223 . 13 1 1 A 16 16 LEU CA C 16 52.600 54.592 -1.992 1
1 224 . 13 1 1 A 16 16 LEU CB C 16 43.500 42.404 1.096 1
1 228 . 13 1 1 A 16 16 LEU N N 16 117.800 121.607 -3.807 1
1 229 . 13 1 1 A 17 17 THR H H 17 8.640 8.540 0.100 1
1 230 . 13 1 1 A 17 17 THR HA H 17 4.250 4.549 -0.299 1
1 235 . 13 1 1 A 17 17 THR C C 17 174.900 175.604 -0.704 1
1 236 . 13 1 1 A 17 17 THR CA C 17 60.500 61.472 -0.972 1
1 237 . 13 1 1 A 17 17 THR CB C 17 70.500 70.018 0.482 1
1 239 . 13 1 1 A 17 17 THR N N 17 115.200 114.633 0.567 1
1 240 . 13 1 1 A 18 18 ALA H H 18 8.820 9.055 -0.235 1
1 241 . 13 1 1 A 18 18 ALA HA H 18 3.680 4.007 -0.327 1
1 245 . 13 1 1 A 18 18 ALA C C 18 178.900 179.544 -0.644 1
1 246 . 13 1 1 A 18 18 ALA CA C 18 55.200 55.220 -0.020 1
1 247 . 13 1 1 A 18 18 ALA CB C 18 17.800 18.027 -0.227 1
1 248 . 13 1 1 A 18 18 ALA N N 18 125.600 127.064 -1.464 1
1 249 . 13 1 1 A 19 19 LYS H H 19 8.280 7.995 0.285 1
1 250 . 13 1 1 A 19 19 LYS HA H 19 3.740 3.958 -0.218 1
1 259 . 13 1 1 A 19 19 LYS C C 19 177.900 179.048 -1.148 1
1 260 . 13 1 1 A 19 19 LYS CA C 19 59.800 59.457 0.343 1
1 261 . 13 1 1 A 19 19 LYS CB C 19 33.300 32.446 0.854 1
1 265 . 13 1 1 A 19 19 LYS N N 19 115.800 119.106 -3.306 1
1 266 . 13 1 1 A 20 20 SER H H 20 7.860 8.015 -0.155 1
1 267 . 13 1 1 A 20 20 SER HA H 20 4.210 4.150 0.060 1
1 271 . 13 1 1 A 20 20 SER C C 20 177.200 176.559 0.641 1
1 272 . 13 1 1 A 20 20 SER CA C 20 61.900 62.535 -0.635 1
1 273 . 13 1 1 A 20 20 SER CB C 20 63.000 63.145 -0.145 1
1 274 . 13 1 1 A 20 20 SER N N 20 114.600 117.047 -2.447 1
1 275 . 13 1 1 A 21 21 VAL H H 21 7.830 7.707 0.123 1
1 276 . 13 1 1 A 21 21 VAL HA H 21 3.280 3.566 -0.286 1
1 284 . 13 1 1 A 21 21 VAL C C 21 177.500 178.094 -0.594 1
1 285 . 13 1 1 A 21 21 VAL CA C 21 66.800 66.540 0.260 1
1 286 . 13 1 1 A 21 21 VAL CB C 21 31.400 31.573 -0.173 1
1 289 . 13 1 1 A 21 21 VAL N N 21 122.600 121.914 0.686 1
1 290 . 13 1 1 A 22 22 ALA H H 22 8.230 8.348 -0.118 1
1 291 . 13 1 1 A 22 22 ALA HA H 22 3.510 3.961 -0.451 1
1 295 . 13 1 1 A 22 22 ALA C C 22 179.500 179.179 0.321 1
1 296 . 13 1 1 A 22 22 ALA CA C 22 55.500 55.455 0.045 1
1 297 . 13 1 1 A 22 22 ALA CB C 22 16.900 17.861 -0.961 1
1 298 . 13 1 1 A 22 22 ALA N N 22 121.200 122.072 -0.872 1
1 299 . 13 1 1 A 23 23 GLU H H 23 7.900 8.652 -0.752 1
1 300 . 13 1 1 A 23 23 GLU HA H 23 3.990 4.022 -0.032 1
1 305 . 13 1 1 A 23 23 GLU C C 23 180.000 178.768 1.232 1
1 306 . 13 1 1 A 23 23 GLU CA C 23 59.300 59.649 -0.349 1
1 307 . 13 1 1 A 23 23 GLU CB C 23 29.300 29.134 0.166 1
1 309 . 13 1 1 A 23 23 GLU N N 23 115.300 118.624 -3.324 1
1 310 . 13 1 1 A 24 24 GLU H H 24 7.950 7.962 -0.012 1
1 311 . 13 1 1 A 24 24 GLU HA H 24 4.060 4.128 -0.068 1
1 316 . 13 1 1 A 24 24 GLU C C 24 179.100 178.990 0.110 1
1 317 . 13 1 1 A 24 24 GLU CA C 24 59.700 59.223 0.477 1
1 318 . 13 1 1 A 24 24 GLU CB C 24 29.500 29.101 0.399 1
1 320 . 13 1 1 A 24 24 GLU N N 24 120.100 119.654 0.446 1
1 321 . 13 1 1 A 25 25 MET H H 25 8.150 8.006 0.144 1
1 322 . 13 1 1 A 25 25 MET HA H 25 4.110 4.304 -0.194 1
1 330 . 13 1 1 A 25 25 MET C C 25 176.600 176.634 -0.034 1
1 331 . 13 1 1 A 25 25 MET CA C 25 57.100 56.838 0.262 1
1 332 . 13 1 1 A 25 25 MET CB C 25 34.900 32.676 2.224 1
1 335 . 13 1 1 A 25 25 MET N N 25 115.500 116.835 -1.335 1
1 336 . 13 1 1 A 26 26 GLY H H 26 7.940 8.446 -0.506 1
1 337 . 13 1 1 A 26 26 GLY HA2 H 26 3.860 3.930 -0.070 1
1 338 . 13 1 1 A 26 26 GLY HA3 H 26 3.960 3.931 0.029 1
1 339 . 13 1 1 A 26 26 GLY C C 26 175.100 173.809 1.291 1
1 340 . 13 1 1 A 26 26 GLY CA C 26 46.600 45.847 0.753 1
1 341 . 13 1 1 A 26 26 GLY N N 26 109.000 106.986 2.014 1
1 342 . 13 1 1 A 27 27 ILE H H 27 7.880 7.334 0.546 1
1 343 . 13 1 1 A 27 27 ILE HA H 27 4.790 4.810 -0.020 1
1 353 . 13 1 1 A 27 27 ILE C C 27 174.300 174.830 -0.530 1
1 354 . 13 1 1 A 27 27 ILE CA C 27 59.000 58.548 0.452 1
1 355 . 13 1 1 A 27 27 ILE CB C 27 40.900 41.536 -0.636 1
1 359 . 13 1 1 A 27 27 ILE N N 27 112.700 115.795 -3.095 1
1 360 . 13 1 1 A 28 28 SER H H 28 8.570 8.617 -0.047 1
1 361 . 13 1 1 A 28 28 SER HA H 28 4.540 4.642 -0.102 1
1 364 . 13 1 1 A 28 28 SER C C 28 175.600 175.602 -0.002 1
1 365 . 13 1 1 A 28 28 SER CA C 28 56.800 58.030 -1.230 1
1 366 . 13 1 1 A 28 28 SER CB C 28 65.500 63.755 1.745 1
1 367 . 13 1 1 A 28 28 SER N N 28 115.400 118.422 -3.022 1
1 368 . 13 1 1 A 29 29 ARG H H 29 8.980 9.037 -0.057 1
1 369 . 13 1 1 A 29 29 ARG HA H 29 3.660 3.966 -0.306 1
1 377 . 13 1 1 A 29 29 ARG C C 29 178.700 178.217 0.483 1
1 378 . 13 1 1 A 29 29 ARG CA C 29 59.500 60.224 -0.724 1
1 379 . 13 1 1 A 29 29 ARG CB C 29 29.500 29.724 -0.224 1
1 382 . 13 1 1 A 29 29 ARG N N 29 122.000 126.944 -4.944 1
1 384 . 13 1 1 A 30 30 GLN H H 30 8.580 7.872 0.708 1
1 385 . 13 1 1 A 30 30 GLN HA H 30 3.860 4.011 -0.151 1
1 392 . 13 1 1 A 30 30 GLN C C 30 178.100 178.264 -0.164 1
1 393 . 13 1 1 A 30 30 GLN CA C 30 59.200 59.137 0.063 1
1 394 . 13 1 1 A 30 30 GLN CB C 30 28.100 28.364 -0.264 1
1 397 . 13 1 1 A 30 30 GLN N N 30 118.700 119.237 -0.537 1
1 399 . 13 1 1 A 31 31 GLN H H 31 7.990 7.808 0.182 1
1 400 . 13 1 1 A 31 31 GLN HA H 31 3.980 4.032 -0.052 1
1 407 . 13 1 1 A 31 31 GLN C C 31 178.700 178.153 0.547 1
1 408 . 13 1 1 A 31 31 GLN CA C 31 59.100 58.506 0.594 1
1 409 . 13 1 1 A 31 31 GLN CB C 31 28.700 27.941 0.759 1
1 412 . 13 1 1 A 31 31 GLN N N 31 119.600 119.709 -0.109 1
1 414 . 13 1 1 A 32 32 LEU H H 32 7.630 7.738 -0.108 1
1 415 . 13 1 1 A 32 32 LEU HA H 32 3.740 4.080 -0.340 1
1 425 . 13 1 1 A 32 32 LEU C C 32 178.300 178.647 -0.347 1
1 426 . 13 1 1 A 32 32 LEU CA C 32 57.700 57.889 -0.189 1
1 427 . 13 1 1 A 32 32 LEU CB C 32 41.500 41.309 0.191 1
1 431 . 13 1 1 A 32 32 LEU N N 32 120.700 121.037 -0.337 1
1 432 . 13 1 1 A 33 33 CYS H H 33 8.240 8.607 -0.367 1
1 433 . 13 1 1 A 33 33 CYS HA H 33 3.990 4.093 -0.103 1
1 436 . 13 1 1 A 33 33 CYS C C 33 177.000 177.090 -0.090 1
1 437 . 13 1 1 A 33 33 CYS CA C 33 63.100 63.227 -0.127 1
1 438 . 13 1 1 A 33 33 CYS CB C 33 26.100 27.037 -0.937 1
1 439 . 13 1 1 A 33 33 CYS N N 33 117.400 117.336 0.064 1
1 440 . 13 1 1 A 34 34 ASN H H 34 8.210 7.773 0.437 1
1 441 . 13 1 1 A 34 34 ASN HA H 34 4.370 4.479 -0.109 1
1 446 . 13 1 1 A 34 34 ASN C C 34 178.700 178.269 0.431 1
1 447 . 13 1 1 A 34 34 ASN CA C 34 56.000 56.574 -0.574 1
1 448 . 13 1 1 A 34 34 ASN CB C 34 37.800 37.961 -0.161 1
1 450 . 13 1 1 A 34 34 ASN N N 34 117.300 118.411 -1.111 1
1 452 . 13 1 1 A 35 35 ILE H H 35 7.850 7.587 0.263 1
1 453 . 13 1 1 A 35 35 ILE HA H 35 3.850 3.608 0.242 1
1 463 . 13 1 1 A 35 35 ILE C C 35 178.100 177.886 0.214 1
1 464 . 13 1 1 A 35 35 ILE CA C 35 64.800 65.510 -0.710 1
1 465 . 13 1 1 A 35 35 ILE CB C 35 38.000 37.768 0.232 1
1 469 . 13 1 1 A 35 35 ILE N N 35 120.400 120.646 -0.246 1
1 470 . 13 1 1 A 36 36 GLU H H 36 7.680 7.825 -0.145 1
1 471 . 13 1 1 A 36 36 GLU HA H 36 4.120 4.054 0.066 1
1 476 . 13 1 1 A 36 36 GLU C C 36 176.300 177.723 -1.423 1
1 477 . 13 1 1 A 36 36 GLU CA C 36 58.600 59.788 -1.188 1
1 478 . 13 1 1 A 36 36 GLU CB C 36 30.000 29.323 0.677 1
1 480 . 13 1 1 A 36 36 GLU N N 36 116.500 119.816 -3.316 1
1 481 . 13 1 1 A 37 37 GLN H H 37 7.630 7.434 0.196 1
1 482 . 13 1 1 A 37 37 GLN HA H 37 4.540 4.385 0.155 1
1 489 . 13 1 1 A 37 37 GLN C C 37 176.000 175.168 0.832 1
1 490 . 13 1 1 A 37 37 GLN CA C 37 54.900 54.618 0.282 1
1 491 . 13 1 1 A 37 37 GLN CB C 37 29.600 27.275 2.325 1
1 494 . 13 1 1 A 37 37 GLN N N 37 115.000 119.012 -4.012 1
1 496 . 13 1 1 A 38 38 SER H H 38 7.380 7.705 -0.325 1
1 497 . 13 1 1 A 38 38 SER HA H 38 4.410 4.340 0.070 1
1 500 . 13 1 1 A 38 38 SER C C 38 175.500 174.060 1.440 1
1 501 . 13 1 1 A 38 38 SER CA C 38 59.200 59.342 -0.142 1
1 502 . 13 1 1 A 38 38 SER CB C 38 64.100 63.503 0.597 1
1 503 . 13 1 1 A 38 38 SER N N 38 115.200 114.698 0.502 1
1 504 . 13 1 1 A 39 39 GLU H H 39 9.040 8.791 0.249 1
1 505 . 13 1 1 A 39 39 GLU HA H 39 4.450 4.539 -0.089 1
1 510 . 13 1 1 A 39 39 GLU C C 39 176.300 175.524 0.776 1
1 511 . 13 1 1 A 39 39 GLU CA C 39 57.100 54.968 2.132 1
1 512 . 13 1 1 A 39 39 GLU CB C 39 30.300 30.500 -0.200 1
1 514 . 13 1 1 A 39 39 GLU N N 39 125.400 123.849 1.551 1
1 515 . 13 1 1 A 40 40 THR H H 40 7.920 8.418 -0.498 1
1 516 . 13 1 1 A 40 40 THR HA H 40 4.590 4.296 0.294 1
1 521 . 13 1 1 A 40 40 THR C C 40 173.500 174.002 -0.502 1
1 522 . 13 1 1 A 40 40 THR CA C 40 60.500 62.990 -2.490 1
1 523 . 13 1 1 A 40 40 THR CB C 40 71.100 67.924 3.176 1
1 525 . 13 1 1 A 40 40 THR N N 40 112.800 120.106 -7.306 1
1 526 . 13 1 1 A 41 41 ALA H H 41 8.780 8.655 0.125 1
1 527 . 13 1 1 A 41 41 ALA HA H 41 4.870 4.516 0.354 1
1 531 . 13 1 1 A 41 41 ALA CA C 41 49.700 50.933 -1.233 1
1 532 . 13 1 1 A 41 41 ALA CB C 41 19.300 18.186 1.114 1
1 533 . 13 1 1 A 41 41 ALA N N 41 127.000 127.606 -0.606 1
1 534 . 13 1 1 A 42 42 PRO HA H 42 4.660 4.611 0.049 1
1 541 . 13 1 1 A 42 42 PRO C C 42 178.300 177.630 0.670 1
1 542 . 13 1 1 A 42 42 PRO CA C 42 62.500 62.882 -0.382 1
1 543 . 13 1 1 A 42 42 PRO CB C 42 32.600 32.745 -0.145 1
1 546 . 13 1 1 A 43 43 VAL H H 43 8.840 8.651 0.189 1
1 547 . 13 1 1 A 43 43 VAL HA H 43 3.660 3.777 -0.117 1
1 555 . 13 1 1 A 43 43 VAL CA C 43 66.800 64.876 1.924 1
1 556 . 13 1 1 A 43 43 VAL CB C 43 31.100 31.496 -0.396 1
1 559 . 13 1 1 A 43 43 VAL N N 43 123.000 123.271 -0.271 1
1 560 . 13 1 1 A 44 44 VAL HA H 44 4.030 3.856 0.174 1
1 568 . 13 1 1 A 44 44 VAL C C 44 176.700 178.188 -1.488 1
1 569 . 13 1 1 A 44 44 VAL CA C 44 65.900 65.752 0.148 1
1 570 . 13 1 1 A 44 44 VAL CB C 44 30.900 31.547 -0.647 1
1 573 . 13 1 1 A 45 45 VAL H H 45 7.500 8.239 -0.739 1
1 574 . 13 1 1 A 45 45 VAL HA H 45 3.760 3.600 0.160 1
1 582 . 13 1 1 A 45 45 VAL C C 45 177.500 177.754 -0.254 1
1 583 . 13 1 1 A 45 45 VAL CA C 45 66.700 66.820 -0.120 1
1 584 . 13 1 1 A 45 45 VAL CB C 45 31.000 31.395 -0.395 1
1 587 . 13 1 1 A 45 45 VAL N N 45 120.100 121.259 -1.159 1
1 588 . 13 1 1 A 46 46 LYS H H 46 7.610 7.781 -0.171 1
1 589 . 13 1 1 A 46 46 LYS HA H 46 4.140 4.021 0.119 1
1 598 . 13 1 1 A 46 46 LYS C C 46 179.500 178.771 0.729 1
1 599 . 13 1 1 A 46 46 LYS CA C 46 59.900 59.195 0.705 1
1 600 . 13 1 1 A 46 46 LYS CB C 46 31.500 32.086 -0.586 1
1 604 . 13 1 1 A 46 46 LYS N N 46 120.700 118.550 2.150 1
1 605 . 13 1 1 A 47 47 TYR H H 47 8.550 7.983 0.567 1
1 606 . 13 1 1 A 47 47 TYR HA H 47 5.000 4.180 0.820 1
1 613 . 13 1 1 A 47 47 TYR C C 47 177.300 177.424 -0.124 1
1 614 . 13 1 1 A 47 47 TYR CA C 47 57.300 61.503 -4.203 1
1 615 . 13 1 1 A 47 47 TYR CB C 47 37.700 38.646 -0.946 1
1 620 . 13 1 1 A 47 47 TYR N N 47 122.700 120.841 1.859 1
1 621 . 13 1 1 A 48 48 ILE H H 48 8.250 8.063 0.187 1
1 622 . 13 1 1 A 48 48 ILE HA H 48 3.160 3.674 -0.514 1
1 632 . 13 1 1 A 48 48 ILE C C 48 177.100 177.941 -0.841 1
1 633 . 13 1 1 A 48 48 ILE CA C 48 67.000 65.682 1.318 1
1 634 . 13 1 1 A 48 48 ILE CB C 48 37.800 38.521 -0.721 1
1 638 . 13 1 1 A 48 48 ILE N N 48 121.200 120.675 0.525 1
1 639 . 13 1 1 A 49 49 ALA H H 49 8.310 8.171 0.139 1
1 640 . 13 1 1 A 49 49 ALA HA H 49 3.940 4.024 -0.084 1
1 644 . 13 1 1 A 49 49 ALA C C 49 179.300 179.050 0.250 1
1 645 . 13 1 1 A 49 49 ALA CA C 49 55.500 54.986 0.514 1
1 646 . 13 1 1 A 49 49 ALA CB C 49 18.200 18.547 -0.347 1
1 647 . 13 1 1 A 49 49 ALA N N 49 120.300 120.518 -0.218 1
1 648 . 13 1 1 A 50 50 PHE H H 50 8.630 8.151 0.479 1
1 649 . 13 1 1 A 50 50 PHE HA H 50 4.200 4.141 0.059 1
1 656 . 13 1 1 A 50 50 PHE C C 50 179.000 176.756 2.244 1
1 657 . 13 1 1 A 50 50 PHE CA C 50 61.300 61.368 -0.068 1
1 658 . 13 1 1 A 50 50 PHE CB C 50 39.200 39.142 0.058 1
1 663 . 13 1 1 A 50 50 PHE N N 50 121.300 120.427 0.873 1
1 664 . 13 1 1 A 51 51 LEU H H 51 8.920 8.323 0.597 1
1 665 . 13 1 1 A 51 51 LEU HA H 51 3.630 3.897 -0.267 1
1 675 . 13 1 1 A 51 51 LEU C C 51 180.000 179.243 0.757 1
1 676 . 13 1 1 A 51 51 LEU CA C 51 58.100 57.882 0.218 1
1 677 . 13 1 1 A 51 51 LEU CB C 51 39.800 41.427 -1.627 1
1 681 . 13 1 1 A 51 51 LEU N N 51 121.900 119.378 2.522 1
1 682 . 13 1 1 A 52 52 ARG H H 52 8.410 7.994 0.416 1
1 683 . 13 1 1 A 52 52 ARG HA H 52 4.420 3.973 0.447 1
1 691 . 13 1 1 A 52 52 ARG C C 52 179.800 178.519 1.281 1
1 692 . 13 1 1 A 52 52 ARG CA C 52 57.800 59.386 -1.586 1
1 693 . 13 1 1 A 52 52 ARG CB C 52 28.200 29.723 -1.523 1
1 695 . 13 1 1 A 52 52 ARG N N 52 120.500 120.037 0.463 1
1 697 . 13 1 1 A 53 53 SER H H 53 8.480 7.932 0.548 1
1 698 . 13 1 1 A 53 53 SER HA H 53 4.300 4.054 0.246 1
1 701 . 13 1 1 A 53 53 SER C C 53 174.600 175.640 -1.040 1
1 702 . 13 1 1 A 53 53 SER CA C 53 61.500 61.305 0.195 1
1 703 . 13 1 1 A 53 53 SER CB C 53 62.300 62.024 0.276 1
1 704 . 13 1 1 A 53 53 SER N N 53 119.500 114.575 4.925 1
1 705 . 13 1 1 A 54 54 LYS H H 54 7.080 7.387 -0.307 1
1 706 . 13 1 1 A 54 54 LYS HA H 54 4.350 4.292 0.058 1
1 715 . 13 1 1 A 54 54 LYS C C 54 176.500 176.901 -0.401 1
1 716 . 13 1 1 A 54 54 LYS CA C 54 53.700 55.844 -2.144 1
1 717 . 13 1 1 A 54 54 LYS CB C 54 31.800 32.970 -1.170 1
1 721 . 13 1 1 A 54 54 LYS N N 54 119.200 118.203 0.997 1
1 722 . 13 1 1 A 55 55 GLY H H 55 8.040 7.489 0.551 1
1 723 . 13 1 1 A 55 55 GLY HA2 H 55 3.540 3.949 -0.409 1
1 724 . 13 1 1 A 55 55 GLY HA3 H 55 4.300 3.953 0.347 1
1 725 . 13 1 1 A 55 55 GLY C C 55 174.500 175.096 -0.596 1
1 726 . 13 1 1 A 55 55 GLY CA C 55 44.700 46.435 -1.735 1
1 727 . 13 1 1 A 55 55 GLY N N 55 106.600 107.919 -1.319 1
1 728 . 13 1 1 A 56 56 VAL H H 56 7.580 7.824 -0.244 1
1 729 . 13 1 1 A 56 56 VAL HA H 56 3.630 4.004 -0.374 1
1 737 . 13 1 1 A 56 56 VAL C C 56 174.700 175.053 -0.353 1
1 738 . 13 1 1 A 56 56 VAL CA C 56 64.000 65.047 -1.047 1
1 739 . 13 1 1 A 56 56 VAL CB C 56 31.600 32.297 -0.697 1
1 742 . 13 1 1 A 56 56 VAL N N 56 122.000 117.270 4.730 1
1 743 . 13 1 1 A 57 57 ASP H H 57 8.440 7.985 0.455 1
1 744 . 13 1 1 A 57 57 ASP HA H 57 4.500 4.258 0.242 1
1 747 . 13 1 1 A 57 57 ASP C C 57 176.900 176.317 0.583 1
1 748 . 13 1 1 A 57 57 ASP CA C 57 52.600 55.179 -2.579 1
1 749 . 13 1 1 A 57 57 ASP CB C 57 39.900 38.839 1.061 1
1 750 . 13 1 1 A 57 57 ASP N N 57 124.100 118.430 5.670 1
1 751 . 13 1 1 A 58 58 LEU H H 58 9.720 7.964 1.756 1
1 752 . 13 1 1 A 58 58 LEU HA H 58 4.020 4.250 -0.230 1
1 762 . 13 1 1 A 58 58 LEU C C 58 179.400 178.978 0.422 1
1 763 . 13 1 1 A 58 58 LEU CA C 58 56.300 57.039 -0.739 1
1 764 . 13 1 1 A 58 58 LEU CB C 58 43.300 41.717 1.583 1
1 768 . 13 1 1 A 58 58 LEU N N 58 127.800 118.367 9.433 1
1 769 . 13 1 1 A 59 59 ASN H H 59 7.740 8.179 -0.439 1
1 770 . 13 1 1 A 59 59 ASN HA H 59 4.340 4.428 -0.088 1
1 775 . 13 1 1 A 59 59 ASN C C 59 176.300 177.757 -1.457 1
1 776 . 13 1 1 A 59 59 ASN CA C 59 56.300 56.372 -0.072 1
1 777 . 13 1 1 A 59 59 ASN CB C 59 36.400 38.004 -1.604 1
1 779 . 13 1 1 A 59 59 ASN N N 59 119.500 118.591 0.909 1
1 781 . 13 1 1 A 60 60 ALA H H 60 7.220 7.731 -0.511 1
1 782 . 13 1 1 A 60 60 ALA HA H 60 4.030 4.128 -0.098 1
1 786 . 13 1 1 A 60 60 ALA C C 60 180.100 180.363 -0.263 1
1 787 . 13 1 1 A 60 60 ALA CA C 60 54.300 54.807 -0.507 1
1 788 . 13 1 1 A 60 60 ALA CB C 60 18.200 18.368 -0.168 1
1 789 . 13 1 1 A 60 60 ALA N N 60 121.400 122.596 -1.196 1
1 790 . 13 1 1 A 61 61 LEU H H 61 7.320 8.213 -0.893 1
1 791 . 13 1 1 A 61 61 LEU HA H 61 3.840 4.131 -0.291 1
1 801 . 13 1 1 A 61 61 LEU C C 61 177.200 178.328 -1.128 1
1 802 . 13 1 1 A 61 61 LEU CA C 61 58.500 58.240 0.260 1
1 803 . 13 1 1 A 61 61 LEU CB C 61 42.600 41.932 0.668 1
1 807 . 13 1 1 A 61 61 LEU N N 61 118.600 120.826 -2.226 1
1 808 . 13 1 1 A 62 62 PHE H H 62 8.360 8.312 0.048 1
1 809 . 13 1 1 A 62 62 PHE HA H 62 3.930 4.106 -0.176 1
1 817 . 13 1 1 A 62 62 PHE C C 62 178.200 177.702 0.498 1
1 818 . 13 1 1 A 62 62 PHE CA C 62 62.800 60.913 1.887 1
1 819 . 13 1 1 A 62 62 PHE CB C 62 38.500 38.499 0.001 1
1 825 . 13 1 1 A 62 62 PHE N N 62 114.400 117.586 -3.186 1
1 826 . 13 1 1 A 63 63 ASP H H 63 8.680 8.453 0.227 1
1 827 . 13 1 1 A 63 63 ASP HA H 63 4.530 4.338 0.192 1
1 830 . 13 1 1 A 63 63 ASP C C 63 178.600 178.362 0.238 1
1 831 . 13 1 1 A 63 63 ASP CA C 63 57.500 57.817 -0.317 1
1 832 . 13 1 1 A 63 63 ASP CB C 63 39.600 42.005 -2.405 1
1 833 . 13 1 1 A 63 63 ASP N N 63 120.400 119.987 0.413 1
1 834 . 13 1 1 A 64 64 ARG H H 64 7.540 7.638 -0.098 1
1 835 . 13 1 1 A 64 64 ARG HA H 64 4.290 4.121 0.169 1
1 843 . 13 1 1 A 64 64 ARG C C 64 177.600 178.747 -1.147 1
1 844 . 13 1 1 A 64 64 ARG CA C 64 58.300 58.944 -0.644 1
1 845 . 13 1 1 A 64 64 ARG CB C 64 30.000 29.998 0.002 1
1 848 . 13 1 1 A 64 64 ARG N N 64 116.800 119.373 -2.573 1
1 850 . 13 1 1 A 65 65 ILE H H 65 7.260 7.344 -0.084 1
1 851 . 13 1 1 A 65 65 ILE HA H 65 4.130 3.793 0.337 1
1 861 . 13 1 1 A 65 65 ILE C C 65 177.000 176.479 0.521 1
1 862 . 13 1 1 A 65 65 ILE CA C 65 62.600 65.074 -2.474 1
1 863 . 13 1 1 A 65 65 ILE CB C 65 38.700 37.755 0.945 1
1 867 . 13 1 1 A 65 65 ILE N N 65 117.000 118.497 -1.497 1
1 868 . 13 1 1 A 66 66 ILE H H 66 7.980 7.785 0.195 1
1 869 . 13 1 1 A 66 66 ILE HA H 66 4.000 4.337 -0.337 1
1 879 . 13 1 1 A 66 66 ILE C C 66 176.400 174.937 1.463 1
1 880 . 13 1 1 A 66 66 ILE CA C 66 63.100 60.470 2.630 1
1 881 . 13 1 1 A 66 66 ILE CB C 66 38.800 39.180 -0.380 1
1 885 . 13 1 1 A 66 66 ILE N N 66 120.700 118.640 2.060 1
1 886 . 13 1 1 A 67 67 VAL H H 67 8.130 8.823 -0.693 1
1 887 . 13 1 1 A 67 67 VAL HA H 67 3.980 5.080 -1.100 1
1 895 . 13 1 1 A 67 67 VAL C C 67 177.300 174.091 3.209 1
1 896 . 13 1 1 A 67 67 VAL CA C 67 63.900 59.732 4.168 1
1 897 . 13 1 1 A 67 67 VAL CB C 67 32.500 34.526 -2.026 1
1 900 . 13 1 1 A 67 67 VAL N N 67 121.600 125.255 -3.655 1
1 901 . 13 1 1 A 68 68 ASN H H 68 8.170 9.100 -0.930 1
1 902 . 13 1 1 A 68 68 ASN HA H 68 4.680 5.411 -0.731 1
1 907 . 13 1 1 A 68 68 ASN CA C 68 54.200 52.537 1.663 1
1 908 . 13 1 1 A 68 68 ASN CB C 68 39.100 41.041 -1.941 1
1 910 . 13 1 1 A 68 68 ASN N N 68 120.500 125.505 -5.005 1
1 912 . 13 1 1 A 69 69 LYS H H 69 8.230 8.569 -0.339 1
1 913 . 13 1 1 A 69 69 LYS HA H 69 4.260 4.348 -0.088 1
1 922 . 13 1 1 A 69 69 LYS C C 69 176.900 176.978 -0.078 1
1 923 . 13 1 1 A 69 69 LYS CA C 69 57.000 56.646 0.354 1
1 924 . 13 1 1 A 69 69 LYS CB C 69 32.800 32.694 0.106 1
1 928 . 13 1 1 A 69 69 LYS N N 69 121.300 124.417 -3.117 1
1 929 . 13 1 1 A 70 70 LEU H H 70 8.150 8.594 -0.444 1
1 930 . 13 1 1 A 70 70 LEU HA H 70 4.300 4.389 -0.089 1
1 940 . 13 1 1 A 70 70 LEU C C 70 178.900 178.002 0.898 1
1 941 . 13 1 1 A 70 70 LEU CA C 70 55.400 55.027 0.373 1
1 942 . 13 1 1 A 70 70 LEU CB C 70 42.100 41.730 0.370 1
1 946 . 13 1 1 A 70 70 LEU N N 70 121.900 123.830 -1.930 1
1 947 . 13 1 1 A 71 71 GLU H H 71 8.210 7.795 0.415 1
1 948 . 13 1 1 A 71 71 GLU HA H 71 4.180 4.476 -0.296 1
1 953 . 13 1 1 A 71 71 GLU C C 71 176.300 176.594 -0.294 1
1 954 . 13 1 1 A 71 71 GLU CA C 71 56.600 56.664 -0.064 1
1 955 . 13 1 1 A 71 71 GLU CB C 71 30.200 30.431 -0.231 1
1 957 . 13 1 1 A 71 71 GLU N N 71 120.900 117.845 3.055 1
1 958 . 13 1 1 A 72 72 HIS H H 72 8.380 8.204 0.176 1
1 959 . 13 1 1 A 72 72 HIS HA H 72 4.600 4.178 0.422 1
1 962 . 13 1 1 A 72 72 HIS C C 72 174.600 174.799 -0.199 1
1 963 . 13 1 1 A 72 72 HIS CA C 72 55.600 56.681 -1.081 1
1 964 . 13 1 1 A 72 72 HIS CB C 72 29.600 27.413 2.187 1
1 965 . 13 1 1 A 72 72 HIS N N 72 119.300 117.332 1.968 1
1 966 . 13 1 1 A 73 73 HIS H H 73 8.410 7.844 0.566 1
1 967 . 13 1 1 A 73 73 HIS HA H 73 4.610 4.568 0.042 1
1 970 . 13 1 1 A 73 73 HIS C C 73 173.700 175.301 -1.601 1
1 971 . 13 1 1 A 73 73 HIS CA C 73 55.700 55.681 0.019 1
1 972 . 13 1 1 A 73 73 HIS CB C 73 29.600 30.894 -1.294 1
1 973 . 13 1 1 A 73 73 HIS N N 73 119.410 120.208 -0.798 1
1 974 . 13 1 1 A 74 74 HIS H H 74 8.310 8.901 -0.591 1
1 975 . 13 1 1 A 74 74 HIS HA H 74 4.630 4.069 0.561 1
1 978 . 13 1 1 A 74 74 HIS CA C 74 57.100 56.860 0.240 1
1 979 . 13 1 1 A 74 74 HIS CB C 74 29.800 28.438 1.362 1
1 14 . 14 1 1 A 2 2 GLU H H 2 9.070 8.614 0.456 1
1 15 . 14 1 1 A 2 2 GLU HA H 2 4.520 4.337 0.183 1
1 20 . 14 1 1 A 2 2 GLU C C 2 176.300 177.391 -1.091 1
1 21 . 14 1 1 A 2 2 GLU CA C 2 55.800 58.353 -2.553 1
1 22 . 14 1 1 A 2 2 GLU CB C 2 31.000 28.692 2.308 1
1 24 . 14 1 1 A 2 2 GLU N N 2 123.100 123.323 -0.223 1
1 25 . 14 1 1 A 3 3 LEU H H 3 8.750 8.676 0.074 1
1 26 . 14 1 1 A 3 3 LEU HA H 3 3.750 3.977 -0.227 1
1 36 . 14 1 1 A 3 3 LEU C C 3 177.400 178.641 -1.241 1
1 37 . 14 1 1 A 3 3 LEU CA C 3 58.300 57.713 0.587 1
1 38 . 14 1 1 A 3 3 LEU CB C 3 41.500 41.590 -0.090 1
1 42 . 14 1 1 A 3 3 LEU N N 3 122.600 124.235 -1.635 1
1 43 . 14 1 1 A 4 4 SER H H 4 8.350 8.016 0.334 1
1 44 . 14 1 1 A 4 4 SER HA H 4 3.890 4.042 -0.152 1
1 47 . 14 1 1 A 4 4 SER C C 4 175.100 176.280 -1.180 1
1 48 . 14 1 1 A 4 4 SER CA C 4 61.500 62.001 -0.501 1
1 49 . 14 1 1 A 4 4 SER CB C 4 62.000 62.429 -0.429 1
1 50 . 14 1 1 A 4 4 SER N N 4 112.900 114.147 -1.247 1
1 51 . 14 1 1 A 5 5 ASN H H 5 7.180 8.402 -1.222 1
1 52 . 14 1 1 A 5 5 ASN HA H 5 4.470 4.452 0.018 1
1 57 . 14 1 1 A 5 5 ASN C C 5 177.400 177.381 0.019 1
1 58 . 14 1 1 A 5 5 ASN CA C 5 56.000 56.638 -0.638 1
1 59 . 14 1 1 A 5 5 ASN CB C 5 39.400 38.726 0.674 1
1 61 . 14 1 1 A 5 5 ASN N N 5 116.600 120.272 -3.672 1
1 63 . 14 1 1 A 6 6 GLU H H 6 7.950 7.783 0.167 1
1 64 . 14 1 1 A 6 6 GLU HA H 6 4.070 4.045 0.025 1
1 69 . 14 1 1 A 6 6 GLU C C 6 178.500 179.299 -0.799 1
1 70 . 14 1 1 A 6 6 GLU CA C 6 58.100 59.278 -1.178 1
1 71 . 14 1 1 A 6 6 GLU CB C 6 29.300 29.548 -0.248 1
1 73 . 14 1 1 A 6 6 GLU N N 6 117.600 119.536 -1.936 1
1 74 . 14 1 1 A 7 7 LEU H H 7 8.140 8.772 -0.632 1
1 75 . 14 1 1 A 7 7 LEU HA H 7 3.640 4.000 -0.360 1
1 85 . 14 1 1 A 7 7 LEU C C 7 177.700 179.287 -1.587 1
1 86 . 14 1 1 A 7 7 LEU CA C 7 58.300 58.035 0.265 1
1 87 . 14 1 1 A 7 7 LEU CB C 7 40.600 41.350 -0.750 1
1 91 . 14 1 1 A 7 7 LEU N N 7 118.500 120.344 -1.844 1
1 92 . 14 1 1 A 8 8 LYS H H 8 7.090 7.855 -0.765 1
1 93 . 14 1 1 A 8 8 LYS HA H 8 4.080 3.992 0.088 1
1 102 . 14 1 1 A 8 8 LYS C C 8 178.300 179.123 -0.823 1
1 103 . 14 1 1 A 8 8 LYS CA C 8 59.700 59.630 0.070 1
1 104 . 14 1 1 A 8 8 LYS CB C 8 32.300 32.585 -0.285 1
1 108 . 14 1 1 A 8 8 LYS N N 8 118.200 118.392 -0.192 1
1 109 . 14 1 1 A 9 9 VAL H H 9 7.940 8.370 -0.430 1
1 110 . 14 1 1 A 9 9 VAL HA H 9 3.440 3.519 -0.079 1
1 118 . 14 1 1 A 9 9 VAL C C 9 179.500 177.317 2.183 1
1 119 . 14 1 1 A 9 9 VAL CA C 9 66.700 66.606 0.094 1
1 120 . 14 1 1 A 9 9 VAL CB C 9 31.600 31.271 0.329 1
1 123 . 14 1 1 A 9 9 VAL N N 9 117.600 120.198 -2.598 1
1 124 . 14 1 1 A 10 10 GLU H H 10 7.830 8.041 -0.211 1
1 125 . 14 1 1 A 10 10 GLU HA H 10 4.130 3.958 0.172 1
1 130 . 14 1 1 A 10 10 GLU C C 10 178.700 179.039 -0.339 1
1 131 . 14 1 1 A 10 10 GLU CA C 10 58.300 59.590 -1.290 1
1 132 . 14 1 1 A 10 10 GLU CB C 10 28.500 28.935 -0.435 1
1 134 . 14 1 1 A 10 10 GLU N N 10 118.300 118.426 -0.126 1
1 135 . 14 1 1 A 11 11 ARG H H 11 8.330 7.922 0.408 1
1 136 . 14 1 1 A 11 11 ARG HA H 11 3.770 4.096 -0.326 1
1 144 . 14 1 1 A 11 11 ARG C C 11 174.600 178.913 -4.313 1
1 145 . 14 1 1 A 11 11 ARG CA C 11 61.300 58.902 2.398 1
1 146 . 14 1 1 A 11 11 ARG CB C 11 28.500 29.947 -1.447 1
1 149 . 14 1 1 A 11 11 ARG N N 11 121.400 120.263 1.137 1
1 151 . 14 1 1 A 12 12 ILE H H 12 8.540 8.460 0.080 1
1 152 . 14 1 1 A 12 12 ILE HA H 12 3.780 3.754 0.026 1
1 162 . 14 1 1 A 12 12 ILE C C 12 181.400 177.852 3.548 1
1 163 . 14 1 1 A 12 12 ILE CA C 12 64.800 64.875 -0.075 1
1 164 . 14 1 1 A 12 12 ILE CB C 12 37.700 37.634 0.066 1
1 168 . 14 1 1 A 12 12 ILE N N 12 118.700 119.780 -1.080 1
1 169 . 14 1 1 A 13 13 ARG H H 13 8.470 7.958 0.512 1
1 170 . 14 1 1 A 13 13 ARG HA H 13 4.060 4.057 0.003 1
1 178 . 14 1 1 A 13 13 ARG C C 13 178.600 178.403 0.197 1
1 179 . 14 1 1 A 13 13 ARG CA C 13 59.600 58.957 0.643 1
1 180 . 14 1 1 A 13 13 ARG CB C 13 30.000 30.106 -0.106 1
1 183 . 14 1 1 A 13 13 ARG N N 13 124.600 121.687 2.913 1
1 185 . 14 1 1 A 14 14 LEU H H 14 7.430 8.393 -0.963 1
1 186 . 14 1 1 A 14 14 LEU HA H 14 4.240 4.350 -0.110 1
1 196 . 14 1 1 A 14 14 LEU C C 14 176.000 176.353 -0.353 1
1 197 . 14 1 1 A 14 14 LEU CA C 14 55.300 54.553 0.747 1
1 198 . 14 1 1 A 14 14 LEU CB C 14 43.000 41.975 1.025 1
1 202 . 14 1 1 A 14 14 LEU N N 14 118.500 118.341 0.159 1
1 203 . 14 1 1 A 15 15 SER H H 15 8.260 7.991 0.269 1
1 204 . 14 1 1 A 15 15 SER HA H 15 4.030 4.401 -0.371 1
1 207 . 14 1 1 A 15 15 SER C C 15 174.000 173.482 0.518 1
1 208 . 14 1 1 A 15 15 SER CA C 15 58.700 58.932 -0.232 1
1 209 . 14 1 1 A 15 15 SER CB C 15 61.300 60.754 0.546 1
1 210 . 14 1 1 A 15 15 SER N N 15 112.500 114.165 -1.665 1
1 211 . 14 1 1 A 16 16 LEU H H 16 7.310 7.656 -0.346 1
1 212 . 14 1 1 A 16 16 LEU HA H 16 4.880 4.776 0.104 1
1 222 . 14 1 1 A 16 16 LEU C C 16 177.900 176.976 0.924 1
1 223 . 14 1 1 A 16 16 LEU CA C 16 52.600 53.185 -0.585 1
1 224 . 14 1 1 A 16 16 LEU CB C 16 43.500 43.963 -0.463 1
1 228 . 14 1 1 A 16 16 LEU N N 16 117.800 122.925 -5.125 1
1 229 . 14 1 1 A 17 17 THR H H 17 8.640 8.797 -0.157 1
1 230 . 14 1 1 A 17 17 THR HA H 17 4.250 4.834 -0.584 1
1 235 . 14 1 1 A 17 17 THR C C 17 174.900 175.747 -0.847 1
1 236 . 14 1 1 A 17 17 THR CA C 17 60.500 60.509 -0.009 1
1 237 . 14 1 1 A 17 17 THR CB C 17 70.500 70.626 -0.126 1
1 239 . 14 1 1 A 17 17 THR N N 17 115.200 115.736 -0.536 1
1 240 . 14 1 1 A 18 18 ALA H H 18 8.820 9.070 -0.250 1
1 241 . 14 1 1 A 18 18 ALA HA H 18 3.680 3.991 -0.311 1
1 245 . 14 1 1 A 18 18 ALA C C 18 178.900 179.830 -0.930 1
1 246 . 14 1 1 A 18 18 ALA CA C 18 55.200 55.227 -0.027 1
1 247 . 14 1 1 A 18 18 ALA CB C 18 17.800 18.056 -0.256 1
1 248 . 14 1 1 A 18 18 ALA N N 18 125.600 126.485 -0.885 1
1 249 . 14 1 1 A 19 19 LYS H H 19 8.280 8.103 0.177 1
1 250 . 14 1 1 A 19 19 LYS HA H 19 3.740 3.998 -0.258 1
1 259 . 14 1 1 A 19 19 LYS C C 19 177.900 178.726 -0.826 1
1 260 . 14 1 1 A 19 19 LYS CA C 19 59.800 59.237 0.563 1
1 261 . 14 1 1 A 19 19 LYS CB C 19 33.300 32.112 1.188 1
1 265 . 14 1 1 A 19 19 LYS N N 19 115.800 118.126 -2.326 1
1 266 . 14 1 1 A 20 20 SER H H 20 7.860 7.727 0.133 1
1 267 . 14 1 1 A 20 20 SER HA H 20 4.210 4.228 -0.018 1
1 271 . 14 1 1 A 20 20 SER C C 20 177.200 177.519 -0.319 1
1 272 . 14 1 1 A 20 20 SER CA C 20 61.900 61.575 0.325 1
1 273 . 14 1 1 A 20 20 SER CB C 20 63.000 63.092 -0.092 1
1 274 . 14 1 1 A 20 20 SER N N 20 114.600 114.643 -0.043 1
1 275 . 14 1 1 A 21 21 VAL H H 21 7.830 8.157 -0.327 1
1 276 . 14 1 1 A 21 21 VAL HA H 21 3.280 3.547 -0.267 1
1 284 . 14 1 1 A 21 21 VAL C C 21 177.500 177.963 -0.463 1
1 285 . 14 1 1 A 21 21 VAL CA C 21 66.800 66.458 0.342 1
1 286 . 14 1 1 A 21 21 VAL CB C 21 31.400 31.540 -0.140 1
1 289 . 14 1 1 A 21 21 VAL N N 21 122.600 121.029 1.571 1
1 290 . 14 1 1 A 22 22 ALA H H 22 8.230 8.719 -0.489 1
1 291 . 14 1 1 A 22 22 ALA HA H 22 3.510 3.852 -0.342 1
1 295 . 14 1 1 A 22 22 ALA C C 22 179.500 180.047 -0.547 1
1 296 . 14 1 1 A 22 22 ALA CA C 22 55.500 55.855 -0.355 1
1 297 . 14 1 1 A 22 22 ALA CB C 22 16.900 18.109 -1.209 1
1 298 . 14 1 1 A 22 22 ALA N N 22 121.200 122.471 -1.271 1
1 299 . 14 1 1 A 23 23 GLU H H 23 7.900 8.005 -0.105 1
1 300 . 14 1 1 A 23 23 GLU HA H 23 3.990 4.001 -0.011 1
1 305 . 14 1 1 A 23 23 GLU C C 23 180.000 179.172 0.828 1
1 306 . 14 1 1 A 23 23 GLU CA C 23 59.300 59.410 -0.110 1
1 307 . 14 1 1 A 23 23 GLU CB C 23 29.300 29.165 0.135 1
1 309 . 14 1 1 A 23 23 GLU N N 23 115.300 117.661 -2.361 1
1 310 . 14 1 1 A 24 24 GLU H H 24 7.950 8.052 -0.102 1
1 311 . 14 1 1 A 24 24 GLU HA H 24 4.060 4.050 0.010 1
1 316 . 14 1 1 A 24 24 GLU C C 24 179.100 179.322 -0.222 1
1 317 . 14 1 1 A 24 24 GLU CA C 24 59.700 59.083 0.617 1
1 318 . 14 1 1 A 24 24 GLU CB C 24 29.500 29.855 -0.355 1
1 320 . 14 1 1 A 24 24 GLU N N 24 120.100 120.720 -0.620 1
1 321 . 14 1 1 A 25 25 MET H H 25 8.150 8.531 -0.381 1
1 322 . 14 1 1 A 25 25 MET HA H 25 4.110 4.308 -0.198 1
1 330 . 14 1 1 A 25 25 MET C C 25 176.600 176.595 0.005 1
1 331 . 14 1 1 A 25 25 MET CA C 25 57.100 56.660 0.440 1
1 332 . 14 1 1 A 25 25 MET CB C 25 34.900 32.682 2.218 1
1 335 . 14 1 1 A 25 25 MET N N 25 115.500 117.422 -1.922 1
1 336 . 14 1 1 A 26 26 GLY H H 26 7.940 8.404 -0.464 1
1 337 . 14 1 1 A 26 26 GLY HA2 H 26 3.860 3.968 -0.108 1
1 338 . 14 1 1 A 26 26 GLY HA3 H 26 3.960 3.998 -0.038 1
1 339 . 14 1 1 A 26 26 GLY C C 26 175.100 173.790 1.310 1
1 340 . 14 1 1 A 26 26 GLY CA C 26 46.600 45.443 1.157 1
1 341 . 14 1 1 A 26 26 GLY N N 26 109.000 106.802 2.198 1
1 342 . 14 1 1 A 27 27 ILE H H 27 7.880 7.478 0.402 1
1 343 . 14 1 1 A 27 27 ILE HA H 27 4.790 4.857 -0.067 1
1 353 . 14 1 1 A 27 27 ILE C C 27 174.300 174.797 -0.497 1
1 354 . 14 1 1 A 27 27 ILE CA C 27 59.000 58.563 0.437 1
1 355 . 14 1 1 A 27 27 ILE CB C 27 40.900 41.485 -0.585 1
1 359 . 14 1 1 A 27 27 ILE N N 27 112.700 115.879 -3.179 1
1 360 . 14 1 1 A 28 28 SER H H 28 8.570 8.732 -0.162 1
1 361 . 14 1 1 A 28 28 SER HA H 28 4.540 4.519 0.021 1
1 364 . 14 1 1 A 28 28 SER C C 28 175.600 175.155 0.445 1
1 365 . 14 1 1 A 28 28 SER CA C 28 56.800 58.168 -1.368 1
1 366 . 14 1 1 A 28 28 SER CB C 28 65.500 63.929 1.571 1
1 367 . 14 1 1 A 28 28 SER N N 28 115.400 119.852 -4.452 1
1 368 . 14 1 1 A 29 29 ARG H H 29 8.980 8.749 0.231 1
1 369 . 14 1 1 A 29 29 ARG HA H 29 3.660 3.987 -0.327 1
1 377 . 14 1 1 A 29 29 ARG C C 29 178.700 178.038 0.662 1
1 378 . 14 1 1 A 29 29 ARG CA C 29 59.500 60.124 -0.624 1
1 379 . 14 1 1 A 29 29 ARG CB C 29 29.500 29.868 -0.368 1
1 382 . 14 1 1 A 29 29 ARG N N 29 122.000 124.787 -2.787 1
1 384 . 14 1 1 A 30 30 GLN H H 30 8.580 8.380 0.200 1
1 385 . 14 1 1 A 30 30 GLN HA H 30 3.860 4.061 -0.201 1
1 392 . 14 1 1 A 30 30 GLN C C 30 178.100 178.223 -0.123 1
1 393 . 14 1 1 A 30 30 GLN CA C 30 59.200 58.663 0.537 1
1 394 . 14 1 1 A 30 30 GLN CB C 30 28.100 28.708 -0.608 1
1 397 . 14 1 1 A 30 30 GLN N N 30 118.700 116.903 1.797 1
1 399 . 14 1 1 A 31 31 GLN H H 31 7.990 7.819 0.171 1
1 400 . 14 1 1 A 31 31 GLN HA H 31 3.980 4.083 -0.103 1
1 407 . 14 1 1 A 31 31 GLN C C 31 178.700 178.206 0.494 1
1 408 . 14 1 1 A 31 31 GLN CA C 31 59.100 58.697 0.403 1
1 409 . 14 1 1 A 31 31 GLN CB C 31 28.700 28.154 0.546 1
1 412 . 14 1 1 A 31 31 GLN N N 31 119.600 119.084 0.516 1
1 414 . 14 1 1 A 32 32 LEU H H 32 7.630 7.744 -0.114 1
1 415 . 14 1 1 A 32 32 LEU HA H 32 3.740 4.136 -0.396 1
1 425 . 14 1 1 A 32 32 LEU C C 32 178.300 179.206 -0.906 1
1 426 . 14 1 1 A 32 32 LEU CA C 32 57.700 57.567 0.133 1
1 427 . 14 1 1 A 32 32 LEU CB C 32 41.500 41.419 0.081 1
1 431 . 14 1 1 A 32 32 LEU N N 32 120.700 120.708 -0.008 1
1 432 . 14 1 1 A 33 33 CYS H H 33 8.240 8.844 -0.604 1
1 433 . 14 1 1 A 33 33 CYS HA H 33 3.990 4.064 -0.074 1
1 436 . 14 1 1 A 33 33 CYS C C 33 177.000 177.095 -0.095 1
1 437 . 14 1 1 A 33 33 CYS CA C 33 63.100 63.300 -0.200 1
1 438 . 14 1 1 A 33 33 CYS CB C 33 26.100 26.450 -0.350 1
1 439 . 14 1 1 A 33 33 CYS N N 33 117.400 118.038 -0.638 1
1 440 . 14 1 1 A 34 34 ASN H H 34 8.210 7.559 0.651 1
1 441 . 14 1 1 A 34 34 ASN HA H 34 4.370 4.469 -0.099 1
1 446 . 14 1 1 A 34 34 ASN C C 34 178.700 178.148 0.552 1
1 447 . 14 1 1 A 34 34 ASN CA C 34 56.000 56.562 -0.562 1
1 448 . 14 1 1 A 34 34 ASN CB C 34 37.800 37.932 -0.132 1
1 450 . 14 1 1 A 34 34 ASN N N 34 117.300 118.347 -1.047 1
1 452 . 14 1 1 A 35 35 ILE H H 35 7.850 7.423 0.427 1
1 453 . 14 1 1 A 35 35 ILE HA H 35 3.850 3.490 0.360 1
1 463 . 14 1 1 A 35 35 ILE C C 35 178.100 178.004 0.096 1
1 464 . 14 1 1 A 35 35 ILE CA C 35 64.800 65.567 -0.767 1
1 465 . 14 1 1 A 35 35 ILE CB C 35 38.000 37.806 0.194 1
1 469 . 14 1 1 A 35 35 ILE N N 35 120.400 120.601 -0.201 1
1 470 . 14 1 1 A 36 36 GLU H H 36 7.680 8.583 -0.903 1
1 471 . 14 1 1 A 36 36 GLU HA H 36 4.120 4.062 0.058 1
1 476 . 14 1 1 A 36 36 GLU C C 36 176.300 178.717 -2.417 1
1 477 . 14 1 1 A 36 36 GLU CA C 36 58.600 59.443 -0.843 1
1 478 . 14 1 1 A 36 36 GLU CB C 36 30.000 29.183 0.817 1
1 480 . 14 1 1 A 36 36 GLU N N 36 116.500 119.553 -3.053 1
1 481 . 14 1 1 A 37 37 GLN H H 37 7.630 7.923 -0.293 1
1 482 . 14 1 1 A 37 37 GLN HA H 37 4.540 4.288 0.252 1
1 489 . 14 1 1 A 37 37 GLN C C 37 176.000 175.324 0.676 1
1 490 . 14 1 1 A 37 37 GLN CA C 37 54.900 56.600 -1.700 1
1 491 . 14 1 1 A 37 37 GLN CB C 37 29.600 29.070 0.530 1
1 494 . 14 1 1 A 37 37 GLN N N 37 115.000 117.419 -2.419 1
1 496 . 14 1 1 A 38 38 SER H H 38 7.380 7.584 -0.204 1
1 497 . 14 1 1 A 38 38 SER HA H 38 4.410 4.831 -0.421 1
1 500 . 14 1 1 A 38 38 SER C C 38 175.500 172.518 2.982 1
1 501 . 14 1 1 A 38 38 SER CA C 38 59.200 58.130 1.070 1
1 502 . 14 1 1 A 38 38 SER CB C 38 64.100 66.304 -2.204 1
1 503 . 14 1 1 A 38 38 SER N N 38 115.200 112.816 2.384 1
1 504 . 14 1 1 A 39 39 GLU H H 39 9.040 8.512 0.528 1
1 505 . 14 1 1 A 39 39 GLU HA H 39 4.450 5.126 -0.676 1
1 510 . 14 1 1 A 39 39 GLU C C 39 176.300 175.994 0.306 1
1 511 . 14 1 1 A 39 39 GLU CA C 39 57.100 55.014 2.086 1
1 512 . 14 1 1 A 39 39 GLU CB C 39 30.300 31.327 -1.027 1
1 514 . 14 1 1 A 39 39 GLU N N 39 125.400 124.001 1.399 1
1 515 . 14 1 1 A 40 40 THR H H 40 7.920 8.743 -0.823 1
1 516 . 14 1 1 A 40 40 THR HA H 40 4.590 4.711 -0.121 1
1 521 . 14 1 1 A 40 40 THR C C 40 173.500 173.812 -0.312 1
1 522 . 14 1 1 A 40 40 THR CA C 40 60.500 60.786 -0.286 1
1 523 . 14 1 1 A 40 40 THR CB C 40 71.100 70.904 0.196 1
1 525 . 14 1 1 A 40 40 THR N N 40 112.800 115.725 -2.925 1
1 526 . 14 1 1 A 41 41 ALA H H 41 8.780 8.730 0.050 1
1 527 . 14 1 1 A 41 41 ALA HA H 41 4.870 4.850 0.020 1
1 531 . 14 1 1 A 41 41 ALA CA C 41 49.700 48.719 0.981 1
1 532 . 14 1 1 A 41 41 ALA CB C 41 19.300 20.490 -1.190 1
1 533 . 14 1 1 A 41 41 ALA N N 41 127.000 124.097 2.903 1
1 534 . 14 1 1 A 42 42 PRO HA H 42 4.660 4.722 -0.062 1
1 541 . 14 1 1 A 42 42 PRO C C 42 178.300 177.560 0.740 1
1 542 . 14 1 1 A 42 42 PRO CA C 42 62.500 62.536 -0.036 1
1 543 . 14 1 1 A 42 42 PRO CB C 42 32.600 32.912 -0.312 1
1 546 . 14 1 1 A 43 43 VAL H H 43 8.840 8.683 0.157 1
1 547 . 14 1 1 A 43 43 VAL HA H 43 3.660 3.756 -0.096 1
1 555 . 14 1 1 A 43 43 VAL CA C 43 66.800 65.177 1.623 1
1 556 . 14 1 1 A 43 43 VAL CB C 43 31.100 31.596 -0.496 1
1 559 . 14 1 1 A 43 43 VAL N N 43 123.000 122.558 0.442 1
1 560 . 14 1 1 A 44 44 VAL HA H 44 4.030 3.719 0.311 1
1 568 . 14 1 1 A 44 44 VAL C C 44 176.700 178.499 -1.799 1
1 569 . 14 1 1 A 44 44 VAL CA C 44 65.900 67.038 -1.138 1
1 570 . 14 1 1 A 44 44 VAL CB C 44 30.900 31.569 -0.669 1
1 573 . 14 1 1 A 45 45 VAL H H 45 7.500 7.903 -0.403 1
1 574 . 14 1 1 A 45 45 VAL HA H 45 3.760 3.611 0.149 1
1 582 . 14 1 1 A 45 45 VAL C C 45 177.500 177.972 -0.472 1
1 583 . 14 1 1 A 45 45 VAL CA C 45 66.700 66.762 -0.062 1
1 584 . 14 1 1 A 45 45 VAL CB C 45 31.000 31.389 -0.389 1
1 587 . 14 1 1 A 45 45 VAL N N 45 120.100 120.123 -0.023 1
1 588 . 14 1 1 A 46 46 LYS H H 46 7.610 7.750 -0.140 1
1 589 . 14 1 1 A 46 46 LYS HA H 46 4.140 3.991 0.149 1
1 598 . 14 1 1 A 46 46 LYS C C 46 179.500 178.806 0.694 1
1 599 . 14 1 1 A 46 46 LYS CA C 46 59.900 59.437 0.463 1
1 600 . 14 1 1 A 46 46 LYS CB C 46 31.500 32.080 -0.580 1
1 604 . 14 1 1 A 46 46 LYS N N 46 120.700 118.508 2.192 1
1 605 . 14 1 1 A 47 47 TYR H H 47 8.550 7.808 0.742 1
1 606 . 14 1 1 A 47 47 TYR HA H 47 5.000 4.326 0.674 1
1 613 . 14 1 1 A 47 47 TYR C C 47 177.300 177.478 -0.178 1
1 614 . 14 1 1 A 47 47 TYR CA C 47 57.300 61.331 -4.031 1
1 615 . 14 1 1 A 47 47 TYR CB C 47 37.700 38.759 -1.059 1
1 620 . 14 1 1 A 47 47 TYR N N 47 122.700 120.465 2.235 1
1 621 . 14 1 1 A 48 48 ILE H H 48 8.250 8.281 -0.031 1
1 622 . 14 1 1 A 48 48 ILE HA H 48 3.160 3.732 -0.572 1
1 632 . 14 1 1 A 48 48 ILE C C 48 177.100 178.045 -0.945 1
1 633 . 14 1 1 A 48 48 ILE CA C 48 67.000 65.669 1.331 1
1 634 . 14 1 1 A 48 48 ILE CB C 48 37.800 38.513 -0.713 1
1 638 . 14 1 1 A 48 48 ILE N N 48 121.200 120.965 0.235 1
1 639 . 14 1 1 A 49 49 ALA H H 49 8.310 8.977 -0.667 1
1 640 . 14 1 1 A 49 49 ALA HA H 49 3.940 4.030 -0.090 1
1 644 . 14 1 1 A 49 49 ALA C C 49 179.300 179.321 -0.021 1
1 645 . 14 1 1 A 49 49 ALA CA C 49 55.500 55.107 0.393 1
1 646 . 14 1 1 A 49 49 ALA CB C 49 18.200 18.432 -0.232 1
1 647 . 14 1 1 A 49 49 ALA N N 49 120.300 120.652 -0.352 1
1 648 . 14 1 1 A 50 50 PHE H H 50 8.630 8.524 0.106 1
1 649 . 14 1 1 A 50 50 PHE HA H 50 4.200 4.239 -0.039 1
1 656 . 14 1 1 A 50 50 PHE C C 50 179.000 176.778 2.222 1
1 657 . 14 1 1 A 50 50 PHE CA C 50 61.300 61.492 -0.192 1
1 658 . 14 1 1 A 50 50 PHE CB C 50 39.200 39.380 -0.180 1
1 663 . 14 1 1 A 50 50 PHE N N 50 121.300 120.035 1.265 1
1 664 . 14 1 1 A 51 51 LEU H H 51 8.920 8.626 0.294 1
1 665 . 14 1 1 A 51 51 LEU HA H 51 3.630 3.775 -0.145 1
1 675 . 14 1 1 A 51 51 LEU C C 51 180.000 179.418 0.582 1
1 676 . 14 1 1 A 51 51 LEU CA C 51 58.100 57.728 0.372 1
1 677 . 14 1 1 A 51 51 LEU CB C 51 39.800 41.488 -1.688 1
1 681 . 14 1 1 A 51 51 LEU N N 51 121.900 118.856 3.044 1
1 682 . 14 1 1 A 52 52 ARG H H 52 8.410 8.427 -0.017 1
1 683 . 14 1 1 A 52 52 ARG HA H 52 4.420 4.035 0.385 1
1 691 . 14 1 1 A 52 52 ARG C C 52 179.800 179.163 0.637 1
1 692 . 14 1 1 A 52 52 ARG CA C 52 57.800 59.720 -1.920 1
1 693 . 14 1 1 A 52 52 ARG CB C 52 28.200 29.841 -1.641 1
1 695 . 14 1 1 A 52 52 ARG N N 52 120.500 119.573 0.927 1
1 697 . 14 1 1 A 53 53 SER H H 53 8.480 8.264 0.216 1
1 698 . 14 1 1 A 53 53 SER HA H 53 4.300 4.187 0.113 1
1 701 . 14 1 1 A 53 53 SER C C 53 174.600 175.445 -0.845 1
1 702 . 14 1 1 A 53 53 SER CA C 53 61.500 61.205 0.295 1
1 703 . 14 1 1 A 53 53 SER CB C 53 62.300 62.788 -0.488 1
1 704 . 14 1 1 A 53 53 SER N N 53 119.500 114.285 5.215 1
1 705 . 14 1 1 A 54 54 LYS H H 54 7.080 7.285 -0.205 1
1 706 . 14 1 1 A 54 54 LYS HA H 54 4.350 4.280 0.070 1
1 715 . 14 1 1 A 54 54 LYS C C 54 176.500 176.876 -0.376 1
1 716 . 14 1 1 A 54 54 LYS CA C 54 53.700 55.778 -2.078 1
1 717 . 14 1 1 A 54 54 LYS CB C 54 31.800 32.812 -1.012 1
1 721 . 14 1 1 A 54 54 LYS N N 54 119.200 119.123 0.077 1
1 722 . 14 1 1 A 55 55 GLY H H 55 8.040 8.265 -0.225 1
1 723 . 14 1 1 A 55 55 GLY HA2 H 55 3.540 3.958 -0.418 1
1 724 . 14 1 1 A 55 55 GLY HA3 H 55 4.300 3.959 0.341 1
1 725 . 14 1 1 A 55 55 GLY C C 55 174.500 175.034 -0.534 1
1 726 . 14 1 1 A 55 55 GLY CA C 55 44.700 46.020 -1.320 1
1 727 . 14 1 1 A 55 55 GLY N N 55 106.600 107.836 -1.236 1
1 728 . 14 1 1 A 56 56 VAL H H 56 7.580 7.638 -0.058 1
1 729 . 14 1 1 A 56 56 VAL HA H 56 3.630 3.995 -0.365 1
1 737 . 14 1 1 A 56 56 VAL C C 56 174.700 175.100 -0.400 1
1 738 . 14 1 1 A 56 56 VAL CA C 56 64.000 65.421 -1.421 1
1 739 . 14 1 1 A 56 56 VAL CB C 56 31.600 31.856 -0.256 1
1 742 . 14 1 1 A 56 56 VAL N N 56 122.000 118.147 3.853 1
1 743 . 14 1 1 A 57 57 ASP H H 57 8.440 7.925 0.515 1
1 744 . 14 1 1 A 57 57 ASP HA H 57 4.500 4.278 0.222 1
1 747 . 14 1 1 A 57 57 ASP C C 57 176.900 176.137 0.763 1
1 748 . 14 1 1 A 57 57 ASP CA C 57 52.600 54.755 -2.155 1
1 749 . 14 1 1 A 57 57 ASP CB C 57 39.900 39.015 0.885 1
1 750 . 14 1 1 A 57 57 ASP N N 57 124.100 118.264 5.836 1
1 751 . 14 1 1 A 58 58 LEU H H 58 9.720 7.975 1.745 1
1 752 . 14 1 1 A 58 58 LEU HA H 58 4.020 4.400 -0.380 1
1 762 . 14 1 1 A 58 58 LEU C C 58 179.400 178.510 0.890 1
1 763 . 14 1 1 A 58 58 LEU CA C 58 56.300 55.228 1.072 1
1 764 . 14 1 1 A 58 58 LEU CB C 58 43.300 41.742 1.558 1
1 768 . 14 1 1 A 58 58 LEU N N 58 127.800 117.888 9.912 1
1 769 . 14 1 1 A 59 59 ASN H H 59 7.740 8.595 -0.855 1
1 770 . 14 1 1 A 59 59 ASN HA H 59 4.340 4.445 -0.105 1
1 775 . 14 1 1 A 59 59 ASN C C 59 176.300 177.289 -0.989 1
1 776 . 14 1 1 A 59 59 ASN CA C 59 56.300 56.156 0.144 1
1 777 . 14 1 1 A 59 59 ASN CB C 59 36.400 37.778 -1.378 1
1 779 . 14 1 1 A 59 59 ASN N N 59 119.500 118.309 1.191 1
1 781 . 14 1 1 A 60 60 ALA H H 60 7.220 7.632 -0.412 1
1 782 . 14 1 1 A 60 60 ALA HA H 60 4.030 4.154 -0.124 1
1 786 . 14 1 1 A 60 60 ALA C C 60 180.100 180.201 -0.101 1
1 787 . 14 1 1 A 60 60 ALA CA C 60 54.300 55.086 -0.786 1
1 788 . 14 1 1 A 60 60 ALA CB C 60 18.200 18.296 -0.096 1
1 789 . 14 1 1 A 60 60 ALA N N 60 121.400 122.241 -0.841 1
1 790 . 14 1 1 A 61 61 LEU H H 61 7.320 8.148 -0.828 1
1 791 . 14 1 1 A 61 61 LEU HA H 61 3.840 4.112 -0.272 1
1 801 . 14 1 1 A 61 61 LEU C C 61 177.200 178.377 -1.177 1
1 802 . 14 1 1 A 61 61 LEU CA C 61 58.500 58.121 0.379 1
1 803 . 14 1 1 A 61 61 LEU CB C 61 42.600 41.916 0.684 1
1 807 . 14 1 1 A 61 61 LEU N N 61 118.600 120.509 -1.909 1
1 808 . 14 1 1 A 62 62 PHE H H 62 8.360 8.731 -0.371 1
1 809 . 14 1 1 A 62 62 PHE HA H 62 3.930 4.128 -0.198 1
1 817 . 14 1 1 A 62 62 PHE C C 62 178.200 177.657 0.543 1
1 818 . 14 1 1 A 62 62 PHE CA C 62 62.800 61.349 1.451 1
1 819 . 14 1 1 A 62 62 PHE CB C 62 38.500 37.772 0.728 1
1 825 . 14 1 1 A 62 62 PHE N N 62 114.400 117.766 -3.366 1
1 826 . 14 1 1 A 63 63 ASP H H 63 8.680 8.751 -0.071 1
1 827 . 14 1 1 A 63 63 ASP HA H 63 4.530 4.356 0.174 1
1 830 . 14 1 1 A 63 63 ASP C C 63 178.600 178.426 0.174 1
1 831 . 14 1 1 A 63 63 ASP CA C 63 57.500 57.724 -0.224 1
1 832 . 14 1 1 A 63 63 ASP CB C 63 39.600 41.843 -2.243 1
1 833 . 14 1 1 A 63 63 ASP N N 63 120.400 120.934 -0.534 1
1 834 . 14 1 1 A 64 64 ARG H H 64 7.540 7.634 -0.094 1
1 835 . 14 1 1 A 64 64 ARG HA H 64 4.290 4.088 0.202 1
1 843 . 14 1 1 A 64 64 ARG C C 64 177.600 178.606 -1.006 1
1 844 . 14 1 1 A 64 64 ARG CA C 64 58.300 59.067 -0.767 1
1 845 . 14 1 1 A 64 64 ARG CB C 64 30.000 30.021 -0.021 1
1 848 . 14 1 1 A 64 64 ARG N N 64 116.800 118.143 -1.343 1
1 850 . 14 1 1 A 65 65 ILE H H 65 7.260 7.850 -0.590 1
1 851 . 14 1 1 A 65 65 ILE HA H 65 4.130 3.820 0.310 1
1 861 . 14 1 1 A 65 65 ILE C C 65 177.000 176.610 0.390 1
1 862 . 14 1 1 A 65 65 ILE CA C 65 62.600 65.154 -2.554 1
1 863 . 14 1 1 A 65 65 ILE CB C 65 38.700 38.130 0.570 1
1 867 . 14 1 1 A 65 65 ILE N N 65 117.000 118.586 -1.586 1
1 868 . 14 1 1 A 66 66 ILE H H 66 7.980 7.459 0.521 1
1 869 . 14 1 1 A 66 66 ILE HA H 66 4.000 4.372 -0.372 1
1 879 . 14 1 1 A 66 66 ILE C C 66 176.400 175.149 1.251 1
1 880 . 14 1 1 A 66 66 ILE CA C 66 63.100 60.887 2.213 1
1 881 . 14 1 1 A 66 66 ILE CB C 66 38.800 36.982 1.818 1
1 885 . 14 1 1 A 66 66 ILE N N 66 120.700 120.997 -0.297 1
1 886 . 14 1 1 A 67 67 VAL H H 67 8.130 8.450 -0.320 1
1 887 . 14 1 1 A 67 67 VAL HA H 67 3.980 4.410 -0.430 1
1 895 . 14 1 1 A 67 67 VAL C C 67 177.300 176.476 0.824 1
1 896 . 14 1 1 A 67 67 VAL CA C 67 63.900 62.968 0.932 1
1 897 . 14 1 1 A 67 67 VAL CB C 67 32.500 33.389 -0.889 1
1 900 . 14 1 1 A 67 67 VAL N N 67 121.600 126.230 -4.630 1
1 901 . 14 1 1 A 68 68 ASN H H 68 8.170 8.220 -0.050 1
1 902 . 14 1 1 A 68 68 ASN HA H 68 4.680 4.938 -0.258 1
1 907 . 14 1 1 A 68 68 ASN CA C 68 54.200 54.062 0.138 1
1 908 . 14 1 1 A 68 68 ASN CB C 68 39.100 39.662 -0.562 1
1 910 . 14 1 1 A 68 68 ASN N N 68 120.500 115.516 4.984 1
1 912 . 14 1 1 A 69 69 LYS H H 69 8.230 7.729 0.501 1
1 913 . 14 1 1 A 69 69 LYS HA H 69 4.260 4.473 -0.213 1
1 922 . 14 1 1 A 69 69 LYS C C 69 176.900 175.585 1.315 1
1 923 . 14 1 1 A 69 69 LYS CA C 69 57.000 55.953 1.047 1
1 924 . 14 1 1 A 69 69 LYS CB C 69 32.800 33.636 -0.836 1
1 928 . 14 1 1 A 69 69 LYS N N 69 121.300 118.853 2.447 1
1 929 . 14 1 1 A 70 70 LEU H H 70 8.150 8.894 -0.744 1
1 930 . 14 1 1 A 70 70 LEU HA H 70 4.300 4.828 -0.528 1
1 940 . 14 1 1 A 70 70 LEU C C 70 178.900 176.114 2.786 1
1 941 . 14 1 1 A 70 70 LEU CA C 70 55.400 52.922 2.478 1
1 942 . 14 1 1 A 70 70 LEU CB C 70 42.100 42.015 0.085 1
1 946 . 14 1 1 A 70 70 LEU N N 70 121.900 120.210 1.690 1
1 947 . 14 1 1 A 71 71 GLU H H 71 8.210 8.743 -0.533 1
1 948 . 14 1 1 A 71 71 GLU HA H 71 4.180 4.433 -0.253 1
1 953 . 14 1 1 A 71 71 GLU C C 71 176.300 176.286 0.014 1
1 954 . 14 1 1 A 71 71 GLU CA C 71 56.600 57.057 -0.457 1
1 955 . 14 1 1 A 71 71 GLU CB C 71 30.200 30.239 -0.039 1
1 957 . 14 1 1 A 71 71 GLU N N 71 120.900 122.036 -1.136 1
1 958 . 14 1 1 A 72 72 HIS H H 72 8.380 8.844 -0.464 1
1 959 . 14 1 1 A 72 72 HIS HA H 72 4.600 4.841 -0.241 1
1 962 . 14 1 1 A 72 72 HIS C C 72 174.600 175.018 -0.418 1
1 963 . 14 1 1 A 72 72 HIS CA C 72 55.600 57.167 -1.567 1
1 964 . 14 1 1 A 72 72 HIS CB C 72 29.600 31.278 -1.678 1
1 965 . 14 1 1 A 72 72 HIS N N 72 119.300 122.761 -3.461 1
1 966 . 14 1 1 A 73 73 HIS H H 73 8.410 8.341 0.069 1
1 967 . 14 1 1 A 73 73 HIS HA H 73 4.610 4.336 0.274 1
1 970 . 14 1 1 A 73 73 HIS C C 73 173.700 174.071 -0.371 1
1 971 . 14 1 1 A 73 73 HIS CA C 73 55.700 58.172 -2.472 1
1 972 . 14 1 1 A 73 73 HIS CB C 73 29.600 29.433 0.167 1
1 973 . 14 1 1 A 73 73 HIS N N 73 119.410 119.637 -0.227 1
1 974 . 14 1 1 A 74 74 HIS H H 74 8.310 8.284 0.026 1
1 975 . 14 1 1 A 74 74 HIS HA H 74 4.630 4.852 -0.222 1
1 978 . 14 1 1 A 74 74 HIS CA C 74 57.100 53.417 3.683 1
1 979 . 14 1 1 A 74 74 HIS CB C 74 29.800 33.121 -3.321 1
1 14 . 15 1 1 A 2 2 GLU H H 2 9.070 8.697 0.373 1
1 15 . 15 1 1 A 2 2 GLU HA H 2 4.520 4.566 -0.046 1
1 20 . 15 1 1 A 2 2 GLU C C 2 176.300 176.557 -0.257 1
1 21 . 15 1 1 A 2 2 GLU CA C 2 55.800 55.380 0.420 1
1 22 . 15 1 1 A 2 2 GLU CB C 2 31.000 30.293 0.707 1
1 24 . 15 1 1 A 2 2 GLU N N 2 123.100 120.075 3.025 1
1 25 . 15 1 1 A 3 3 LEU H H 3 8.750 8.784 -0.034 1
1 26 . 15 1 1 A 3 3 LEU HA H 3 3.750 4.093 -0.343 1
1 36 . 15 1 1 A 3 3 LEU C C 3 177.400 178.434 -1.034 1
1 37 . 15 1 1 A 3 3 LEU CA C 3 58.300 58.229 0.071 1
1 38 . 15 1 1 A 3 3 LEU CB C 3 41.500 41.181 0.319 1
1 42 . 15 1 1 A 3 3 LEU N N 3 122.600 121.992 0.608 1
1 43 . 15 1 1 A 4 4 SER H H 4 8.350 8.330 0.020 1
1 44 . 15 1 1 A 4 4 SER HA H 4 3.890 4.162 -0.272 1
1 47 . 15 1 1 A 4 4 SER C C 4 175.100 176.624 -1.524 1
1 48 . 15 1 1 A 4 4 SER CA C 4 61.500 61.503 -0.003 1
1 49 . 15 1 1 A 4 4 SER CB C 4 62.000 62.246 -0.246 1
1 50 . 15 1 1 A 4 4 SER N N 4 112.900 114.961 -2.061 1
1 51 . 15 1 1 A 5 5 ASN H H 5 7.180 8.213 -1.033 1
1 52 . 15 1 1 A 5 5 ASN HA H 5 4.470 4.415 0.055 1
1 57 . 15 1 1 A 5 5 ASN C C 5 177.400 177.869 -0.469 1
1 58 . 15 1 1 A 5 5 ASN CA C 5 56.000 56.879 -0.879 1
1 59 . 15 1 1 A 5 5 ASN CB C 5 39.400 39.099 0.301 1
1 61 . 15 1 1 A 5 5 ASN N N 5 116.600 120.027 -3.427 1
1 63 . 15 1 1 A 6 6 GLU H H 6 7.950 7.850 0.100 1
1 64 . 15 1 1 A 6 6 GLU HA H 6 4.070 4.063 0.007 1
1 69 . 15 1 1 A 6 6 GLU C C 6 178.500 179.226 -0.726 1
1 70 . 15 1 1 A 6 6 GLU CA C 6 58.100 59.187 -1.087 1
1 71 . 15 1 1 A 6 6 GLU CB C 6 29.300 29.816 -0.516 1
1 73 . 15 1 1 A 6 6 GLU N N 6 117.600 118.416 -0.816 1
1 74 . 15 1 1 A 7 7 LEU H H 7 8.140 8.842 -0.702 1
1 75 . 15 1 1 A 7 7 LEU HA H 7 3.640 4.181 -0.541 1
1 85 . 15 1 1 A 7 7 LEU C C 7 177.700 178.290 -0.590 1
1 86 . 15 1 1 A 7 7 LEU CA C 7 58.300 57.784 0.516 1
1 87 . 15 1 1 A 7 7 LEU CB C 7 40.600 41.511 -0.911 1
1 91 . 15 1 1 A 7 7 LEU N N 7 118.500 120.781 -2.281 1
1 92 . 15 1 1 A 8 8 LYS H H 8 7.090 8.183 -1.093 1
1 93 . 15 1 1 A 8 8 LYS HA H 8 4.080 3.962 0.118 1
1 102 . 15 1 1 A 8 8 LYS C C 8 178.300 178.792 -0.492 1
1 103 . 15 1 1 A 8 8 LYS CA C 8 59.700 59.613 0.087 1
1 104 . 15 1 1 A 8 8 LYS CB C 8 32.300 32.332 -0.032 1
1 108 . 15 1 1 A 8 8 LYS N N 8 118.200 119.262 -1.062 1
1 109 . 15 1 1 A 9 9 VAL H H 9 7.940 7.859 0.081 1
1 110 . 15 1 1 A 9 9 VAL HA H 9 3.440 3.544 -0.104 1
1 118 . 15 1 1 A 9 9 VAL C C 9 179.500 177.776 1.724 1
1 119 . 15 1 1 A 9 9 VAL CA C 9 66.700 66.456 0.244 1
1 120 . 15 1 1 A 9 9 VAL CB C 9 31.600 31.323 0.277 1
1 123 . 15 1 1 A 9 9 VAL N N 9 117.600 119.300 -1.700 1
1 124 . 15 1 1 A 10 10 GLU H H 10 7.830 8.276 -0.446 1
1 125 . 15 1 1 A 10 10 GLU HA H 10 4.130 3.911 0.219 1
1 130 . 15 1 1 A 10 10 GLU C C 10 178.700 179.264 -0.564 1
1 131 . 15 1 1 A 10 10 GLU CA C 10 58.300 59.725 -1.425 1
1 132 . 15 1 1 A 10 10 GLU CB C 10 28.500 29.516 -1.016 1
1 134 . 15 1 1 A 10 10 GLU N N 10 118.300 118.285 0.015 1
1 135 . 15 1 1 A 11 11 ARG H H 11 8.330 7.435 0.895 1
1 136 . 15 1 1 A 11 11 ARG HA H 11 3.770 4.057 -0.287 1
1 144 . 15 1 1 A 11 11 ARG C C 11 174.600 179.090 -4.490 1
1 145 . 15 1 1 A 11 11 ARG CA C 11 61.300 59.059 2.241 1
1 146 . 15 1 1 A 11 11 ARG CB C 11 28.500 29.829 -1.329 1
1 149 . 15 1 1 A 11 11 ARG N N 11 121.400 120.183 1.217 1
1 151 . 15 1 1 A 12 12 ILE H H 12 8.540 7.940 0.600 1
1 152 . 15 1 1 A 12 12 ILE HA H 12 3.780 3.755 0.025 1
1 162 . 15 1 1 A 12 12 ILE C C 12 181.400 177.740 3.660 1
1 163 . 15 1 1 A 12 12 ILE CA C 12 64.800 65.245 -0.445 1
1 164 . 15 1 1 A 12 12 ILE CB C 12 37.700 37.378 0.322 1
1 168 . 15 1 1 A 12 12 ILE N N 12 118.700 119.892 -1.192 1
1 169 . 15 1 1 A 13 13 ARG H H 13 8.470 8.460 0.010 1
1 170 . 15 1 1 A 13 13 ARG HA H 13 4.060 4.030 0.030 1
1 178 . 15 1 1 A 13 13 ARG C C 13 178.600 177.940 0.660 1
1 179 . 15 1 1 A 13 13 ARG CA C 13 59.600 59.428 0.172 1
1 180 . 15 1 1 A 13 13 ARG CB C 13 30.000 29.853 0.147 1
1 183 . 15 1 1 A 13 13 ARG N N 13 124.600 121.754 2.846 1
1 185 . 15 1 1 A 14 14 LEU H H 14 7.430 7.868 -0.438 1
1 186 . 15 1 1 A 14 14 LEU HA H 14 4.240 4.381 -0.141 1
1 196 . 15 1 1 A 14 14 LEU C C 14 176.000 175.920 0.080 1
1 197 . 15 1 1 A 14 14 LEU CA C 14 55.300 54.357 0.943 1
1 198 . 15 1 1 A 14 14 LEU CB C 14 43.000 42.319 0.681 1
1 202 . 15 1 1 A 14 14 LEU N N 14 118.500 118.310 0.190 1
1 203 . 15 1 1 A 15 15 SER H H 15 8.260 7.928 0.332 1
1 204 . 15 1 1 A 15 15 SER HA H 15 4.030 4.391 -0.361 1
1 207 . 15 1 1 A 15 15 SER C C 15 174.000 173.605 0.395 1
1 208 . 15 1 1 A 15 15 SER CA C 15 58.700 58.914 -0.214 1
1 209 . 15 1 1 A 15 15 SER CB C 15 61.300 61.697 -0.397 1
1 210 . 15 1 1 A 15 15 SER N N 15 112.500 113.340 -0.840 1
1 211 . 15 1 1 A 16 16 LEU H H 16 7.310 7.705 -0.395 1
1 212 . 15 1 1 A 16 16 LEU HA H 16 4.880 4.863 0.017 1
1 222 . 15 1 1 A 16 16 LEU C C 16 177.900 176.503 1.397 1
1 223 . 15 1 1 A 16 16 LEU CA C 16 52.600 53.317 -0.717 1
1 224 . 15 1 1 A 16 16 LEU CB C 16 43.500 44.665 -1.165 1
1 228 . 15 1 1 A 16 16 LEU N N 16 117.800 122.284 -4.484 1
1 229 . 15 1 1 A 17 17 THR H H 17 8.640 8.388 0.252 1
1 230 . 15 1 1 A 17 17 THR HA H 17 4.250 5.002 -0.752 1
1 235 . 15 1 1 A 17 17 THR C C 17 174.900 175.633 -0.733 1
1 236 . 15 1 1 A 17 17 THR CA C 17 60.500 59.231 1.269 1
1 237 . 15 1 1 A 17 17 THR CB C 17 70.500 71.562 -1.062 1
1 239 . 15 1 1 A 17 17 THR N N 17 115.200 112.272 2.928 1
1 240 . 15 1 1 A 18 18 ALA H H 18 8.820 9.067 -0.247 1
1 241 . 15 1 1 A 18 18 ALA HA H 18 3.680 3.999 -0.319 1
1 245 . 15 1 1 A 18 18 ALA C C 18 178.900 179.721 -0.821 1
1 246 . 15 1 1 A 18 18 ALA CA C 18 55.200 55.222 -0.022 1
1 247 . 15 1 1 A 18 18 ALA CB C 18 17.800 18.108 -0.308 1
1 248 . 15 1 1 A 18 18 ALA N N 18 125.600 126.421 -0.821 1
1 249 . 15 1 1 A 19 19 LYS H H 19 8.280 8.108 0.172 1
1 250 . 15 1 1 A 19 19 LYS HA H 19 3.740 4.008 -0.268 1
1 259 . 15 1 1 A 19 19 LYS C C 19 177.900 179.325 -1.425 1
1 260 . 15 1 1 A 19 19 LYS CA C 19 59.800 59.220 0.580 1
1 261 . 15 1 1 A 19 19 LYS CB C 19 33.300 32.139 1.161 1
1 265 . 15 1 1 A 19 19 LYS N N 19 115.800 118.005 -2.205 1
1 266 . 15 1 1 A 20 20 SER H H 20 7.860 7.719 0.141 1
1 267 . 15 1 1 A 20 20 SER HA H 20 4.210 4.154 0.056 1
1 271 . 15 1 1 A 20 20 SER C C 20 177.200 176.310 0.890 1
1 272 . 15 1 1 A 20 20 SER CA C 20 61.900 62.507 -0.607 1
1 273 . 15 1 1 A 20 20 SER CB C 20 63.000 63.138 -0.138 1
1 274 . 15 1 1 A 20 20 SER N N 20 114.600 116.704 -2.104 1
1 275 . 15 1 1 A 21 21 VAL H H 21 7.830 7.922 -0.092 1
1 276 . 15 1 1 A 21 21 VAL HA H 21 3.280 3.549 -0.269 1
1 284 . 15 1 1 A 21 21 VAL C C 21 177.500 178.105 -0.605 1
1 285 . 15 1 1 A 21 21 VAL CA C 21 66.800 66.630 0.170 1
1 286 . 15 1 1 A 21 21 VAL CB C 21 31.400 31.457 -0.057 1
1 289 . 15 1 1 A 21 21 VAL N N 21 122.600 121.741 0.859 1
1 290 . 15 1 1 A 22 22 ALA H H 22 8.230 8.676 -0.446 1
1 291 . 15 1 1 A 22 22 ALA HA H 22 3.510 3.954 -0.444 1
1 295 . 15 1 1 A 22 22 ALA C C 22 179.500 179.394 0.106 1
1 296 . 15 1 1 A 22 22 ALA CA C 22 55.500 55.453 0.047 1
1 297 . 15 1 1 A 22 22 ALA CB C 22 16.900 17.874 -0.974 1
1 298 . 15 1 1 A 22 22 ALA N N 22 121.200 121.804 -0.604 1
1 299 . 15 1 1 A 23 23 GLU H H 23 7.900 8.311 -0.411 1
1 300 . 15 1 1 A 23 23 GLU HA H 23 3.990 4.051 -0.061 1
1 305 . 15 1 1 A 23 23 GLU C C 23 180.000 178.310 1.690 1
1 306 . 15 1 1 A 23 23 GLU CA C 23 59.300 59.359 -0.059 1
1 307 . 15 1 1 A 23 23 GLU CB C 23 29.300 29.345 -0.045 1
1 309 . 15 1 1 A 23 23 GLU N N 23 115.300 118.794 -3.494 1
1 310 . 15 1 1 A 24 24 GLU H H 24 7.950 7.775 0.175 1
1 311 . 15 1 1 A 24 24 GLU HA H 24 4.060 4.113 -0.053 1
1 316 . 15 1 1 A 24 24 GLU C C 24 179.100 179.147 -0.047 1
1 317 . 15 1 1 A 24 24 GLU CA C 24 59.700 59.128 0.572 1
1 318 . 15 1 1 A 24 24 GLU CB C 24 29.500 29.192 0.308 1
1 320 . 15 1 1 A 24 24 GLU N N 24 120.100 119.626 0.474 1
1 321 . 15 1 1 A 25 25 MET H H 25 8.150 8.380 -0.230 1
1 322 . 15 1 1 A 25 25 MET HA H 25 4.110 4.316 -0.206 1
1 330 . 15 1 1 A 25 25 MET C C 25 176.600 176.642 -0.042 1
1 331 . 15 1 1 A 25 25 MET CA C 25 57.100 56.840 0.260 1
1 332 . 15 1 1 A 25 25 MET CB C 25 34.900 32.668 2.232 1
1 335 . 15 1 1 A 25 25 MET N N 25 115.500 117.339 -1.839 1
1 336 . 15 1 1 A 26 26 GLY H H 26 7.940 8.498 -0.558 1
1 337 . 15 1 1 A 26 26 GLY HA2 H 26 3.860 3.935 -0.075 1
1 338 . 15 1 1 A 26 26 GLY HA3 H 26 3.960 3.937 0.023 1
1 339 . 15 1 1 A 26 26 GLY C C 26 175.100 173.795 1.305 1
1 340 . 15 1 1 A 26 26 GLY CA C 26 46.600 45.639 0.961 1
1 341 . 15 1 1 A 26 26 GLY N N 26 109.000 106.789 2.211 1
1 342 . 15 1 1 A 27 27 ILE H H 27 7.880 7.309 0.571 1
1 343 . 15 1 1 A 27 27 ILE HA H 27 4.790 4.804 -0.014 1
1 353 . 15 1 1 A 27 27 ILE C C 27 174.300 175.123 -0.823 1
1 354 . 15 1 1 A 27 27 ILE CA C 27 59.000 58.600 0.400 1
1 355 . 15 1 1 A 27 27 ILE CB C 27 40.900 41.514 -0.614 1
1 359 . 15 1 1 A 27 27 ILE N N 27 112.700 116.064 -3.364 1
1 360 . 15 1 1 A 28 28 SER H H 28 8.570 8.735 -0.165 1
1 361 . 15 1 1 A 28 28 SER HA H 28 4.540 4.774 -0.234 1
1 364 . 15 1 1 A 28 28 SER C C 28 175.600 175.846 -0.246 1
1 365 . 15 1 1 A 28 28 SER CA C 28 56.800 57.137 -0.337 1
1 366 . 15 1 1 A 28 28 SER CB C 28 65.500 65.677 -0.177 1
1 367 . 15 1 1 A 28 28 SER N N 28 115.400 117.130 -1.730 1
1 368 . 15 1 1 A 29 29 ARG H H 29 8.980 8.967 0.013 1
1 369 . 15 1 1 A 29 29 ARG HA H 29 3.660 3.953 -0.293 1
1 377 . 15 1 1 A 29 29 ARG C C 29 178.700 178.273 0.427 1
1 378 . 15 1 1 A 29 29 ARG CA C 29 59.500 60.230 -0.730 1
1 379 . 15 1 1 A 29 29 ARG CB C 29 29.500 29.758 -0.258 1
1 382 . 15 1 1 A 29 29 ARG N N 29 122.000 120.489 1.511 1
1 384 . 15 1 1 A 30 30 GLN H H 30 8.580 8.251 0.329 1
1 385 . 15 1 1 A 30 30 GLN HA H 30 3.860 3.998 -0.138 1
1 392 . 15 1 1 A 30 30 GLN C C 30 178.100 178.408 -0.308 1
1 393 . 15 1 1 A 30 30 GLN CA C 30 59.200 59.144 0.056 1
1 394 . 15 1 1 A 30 30 GLN CB C 30 28.100 28.322 -0.222 1
1 397 . 15 1 1 A 30 30 GLN N N 30 118.700 119.249 -0.549 1
1 399 . 15 1 1 A 31 31 GLN H H 31 7.990 7.357 0.633 1
1 400 . 15 1 1 A 31 31 GLN HA H 31 3.980 4.058 -0.078 1
1 407 . 15 1 1 A 31 31 GLN C C 31 178.700 178.146 0.554 1
1 408 . 15 1 1 A 31 31 GLN CA C 31 59.100 58.632 0.468 1
1 409 . 15 1 1 A 31 31 GLN CB C 31 28.700 28.077 0.623 1
1 412 . 15 1 1 A 31 31 GLN N N 31 119.600 119.741 -0.141 1
1 414 . 15 1 1 A 32 32 LEU H H 32 7.630 7.635 -0.005 1
1 415 . 15 1 1 A 32 32 LEU HA H 32 3.740 4.131 -0.391 1
1 425 . 15 1 1 A 32 32 LEU C C 32 178.300 178.457 -0.157 1
1 426 . 15 1 1 A 32 32 LEU CA C 32 57.700 57.599 0.101 1
1 427 . 15 1 1 A 32 32 LEU CB C 32 41.500 41.354 0.146 1
1 431 . 15 1 1 A 32 32 LEU N N 32 120.700 120.843 -0.143 1
1 432 . 15 1 1 A 33 33 CYS H H 33 8.240 8.812 -0.572 1
1 433 . 15 1 1 A 33 33 CYS HA H 33 3.990 4.082 -0.092 1
1 436 . 15 1 1 A 33 33 CYS C C 33 177.000 176.804 0.196 1
1 437 . 15 1 1 A 33 33 CYS CA C 33 63.100 62.709 0.391 1
1 438 . 15 1 1 A 33 33 CYS CB C 33 26.100 27.158 -1.058 1
1 439 . 15 1 1 A 33 33 CYS N N 33 117.400 117.858 -0.458 1
1 440 . 15 1 1 A 34 34 ASN H H 34 8.210 7.980 0.230 1
1 441 . 15 1 1 A 34 34 ASN HA H 34 4.370 4.455 -0.085 1
1 446 . 15 1 1 A 34 34 ASN C C 34 178.700 177.803 0.897 1
1 447 . 15 1 1 A 34 34 ASN CA C 34 56.000 56.721 -0.721 1
1 448 . 15 1 1 A 34 34 ASN CB C 34 37.800 39.369 -1.569 1
1 450 . 15 1 1 A 34 34 ASN N N 34 117.300 118.607 -1.307 1
1 452 . 15 1 1 A 35 35 ILE H H 35 7.850 7.532 0.318 1
1 453 . 15 1 1 A 35 35 ILE HA H 35 3.850 3.596 0.254 1
1 463 . 15 1 1 A 35 35 ILE C C 35 178.100 177.708 0.392 1
1 464 . 15 1 1 A 35 35 ILE CA C 35 64.800 65.460 -0.660 1
1 465 . 15 1 1 A 35 35 ILE CB C 35 38.000 37.905 0.095 1
1 469 . 15 1 1 A 35 35 ILE N N 35 120.400 119.542 0.858 1
1 470 . 15 1 1 A 36 36 GLU H H 36 7.680 7.874 -0.194 1
1 471 . 15 1 1 A 36 36 GLU HA H 36 4.120 4.121 -0.001 1
1 476 . 15 1 1 A 36 36 GLU C C 36 176.300 178.182 -1.882 1
1 477 . 15 1 1 A 36 36 GLU CA C 36 58.600 58.694 -0.094 1
1 478 . 15 1 1 A 36 36 GLU CB C 36 30.000 29.712 0.288 1
1 480 . 15 1 1 A 36 36 GLU N N 36 116.500 120.647 -4.147 1
1 481 . 15 1 1 A 37 37 GLN H H 37 7.630 7.709 -0.079 1
1 482 . 15 1 1 A 37 37 GLN HA H 37 4.540 4.359 0.181 1
1 489 . 15 1 1 A 37 37 GLN C C 37 176.000 175.568 0.432 1
1 490 . 15 1 1 A 37 37 GLN CA C 37 54.900 54.679 0.221 1
1 491 . 15 1 1 A 37 37 GLN CB C 37 29.600 27.631 1.969 1
1 494 . 15 1 1 A 37 37 GLN N N 37 115.000 120.032 -5.032 1
1 496 . 15 1 1 A 38 38 SER H H 38 7.380 8.969 -1.589 1
1 497 . 15 1 1 A 38 38 SER HA H 38 4.410 4.224 0.186 1
1 500 . 15 1 1 A 38 38 SER C C 38 175.500 173.825 1.675 1
1 501 . 15 1 1 A 38 38 SER CA C 38 59.200 60.011 -0.811 1
1 502 . 15 1 1 A 38 38 SER CB C 38 64.100 62.931 1.169 1
1 503 . 15 1 1 A 38 38 SER N N 38 115.200 117.452 -2.252 1
1 504 . 15 1 1 A 39 39 GLU H H 39 9.040 8.432 0.608 1
1 505 . 15 1 1 A 39 39 GLU HA H 39 4.450 4.362 0.088 1
1 510 . 15 1 1 A 39 39 GLU C C 39 176.300 176.079 0.221 1
1 511 . 15 1 1 A 39 39 GLU CA C 39 57.100 58.108 -1.008 1
1 512 . 15 1 1 A 39 39 GLU CB C 39 30.300 28.612 1.688 1
1 514 . 15 1 1 A 39 39 GLU N N 39 125.400 121.607 3.793 1
1 515 . 15 1 1 A 40 40 THR H H 40 7.920 8.363 -0.443 1
1 516 . 15 1 1 A 40 40 THR HA H 40 4.590 4.245 0.345 1
1 521 . 15 1 1 A 40 40 THR C C 40 173.500 174.516 -1.016 1
1 522 . 15 1 1 A 40 40 THR CA C 40 60.500 62.286 -1.786 1
1 523 . 15 1 1 A 40 40 THR CB C 40 71.100 69.732 1.368 1
1 525 . 15 1 1 A 40 40 THR N N 40 112.800 114.987 -2.187 1
1 526 . 15 1 1 A 41 41 ALA H H 41 8.780 8.467 0.313 1
1 527 . 15 1 1 A 41 41 ALA HA H 41 4.870 4.533 0.337 1
1 531 . 15 1 1 A 41 41 ALA CA C 41 49.700 50.901 -1.201 1
1 532 . 15 1 1 A 41 41 ALA CB C 41 19.300 17.743 1.557 1
1 533 . 15 1 1 A 41 41 ALA N N 41 127.000 126.639 0.361 1
1 534 . 15 1 1 A 42 42 PRO HA H 42 4.660 4.570 0.090 1
1 541 . 15 1 1 A 42 42 PRO C C 42 178.300 177.602 0.698 1
1 542 . 15 1 1 A 42 42 PRO CA C 42 62.500 62.878 -0.378 1
1 543 . 15 1 1 A 42 42 PRO CB C 42 32.600 32.697 -0.097 1
1 546 . 15 1 1 A 43 43 VAL H H 43 8.840 8.670 0.170 1
1 547 . 15 1 1 A 43 43 VAL HA H 43 3.660 3.758 -0.098 1
1 555 . 15 1 1 A 43 43 VAL CA C 43 66.800 65.230 1.570 1
1 556 . 15 1 1 A 43 43 VAL CB C 43 31.100 31.477 -0.377 1
1 559 . 15 1 1 A 43 43 VAL N N 43 123.000 123.451 -0.451 1
1 560 . 15 1 1 A 44 44 VAL HA H 44 4.030 3.910 0.120 1
1 568 . 15 1 1 A 44 44 VAL C C 44 176.700 178.238 -1.538 1
1 569 . 15 1 1 A 44 44 VAL CA C 44 65.900 65.761 0.139 1
1 570 . 15 1 1 A 44 44 VAL CB C 44 30.900 31.564 -0.664 1
1 573 . 15 1 1 A 45 45 VAL H H 45 7.500 7.903 -0.403 1
1 574 . 15 1 1 A 45 45 VAL HA H 45 3.760 3.583 0.177 1
1 582 . 15 1 1 A 45 45 VAL C C 45 177.500 177.835 -0.335 1
1 583 . 15 1 1 A 45 45 VAL CA C 45 66.700 66.773 -0.073 1
1 584 . 15 1 1 A 45 45 VAL CB C 45 31.000 31.413 -0.413 1
1 587 . 15 1 1 A 45 45 VAL N N 45 120.100 121.316 -1.216 1
1 588 . 15 1 1 A 46 46 LYS H H 46 7.610 7.797 -0.187 1
1 589 . 15 1 1 A 46 46 LYS HA H 46 4.140 4.016 0.124 1
1 598 . 15 1 1 A 46 46 LYS C C 46 179.500 178.787 0.713 1
1 599 . 15 1 1 A 46 46 LYS CA C 46 59.900 59.244 0.656 1
1 600 . 15 1 1 A 46 46 LYS CB C 46 31.500 32.100 -0.600 1
1 604 . 15 1 1 A 46 46 LYS N N 46 120.700 118.539 2.161 1
1 605 . 15 1 1 A 47 47 TYR H H 47 8.550 8.107 0.443 1
1 606 . 15 1 1 A 47 47 TYR HA H 47 5.000 4.207 0.793 1
1 613 . 15 1 1 A 47 47 TYR C C 47 177.300 177.193 0.107 1
1 614 . 15 1 1 A 47 47 TYR CA C 47 57.300 61.372 -4.072 1
1 615 . 15 1 1 A 47 47 TYR CB C 47 37.700 38.786 -1.086 1
1 620 . 15 1 1 A 47 47 TYR N N 47 122.700 120.776 1.924 1
1 621 . 15 1 1 A 48 48 ILE H H 48 8.250 8.163 0.087 1
1 622 . 15 1 1 A 48 48 ILE HA H 48 3.160 3.368 -0.208 1
1 632 . 15 1 1 A 48 48 ILE C C 48 177.100 177.874 -0.774 1
1 633 . 15 1 1 A 48 48 ILE CA C 48 67.000 65.346 1.654 1
1 634 . 15 1 1 A 48 48 ILE CB C 48 37.800 38.352 -0.552 1
1 638 . 15 1 1 A 48 48 ILE N N 48 121.200 120.466 0.734 1
1 639 . 15 1 1 A 49 49 ALA H H 49 8.310 8.508 -0.198 1
1 640 . 15 1 1 A 49 49 ALA HA H 49 3.940 4.052 -0.112 1
1 644 . 15 1 1 A 49 49 ALA C C 49 179.300 179.650 -0.350 1
1 645 . 15 1 1 A 49 49 ALA CA C 49 55.500 54.989 0.511 1
1 646 . 15 1 1 A 49 49 ALA CB C 49 18.200 17.879 0.321 1
1 647 . 15 1 1 A 49 49 ALA N N 49 120.300 122.030 -1.730 1
1 648 . 15 1 1 A 50 50 PHE H H 50 8.630 7.892 0.738 1
1 649 . 15 1 1 A 50 50 PHE HA H 50 4.200 4.238 -0.038 1
1 656 . 15 1 1 A 50 50 PHE C C 50 179.000 176.743 2.257 1
1 657 . 15 1 1 A 50 50 PHE CA C 50 61.300 61.400 -0.100 1
1 658 . 15 1 1 A 50 50 PHE CB C 50 39.200 39.340 -0.140 1
1 663 . 15 1 1 A 50 50 PHE N N 50 121.300 120.240 1.060 1
1 664 . 15 1 1 A 51 51 LEU H H 51 8.920 8.036 0.884 1
1 665 . 15 1 1 A 51 51 LEU HA H 51 3.630 3.824 -0.194 1
1 675 . 15 1 1 A 51 51 LEU C C 51 180.000 179.090 0.910 1
1 676 . 15 1 1 A 51 51 LEU CA C 51 58.100 57.536 0.564 1
1 677 . 15 1 1 A 51 51 LEU CB C 51 39.800 41.165 -1.365 1
1 681 . 15 1 1 A 51 51 LEU N N 51 121.900 118.047 3.853 1
1 682 . 15 1 1 A 52 52 ARG H H 52 8.410 7.949 0.461 1
1 683 . 15 1 1 A 52 52 ARG HA H 52 4.420 3.870 0.550 1
1 691 . 15 1 1 A 52 52 ARG C C 52 179.800 178.974 0.826 1
1 692 . 15 1 1 A 52 52 ARG CA C 52 57.800 59.625 -1.825 1
1 693 . 15 1 1 A 52 52 ARG CB C 52 28.200 29.881 -1.681 1
1 695 . 15 1 1 A 52 52 ARG N N 52 120.500 120.520 -0.020 1
1 697 . 15 1 1 A 53 53 SER H H 53 8.480 7.838 0.642 1
1 698 . 15 1 1 A 53 53 SER HA H 53 4.300 4.024 0.276 1
1 701 . 15 1 1 A 53 53 SER C C 53 174.600 175.428 -0.828 1
1 702 . 15 1 1 A 53 53 SER CA C 53 61.500 61.975 -0.475 1
1 703 . 15 1 1 A 53 53 SER CB C 53 62.300 62.606 -0.306 1
1 704 . 15 1 1 A 53 53 SER N N 53 119.500 117.301 2.199 1
1 705 . 15 1 1 A 54 54 LYS H H 54 7.080 7.371 -0.291 1
1 706 . 15 1 1 A 54 54 LYS HA H 54 4.350 4.260 0.090 1
1 715 . 15 1 1 A 54 54 LYS C C 54 176.500 176.869 -0.369 1
1 716 . 15 1 1 A 54 54 LYS CA C 54 53.700 55.731 -2.031 1
1 717 . 15 1 1 A 54 54 LYS CB C 54 31.800 32.705 -0.905 1
1 721 . 15 1 1 A 54 54 LYS N N 54 119.200 118.065 1.135 1
1 722 . 15 1 1 A 55 55 GLY H H 55 8.040 8.549 -0.509 1
1 723 . 15 1 1 A 55 55 GLY HA2 H 55 3.540 3.868 -0.328 1
1 724 . 15 1 1 A 55 55 GLY HA3 H 55 4.300 3.876 0.424 1
1 725 . 15 1 1 A 55 55 GLY C C 55 174.500 174.894 -0.394 1
1 726 . 15 1 1 A 55 55 GLY CA C 55 44.700 45.964 -1.264 1
1 727 . 15 1 1 A 55 55 GLY N N 55 106.600 108.138 -1.538 1
1 728 . 15 1 1 A 56 56 VAL H H 56 7.580 7.458 0.122 1
1 729 . 15 1 1 A 56 56 VAL HA H 56 3.630 3.806 -0.176 1
1 737 . 15 1 1 A 56 56 VAL C C 56 174.700 175.173 -0.473 1
1 738 . 15 1 1 A 56 56 VAL CA C 56 64.000 62.477 1.523 1
1 739 . 15 1 1 A 56 56 VAL CB C 56 31.600 32.012 -0.412 1
1 742 . 15 1 1 A 56 56 VAL N N 56 122.000 122.025 -0.025 1
1 743 . 15 1 1 A 57 57 ASP H H 57 8.440 8.952 -0.512 1
1 744 . 15 1 1 A 57 57 ASP HA H 57 4.500 4.792 -0.292 1
1 747 . 15 1 1 A 57 57 ASP C C 57 176.900 176.173 0.727 1
1 748 . 15 1 1 A 57 57 ASP CA C 57 52.600 53.563 -0.963 1
1 749 . 15 1 1 A 57 57 ASP CB C 57 39.900 39.920 -0.020 1
1 750 . 15 1 1 A 57 57 ASP N N 57 124.100 127.515 -3.415 1
1 751 . 15 1 1 A 58 58 LEU H H 58 9.720 8.301 1.419 1
1 752 . 15 1 1 A 58 58 LEU HA H 58 4.020 4.336 -0.316 1
1 762 . 15 1 1 A 58 58 LEU C C 58 179.400 178.343 1.057 1
1 763 . 15 1 1 A 58 58 LEU CA C 58 56.300 56.620 -0.320 1
1 764 . 15 1 1 A 58 58 LEU CB C 58 43.300 41.944 1.356 1
1 768 . 15 1 1 A 58 58 LEU N N 58 127.800 126.621 1.179 1
1 769 . 15 1 1 A 59 59 ASN H H 59 7.740 8.753 -1.013 1
1 770 . 15 1 1 A 59 59 ASN HA H 59 4.340 4.392 -0.052 1
1 775 . 15 1 1 A 59 59 ASN C C 59 176.300 177.498 -1.198 1
1 776 . 15 1 1 A 59 59 ASN CA C 59 56.300 55.955 0.345 1
1 777 . 15 1 1 A 59 59 ASN CB C 59 36.400 37.633 -1.233 1
1 779 . 15 1 1 A 59 59 ASN N N 59 119.500 116.441 3.059 1
1 781 . 15 1 1 A 60 60 ALA H H 60 7.220 7.739 -0.519 1
1 782 . 15 1 1 A 60 60 ALA HA H 60 4.030 4.103 -0.073 1
1 786 . 15 1 1 A 60 60 ALA C C 60 180.100 180.329 -0.229 1
1 787 . 15 1 1 A 60 60 ALA CA C 60 54.300 54.872 -0.572 1
1 788 . 15 1 1 A 60 60 ALA CB C 60 18.200 18.025 0.175 1
1 789 . 15 1 1 A 60 60 ALA N N 60 121.400 122.350 -0.950 1
1 790 . 15 1 1 A 61 61 LEU H H 61 7.320 8.157 -0.837 1
1 791 . 15 1 1 A 61 61 LEU HA H 61 3.840 4.159 -0.319 1
1 801 . 15 1 1 A 61 61 LEU C C 61 177.200 178.435 -1.235 1
1 802 . 15 1 1 A 61 61 LEU CA C 61 58.500 58.259 0.241 1
1 803 . 15 1 1 A 61 61 LEU CB C 61 42.600 41.966 0.634 1
1 807 . 15 1 1 A 61 61 LEU N N 61 118.600 121.007 -2.407 1
1 808 . 15 1 1 A 62 62 PHE H H 62 8.360 8.340 0.020 1
1 809 . 15 1 1 A 62 62 PHE HA H 62 3.930 4.100 -0.170 1
1 817 . 15 1 1 A 62 62 PHE C C 62 178.200 177.847 0.353 1
1 818 . 15 1 1 A 62 62 PHE CA C 62 62.800 60.700 2.100 1
1 819 . 15 1 1 A 62 62 PHE CB C 62 38.500 38.613 -0.113 1
1 825 . 15 1 1 A 62 62 PHE N N 62 114.400 117.567 -3.167 1
1 826 . 15 1 1 A 63 63 ASP H H 63 8.680 8.171 0.509 1
1 827 . 15 1 1 A 63 63 ASP HA H 63 4.530 4.197 0.333 1
1 830 . 15 1 1 A 63 63 ASP C C 63 178.600 178.622 -0.022 1
1 831 . 15 1 1 A 63 63 ASP CA C 63 57.500 57.293 0.207 1
1 832 . 15 1 1 A 63 63 ASP CB C 63 39.600 40.124 -0.524 1
1 833 . 15 1 1 A 63 63 ASP N N 63 120.400 118.591 1.809 1
1 834 . 15 1 1 A 64 64 ARG H H 64 7.540 7.627 -0.087 1
1 835 . 15 1 1 A 64 64 ARG HA H 64 4.290 4.197 0.093 1
1 843 . 15 1 1 A 64 64 ARG C C 64 177.600 178.814 -1.214 1
1 844 . 15 1 1 A 64 64 ARG CA C 64 58.300 58.838 -0.538 1
1 845 . 15 1 1 A 64 64 ARG CB C 64 30.000 30.018 -0.018 1
1 848 . 15 1 1 A 64 64 ARG N N 64 116.800 120.106 -3.306 1
1 850 . 15 1 1 A 65 65 ILE H H 65 7.260 7.402 -0.142 1
1 851 . 15 1 1 A 65 65 ILE HA H 65 4.130 3.617 0.513 1
1 861 . 15 1 1 A 65 65 ILE C C 65 177.000 178.200 -1.200 1
1 862 . 15 1 1 A 65 65 ILE CA C 65 62.600 65.471 -2.871 1
1 863 . 15 1 1 A 65 65 ILE CB C 65 38.700 37.739 0.961 1
1 867 . 15 1 1 A 65 65 ILE N N 65 117.000 119.321 -2.321 1
1 868 . 15 1 1 A 66 66 ILE H H 66 7.980 7.999 -0.019 1
1 869 . 15 1 1 A 66 66 ILE HA H 66 4.000 3.628 0.372 1
1 879 . 15 1 1 A 66 66 ILE C C 66 176.400 176.471 -0.071 1
1 880 . 15 1 1 A 66 66 ILE CA C 66 63.100 65.019 -1.919 1
1 881 . 15 1 1 A 66 66 ILE CB C 66 38.800 37.734 1.066 1
1 885 . 15 1 1 A 66 66 ILE N N 66 120.700 119.896 0.804 1
1 886 . 15 1 1 A 67 67 VAL H H 67 8.130 7.384 0.746 1
1 887 . 15 1 1 A 67 67 VAL HA H 67 3.980 4.082 -0.102 1
1 895 . 15 1 1 A 67 67 VAL C C 67 177.300 175.500 1.800 1
1 896 . 15 1 1 A 67 67 VAL CA C 67 63.900 61.891 2.009 1
1 897 . 15 1 1 A 67 67 VAL CB C 67 32.500 32.643 -0.143 1
1 900 . 15 1 1 A 67 67 VAL N N 67 121.600 118.738 2.862 1
1 901 . 15 1 1 A 68 68 ASN H H 68 8.170 8.959 -0.789 1
1 902 . 15 1 1 A 68 68 ASN HA H 68 4.680 4.814 -0.134 1
1 907 . 15 1 1 A 68 68 ASN CA C 68 54.200 53.747 0.453 1
1 908 . 15 1 1 A 68 68 ASN CB C 68 39.100 39.632 -0.532 1
1 910 . 15 1 1 A 68 68 ASN N N 68 120.500 122.552 -2.052 1
1 912 . 15 1 1 A 69 69 LYS H H 69 8.230 7.769 0.461 1
1 913 . 15 1 1 A 69 69 LYS HA H 69 4.260 4.024 0.236 1
1 922 . 15 1 1 A 69 69 LYS C C 69 176.900 177.307 -0.407 1
1 923 . 15 1 1 A 69 69 LYS CA C 69 57.000 56.922 0.078 1
1 924 . 15 1 1 A 69 69 LYS CB C 69 32.800 33.058 -0.258 1
1 928 . 15 1 1 A 69 69 LYS N N 69 121.300 120.165 1.135 1
1 929 . 15 1 1 A 70 70 LEU H H 70 8.150 8.914 -0.764 1
1 930 . 15 1 1 A 70 70 LEU HA H 70 4.300 3.973 0.327 1
1 940 . 15 1 1 A 70 70 LEU C C 70 178.900 175.415 3.485 1
1 941 . 15 1 1 A 70 70 LEU CA C 70 55.400 56.022 -0.622 1
1 942 . 15 1 1 A 70 70 LEU CB C 70 42.100 41.563 0.537 1
1 946 . 15 1 1 A 70 70 LEU N N 70 121.900 125.995 -4.095 1
1 947 . 15 1 1 A 71 71 GLU H H 71 8.210 7.636 0.574 1
1 948 . 15 1 1 A 71 71 GLU HA H 71 4.180 4.587 -0.407 1
1 953 . 15 1 1 A 71 71 GLU C C 71 176.300 177.296 -0.996 1
1 954 . 15 1 1 A 71 71 GLU CA C 71 56.600 54.732 1.868 1
1 955 . 15 1 1 A 71 71 GLU CB C 71 30.200 31.020 -0.820 1
1 957 . 15 1 1 A 71 71 GLU N N 71 120.900 114.882 6.018 1
1 958 . 15 1 1 A 72 72 HIS H H 72 8.380 8.222 0.158 1
1 959 . 15 1 1 A 72 72 HIS HA H 72 4.600 4.086 0.514 1
1 962 . 15 1 1 A 72 72 HIS C C 72 174.600 176.157 -1.557 1
1 963 . 15 1 1 A 72 72 HIS CA C 72 55.600 58.731 -3.131 1
1 964 . 15 1 1 A 72 72 HIS CB C 72 29.600 30.020 -0.420 1
1 965 . 15 1 1 A 72 72 HIS N N 72 119.300 117.502 1.798 1
1 966 . 15 1 1 A 73 73 HIS H H 73 8.410 7.711 0.699 1
1 967 . 15 1 1 A 73 73 HIS HA H 73 4.610 4.397 0.213 1
1 970 . 15 1 1 A 73 73 HIS C C 73 173.700 174.389 -0.689 1
1 971 . 15 1 1 A 73 73 HIS CA C 73 55.700 55.302 0.398 1
1 972 . 15 1 1 A 73 73 HIS CB C 73 29.600 30.363 -0.763 1
1 973 . 15 1 1 A 73 73 HIS N N 73 119.410 114.281 5.129 1
1 974 . 15 1 1 A 74 74 HIS H H 74 8.310 8.041 0.269 1
1 975 . 15 1 1 A 74 74 HIS HA H 74 4.630 4.224 0.406 1
1 978 . 15 1 1 A 74 74 HIS CA C 74 57.100 58.193 -1.093 1
1 979 . 15 1 1 A 74 74 HIS CB C 74 29.800 28.268 1.532 1
1 14 . 16 1 1 A 2 2 GLU H H 2 9.070 8.043 1.027 1
1 15 . 16 1 1 A 2 2 GLU HA H 2 4.520 4.100 0.420 1
1 20 . 16 1 1 A 2 2 GLU C C 2 176.300 176.881 -0.581 1
1 21 . 16 1 1 A 2 2 GLU CA C 2 55.800 57.030 -1.230 1
1 22 . 16 1 1 A 2 2 GLU CB C 2 31.000 28.512 2.488 1
1 24 . 16 1 1 A 2 2 GLU N N 2 123.100 119.458 3.642 1
1 25 . 16 1 1 A 3 3 LEU H H 3 8.750 8.392 0.358 1
1 26 . 16 1 1 A 3 3 LEU HA H 3 3.750 4.073 -0.323 1
1 36 . 16 1 1 A 3 3 LEU C C 3 177.400 178.586 -1.186 1
1 37 . 16 1 1 A 3 3 LEU CA C 3 58.300 58.257 0.043 1
1 38 . 16 1 1 A 3 3 LEU CB C 3 41.500 41.663 -0.163 1
1 42 . 16 1 1 A 3 3 LEU N N 3 122.600 128.983 -6.383 1
1 43 . 16 1 1 A 4 4 SER H H 4 8.350 8.064 0.286 1
1 44 . 16 1 1 A 4 4 SER HA H 4 3.890 4.053 -0.163 1
1 47 . 16 1 1 A 4 4 SER C C 4 175.100 176.125 -1.025 1
1 48 . 16 1 1 A 4 4 SER CA C 4 61.500 62.316 -0.816 1
1 49 . 16 1 1 A 4 4 SER CB C 4 62.000 62.654 -0.654 1
1 50 . 16 1 1 A 4 4 SER N N 4 112.900 116.926 -4.026 1
1 51 . 16 1 1 A 5 5 ASN H H 5 7.180 8.388 -1.208 1
1 52 . 16 1 1 A 5 5 ASN HA H 5 4.470 4.491 -0.021 1
1 57 . 16 1 1 A 5 5 ASN C C 5 177.400 177.689 -0.289 1
1 58 . 16 1 1 A 5 5 ASN CA C 5 56.000 56.731 -0.731 1
1 59 . 16 1 1 A 5 5 ASN CB C 5 39.400 39.019 0.381 1
1 61 . 16 1 1 A 5 5 ASN N N 5 116.600 120.367 -3.767 1
1 63 . 16 1 1 A 6 6 GLU H H 6 7.950 7.711 0.239 1
1 64 . 16 1 1 A 6 6 GLU HA H 6 4.070 4.038 0.032 1
1 69 . 16 1 1 A 6 6 GLU C C 6 178.500 179.240 -0.740 1
1 70 . 16 1 1 A 6 6 GLU CA C 6 58.100 59.173 -1.073 1
1 71 . 16 1 1 A 6 6 GLU CB C 6 29.300 29.599 -0.299 1
1 73 . 16 1 1 A 6 6 GLU N N 6 117.600 118.804 -1.204 1
1 74 . 16 1 1 A 7 7 LEU H H 7 8.140 7.969 0.171 1
1 75 . 16 1 1 A 7 7 LEU HA H 7 3.640 4.085 -0.445 1
1 85 . 16 1 1 A 7 7 LEU C C 7 177.700 178.237 -0.537 1
1 86 . 16 1 1 A 7 7 LEU CA C 7 58.300 57.882 0.418 1
1 87 . 16 1 1 A 7 7 LEU CB C 7 40.600 41.948 -1.348 1
1 91 . 16 1 1 A 7 7 LEU N N 7 118.500 121.704 -3.204 1
1 92 . 16 1 1 A 8 8 LYS H H 8 7.090 7.785 -0.695 1
1 93 . 16 1 1 A 8 8 LYS HA H 8 4.080 3.989 0.091 1
1 102 . 16 1 1 A 8 8 LYS C C 8 178.300 178.924 -0.624 1
1 103 . 16 1 1 A 8 8 LYS CA C 8 59.700 59.405 0.295 1
1 104 . 16 1 1 A 8 8 LYS CB C 8 32.300 32.257 0.043 1
1 108 . 16 1 1 A 8 8 LYS N N 8 118.200 119.196 -0.996 1
1 109 . 16 1 1 A 9 9 VAL H H 9 7.940 7.781 0.159 1
1 110 . 16 1 1 A 9 9 VAL HA H 9 3.440 3.528 -0.088 1
1 118 . 16 1 1 A 9 9 VAL C C 9 179.500 177.795 1.705 1
1 119 . 16 1 1 A 9 9 VAL CA C 9 66.700 66.430 0.270 1
1 120 . 16 1 1 A 9 9 VAL CB C 9 31.600 31.471 0.129 1
1 123 . 16 1 1 A 9 9 VAL N N 9 117.600 119.565 -1.965 1
1 124 . 16 1 1 A 10 10 GLU H H 10 7.830 8.417 -0.587 1
1 125 . 16 1 1 A 10 10 GLU HA H 10 4.130 3.875 0.255 1
1 130 . 16 1 1 A 10 10 GLU C C 10 178.700 179.315 -0.615 1
1 131 . 16 1 1 A 10 10 GLU CA C 10 58.300 59.596 -1.296 1
1 132 . 16 1 1 A 10 10 GLU CB C 10 28.500 29.610 -1.110 1
1 134 . 16 1 1 A 10 10 GLU N N 10 118.300 118.248 0.052 1
1 135 . 16 1 1 A 11 11 ARG H H 11 8.330 7.535 0.795 1
1 136 . 16 1 1 A 11 11 ARG HA H 11 3.770 4.108 -0.338 1
1 144 . 16 1 1 A 11 11 ARG C C 11 174.600 178.869 -4.269 1
1 145 . 16 1 1 A 11 11 ARG CA C 11 61.300 58.883 2.417 1
1 146 . 16 1 1 A 11 11 ARG CB C 11 28.500 29.937 -1.437 1
1 149 . 16 1 1 A 11 11 ARG N N 11 121.400 119.922 1.478 1
1 151 . 16 1 1 A 12 12 ILE H H 12 8.540 8.236 0.304 1
1 152 . 16 1 1 A 12 12 ILE HA H 12 3.780 3.750 0.030 1
1 162 . 16 1 1 A 12 12 ILE C C 12 181.400 177.766 3.634 1
1 163 . 16 1 1 A 12 12 ILE CA C 12 64.800 65.107 -0.307 1
1 164 . 16 1 1 A 12 12 ILE CB C 12 37.700 37.543 0.157 1
1 168 . 16 1 1 A 12 12 ILE N N 12 118.700 119.807 -1.107 1
1 169 . 16 1 1 A 13 13 ARG H H 13 8.470 8.515 -0.045 1
1 170 . 16 1 1 A 13 13 ARG HA H 13 4.060 3.997 0.063 1
1 178 . 16 1 1 A 13 13 ARG C C 13 178.600 178.625 -0.025 1
1 179 . 16 1 1 A 13 13 ARG CA C 13 59.600 59.093 0.507 1
1 180 . 16 1 1 A 13 13 ARG CB C 13 30.000 30.053 -0.053 1
1 183 . 16 1 1 A 13 13 ARG N N 13 124.600 121.420 3.180 1
1 185 . 16 1 1 A 14 14 LEU H H 14 7.430 8.038 -0.608 1
1 186 . 16 1 1 A 14 14 LEU HA H 14 4.240 4.305 -0.065 1
1 196 . 16 1 1 A 14 14 LEU C C 14 176.000 176.153 -0.153 1
1 197 . 16 1 1 A 14 14 LEU CA C 14 55.300 54.858 0.442 1
1 198 . 16 1 1 A 14 14 LEU CB C 14 43.000 42.095 0.905 1
1 202 . 16 1 1 A 14 14 LEU N N 14 118.500 118.302 0.198 1
1 203 . 16 1 1 A 15 15 SER H H 15 8.260 7.781 0.479 1
1 204 . 16 1 1 A 15 15 SER HA H 15 4.030 4.114 -0.084 1
1 207 . 16 1 1 A 15 15 SER C C 15 174.000 173.188 0.812 1
1 208 . 16 1 1 A 15 15 SER CA C 15 58.700 59.008 -0.308 1
1 209 . 16 1 1 A 15 15 SER CB C 15 61.300 61.438 -0.138 1
1 210 . 16 1 1 A 15 15 SER N N 15 112.500 115.107 -2.607 1
1 211 . 16 1 1 A 16 16 LEU H H 16 7.310 7.474 -0.164 1
1 212 . 16 1 1 A 16 16 LEU HA H 16 4.880 4.689 0.191 1
1 222 . 16 1 1 A 16 16 LEU C C 16 177.900 176.925 0.975 1
1 223 . 16 1 1 A 16 16 LEU CA C 16 52.600 53.078 -0.478 1
1 224 . 16 1 1 A 16 16 LEU CB C 16 43.500 43.282 0.218 1
1 228 . 16 1 1 A 16 16 LEU N N 16 117.800 121.015 -3.215 1
1 229 . 16 1 1 A 17 17 THR H H 17 8.640 8.845 -0.205 1
1 230 . 16 1 1 A 17 17 THR HA H 17 4.250 4.698 -0.448 1
1 235 . 16 1 1 A 17 17 THR C C 17 174.900 175.780 -0.880 1
1 236 . 16 1 1 A 17 17 THR CA C 17 60.500 60.801 -0.301 1
1 237 . 16 1 1 A 17 17 THR CB C 17 70.500 70.581 -0.081 1
1 239 . 16 1 1 A 17 17 THR N N 17 115.200 115.546 -0.346 1
1 240 . 16 1 1 A 18 18 ALA H H 18 8.820 9.023 -0.203 1
1 241 . 16 1 1 A 18 18 ALA HA H 18 3.680 3.961 -0.281 1
1 245 . 16 1 1 A 18 18 ALA C C 18 178.900 179.453 -0.553 1
1 246 . 16 1 1 A 18 18 ALA CA C 18 55.200 54.944 0.256 1
1 247 . 16 1 1 A 18 18 ALA CB C 18 17.800 18.081 -0.281 1
1 248 . 16 1 1 A 18 18 ALA N N 18 125.600 125.262 0.338 1
1 249 . 16 1 1 A 19 19 LYS H H 19 8.280 8.019 0.261 1
1 250 . 16 1 1 A 19 19 LYS HA H 19 3.740 3.944 -0.204 1
1 259 . 16 1 1 A 19 19 LYS C C 19 177.900 178.569 -0.669 1
1 260 . 16 1 1 A 19 19 LYS CA C 19 59.800 59.522 0.278 1
1 261 . 16 1 1 A 19 19 LYS CB C 19 33.300 32.386 0.914 1
1 265 . 16 1 1 A 19 19 LYS N N 19 115.800 119.113 -3.313 1
1 266 . 16 1 1 A 20 20 SER H H 20 7.860 7.713 0.147 1
1 267 . 16 1 1 A 20 20 SER HA H 20 4.210 4.219 -0.009 1
1 271 . 16 1 1 A 20 20 SER C C 20 177.200 177.506 -0.306 1
1 272 . 16 1 1 A 20 20 SER CA C 20 61.900 61.608 0.292 1
1 273 . 16 1 1 A 20 20 SER CB C 20 63.000 63.155 -0.155 1
1 274 . 16 1 1 A 20 20 SER N N 20 114.600 114.373 0.227 1
1 275 . 16 1 1 A 21 21 VAL H H 21 7.830 7.867 -0.037 1
1 276 . 16 1 1 A 21 21 VAL HA H 21 3.280 3.544 -0.264 1
1 284 . 16 1 1 A 21 21 VAL C C 21 177.500 178.354 -0.854 1
1 285 . 16 1 1 A 21 21 VAL CA C 21 66.800 66.606 0.194 1
1 286 . 16 1 1 A 21 21 VAL CB C 21 31.400 31.542 -0.142 1
1 289 . 16 1 1 A 21 21 VAL N N 21 122.600 121.167 1.433 1
1 290 . 16 1 1 A 22 22 ALA H H 22 8.230 8.647 -0.417 1
1 291 . 16 1 1 A 22 22 ALA HA H 22 3.510 3.919 -0.409 1
1 295 . 16 1 1 A 22 22 ALA C C 22 179.500 179.439 0.061 1
1 296 . 16 1 1 A 22 22 ALA CA C 22 55.500 55.239 0.261 1
1 297 . 16 1 1 A 22 22 ALA CB C 22 16.900 18.033 -1.133 1
1 298 . 16 1 1 A 22 22 ALA N N 22 121.200 121.917 -0.717 1
1 299 . 16 1 1 A 23 23 GLU H H 23 7.900 8.130 -0.230 1
1 300 . 16 1 1 A 23 23 GLU HA H 23 3.990 4.028 -0.038 1
1 305 . 16 1 1 A 23 23 GLU C C 23 180.000 179.102 0.898 1
1 306 . 16 1 1 A 23 23 GLU CA C 23 59.300 59.547 -0.247 1
1 307 . 16 1 1 A 23 23 GLU CB C 23 29.300 29.209 0.091 1
1 309 . 16 1 1 A 23 23 GLU N N 23 115.300 119.095 -3.795 1
1 310 . 16 1 1 A 24 24 GLU H H 24 7.950 7.760 0.190 1
1 311 . 16 1 1 A 24 24 GLU HA H 24 4.060 4.109 -0.049 1
1 316 . 16 1 1 A 24 24 GLU C C 24 179.100 179.413 -0.313 1
1 317 . 16 1 1 A 24 24 GLU CA C 24 59.700 59.455 0.245 1
1 318 . 16 1 1 A 24 24 GLU CB C 24 29.500 29.299 0.201 1
1 320 . 16 1 1 A 24 24 GLU N N 24 120.100 119.451 0.649 1
1 321 . 16 1 1 A 25 25 MET H H 25 8.150 8.298 -0.148 1
1 322 . 16 1 1 A 25 25 MET HA H 25 4.110 4.314 -0.204 1
1 330 . 16 1 1 A 25 25 MET C C 25 176.600 176.677 -0.077 1
1 331 . 16 1 1 A 25 25 MET CA C 25 57.100 56.906 0.194 1
1 332 . 16 1 1 A 25 25 MET CB C 25 34.900 32.687 2.213 1
1 335 . 16 1 1 A 25 25 MET N N 25 115.500 117.892 -2.392 1
1 336 . 16 1 1 A 26 26 GLY H H 26 7.940 8.857 -0.917 1
1 337 . 16 1 1 A 26 26 GLY HA2 H 26 3.860 3.920 -0.060 1
1 338 . 16 1 1 A 26 26 GLY HA3 H 26 3.960 3.921 0.039 1
1 339 . 16 1 1 A 26 26 GLY C C 26 175.100 173.790 1.310 1
1 340 . 16 1 1 A 26 26 GLY CA C 26 46.600 46.059 0.541 1
1 341 . 16 1 1 A 26 26 GLY N N 26 109.000 106.989 2.011 1
1 342 . 16 1 1 A 27 27 ILE H H 27 7.880 7.318 0.562 1
1 343 . 16 1 1 A 27 27 ILE HA H 27 4.790 4.822 -0.032 1
1 353 . 16 1 1 A 27 27 ILE C C 27 174.300 174.863 -0.563 1
1 354 . 16 1 1 A 27 27 ILE CA C 27 59.000 58.603 0.397 1
1 355 . 16 1 1 A 27 27 ILE CB C 27 40.900 41.359 -0.459 1
1 359 . 16 1 1 A 27 27 ILE N N 27 112.700 115.460 -2.760 1
1 360 . 16 1 1 A 28 28 SER H H 28 8.570 8.666 -0.096 1
1 361 . 16 1 1 A 28 28 SER HA H 28 4.540 4.512 0.028 1
1 364 . 16 1 1 A 28 28 SER C C 28 175.600 175.789 -0.189 1
1 365 . 16 1 1 A 28 28 SER CA C 28 56.800 57.705 -0.905 1
1 366 . 16 1 1 A 28 28 SER CB C 28 65.500 64.212 1.288 1
1 367 . 16 1 1 A 28 28 SER N N 28 115.400 119.440 -4.040 1
1 368 . 16 1 1 A 29 29 ARG H H 29 8.980 9.041 -0.061 1
1 369 . 16 1 1 A 29 29 ARG HA H 29 3.660 3.954 -0.294 1
1 377 . 16 1 1 A 29 29 ARG C C 29 178.700 178.745 -0.045 1
1 378 . 16 1 1 A 29 29 ARG CA C 29 59.500 60.199 -0.699 1
1 379 . 16 1 1 A 29 29 ARG CB C 29 29.500 29.777 -0.277 1
1 382 . 16 1 1 A 29 29 ARG N N 29 122.000 124.957 -2.957 1
1 384 . 16 1 1 A 30 30 GLN H H 30 8.580 8.094 0.486 1
1 385 . 16 1 1 A 30 30 GLN HA H 30 3.860 4.033 -0.173 1
1 392 . 16 1 1 A 30 30 GLN C C 30 178.100 178.121 -0.021 1
1 393 . 16 1 1 A 30 30 GLN CA C 30 59.200 59.176 0.024 1
1 394 . 16 1 1 A 30 30 GLN CB C 30 28.100 28.394 -0.294 1
1 397 . 16 1 1 A 30 30 GLN N N 30 118.700 119.309 -0.609 1
1 399 . 16 1 1 A 31 31 GLN H H 31 7.990 7.989 0.001 1
1 400 . 16 1 1 A 31 31 GLN HA H 31 3.980 3.962 0.018 1
1 407 . 16 1 1 A 31 31 GLN C C 31 178.700 178.626 0.074 1
1 408 . 16 1 1 A 31 31 GLN CA C 31 59.100 58.854 0.246 1
1 409 . 16 1 1 A 31 31 GLN CB C 31 28.700 27.987 0.713 1
1 412 . 16 1 1 A 31 31 GLN N N 31 119.600 118.488 1.112 1
1 414 . 16 1 1 A 32 32 LEU H H 32 7.630 7.655 -0.025 1
1 415 . 16 1 1 A 32 32 LEU HA H 32 3.740 4.099 -0.359 1
1 425 . 16 1 1 A 32 32 LEU C C 32 178.300 178.452 -0.152 1
1 426 . 16 1 1 A 32 32 LEU CA C 32 57.700 57.851 -0.151 1
1 427 . 16 1 1 A 32 32 LEU CB C 32 41.500 41.426 0.074 1
1 431 . 16 1 1 A 32 32 LEU N N 32 120.700 122.174 -1.474 1
1 432 . 16 1 1 A 33 33 CYS H H 33 8.240 8.274 -0.034 1
1 433 . 16 1 1 A 33 33 CYS HA H 33 3.990 4.207 -0.217 1
1 436 . 16 1 1 A 33 33 CYS C C 33 177.000 176.813 0.187 1
1 437 . 16 1 1 A 33 33 CYS CA C 33 63.100 62.527 0.573 1
1 438 . 16 1 1 A 33 33 CYS CB C 33 26.100 27.277 -1.177 1
1 439 . 16 1 1 A 33 33 CYS N N 33 117.400 118.019 -0.619 1
1 440 . 16 1 1 A 34 34 ASN H H 34 8.210 8.509 -0.299 1
1 441 . 16 1 1 A 34 34 ASN HA H 34 4.370 4.452 -0.082 1
1 446 . 16 1 1 A 34 34 ASN C C 34 178.700 177.830 0.870 1
1 447 . 16 1 1 A 34 34 ASN CA C 34 56.000 56.527 -0.527 1
1 448 . 16 1 1 A 34 34 ASN CB C 34 37.800 39.536 -1.736 1
1 450 . 16 1 1 A 34 34 ASN N N 34 117.300 118.626 -1.326 1
1 452 . 16 1 1 A 35 35 ILE H H 35 7.850 7.656 0.194 1
1 453 . 16 1 1 A 35 35 ILE HA H 35 3.850 3.620 0.230 1
1 463 . 16 1 1 A 35 35 ILE C C 35 178.100 177.856 0.244 1
1 464 . 16 1 1 A 35 35 ILE CA C 35 64.800 65.362 -0.562 1
1 465 . 16 1 1 A 35 35 ILE CB C 35 38.000 37.712 0.288 1
1 469 . 16 1 1 A 35 35 ILE N N 35 120.400 119.587 0.813 1
1 470 . 16 1 1 A 36 36 GLU H H 36 7.680 7.931 -0.251 1
1 471 . 16 1 1 A 36 36 GLU HA H 36 4.120 4.076 0.044 1
1 476 . 16 1 1 A 36 36 GLU C C 36 176.300 178.496 -2.196 1
1 477 . 16 1 1 A 36 36 GLU CA C 36 58.600 59.690 -1.090 1
1 478 . 16 1 1 A 36 36 GLU CB C 36 30.000 29.363 0.637 1
1 480 . 16 1 1 A 36 36 GLU N N 36 116.500 120.145 -3.645 1
1 481 . 16 1 1 A 37 37 GLN H H 37 7.630 7.204 0.426 1
1 482 . 16 1 1 A 37 37 GLN HA H 37 4.540 4.372 0.168 1
1 489 . 16 1 1 A 37 37 GLN C C 37 176.000 175.439 0.561 1
1 490 . 16 1 1 A 37 37 GLN CA C 37 54.900 55.311 -0.411 1
1 491 . 16 1 1 A 37 37 GLN CB C 37 29.600 29.389 0.211 1
1 494 . 16 1 1 A 37 37 GLN N N 37 115.000 116.937 -1.937 1
1 496 . 16 1 1 A 38 38 SER H H 38 7.380 7.704 -0.324 1
1 497 . 16 1 1 A 38 38 SER HA H 38 4.410 4.350 0.060 1
1 500 . 16 1 1 A 38 38 SER C C 38 175.500 174.197 1.303 1
1 501 . 16 1 1 A 38 38 SER CA C 38 59.200 58.430 0.770 1
1 502 . 16 1 1 A 38 38 SER CB C 38 64.100 63.954 0.146 1
1 503 . 16 1 1 A 38 38 SER N N 38 115.200 116.782 -1.582 1
1 504 . 16 1 1 A 39 39 GLU H H 39 9.040 8.758 0.282 1
1 505 . 16 1 1 A 39 39 GLU HA H 39 4.450 4.370 0.080 1
1 510 . 16 1 1 A 39 39 GLU C C 39 176.300 176.338 -0.038 1
1 511 . 16 1 1 A 39 39 GLU CA C 39 57.100 58.080 -0.980 1
1 512 . 16 1 1 A 39 39 GLU CB C 39 30.300 30.113 0.187 1
1 514 . 16 1 1 A 39 39 GLU N N 39 125.400 124.153 1.247 1
1 515 . 16 1 1 A 40 40 THR H H 40 7.920 8.015 -0.095 1
1 516 . 16 1 1 A 40 40 THR HA H 40 4.590 4.425 0.165 1
1 521 . 16 1 1 A 40 40 THR C C 40 173.500 174.719 -1.219 1
1 522 . 16 1 1 A 40 40 THR CA C 40 60.500 61.808 -1.308 1
1 523 . 16 1 1 A 40 40 THR CB C 40 71.100 69.608 1.492 1
1 525 . 16 1 1 A 40 40 THR N N 40 112.800 113.164 -0.364 1
1 526 . 16 1 1 A 41 41 ALA H H 41 8.780 8.492 0.288 1
1 527 . 16 1 1 A 41 41 ALA HA H 41 4.870 4.669 0.201 1
1 531 . 16 1 1 A 41 41 ALA CA C 41 49.700 50.428 -0.728 1
1 532 . 16 1 1 A 41 41 ALA CB C 41 19.300 18.959 0.341 1
1 533 . 16 1 1 A 41 41 ALA N N 41 127.000 125.999 1.001 1
1 534 . 16 1 1 A 42 42 PRO HA H 42 4.660 4.550 0.110 1
1 541 . 16 1 1 A 42 42 PRO C C 42 178.300 177.705 0.595 1
1 542 . 16 1 1 A 42 42 PRO CA C 42 62.500 62.785 -0.285 1
1 543 . 16 1 1 A 42 42 PRO CB C 42 32.600 32.654 -0.054 1
1 546 . 16 1 1 A 43 43 VAL H H 43 8.840 8.676 0.164 1
1 547 . 16 1 1 A 43 43 VAL HA H 43 3.660 3.757 -0.097 1
1 555 . 16 1 1 A 43 43 VAL CA C 43 66.800 65.220 1.580 1
1 556 . 16 1 1 A 43 43 VAL CB C 43 31.100 31.552 -0.452 1
1 559 . 16 1 1 A 43 43 VAL N N 43 123.000 122.772 0.228 1
1 560 . 16 1 1 A 44 44 VAL HA H 44 4.030 3.599 0.431 1
1 568 . 16 1 1 A 44 44 VAL C C 44 176.700 178.602 -1.902 1
1 569 . 16 1 1 A 44 44 VAL CA C 44 65.900 67.006 -1.106 1
1 570 . 16 1 1 A 44 44 VAL CB C 44 30.900 31.576 -0.676 1
1 573 . 16 1 1 A 45 45 VAL H H 45 7.500 7.916 -0.416 1
1 574 . 16 1 1 A 45 45 VAL HA H 45 3.760 3.646 0.114 1
1 582 . 16 1 1 A 45 45 VAL C C 45 177.500 178.017 -0.517 1
1 583 . 16 1 1 A 45 45 VAL CA C 45 66.700 66.687 0.013 1
1 584 . 16 1 1 A 45 45 VAL CB C 45 31.000 31.425 -0.425 1
1 587 . 16 1 1 A 45 45 VAL N N 45 120.100 120.540 -0.440 1
1 588 . 16 1 1 A 46 46 LYS H H 46 7.610 7.405 0.205 1
1 589 . 16 1 1 A 46 46 LYS HA H 46 4.140 4.008 0.132 1
1 598 . 16 1 1 A 46 46 LYS C C 46 179.500 178.821 0.679 1
1 599 . 16 1 1 A 46 46 LYS CA C 46 59.900 59.393 0.507 1
1 600 . 16 1 1 A 46 46 LYS CB C 46 31.500 32.116 -0.616 1
1 604 . 16 1 1 A 46 46 LYS N N 46 120.700 118.607 2.093 1
1 605 . 16 1 1 A 47 47 TYR H H 47 8.550 8.009 0.541 1
1 606 . 16 1 1 A 47 47 TYR HA H 47 5.000 4.174 0.826 1
1 613 . 16 1 1 A 47 47 TYR C C 47 177.300 177.358 -0.058 1
1 614 . 16 1 1 A 47 47 TYR CA C 47 57.300 61.489 -4.189 1
1 615 . 16 1 1 A 47 47 TYR CB C 47 37.700 38.685 -0.985 1
1 620 . 16 1 1 A 47 47 TYR N N 47 122.700 120.482 2.218 1
1 621 . 16 1 1 A 48 48 ILE H H 48 8.250 8.152 0.098 1
1 622 . 16 1 1 A 48 48 ILE HA H 48 3.160 3.717 -0.557 1
1 632 . 16 1 1 A 48 48 ILE C C 48 177.100 178.125 -1.025 1
1 633 . 16 1 1 A 48 48 ILE CA C 48 67.000 65.662 1.338 1
1 634 . 16 1 1 A 48 48 ILE CB C 48 37.800 38.485 -0.685 1
1 638 . 16 1 1 A 48 48 ILE N N 48 121.200 120.841 0.359 1
1 639 . 16 1 1 A 49 49 ALA H H 49 8.310 8.490 -0.180 1
1 640 . 16 1 1 A 49 49 ALA HA H 49 3.940 4.120 -0.180 1
1 644 . 16 1 1 A 49 49 ALA C C 49 179.300 179.607 -0.307 1
1 645 . 16 1 1 A 49 49 ALA CA C 49 55.500 54.971 0.529 1
1 646 . 16 1 1 A 49 49 ALA CB C 49 18.200 18.212 -0.012 1
1 647 . 16 1 1 A 49 49 ALA N N 49 120.300 121.734 -1.434 1
1 648 . 16 1 1 A 50 50 PHE H H 50 8.630 7.906 0.724 1
1 649 . 16 1 1 A 50 50 PHE HA H 50 4.200 4.143 0.057 1
1 656 . 16 1 1 A 50 50 PHE C C 50 179.000 176.113 2.887 1
1 657 . 16 1 1 A 50 50 PHE CA C 50 61.300 61.428 -0.128 1
1 658 . 16 1 1 A 50 50 PHE CB C 50 39.200 39.183 0.017 1
1 663 . 16 1 1 A 50 50 PHE N N 50 121.300 120.564 0.736 1
1 664 . 16 1 1 A 51 51 LEU H H 51 8.920 7.954 0.966 1
1 665 . 16 1 1 A 51 51 LEU HA H 51 3.630 3.827 -0.197 1
1 675 . 16 1 1 A 51 51 LEU C C 51 180.000 178.855 1.145 1
1 676 . 16 1 1 A 51 51 LEU CA C 51 58.100 57.749 0.351 1
1 677 . 16 1 1 A 51 51 LEU CB C 51 39.800 41.281 -1.481 1
1 681 . 16 1 1 A 51 51 LEU N N 51 121.900 118.598 3.302 1
1 682 . 16 1 1 A 52 52 ARG H H 52 8.410 8.151 0.259 1
1 683 . 16 1 1 A 52 52 ARG HA H 52 4.420 3.942 0.478 1
1 691 . 16 1 1 A 52 52 ARG C C 52 179.800 178.889 0.911 1
1 692 . 16 1 1 A 52 52 ARG CA C 52 57.800 59.682 -1.882 1
1 693 . 16 1 1 A 52 52 ARG CB C 52 28.200 30.087 -1.887 1
1 695 . 16 1 1 A 52 52 ARG N N 52 120.500 120.889 -0.389 1
1 697 . 16 1 1 A 53 53 SER H H 53 8.480 8.164 0.316 1
1 698 . 16 1 1 A 53 53 SER HA H 53 4.300 4.275 0.025 1
1 701 . 16 1 1 A 53 53 SER C C 53 174.600 175.349 -0.749 1
1 702 . 16 1 1 A 53 53 SER CA C 53 61.500 60.699 0.801 1
1 703 . 16 1 1 A 53 53 SER CB C 53 62.300 62.629 -0.329 1
1 704 . 16 1 1 A 53 53 SER N N 53 119.500 114.483 5.017 1
1 705 . 16 1 1 A 54 54 LYS H H 54 7.080 7.353 -0.273 1
1 706 . 16 1 1 A 54 54 LYS HA H 54 4.350 4.300 0.050 1
1 715 . 16 1 1 A 54 54 LYS C C 54 176.500 176.865 -0.365 1
1 716 . 16 1 1 A 54 54 LYS CA C 54 53.700 55.632 -1.932 1
1 717 . 16 1 1 A 54 54 LYS CB C 54 31.800 32.516 -0.716 1
1 721 . 16 1 1 A 54 54 LYS N N 54 119.200 117.906 1.294 1
1 722 . 16 1 1 A 55 55 GLY H H 55 8.040 8.274 -0.234 1
1 723 . 16 1 1 A 55 55 GLY HA2 H 55 3.540 3.911 -0.371 1
1 724 . 16 1 1 A 55 55 GLY HA3 H 55 4.300 3.915 0.385 1
1 725 . 16 1 1 A 55 55 GLY C C 55 174.500 175.105 -0.605 1
1 726 . 16 1 1 A 55 55 GLY CA C 55 44.700 46.598 -1.898 1
1 727 . 16 1 1 A 55 55 GLY N N 55 106.600 108.005 -1.405 1
1 728 . 16 1 1 A 56 56 VAL H H 56 7.580 7.645 -0.065 1
1 729 . 16 1 1 A 56 56 VAL HA H 56 3.630 4.043 -0.413 1
1 737 . 16 1 1 A 56 56 VAL C C 56 174.700 175.068 -0.368 1
1 738 . 16 1 1 A 56 56 VAL CA C 56 64.000 65.302 -1.302 1
1 739 . 16 1 1 A 56 56 VAL CB C 56 31.600 31.977 -0.377 1
1 742 . 16 1 1 A 56 56 VAL N N 56 122.000 117.466 4.534 1
1 743 . 16 1 1 A 57 57 ASP H H 57 8.440 7.978 0.462 1
1 744 . 16 1 1 A 57 57 ASP HA H 57 4.500 4.403 0.097 1
1 747 . 16 1 1 A 57 57 ASP C C 57 176.900 176.192 0.708 1
1 748 . 16 1 1 A 57 57 ASP CA C 57 52.600 54.862 -2.262 1
1 749 . 16 1 1 A 57 57 ASP CB C 57 39.900 39.565 0.335 1
1 750 . 16 1 1 A 57 57 ASP N N 57 124.100 118.734 5.366 1
1 751 . 16 1 1 A 58 58 LEU H H 58 9.720 8.380 1.340 1
1 752 . 16 1 1 A 58 58 LEU HA H 58 4.020 4.451 -0.431 1
1 762 . 16 1 1 A 58 58 LEU C C 58 179.400 177.926 1.474 1
1 763 . 16 1 1 A 58 58 LEU CA C 58 56.300 55.029 1.271 1
1 764 . 16 1 1 A 58 58 LEU CB C 58 43.300 42.138 1.162 1
1 768 . 16 1 1 A 58 58 LEU N N 58 127.800 123.776 4.024 1
1 769 . 16 1 1 A 59 59 ASN H H 59 7.740 8.010 -0.270 1
1 770 . 16 1 1 A 59 59 ASN HA H 59 4.340 4.505 -0.165 1
1 775 . 16 1 1 A 59 59 ASN C C 59 176.300 177.776 -1.476 1
1 776 . 16 1 1 A 59 59 ASN CA C 59 56.300 56.442 -0.142 1
1 777 . 16 1 1 A 59 59 ASN CB C 59 36.400 37.935 -1.535 1
1 779 . 16 1 1 A 59 59 ASN N N 59 119.500 118.485 1.015 1
1 781 . 16 1 1 A 60 60 ALA H H 60 7.220 7.835 -0.615 1
1 782 . 16 1 1 A 60 60 ALA HA H 60 4.030 4.096 -0.066 1
1 786 . 16 1 1 A 60 60 ALA C C 60 180.100 180.073 0.027 1
1 787 . 16 1 1 A 60 60 ALA CA C 60 54.300 54.813 -0.513 1
1 788 . 16 1 1 A 60 60 ALA CB C 60 18.200 18.353 -0.153 1
1 789 . 16 1 1 A 60 60 ALA N N 60 121.400 122.549 -1.149 1
1 790 . 16 1 1 A 61 61 LEU H H 61 7.320 8.176 -0.856 1
1 791 . 16 1 1 A 61 61 LEU HA H 61 3.840 3.992 -0.152 1
1 801 . 16 1 1 A 61 61 LEU C C 61 177.200 178.306 -1.106 1
1 802 . 16 1 1 A 61 61 LEU CA C 61 58.500 58.090 0.410 1
1 803 . 16 1 1 A 61 61 LEU CB C 61 42.600 41.739 0.861 1
1 807 . 16 1 1 A 61 61 LEU N N 61 118.600 120.486 -1.886 1
1 808 . 16 1 1 A 62 62 PHE H H 62 8.360 8.173 0.187 1
1 809 . 16 1 1 A 62 62 PHE HA H 62 3.930 4.142 -0.212 1
1 817 . 16 1 1 A 62 62 PHE C C 62 178.200 178.164 0.036 1
1 818 . 16 1 1 A 62 62 PHE CA C 62 62.800 60.459 2.341 1
1 819 . 16 1 1 A 62 62 PHE CB C 62 38.500 38.818 -0.318 1
1 825 . 16 1 1 A 62 62 PHE N N 62 114.400 117.240 -2.840 1
1 826 . 16 1 1 A 63 63 ASP H H 63 8.680 8.031 0.649 1
1 827 . 16 1 1 A 63 63 ASP HA H 63 4.530 4.294 0.236 1
1 830 . 16 1 1 A 63 63 ASP C C 63 178.600 179.049 -0.449 1
1 831 . 16 1 1 A 63 63 ASP CA C 63 57.500 57.074 0.426 1
1 832 . 16 1 1 A 63 63 ASP CB C 63 39.600 40.392 -0.792 1
1 833 . 16 1 1 A 63 63 ASP N N 63 120.400 118.751 1.649 1
1 834 . 16 1 1 A 64 64 ARG H H 64 7.540 7.577 -0.037 1
1 835 . 16 1 1 A 64 64 ARG HA H 64 4.290 4.112 0.178 1
1 843 . 16 1 1 A 64 64 ARG C C 64 177.600 178.700 -1.100 1
1 844 . 16 1 1 A 64 64 ARG CA C 64 58.300 59.201 -0.901 1
1 845 . 16 1 1 A 64 64 ARG CB C 64 30.000 30.003 -0.003 1
1 848 . 16 1 1 A 64 64 ARG N N 64 116.800 119.704 -2.904 1
1 850 . 16 1 1 A 65 65 ILE H H 65 7.260 7.375 -0.115 1
1 851 . 16 1 1 A 65 65 ILE HA H 65 4.130 3.918 0.212 1
1 861 . 16 1 1 A 65 65 ILE C C 65 177.000 177.301 -0.301 1
1 862 . 16 1 1 A 65 65 ILE CA C 65 62.600 65.238 -2.638 1
1 863 . 16 1 1 A 65 65 ILE CB C 65 38.700 38.217 0.483 1
1 867 . 16 1 1 A 65 65 ILE N N 65 117.000 118.150 -1.150 1
1 868 . 16 1 1 A 66 66 ILE H H 66 7.980 7.995 -0.015 1
1 869 . 16 1 1 A 66 66 ILE HA H 66 4.000 4.063 -0.063 1
1 879 . 16 1 1 A 66 66 ILE C C 66 176.400 176.813 -0.413 1
1 880 . 16 1 1 A 66 66 ILE CA C 66 63.100 62.277 0.823 1
1 881 . 16 1 1 A 66 66 ILE CB C 66 38.800 38.206 0.594 1
1 885 . 16 1 1 A 66 66 ILE N N 66 120.700 122.167 -1.467 1
1 886 . 16 1 1 A 67 67 VAL H H 67 8.130 8.478 -0.348 1
1 887 . 16 1 1 A 67 67 VAL HA H 67 3.980 4.216 -0.236 1
1 895 . 16 1 1 A 67 67 VAL C C 67 177.300 177.780 -0.480 1
1 896 . 16 1 1 A 67 67 VAL CA C 67 63.900 62.993 0.907 1
1 897 . 16 1 1 A 67 67 VAL CB C 67 32.500 32.198 0.302 1
1 900 . 16 1 1 A 67 67 VAL N N 67 121.600 122.703 -1.103 1
1 901 . 16 1 1 A 68 68 ASN H H 68 8.170 7.990 0.180 1
1 902 . 16 1 1 A 68 68 ASN HA H 68 4.680 4.335 0.345 1
1 907 . 16 1 1 A 68 68 ASN CA C 68 54.200 56.593 -2.393 1
1 908 . 16 1 1 A 68 68 ASN CB C 68 39.100 38.846 0.254 1
1 910 . 16 1 1 A 68 68 ASN N N 68 120.500 119.973 0.527 1
1 912 . 16 1 1 A 69 69 LYS H H 69 8.230 7.959 0.271 1
1 913 . 16 1 1 A 69 69 LYS HA H 69 4.260 4.098 0.162 1
1 922 . 16 1 1 A 69 69 LYS C C 69 176.900 176.724 0.176 1
1 923 . 16 1 1 A 69 69 LYS CA C 69 57.000 56.914 0.086 1
1 924 . 16 1 1 A 69 69 LYS CB C 69 32.800 31.192 1.608 1
1 928 . 16 1 1 A 69 69 LYS N N 69 121.300 118.575 2.725 1
1 929 . 16 1 1 A 70 70 LEU H H 70 8.150 8.680 -0.530 1
1 930 . 16 1 1 A 70 70 LEU HA H 70 4.300 3.999 0.301 1
1 940 . 16 1 1 A 70 70 LEU C C 70 178.900 177.106 1.794 1
1 941 . 16 1 1 A 70 70 LEU CA C 70 55.400 57.220 -1.820 1
1 942 . 16 1 1 A 70 70 LEU CB C 70 42.100 42.242 -0.142 1
1 946 . 16 1 1 A 70 70 LEU N N 70 121.900 127.438 -5.538 1
1 947 . 16 1 1 A 71 71 GLU H H 71 8.210 8.229 -0.019 1
1 948 . 16 1 1 A 71 71 GLU HA H 71 4.180 3.988 0.192 1
1 953 . 16 1 1 A 71 71 GLU C C 71 176.300 176.125 0.175 1
1 954 . 16 1 1 A 71 71 GLU CA C 71 56.600 57.988 -1.388 1
1 955 . 16 1 1 A 71 71 GLU CB C 71 30.200 29.403 0.797 1
1 957 . 16 1 1 A 71 71 GLU N N 71 120.900 119.238 1.662 1
1 958 . 16 1 1 A 72 72 HIS H H 72 8.380 8.182 0.198 1
1 959 . 16 1 1 A 72 72 HIS HA H 72 4.600 4.546 0.054 1
1 962 . 16 1 1 A 72 72 HIS C C 72 174.600 174.103 0.497 1
1 963 . 16 1 1 A 72 72 HIS CA C 72 55.600 56.972 -1.372 1
1 964 . 16 1 1 A 72 72 HIS CB C 72 29.600 30.489 -0.889 1
1 965 . 16 1 1 A 72 72 HIS N N 72 119.300 121.311 -2.011 1
1 966 . 16 1 1 A 73 73 HIS H H 73 8.410 8.126 0.284 1
1 967 . 16 1 1 A 73 73 HIS HA H 73 4.610 4.600 0.010 1
1 970 . 16 1 1 A 73 73 HIS C C 73 173.700 171.407 2.293 1
1 971 . 16 1 1 A 73 73 HIS CA C 73 55.700 53.973 1.727 1
1 972 . 16 1 1 A 73 73 HIS CB C 73 29.600 32.040 -2.440 1
1 973 . 16 1 1 A 73 73 HIS N N 73 119.410 118.444 0.966 1
1 974 . 16 1 1 A 74 74 HIS H H 74 8.310 8.678 -0.368 1
1 975 . 16 1 1 A 74 74 HIS HA H 74 4.630 4.684 -0.054 1
1 978 . 16 1 1 A 74 74 HIS CA C 74 57.100 54.270 2.830 1
1 979 . 16 1 1 A 74 74 HIS CB C 74 29.800 30.710 -0.910 1
1 14 . 17 1 1 A 2 2 GLU H H 2 9.070 7.808 1.262 1
1 15 . 17 1 1 A 2 2 GLU HA H 2 4.520 4.577 -0.057 1
1 20 . 17 1 1 A 2 2 GLU C C 2 176.300 178.229 -1.929 1
1 21 . 17 1 1 A 2 2 GLU CA C 2 55.800 55.345 0.455 1
1 22 . 17 1 1 A 2 2 GLU CB C 2 31.000 31.191 -0.191 1
1 24 . 17 1 1 A 2 2 GLU N N 2 123.100 119.934 3.166 1
1 25 . 17 1 1 A 3 3 LEU H H 3 8.750 8.826 -0.076 1
1 26 . 17 1 1 A 3 3 LEU HA H 3 3.750 4.121 -0.371 1
1 36 . 17 1 1 A 3 3 LEU C C 3 177.400 178.218 -0.818 1
1 37 . 17 1 1 A 3 3 LEU CA C 3 58.300 58.261 0.039 1
1 38 . 17 1 1 A 3 3 LEU CB C 3 41.500 41.335 0.165 1
1 42 . 17 1 1 A 3 3 LEU N N 3 122.600 126.478 -3.878 1
1 43 . 17 1 1 A 4 4 SER H H 4 8.350 7.824 0.526 1
1 44 . 17 1 1 A 4 4 SER HA H 4 3.890 4.183 -0.293 1
1 47 . 17 1 1 A 4 4 SER C C 4 175.100 176.685 -1.585 1
1 48 . 17 1 1 A 4 4 SER CA C 4 61.500 61.419 0.081 1
1 49 . 17 1 1 A 4 4 SER CB C 4 62.000 62.357 -0.357 1
1 50 . 17 1 1 A 4 4 SER N N 4 112.900 114.018 -1.118 1
1 51 . 17 1 1 A 5 5 ASN H H 5 7.180 8.166 -0.986 1
1 52 . 17 1 1 A 5 5 ASN HA H 5 4.470 4.434 0.036 1
1 57 . 17 1 1 A 5 5 ASN C C 5 177.400 177.684 -0.284 1
1 58 . 17 1 1 A 5 5 ASN CA C 5 56.000 56.825 -0.825 1
1 59 . 17 1 1 A 5 5 ASN CB C 5 39.400 39.170 0.230 1
1 61 . 17 1 1 A 5 5 ASN N N 5 116.600 120.682 -4.082 1
1 63 . 17 1 1 A 6 6 GLU H H 6 7.950 7.992 -0.042 1
1 64 . 17 1 1 A 6 6 GLU HA H 6 4.070 4.070 0.000 1
1 69 . 17 1 1 A 6 6 GLU C C 6 178.500 179.255 -0.755 1
1 70 . 17 1 1 A 6 6 GLU CA C 6 58.100 59.136 -1.036 1
1 71 . 17 1 1 A 6 6 GLU CB C 6 29.300 29.810 -0.510 1
1 73 . 17 1 1 A 6 6 GLU N N 6 117.600 118.839 -1.239 1
1 74 . 17 1 1 A 7 7 LEU H H 7 8.140 7.884 0.256 1
1 75 . 17 1 1 A 7 7 LEU HA H 7 3.640 4.114 -0.474 1
1 85 . 17 1 1 A 7 7 LEU C C 7 177.700 178.668 -0.968 1
1 86 . 17 1 1 A 7 7 LEU CA C 7 58.300 57.794 0.506 1
1 87 . 17 1 1 A 7 7 LEU CB C 7 40.600 41.833 -1.233 1
1 91 . 17 1 1 A 7 7 LEU N N 7 118.500 121.070 -2.570 1
1 92 . 17 1 1 A 8 8 LYS H H 8 7.090 7.908 -0.818 1
1 93 . 17 1 1 A 8 8 LYS HA H 8 4.080 3.952 0.128 1
1 102 . 17 1 1 A 8 8 LYS C C 8 178.300 179.047 -0.747 1
1 103 . 17 1 1 A 8 8 LYS CA C 8 59.700 59.580 0.120 1
1 104 . 17 1 1 A 8 8 LYS CB C 8 32.300 32.509 -0.209 1
1 108 . 17 1 1 A 8 8 LYS N N 8 118.200 119.016 -0.816 1
1 109 . 17 1 1 A 9 9 VAL H H 9 7.940 7.752 0.188 1
1 110 . 17 1 1 A 9 9 VAL HA H 9 3.440 3.536 -0.096 1
1 118 . 17 1 1 A 9 9 VAL C C 9 179.500 177.492 2.008 1
1 119 . 17 1 1 A 9 9 VAL CA C 9 66.700 66.480 0.220 1
1 120 . 17 1 1 A 9 9 VAL CB C 9 31.600 31.187 0.413 1
1 123 . 17 1 1 A 9 9 VAL N N 9 117.600 120.220 -2.620 1
1 124 . 17 1 1 A 10 10 GLU H H 10 7.830 7.871 -0.041 1
1 125 . 17 1 1 A 10 10 GLU HA H 10 4.130 3.940 0.190 1
1 130 . 17 1 1 A 10 10 GLU C C 10 178.700 179.110 -0.410 1
1 131 . 17 1 1 A 10 10 GLU CA C 10 58.300 59.557 -1.257 1
1 132 . 17 1 1 A 10 10 GLU CB C 10 28.500 28.963 -0.463 1
1 134 . 17 1 1 A 10 10 GLU N N 10 118.300 118.416 -0.116 1
1 135 . 17 1 1 A 11 11 ARG H H 11 8.330 7.688 0.642 1
1 136 . 17 1 1 A 11 11 ARG HA H 11 3.770 4.075 -0.305 1
1 144 . 17 1 1 A 11 11 ARG C C 11 174.600 178.945 -4.345 1
1 145 . 17 1 1 A 11 11 ARG CA C 11 61.300 59.001 2.299 1
1 146 . 17 1 1 A 11 11 ARG CB C 11 28.500 29.951 -1.451 1
1 149 . 17 1 1 A 11 11 ARG N N 11 121.400 120.057 1.343 1
1 151 . 17 1 1 A 12 12 ILE H H 12 8.540 8.208 0.332 1
1 152 . 17 1 1 A 12 12 ILE HA H 12 3.780 3.744 0.036 1
1 162 . 17 1 1 A 12 12 ILE C C 12 181.400 177.716 3.684 1
1 163 . 17 1 1 A 12 12 ILE CA C 12 64.800 65.204 -0.404 1
1 164 . 17 1 1 A 12 12 ILE CB C 12 37.700 37.345 0.355 1
1 168 . 17 1 1 A 12 12 ILE N N 12 118.700 119.803 -1.103 1
1 169 . 17 1 1 A 13 13 ARG H H 13 8.470 8.477 -0.007 1
1 170 . 17 1 1 A 13 13 ARG HA H 13 4.060 3.989 0.071 1
1 178 . 17 1 1 A 13 13 ARG C C 13 178.600 178.345 0.255 1
1 179 . 17 1 1 A 13 13 ARG CA C 13 59.600 59.279 0.321 1
1 180 . 17 1 1 A 13 13 ARG CB C 13 30.000 30.030 -0.030 1
1 183 . 17 1 1 A 13 13 ARG N N 13 124.600 121.603 2.997 1
1 185 . 17 1 1 A 14 14 LEU H H 14 7.430 8.112 -0.682 1
1 186 . 17 1 1 A 14 14 LEU HA H 14 4.240 4.358 -0.118 1
1 196 . 17 1 1 A 14 14 LEU C C 14 176.000 176.173 -0.173 1
1 197 . 17 1 1 A 14 14 LEU CA C 14 55.300 54.644 0.656 1
1 198 . 17 1 1 A 14 14 LEU CB C 14 43.000 41.972 1.028 1
1 202 . 17 1 1 A 14 14 LEU N N 14 118.500 118.406 0.094 1
1 203 . 17 1 1 A 15 15 SER H H 15 8.260 7.789 0.471 1
1 204 . 17 1 1 A 15 15 SER HA H 15 4.030 4.124 -0.094 1
1 207 . 17 1 1 A 15 15 SER C C 15 174.000 173.207 0.793 1
1 208 . 17 1 1 A 15 15 SER CA C 15 58.700 59.012 -0.312 1
1 209 . 17 1 1 A 15 15 SER CB C 15 61.300 61.438 -0.138 1
1 210 . 17 1 1 A 15 15 SER N N 15 112.500 115.134 -2.634 1
1 211 . 17 1 1 A 16 16 LEU H H 16 7.310 7.484 -0.174 1
1 212 . 17 1 1 A 16 16 LEU HA H 16 4.880 4.705 0.175 1
1 222 . 17 1 1 A 16 16 LEU C C 16 177.900 176.617 1.283 1
1 223 . 17 1 1 A 16 16 LEU CA C 16 52.600 53.218 -0.618 1
1 224 . 17 1 1 A 16 16 LEU CB C 16 43.500 43.173 0.327 1
1 228 . 17 1 1 A 16 16 LEU N N 16 117.800 121.081 -3.281 1
1 229 . 17 1 1 A 17 17 THR H H 17 8.640 8.688 -0.048 1
1 230 . 17 1 1 A 17 17 THR HA H 17 4.250 4.490 -0.240 1
1 235 . 17 1 1 A 17 17 THR C C 17 174.900 175.623 -0.723 1
1 236 . 17 1 1 A 17 17 THR CA C 17 60.500 61.685 -1.185 1
1 237 . 17 1 1 A 17 17 THR CB C 17 70.500 69.979 0.521 1
1 239 . 17 1 1 A 17 17 THR N N 17 115.200 115.713 -0.513 1
1 240 . 17 1 1 A 18 18 ALA H H 18 8.820 9.039 -0.219 1
1 241 . 17 1 1 A 18 18 ALA HA H 18 3.680 3.958 -0.278 1
1 245 . 17 1 1 A 18 18 ALA C C 18 178.900 179.656 -0.756 1
1 246 . 17 1 1 A 18 18 ALA CA C 18 55.200 55.216 -0.016 1
1 247 . 17 1 1 A 18 18 ALA CB C 18 17.800 18.021 -0.221 1
1 248 . 17 1 1 A 18 18 ALA N N 18 125.600 126.509 -0.909 1
1 249 . 17 1 1 A 19 19 LYS H H 19 8.280 7.969 0.311 1
1 250 . 17 1 1 A 19 19 LYS HA H 19 3.740 3.983 -0.243 1
1 259 . 17 1 1 A 19 19 LYS C C 19 177.900 178.805 -0.905 1
1 260 . 17 1 1 A 19 19 LYS CA C 19 59.800 59.486 0.314 1
1 261 . 17 1 1 A 19 19 LYS CB C 19 33.300 32.372 0.928 1
1 265 . 17 1 1 A 19 19 LYS N N 19 115.800 119.072 -3.272 1
1 266 . 17 1 1 A 20 20 SER H H 20 7.860 8.341 -0.481 1
1 267 . 17 1 1 A 20 20 SER HA H 20 4.210 4.165 0.045 1
1 271 . 17 1 1 A 20 20 SER C C 20 177.200 177.161 0.039 1
1 272 . 17 1 1 A 20 20 SER CA C 20 61.900 61.303 0.597 1
1 273 . 17 1 1 A 20 20 SER CB C 20 63.000 62.168 0.832 1
1 274 . 17 1 1 A 20 20 SER N N 20 114.600 115.407 -0.807 1
1 275 . 17 1 1 A 21 21 VAL H H 21 7.830 7.731 0.099 1
1 276 . 17 1 1 A 21 21 VAL HA H 21 3.280 3.549 -0.269 1
1 284 . 17 1 1 A 21 21 VAL C C 21 177.500 177.937 -0.437 1
1 285 . 17 1 1 A 21 21 VAL CA C 21 66.800 66.624 0.176 1
1 286 . 17 1 1 A 21 21 VAL CB C 21 31.400 31.482 -0.082 1
1 289 . 17 1 1 A 21 21 VAL N N 21 122.600 121.806 0.794 1
1 290 . 17 1 1 A 22 22 ALA H H 22 8.230 8.670 -0.440 1
1 291 . 17 1 1 A 22 22 ALA HA H 22 3.510 3.935 -0.425 1
1 295 . 17 1 1 A 22 22 ALA C C 22 179.500 179.485 0.015 1
1 296 . 17 1 1 A 22 22 ALA CA C 22 55.500 55.952 -0.452 1
1 297 . 17 1 1 A 22 22 ALA CB C 22 16.900 18.567 -1.667 1
1 298 . 17 1 1 A 22 22 ALA N N 22 121.200 122.333 -1.133 1
1 299 . 17 1 1 A 23 23 GLU H H 23 7.900 8.471 -0.571 1
1 300 . 17 1 1 A 23 23 GLU HA H 23 3.990 4.062 -0.072 1
1 305 . 17 1 1 A 23 23 GLU C C 23 180.000 178.283 1.717 1
1 306 . 17 1 1 A 23 23 GLU CA C 23 59.300 59.429 -0.129 1
1 307 . 17 1 1 A 23 23 GLU CB C 23 29.300 29.311 -0.011 1
1 309 . 17 1 1 A 23 23 GLU N N 23 115.300 118.360 -3.060 1
1 310 . 17 1 1 A 24 24 GLU H H 24 7.950 8.013 -0.063 1
1 311 . 17 1 1 A 24 24 GLU HA H 24 4.060 4.080 -0.020 1
1 316 . 17 1 1 A 24 24 GLU C C 24 179.100 178.861 0.239 1
1 317 . 17 1 1 A 24 24 GLU CA C 24 59.700 59.278 0.422 1
1 318 . 17 1 1 A 24 24 GLU CB C 24 29.500 29.007 0.493 1
1 320 . 17 1 1 A 24 24 GLU N N 24 120.100 119.802 0.298 1
1 321 . 17 1 1 A 25 25 MET H H 25 8.150 8.290 -0.140 1
1 322 . 17 1 1 A 25 25 MET HA H 25 4.110 4.354 -0.244 1
1 330 . 17 1 1 A 25 25 MET C C 25 176.600 176.443 0.157 1
1 331 . 17 1 1 A 25 25 MET CA C 25 57.100 56.392 0.708 1
1 332 . 17 1 1 A 25 25 MET CB C 25 34.900 32.711 2.189 1
1 335 . 17 1 1 A 25 25 MET N N 25 115.500 116.641 -1.141 1
1 336 . 17 1 1 A 26 26 GLY H H 26 7.940 8.189 -0.249 1
1 337 . 17 1 1 A 26 26 GLY HA2 H 26 3.860 4.006 -0.146 1
1 338 . 17 1 1 A 26 26 GLY HA3 H 26 3.960 4.031 -0.071 1
1 339 . 17 1 1 A 26 26 GLY C C 26 175.100 173.830 1.270 1
1 340 . 17 1 1 A 26 26 GLY CA C 26 46.600 45.026 1.574 1
1 341 . 17 1 1 A 26 26 GLY N N 26 109.000 106.446 2.554 1
1 342 . 17 1 1 A 27 27 ILE H H 27 7.880 7.597 0.283 1
1 343 . 17 1 1 A 27 27 ILE HA H 27 4.790 4.905 -0.115 1
1 353 . 17 1 1 A 27 27 ILE C C 27 174.300 174.998 -0.698 1
1 354 . 17 1 1 A 27 27 ILE CA C 27 59.000 58.730 0.270 1
1 355 . 17 1 1 A 27 27 ILE CB C 27 40.900 41.503 -0.603 1
1 359 . 17 1 1 A 27 27 ILE N N 27 112.700 116.355 -3.655 1
1 360 . 17 1 1 A 28 28 SER H H 28 8.570 8.862 -0.292 1
1 361 . 17 1 1 A 28 28 SER HA H 28 4.540 4.617 -0.077 1
1 364 . 17 1 1 A 28 28 SER C C 28 175.600 175.769 -0.169 1
1 365 . 17 1 1 A 28 28 SER CA C 28 56.800 57.645 -0.845 1
1 366 . 17 1 1 A 28 28 SER CB C 28 65.500 64.353 1.147 1
1 367 . 17 1 1 A 28 28 SER N N 28 115.400 119.689 -4.289 1
1 368 . 17 1 1 A 29 29 ARG H H 29 8.980 8.908 0.072 1
1 369 . 17 1 1 A 29 29 ARG HA H 29 3.660 3.931 -0.271 1
1 377 . 17 1 1 A 29 29 ARG C C 29 178.700 178.717 -0.017 1
1 378 . 17 1 1 A 29 29 ARG CA C 29 59.500 60.153 -0.653 1
1 379 . 17 1 1 A 29 29 ARG CB C 29 29.500 29.793 -0.293 1
1 382 . 17 1 1 A 29 29 ARG N N 29 122.000 124.688 -2.688 1
1 384 . 17 1 1 A 30 30 GLN H H 30 8.580 8.057 0.523 1
1 385 . 17 1 1 A 30 30 GLN HA H 30 3.860 3.950 -0.090 1
1 392 . 17 1 1 A 30 30 GLN C C 30 178.100 178.404 -0.304 1
1 393 . 17 1 1 A 30 30 GLN CA C 30 59.200 59.167 0.033 1
1 394 . 17 1 1 A 30 30 GLN CB C 30 28.100 28.460 -0.360 1
1 397 . 17 1 1 A 30 30 GLN N N 30 118.700 119.237 -0.537 1
1 399 . 17 1 1 A 31 31 GLN H H 31 7.990 7.821 0.169 1
1 400 . 17 1 1 A 31 31 GLN HA H 31 3.980 4.013 -0.033 1
1 407 . 17 1 1 A 31 31 GLN C C 31 178.700 178.568 0.132 1
1 408 . 17 1 1 A 31 31 GLN CA C 31 59.100 58.530 0.570 1
1 409 . 17 1 1 A 31 31 GLN CB C 31 28.700 28.281 0.419 1
1 412 . 17 1 1 A 31 31 GLN N N 31 119.600 118.567 1.033 1
1 414 . 17 1 1 A 32 32 LEU H H 32 7.630 7.654 -0.024 1
1 415 . 17 1 1 A 32 32 LEU HA H 32 3.740 4.069 -0.329 1
1 425 . 17 1 1 A 32 32 LEU C C 32 178.300 178.506 -0.206 1
1 426 . 17 1 1 A 32 32 LEU CA C 32 57.700 57.947 -0.247 1
1 427 . 17 1 1 A 32 32 LEU CB C 32 41.500 41.298 0.202 1
1 431 . 17 1 1 A 32 32 LEU N N 32 120.700 121.886 -1.186 1
1 432 . 17 1 1 A 33 33 CYS H H 33 8.240 8.928 -0.688 1
1 433 . 17 1 1 A 33 33 CYS HA H 33 3.990 4.119 -0.129 1
1 436 . 17 1 1 A 33 33 CYS C C 33 177.000 176.932 0.068 1
1 437 . 17 1 1 A 33 33 CYS CA C 33 63.100 62.482 0.618 1
1 438 . 17 1 1 A 33 33 CYS CB C 33 26.100 27.064 -0.964 1
1 439 . 17 1 1 A 33 33 CYS N N 33 117.400 118.472 -1.072 1
1 440 . 17 1 1 A 34 34 ASN H H 34 8.210 7.820 0.390 1
1 441 . 17 1 1 A 34 34 ASN HA H 34 4.370 4.478 -0.108 1
1 446 . 17 1 1 A 34 34 ASN C C 34 178.700 178.315 0.385 1
1 447 . 17 1 1 A 34 34 ASN CA C 34 56.000 56.535 -0.535 1
1 448 . 17 1 1 A 34 34 ASN CB C 34 37.800 37.901 -0.101 1
1 450 . 17 1 1 A 34 34 ASN N N 34 117.300 118.455 -1.155 1
1 452 . 17 1 1 A 35 35 ILE H H 35 7.850 7.777 0.073 1
1 453 . 17 1 1 A 35 35 ILE HA H 35 3.850 3.815 0.035 1
1 463 . 17 1 1 A 35 35 ILE C C 35 178.100 177.919 0.181 1
1 464 . 17 1 1 A 35 35 ILE CA C 35 64.800 65.519 -0.719 1
1 465 . 17 1 1 A 35 35 ILE CB C 35 38.000 37.722 0.278 1
1 469 . 17 1 1 A 35 35 ILE N N 35 120.400 120.619 -0.219 1
1 470 . 17 1 1 A 36 36 GLU H H 36 7.680 7.912 -0.232 1
1 471 . 17 1 1 A 36 36 GLU HA H 36 4.120 4.014 0.106 1
1 476 . 17 1 1 A 36 36 GLU C C 36 176.300 178.073 -1.773 1
1 477 . 17 1 1 A 36 36 GLU CA C 36 58.600 59.329 -0.729 1
1 478 . 17 1 1 A 36 36 GLU CB C 36 30.000 29.347 0.653 1
1 480 . 17 1 1 A 36 36 GLU N N 36 116.500 121.277 -4.777 1
1 481 . 17 1 1 A 37 37 GLN H H 37 7.630 7.749 -0.119 1
1 482 . 17 1 1 A 37 37 GLN HA H 37 4.540 4.341 0.199 1
1 489 . 17 1 1 A 37 37 GLN C C 37 176.000 176.707 -0.707 1
1 490 . 17 1 1 A 37 37 GLN CA C 37 54.900 56.547 -1.647 1
1 491 . 17 1 1 A 37 37 GLN CB C 37 29.600 28.730 0.870 1
1 494 . 17 1 1 A 37 37 GLN N N 37 115.000 117.836 -2.836 1
1 496 . 17 1 1 A 38 38 SER H H 38 7.380 7.667 -0.287 1
1 497 . 17 1 1 A 38 38 SER HA H 38 4.410 4.525 -0.115 1
1 500 . 17 1 1 A 38 38 SER C C 38 175.500 174.493 1.007 1
1 501 . 17 1 1 A 38 38 SER CA C 38 59.200 58.555 0.645 1
1 502 . 17 1 1 A 38 38 SER CB C 38 64.100 63.275 0.825 1
1 503 . 17 1 1 A 38 38 SER N N 38 115.200 115.958 -0.758 1
1 504 . 17 1 1 A 39 39 GLU H H 39 9.040 8.049 0.991 1
1 505 . 17 1 1 A 39 39 GLU HA H 39 4.450 3.881 0.569 1
1 510 . 17 1 1 A 39 39 GLU C C 39 176.300 175.587 0.713 1
1 511 . 17 1 1 A 39 39 GLU CA C 39 57.100 58.961 -1.861 1
1 512 . 17 1 1 A 39 39 GLU CB C 39 30.300 28.268 2.032 1
1 514 . 17 1 1 A 39 39 GLU N N 39 125.400 117.743 7.657 1
1 515 . 17 1 1 A 40 40 THR H H 40 7.920 8.152 -0.232 1
1 516 . 17 1 1 A 40 40 THR HA H 40 4.590 4.616 -0.026 1
1 521 . 17 1 1 A 40 40 THR C C 40 173.500 173.980 -0.480 1
1 522 . 17 1 1 A 40 40 THR CA C 40 60.500 60.213 0.287 1
1 523 . 17 1 1 A 40 40 THR CB C 40 71.100 70.881 0.219 1
1 525 . 17 1 1 A 40 40 THR N N 40 112.800 111.851 0.949 1
1 526 . 17 1 1 A 41 41 ALA H H 41 8.780 8.502 0.278 1
1 527 . 17 1 1 A 41 41 ALA HA H 41 4.870 4.711 0.159 1
1 531 . 17 1 1 A 41 41 ALA CA C 41 49.700 50.462 -0.762 1
1 532 . 17 1 1 A 41 41 ALA CB C 41 19.300 18.979 0.321 1
1 533 . 17 1 1 A 41 41 ALA N N 41 127.000 124.002 2.998 1
1 534 . 17 1 1 A 42 42 PRO HA H 42 4.660 4.622 0.038 1
1 541 . 17 1 1 A 42 42 PRO C C 42 178.300 177.634 0.666 1
1 542 . 17 1 1 A 42 42 PRO CA C 42 62.500 62.895 -0.395 1
1 543 . 17 1 1 A 42 42 PRO CB C 42 32.600 32.722 -0.122 1
1 546 . 17 1 1 A 43 43 VAL H H 43 8.840 8.661 0.179 1
1 547 . 17 1 1 A 43 43 VAL HA H 43 3.660 3.763 -0.103 1
1 555 . 17 1 1 A 43 43 VAL CA C 43 66.800 65.150 1.650 1
1 556 . 17 1 1 A 43 43 VAL CB C 43 31.100 31.612 -0.512 1
1 559 . 17 1 1 A 43 43 VAL N N 43 123.000 123.287 -0.287 1
1 560 . 17 1 1 A 44 44 VAL HA H 44 4.030 3.626 0.404 1
1 568 . 17 1 1 A 44 44 VAL C C 44 176.700 178.635 -1.935 1
1 569 . 17 1 1 A 44 44 VAL CA C 44 65.900 66.930 -1.030 1
1 570 . 17 1 1 A 44 44 VAL CB C 44 30.900 31.604 -0.704 1
1 573 . 17 1 1 A 45 45 VAL H H 45 7.500 8.086 -0.586 1
1 574 . 17 1 1 A 45 45 VAL HA H 45 3.760 3.556 0.204 1
1 582 . 17 1 1 A 45 45 VAL C C 45 177.500 177.351 0.149 1
1 583 . 17 1 1 A 45 45 VAL CA C 45 66.700 66.807 -0.107 1
1 584 . 17 1 1 A 45 45 VAL CB C 45 31.000 31.312 -0.312 1
1 587 . 17 1 1 A 45 45 VAL N N 45 120.100 120.272 -0.172 1
1 588 . 17 1 1 A 46 46 LYS H H 46 7.610 7.498 0.112 1
1 589 . 17 1 1 A 46 46 LYS HA H 46 4.140 4.050 0.090 1
1 598 . 17 1 1 A 46 46 LYS C C 46 179.500 178.162 1.338 1
1 599 . 17 1 1 A 46 46 LYS CA C 46 59.900 58.885 1.015 1
1 600 . 17 1 1 A 46 46 LYS CB C 46 31.500 32.285 -0.785 1
1 604 . 17 1 1 A 46 46 LYS N N 46 120.700 118.606 2.094 1
1 605 . 17 1 1 A 47 47 TYR H H 47 8.550 8.101 0.449 1
1 606 . 17 1 1 A 47 47 TYR HA H 47 5.000 4.285 0.715 1
1 613 . 17 1 1 A 47 47 TYR C C 47 177.300 177.823 -0.523 1
1 614 . 17 1 1 A 47 47 TYR CA C 47 57.300 61.360 -4.060 1
1 615 . 17 1 1 A 47 47 TYR CB C 47 37.700 38.659 -0.959 1
1 620 . 17 1 1 A 47 47 TYR N N 47 122.700 121.048 1.652 1
1 621 . 17 1 1 A 48 48 ILE H H 48 8.250 8.141 0.109 1
1 622 . 17 1 1 A 48 48 ILE HA H 48 3.160 3.919 -0.759 1
1 632 . 17 1 1 A 48 48 ILE C C 48 177.100 178.106 -1.006 1
1 633 . 17 1 1 A 48 48 ILE CA C 48 67.000 64.248 2.752 1
1 634 . 17 1 1 A 48 48 ILE CB C 48 37.800 37.499 0.301 1
1 638 . 17 1 1 A 48 48 ILE N N 48 121.200 118.949 2.251 1
1 639 . 17 1 1 A 49 49 ALA H H 49 8.310 8.093 0.217 1
1 640 . 17 1 1 A 49 49 ALA HA H 49 3.940 4.065 -0.125 1
1 644 . 17 1 1 A 49 49 ALA C C 49 179.300 179.330 -0.030 1
1 645 . 17 1 1 A 49 49 ALA CA C 49 55.500 54.844 0.656 1
1 646 . 17 1 1 A 49 49 ALA CB C 49 18.200 18.554 -0.354 1
1 647 . 17 1 1 A 49 49 ALA N N 49 120.300 124.311 -4.011 1
1 648 . 17 1 1 A 50 50 PHE H H 50 8.630 8.198 0.432 1
1 649 . 17 1 1 A 50 50 PHE HA H 50 4.200 4.187 0.013 1
1 656 . 17 1 1 A 50 50 PHE C C 50 179.000 176.552 2.448 1
1 657 . 17 1 1 A 50 50 PHE CA C 50 61.300 61.398 -0.098 1
1 658 . 17 1 1 A 50 50 PHE CB C 50 39.200 39.276 -0.076 1
1 663 . 17 1 1 A 50 50 PHE N N 50 121.300 120.439 0.861 1
1 664 . 17 1 1 A 51 51 LEU H H 51 8.920 7.941 0.979 1
1 665 . 17 1 1 A 51 51 LEU HA H 51 3.630 3.698 -0.068 1
1 675 . 17 1 1 A 51 51 LEU C C 51 180.000 179.098 0.902 1
1 676 . 17 1 1 A 51 51 LEU CA C 51 58.100 57.574 0.526 1
1 677 . 17 1 1 A 51 51 LEU CB C 51 39.800 41.258 -1.458 1
1 681 . 17 1 1 A 51 51 LEU N N 51 121.900 118.355 3.545 1
1 682 . 17 1 1 A 52 52 ARG H H 52 8.410 8.055 0.355 1
1 683 . 17 1 1 A 52 52 ARG HA H 52 4.420 3.890 0.530 1
1 691 . 17 1 1 A 52 52 ARG C C 52 179.800 178.905 0.895 1
1 692 . 17 1 1 A 52 52 ARG CA C 52 57.800 59.612 -1.812 1
1 693 . 17 1 1 A 52 52 ARG CB C 52 28.200 29.908 -1.708 1
1 695 . 17 1 1 A 52 52 ARG N N 52 120.500 120.756 -0.256 1
1 697 . 17 1 1 A 53 53 SER H H 53 8.480 8.236 0.244 1
1 698 . 17 1 1 A 53 53 SER HA H 53 4.300 4.173 0.127 1
1 701 . 17 1 1 A 53 53 SER C C 53 174.600 175.499 -0.899 1
1 702 . 17 1 1 A 53 53 SER CA C 53 61.500 61.071 0.429 1
1 703 . 17 1 1 A 53 53 SER CB C 53 62.300 62.745 -0.445 1
1 704 . 17 1 1 A 53 53 SER N N 53 119.500 115.336 4.164 1
1 705 . 17 1 1 A 54 54 LYS H H 54 7.080 7.268 -0.188 1
1 706 . 17 1 1 A 54 54 LYS HA H 54 4.350 4.208 0.142 1
1 715 . 17 1 1 A 54 54 LYS C C 54 176.500 176.814 -0.314 1
1 716 . 17 1 1 A 54 54 LYS CA C 54 53.700 55.791 -2.091 1
1 717 . 17 1 1 A 54 54 LYS CB C 54 31.800 32.197 -0.397 1
1 721 . 17 1 1 A 54 54 LYS N N 54 119.200 119.179 0.021 1
1 722 . 17 1 1 A 55 55 GLY H H 55 8.040 8.150 -0.110 1
1 723 . 17 1 1 A 55 55 GLY HA2 H 55 3.540 3.898 -0.358 1
1 724 . 17 1 1 A 55 55 GLY HA3 H 55 4.300 3.899 0.401 1
1 725 . 17 1 1 A 55 55 GLY C C 55 174.500 174.702 -0.202 1
1 726 . 17 1 1 A 55 55 GLY CA C 55 44.700 45.731 -1.031 1
1 727 . 17 1 1 A 55 55 GLY N N 55 106.600 107.925 -1.325 1
1 728 . 17 1 1 A 56 56 VAL H H 56 7.580 7.375 0.205 1
1 729 . 17 1 1 A 56 56 VAL HA H 56 3.630 3.849 -0.219 1
1 737 . 17 1 1 A 56 56 VAL C C 56 174.700 175.565 -0.865 1
1 738 . 17 1 1 A 56 56 VAL CA C 56 64.000 62.462 1.538 1
1 739 . 17 1 1 A 56 56 VAL CB C 56 31.600 32.027 -0.427 1
1 742 . 17 1 1 A 56 56 VAL N N 56 122.000 122.208 -0.208 1
1 743 . 17 1 1 A 57 57 ASP H H 57 8.440 8.579 -0.139 1
1 744 . 17 1 1 A 57 57 ASP HA H 57 4.500 4.595 -0.095 1
1 747 . 17 1 1 A 57 57 ASP C C 57 176.900 176.541 0.359 1
1 748 . 17 1 1 A 57 57 ASP CA C 57 52.600 53.185 -0.585 1
1 749 . 17 1 1 A 57 57 ASP CB C 57 39.900 40.095 -0.195 1
1 750 . 17 1 1 A 57 57 ASP N N 57 124.100 127.117 -3.017 1
1 751 . 17 1 1 A 58 58 LEU H H 58 9.720 8.565 1.155 1
1 752 . 17 1 1 A 58 58 LEU HA H 58 4.020 4.391 -0.371 1
1 762 . 17 1 1 A 58 58 LEU C C 58 179.400 178.483 0.917 1
1 763 . 17 1 1 A 58 58 LEU CA C 58 56.300 56.920 -0.620 1
1 764 . 17 1 1 A 58 58 LEU CB C 58 43.300 42.622 0.678 1
1 768 . 17 1 1 A 58 58 LEU N N 58 127.800 127.801 -0.001 1
1 769 . 17 1 1 A 59 59 ASN H H 59 7.740 8.436 -0.696 1
1 770 . 17 1 1 A 59 59 ASN HA H 59 4.340 4.403 -0.063 1
1 775 . 17 1 1 A 59 59 ASN C C 59 176.300 177.635 -1.335 1
1 776 . 17 1 1 A 59 59 ASN CA C 59 56.300 56.129 0.171 1
1 777 . 17 1 1 A 59 59 ASN CB C 59 36.400 37.652 -1.252 1
1 779 . 17 1 1 A 59 59 ASN N N 59 119.500 117.093 2.407 1
1 781 . 17 1 1 A 60 60 ALA H H 60 7.220 7.379 -0.159 1
1 782 . 17 1 1 A 60 60 ALA HA H 60 4.030 4.134 -0.104 1
1 786 . 17 1 1 A 60 60 ALA C C 60 180.100 180.326 -0.226 1
1 787 . 17 1 1 A 60 60 ALA CA C 60 54.300 54.881 -0.581 1
1 788 . 17 1 1 A 60 60 ALA CB C 60 18.200 18.460 -0.260 1
1 789 . 17 1 1 A 60 60 ALA N N 60 121.400 122.379 -0.979 1
1 790 . 17 1 1 A 61 61 LEU H H 61 7.320 8.258 -0.938 1
1 791 . 17 1 1 A 61 61 LEU HA H 61 3.840 4.114 -0.274 1
1 801 . 17 1 1 A 61 61 LEU C C 61 177.200 178.523 -1.323 1
1 802 . 17 1 1 A 61 61 LEU CA C 61 58.500 58.263 0.237 1
1 803 . 17 1 1 A 61 61 LEU CB C 61 42.600 41.762 0.838 1
1 807 . 17 1 1 A 61 61 LEU N N 61 118.600 120.562 -1.962 1
1 808 . 17 1 1 A 62 62 PHE H H 62 8.360 8.106 0.254 1
1 809 . 17 1 1 A 62 62 PHE HA H 62 3.930 4.205 -0.275 1
1 817 . 17 1 1 A 62 62 PHE C C 62 178.200 177.725 0.475 1
1 818 . 17 1 1 A 62 62 PHE CA C 62 62.800 60.590 2.210 1
1 819 . 17 1 1 A 62 62 PHE CB C 62 38.500 38.630 -0.130 1
1 825 . 17 1 1 A 62 62 PHE N N 62 114.400 117.609 -3.209 1
1 826 . 17 1 1 A 63 63 ASP H H 63 8.680 8.307 0.373 1
1 827 . 17 1 1 A 63 63 ASP HA H 63 4.530 4.440 0.090 1
1 830 . 17 1 1 A 63 63 ASP C C 63 178.600 177.906 0.694 1
1 831 . 17 1 1 A 63 63 ASP CA C 63 57.500 57.526 -0.026 1
1 832 . 17 1 1 A 63 63 ASP CB C 63 39.600 41.279 -1.679 1
1 833 . 17 1 1 A 63 63 ASP N N 63 120.400 119.542 0.858 1
1 834 . 17 1 1 A 64 64 ARG H H 64 7.540 7.738 -0.198 1
1 835 . 17 1 1 A 64 64 ARG HA H 64 4.290 4.125 0.165 1
1 843 . 17 1 1 A 64 64 ARG C C 64 177.600 178.322 -0.722 1
1 844 . 17 1 1 A 64 64 ARG CA C 64 58.300 58.596 -0.296 1
1 845 . 17 1 1 A 64 64 ARG CB C 64 30.000 30.000 0.000 1
1 848 . 17 1 1 A 64 64 ARG N N 64 116.800 117.727 -0.927 1
1 850 . 17 1 1 A 65 65 ILE H H 65 7.260 8.412 -1.152 1
1 851 . 17 1 1 A 65 65 ILE HA H 65 4.130 3.642 0.488 1
1 861 . 17 1 1 A 65 65 ILE C C 65 177.000 178.166 -1.166 1
1 862 . 17 1 1 A 65 65 ILE CA C 65 62.600 65.205 -2.605 1
1 863 . 17 1 1 A 65 65 ILE CB C 65 38.700 37.766 0.934 1
1 867 . 17 1 1 A 65 65 ILE N N 65 117.000 120.582 -3.582 1
1 868 . 17 1 1 A 66 66 ILE H H 66 7.980 7.773 0.207 1
1 869 . 17 1 1 A 66 66 ILE HA H 66 4.000 4.084 -0.084 1
1 879 . 17 1 1 A 66 66 ILE C C 66 176.400 176.131 0.269 1
1 880 . 17 1 1 A 66 66 ILE CA C 66 63.100 63.166 -0.066 1
1 881 . 17 1 1 A 66 66 ILE CB C 66 38.800 37.629 1.171 1
1 885 . 17 1 1 A 66 66 ILE N N 66 120.700 116.376 4.324 1
1 886 . 17 1 1 A 67 67 VAL H H 67 8.130 7.455 0.675 1
1 887 . 17 1 1 A 67 67 VAL HA H 67 3.980 3.798 0.182 1
1 895 . 17 1 1 A 67 67 VAL C C 67 177.300 175.699 1.601 1
1 896 . 17 1 1 A 67 67 VAL CA C 67 63.900 62.885 1.015 1
1 897 . 17 1 1 A 67 67 VAL CB C 67 32.500 31.978 0.522 1
1 900 . 17 1 1 A 67 67 VAL N N 67 121.600 123.675 -2.075 1
1 901 . 17 1 1 A 68 68 ASN H H 68 8.170 8.791 -0.621 1
1 902 . 17 1 1 A 68 68 ASN HA H 68 4.680 4.434 0.246 1
1 907 . 17 1 1 A 68 68 ASN CA C 68 54.200 55.260 -1.060 1
1 908 . 17 1 1 A 68 68 ASN CB C 68 39.100 37.174 1.926 1
1 910 . 17 1 1 A 68 68 ASN N N 68 120.500 124.385 -3.885 1
1 912 . 17 1 1 A 69 69 LYS H H 69 8.230 8.399 -0.169 1
1 913 . 17 1 1 A 69 69 LYS HA H 69 4.260 4.415 -0.155 1
1 922 . 17 1 1 A 69 69 LYS C C 69 176.900 176.312 0.588 1
1 923 . 17 1 1 A 69 69 LYS CA C 69 57.000 57.713 -0.713 1
1 924 . 17 1 1 A 69 69 LYS CB C 69 32.800 33.525 -0.725 1
1 928 . 17 1 1 A 69 69 LYS N N 69 121.300 121.274 0.026 1
1 929 . 17 1 1 A 70 70 LEU H H 70 8.150 7.901 0.249 1
1 930 . 17 1 1 A 70 70 LEU HA H 70 4.300 3.857 0.443 1
1 940 . 17 1 1 A 70 70 LEU C C 70 178.900 174.667 4.233 1
1 941 . 17 1 1 A 70 70 LEU CA C 70 55.400 56.211 -0.811 1
1 942 . 17 1 1 A 70 70 LEU CB C 70 42.100 40.204 1.896 1
1 946 . 17 1 1 A 70 70 LEU N N 70 121.900 120.973 0.927 1
1 947 . 17 1 1 A 71 71 GLU H H 71 8.210 7.713 0.497 1
1 948 . 17 1 1 A 71 71 GLU HA H 71 4.180 4.636 -0.456 1
1 953 . 17 1 1 A 71 71 GLU C C 71 176.300 175.390 0.910 1
1 954 . 17 1 1 A 71 71 GLU CA C 71 56.600 54.908 1.692 1
1 955 . 17 1 1 A 71 71 GLU CB C 71 30.200 31.874 -1.674 1
1 957 . 17 1 1 A 71 71 GLU N N 71 120.900 119.815 1.085 1
1 958 . 17 1 1 A 72 72 HIS H H 72 8.380 9.037 -0.657 1
1 959 . 17 1 1 A 72 72 HIS HA H 72 4.600 5.021 -0.421 1
1 962 . 17 1 1 A 72 72 HIS C C 72 174.600 173.556 1.044 1
1 963 . 17 1 1 A 72 72 HIS CA C 72 55.600 54.155 1.445 1
1 964 . 17 1 1 A 72 72 HIS CB C 72 29.600 32.609 -3.009 1
1 965 . 17 1 1 A 72 72 HIS N N 72 119.300 120.220 -0.920 1
1 966 . 17 1 1 A 73 73 HIS H H 73 8.410 8.741 -0.331 1
1 967 . 17 1 1 A 73 73 HIS HA H 73 4.610 4.679 -0.069 1
1 970 . 17 1 1 A 73 73 HIS C C 73 173.700 175.266 -1.566 1
1 971 . 17 1 1 A 73 73 HIS CA C 73 55.700 56.916 -1.216 1
1 972 . 17 1 1 A 73 73 HIS CB C 73 29.600 30.581 -0.981 1
1 973 . 17 1 1 A 73 73 HIS N N 73 119.410 120.693 -1.283 1
1 974 . 17 1 1 A 74 74 HIS H H 74 8.310 9.042 -0.732 1
1 975 . 17 1 1 A 74 74 HIS HA H 74 4.630 4.671 -0.041 1
1 978 . 17 1 1 A 74 74 HIS CA C 74 57.100 54.495 2.605 1
1 979 . 17 1 1 A 74 74 HIS CB C 74 29.800 29.305 0.495 1
1 14 . 18 1 1 A 2 2 GLU H H 2 9.070 8.228 0.842 1
1 15 . 18 1 1 A 2 2 GLU HA H 2 4.520 4.531 -0.011 1
1 20 . 18 1 1 A 2 2 GLU C C 2 176.300 178.289 -1.989 1
1 21 . 18 1 1 A 2 2 GLU CA C 2 55.800 55.550 0.250 1
1 22 . 18 1 1 A 2 2 GLU CB C 2 31.000 30.988 0.012 1
1 24 . 18 1 1 A 2 2 GLU N N 2 123.100 121.673 1.427 1
1 25 . 18 1 1 A 3 3 LEU H H 3 8.750 8.794 -0.044 1
1 26 . 18 1 1 A 3 3 LEU HA H 3 3.750 4.051 -0.301 1
1 36 . 18 1 1 A 3 3 LEU C C 3 177.400 178.256 -0.856 1
1 37 . 18 1 1 A 3 3 LEU CA C 3 58.300 58.275 0.025 1
1 38 . 18 1 1 A 3 3 LEU CB C 3 41.500 41.297 0.203 1
1 42 . 18 1 1 A 3 3 LEU N N 3 122.600 126.925 -4.325 1
1 43 . 18 1 1 A 4 4 SER H H 4 8.350 8.158 0.192 1
1 44 . 18 1 1 A 4 4 SER HA H 4 3.890 4.190 -0.300 1
1 47 . 18 1 1 A 4 4 SER C C 4 175.100 176.441 -1.341 1
1 48 . 18 1 1 A 4 4 SER CA C 4 61.500 61.505 -0.005 1
1 49 . 18 1 1 A 4 4 SER CB C 4 62.000 62.450 -0.450 1
1 50 . 18 1 1 A 4 4 SER N N 4 112.900 115.046 -2.146 1
1 51 . 18 1 1 A 5 5 ASN H H 5 7.180 8.123 -0.943 1
1 52 . 18 1 1 A 5 5 ASN HA H 5 4.470 4.482 -0.012 1
1 57 . 18 1 1 A 5 5 ASN C C 5 177.400 177.824 -0.424 1
1 58 . 18 1 1 A 5 5 ASN CA C 5 56.000 56.763 -0.763 1
1 59 . 18 1 1 A 5 5 ASN CB C 5 39.400 38.946 0.454 1
1 61 . 18 1 1 A 5 5 ASN N N 5 116.600 120.261 -3.661 1
1 63 . 18 1 1 A 6 6 GLU H H 6 7.950 8.119 -0.169 1
1 64 . 18 1 1 A 6 6 GLU HA H 6 4.070 4.064 0.006 1
1 69 . 18 1 1 A 6 6 GLU C C 6 178.500 179.142 -0.642 1
1 70 . 18 1 1 A 6 6 GLU CA C 6 58.100 59.153 -1.053 1
1 71 . 18 1 1 A 6 6 GLU CB C 6 29.300 29.923 -0.623 1
1 73 . 18 1 1 A 6 6 GLU N N 6 117.600 118.785 -1.185 1
1 74 . 18 1 1 A 7 7 LEU H H 7 8.140 8.081 0.059 1
1 75 . 18 1 1 A 7 7 LEU HA H 7 3.640 4.106 -0.466 1
1 85 . 18 1 1 A 7 7 LEU C C 7 177.700 178.614 -0.914 1
1 86 . 18 1 1 A 7 7 LEU CA C 7 58.300 57.805 0.495 1
1 87 . 18 1 1 A 7 7 LEU CB C 7 40.600 41.929 -1.329 1
1 91 . 18 1 1 A 7 7 LEU N N 7 118.500 121.242 -2.742 1
1 92 . 18 1 1 A 8 8 LYS H H 8 7.090 7.890 -0.800 1
1 93 . 18 1 1 A 8 8 LYS HA H 8 4.080 3.974 0.106 1
1 102 . 18 1 1 A 8 8 LYS C C 8 178.300 178.988 -0.688 1
1 103 . 18 1 1 A 8 8 LYS CA C 8 59.700 59.550 0.150 1
1 104 . 18 1 1 A 8 8 LYS CB C 8 32.300 32.366 -0.066 1
1 108 . 18 1 1 A 8 8 LYS N N 8 118.200 119.250 -1.050 1
1 109 . 18 1 1 A 9 9 VAL H H 9 7.940 7.972 -0.032 1
1 110 . 18 1 1 A 9 9 VAL HA H 9 3.440 3.551 -0.111 1
1 118 . 18 1 1 A 9 9 VAL C C 9 179.500 177.924 1.576 1
1 119 . 18 1 1 A 9 9 VAL CA C 9 66.700 66.770 -0.070 1
1 120 . 18 1 1 A 9 9 VAL CB C 9 31.600 31.579 0.021 1
1 123 . 18 1 1 A 9 9 VAL N N 9 117.600 120.201 -2.601 1
1 124 . 18 1 1 A 10 10 GLU H H 10 7.830 7.956 -0.126 1
1 125 . 18 1 1 A 10 10 GLU HA H 10 4.130 4.077 0.053 1
1 130 . 18 1 1 A 10 10 GLU C C 10 178.700 179.228 -0.528 1
1 131 . 18 1 1 A 10 10 GLU CA C 10 58.300 59.115 -0.815 1
1 132 . 18 1 1 A 10 10 GLU CB C 10 28.500 29.412 -0.912 1
1 134 . 18 1 1 A 10 10 GLU N N 10 118.300 120.002 -1.702 1
1 135 . 18 1 1 A 11 11 ARG H H 11 8.330 7.363 0.967 1
1 136 . 18 1 1 A 11 11 ARG HA H 11 3.770 4.095 -0.325 1
1 144 . 18 1 1 A 11 11 ARG C C 11 174.600 178.813 -4.213 1
1 145 . 18 1 1 A 11 11 ARG CA C 11 61.300 58.783 2.517 1
1 146 . 18 1 1 A 11 11 ARG CB C 11 28.500 30.046 -1.546 1
1 149 . 18 1 1 A 11 11 ARG N N 11 121.400 119.210 2.190 1
1 151 . 18 1 1 A 12 12 ILE H H 12 8.540 8.937 -0.397 1
1 152 . 18 1 1 A 12 12 ILE HA H 12 3.780 3.747 0.033 1
1 162 . 18 1 1 A 12 12 ILE C C 12 181.400 177.752 3.648 1
1 163 . 18 1 1 A 12 12 ILE CA C 12 64.800 65.172 -0.372 1
1 164 . 18 1 1 A 12 12 ILE CB C 12 37.700 37.462 0.238 1
1 168 . 18 1 1 A 12 12 ILE N N 12 118.700 119.741 -1.041 1
1 169 . 18 1 1 A 13 13 ARG H H 13 8.470 8.833 -0.363 1
1 170 . 18 1 1 A 13 13 ARG HA H 13 4.060 3.965 0.095 1
1 178 . 18 1 1 A 13 13 ARG C C 13 178.600 178.208 0.392 1
1 179 . 18 1 1 A 13 13 ARG CA C 13 59.600 59.920 -0.320 1
1 180 . 18 1 1 A 13 13 ARG CB C 13 30.000 29.701 0.299 1
1 183 . 18 1 1 A 13 13 ARG N N 13 124.600 120.197 4.403 1
1 185 . 18 1 1 A 14 14 LEU H H 14 7.430 7.809 -0.379 1
1 186 . 18 1 1 A 14 14 LEU HA H 14 4.240 4.344 -0.104 1
1 196 . 18 1 1 A 14 14 LEU C C 14 176.000 175.924 0.076 1
1 197 . 18 1 1 A 14 14 LEU CA C 14 55.300 54.660 0.640 1
1 198 . 18 1 1 A 14 14 LEU CB C 14 43.000 41.901 1.099 1
1 202 . 18 1 1 A 14 14 LEU N N 14 118.500 118.166 0.334 1
1 203 . 18 1 1 A 15 15 SER H H 15 8.260 8.186 0.074 1
1 204 . 18 1 1 A 15 15 SER HA H 15 4.030 4.125 -0.095 1
1 207 . 18 1 1 A 15 15 SER C C 15 174.000 173.642 0.358 1
1 208 . 18 1 1 A 15 15 SER CA C 15 58.700 58.683 0.017 1
1 209 . 18 1 1 A 15 15 SER CB C 15 61.300 61.847 -0.547 1
1 210 . 18 1 1 A 15 15 SER N N 15 112.500 113.587 -1.087 1
1 211 . 18 1 1 A 16 16 LEU H H 16 7.310 7.682 -0.372 1
1 212 . 18 1 1 A 16 16 LEU HA H 16 4.880 4.303 0.577 1
1 222 . 18 1 1 A 16 16 LEU C C 16 177.900 177.059 0.841 1
1 223 . 18 1 1 A 16 16 LEU CA C 16 52.600 55.120 -2.520 1
1 224 . 18 1 1 A 16 16 LEU CB C 16 43.500 41.974 1.526 1
1 228 . 18 1 1 A 16 16 LEU N N 16 117.800 121.533 -3.733 1
1 229 . 18 1 1 A 17 17 THR H H 17 8.640 8.622 0.018 1
1 230 . 18 1 1 A 17 17 THR HA H 17 4.250 4.706 -0.456 1
1 235 . 18 1 1 A 17 17 THR C C 17 174.900 175.799 -0.899 1
1 236 . 18 1 1 A 17 17 THR CA C 17 60.500 60.799 -0.299 1
1 237 . 18 1 1 A 17 17 THR CB C 17 70.500 70.664 -0.164 1
1 239 . 18 1 1 A 17 17 THR N N 17 115.200 115.914 -0.714 1
1 240 . 18 1 1 A 18 18 ALA H H 18 8.820 9.065 -0.245 1
1 241 . 18 1 1 A 18 18 ALA HA H 18 3.680 3.992 -0.312 1
1 245 . 18 1 1 A 18 18 ALA C C 18 178.900 179.847 -0.947 1
1 246 . 18 1 1 A 18 18 ALA CA C 18 55.200 55.234 -0.034 1
1 247 . 18 1 1 A 18 18 ALA CB C 18 17.800 18.001 -0.201 1
1 248 . 18 1 1 A 18 18 ALA N N 18 125.600 125.618 -0.018 1
1 249 . 18 1 1 A 19 19 LYS H H 19 8.280 8.108 0.172 1
1 250 . 18 1 1 A 19 19 LYS HA H 19 3.740 4.009 -0.269 1
1 259 . 18 1 1 A 19 19 LYS C C 19 177.900 179.119 -1.219 1
1 260 . 18 1 1 A 19 19 LYS CA C 19 59.800 59.238 0.562 1
1 261 . 18 1 1 A 19 19 LYS CB C 19 33.300 32.178 1.122 1
1 265 . 18 1 1 A 19 19 LYS N N 19 115.800 118.134 -2.334 1
1 266 . 18 1 1 A 20 20 SER H H 20 7.860 8.342 -0.482 1
1 267 . 18 1 1 A 20 20 SER HA H 20 4.210 4.180 0.030 1
1 271 . 18 1 1 A 20 20 SER C C 20 177.200 177.297 -0.097 1
1 272 . 18 1 1 A 20 20 SER CA C 20 61.900 61.256 0.644 1
1 273 . 18 1 1 A 20 20 SER CB C 20 63.000 62.373 0.627 1
1 274 . 18 1 1 A 20 20 SER N N 20 114.600 114.514 0.086 1
1 275 . 18 1 1 A 21 21 VAL H H 21 7.830 8.132 -0.302 1
1 276 . 18 1 1 A 21 21 VAL HA H 21 3.280 3.576 -0.296 1
1 284 . 18 1 1 A 21 21 VAL C C 21 177.500 178.083 -0.583 1
1 285 . 18 1 1 A 21 21 VAL CA C 21 66.800 66.717 0.083 1
1 286 . 18 1 1 A 21 21 VAL CB C 21 31.400 31.556 -0.156 1
1 289 . 18 1 1 A 21 21 VAL N N 21 122.600 122.202 0.398 1
1 290 . 18 1 1 A 22 22 ALA H H 22 8.230 8.559 -0.329 1
1 291 . 18 1 1 A 22 22 ALA HA H 22 3.510 3.953 -0.443 1
1 295 . 18 1 1 A 22 22 ALA C C 22 179.500 179.197 0.303 1
1 296 . 18 1 1 A 22 22 ALA CA C 22 55.500 55.518 -0.018 1
1 297 . 18 1 1 A 22 22 ALA CB C 22 16.900 17.771 -0.871 1
1 298 . 18 1 1 A 22 22 ALA N N 22 121.200 122.077 -0.877 1
1 299 . 18 1 1 A 23 23 GLU H H 23 7.900 8.503 -0.603 1
1 300 . 18 1 1 A 23 23 GLU HA H 23 3.990 4.037 -0.047 1
1 305 . 18 1 1 A 23 23 GLU C C 23 180.000 179.053 0.947 1
1 306 . 18 1 1 A 23 23 GLU CA C 23 59.300 59.627 -0.327 1
1 307 . 18 1 1 A 23 23 GLU CB C 23 29.300 29.264 0.036 1
1 309 . 18 1 1 A 23 23 GLU N N 23 115.300 118.659 -3.359 1
1 310 . 18 1 1 A 24 24 GLU H H 24 7.950 8.305 -0.355 1
1 311 . 18 1 1 A 24 24 GLU HA H 24 4.060 4.088 -0.028 1
1 316 . 18 1 1 A 24 24 GLU C C 24 179.100 179.461 -0.361 1
1 317 . 18 1 1 A 24 24 GLU CA C 24 59.700 59.149 0.551 1
1 318 . 18 1 1 A 24 24 GLU CB C 24 29.500 29.740 -0.240 1
1 320 . 18 1 1 A 24 24 GLU N N 24 120.100 119.472 0.628 1
1 321 . 18 1 1 A 25 25 MET H H 25 8.150 8.177 -0.027 1
1 322 . 18 1 1 A 25 25 MET HA H 25 4.110 4.324 -0.214 1
1 330 . 18 1 1 A 25 25 MET C C 25 176.600 176.898 -0.298 1
1 331 . 18 1 1 A 25 25 MET CA C 25 57.100 56.791 0.309 1
1 332 . 18 1 1 A 25 25 MET CB C 25 34.900 32.727 2.173 1
1 335 . 18 1 1 A 25 25 MET N N 25 115.500 117.587 -2.087 1
1 336 . 18 1 1 A 26 26 GLY H H 26 7.940 8.903 -0.963 1
1 337 . 18 1 1 A 26 26 GLY HA2 H 26 3.860 3.951 -0.091 1
1 338 . 18 1 1 A 26 26 GLY HA3 H 26 3.960 3.952 0.008 1
1 339 . 18 1 1 A 26 26 GLY C C 26 175.100 173.872 1.228 1
1 340 . 18 1 1 A 26 26 GLY CA C 26 46.600 46.431 0.169 1
1 341 . 18 1 1 A 26 26 GLY N N 26 109.000 106.883 2.117 1
1 342 . 18 1 1 A 27 27 ILE H H 27 7.880 7.432 0.448 1
1 343 . 18 1 1 A 27 27 ILE HA H 27 4.790 4.819 -0.029 1
1 353 . 18 1 1 A 27 27 ILE C C 27 174.300 174.818 -0.518 1
1 354 . 18 1 1 A 27 27 ILE CA C 27 59.000 58.524 0.476 1
1 355 . 18 1 1 A 27 27 ILE CB C 27 40.900 41.590 -0.690 1
1 359 . 18 1 1 A 27 27 ILE N N 27 112.700 114.962 -2.262 1
1 360 . 18 1 1 A 28 28 SER H H 28 8.570 8.595 -0.025 1
1 361 . 18 1 1 A 28 28 SER HA H 28 4.540 4.623 -0.083 1
1 364 . 18 1 1 A 28 28 SER C C 28 175.600 175.710 -0.110 1
1 365 . 18 1 1 A 28 28 SER CA C 28 56.800 58.466 -1.666 1
1 366 . 18 1 1 A 28 28 SER CB C 28 65.500 63.634 1.866 1
1 367 . 18 1 1 A 28 28 SER N N 28 115.400 118.182 -2.782 1
1 368 . 18 1 1 A 29 29 ARG H H 29 8.980 9.067 -0.087 1
1 369 . 18 1 1 A 29 29 ARG HA H 29 3.660 3.957 -0.297 1
1 377 . 18 1 1 A 29 29 ARG C C 29 178.700 178.714 -0.014 1
1 378 . 18 1 1 A 29 29 ARG CA C 29 59.500 60.229 -0.729 1
1 379 . 18 1 1 A 29 29 ARG CB C 29 29.500 29.737 -0.237 1
1 382 . 18 1 1 A 29 29 ARG N N 29 122.000 128.044 -6.044 1
1 384 . 18 1 1 A 30 30 GLN H H 30 8.580 7.702 0.878 1
1 385 . 18 1 1 A 30 30 GLN HA H 30 3.860 3.995 -0.135 1
1 392 . 18 1 1 A 30 30 GLN C C 30 178.100 178.315 -0.215 1
1 393 . 18 1 1 A 30 30 GLN CA C 30 59.200 59.277 -0.077 1
1 394 . 18 1 1 A 30 30 GLN CB C 30 28.100 28.189 -0.089 1
1 397 . 18 1 1 A 30 30 GLN N N 30 118.700 119.236 -0.536 1
1 399 . 18 1 1 A 31 31 GLN H H 31 7.990 7.847 0.143 1
1 400 . 18 1 1 A 31 31 GLN HA H 31 3.980 4.030 -0.050 1
1 407 . 18 1 1 A 31 31 GLN C C 31 178.700 178.551 0.149 1
1 408 . 18 1 1 A 31 31 GLN CA C 31 59.100 58.752 0.348 1
1 409 . 18 1 1 A 31 31 GLN CB C 31 28.700 28.114 0.586 1
1 412 . 18 1 1 A 31 31 GLN N N 31 119.600 118.704 0.896 1
1 414 . 18 1 1 A 32 32 LEU H H 32 7.630 7.651 -0.021 1
1 415 . 18 1 1 A 32 32 LEU HA H 32 3.740 4.097 -0.357 1
1 425 . 18 1 1 A 32 32 LEU C C 32 178.300 178.436 -0.136 1
1 426 . 18 1 1 A 32 32 LEU CA C 32 57.700 57.970 -0.270 1
1 427 . 18 1 1 A 32 32 LEU CB C 32 41.500 41.395 0.105 1
1 431 . 18 1 1 A 32 32 LEU N N 32 120.700 122.119 -1.419 1
1 432 . 18 1 1 A 33 33 CYS H H 33 8.240 8.401 -0.161 1
1 433 . 18 1 1 A 33 33 CYS HA H 33 3.990 4.084 -0.094 1
1 436 . 18 1 1 A 33 33 CYS C C 33 177.000 176.819 0.181 1
1 437 . 18 1 1 A 33 33 CYS CA C 33 63.100 62.696 0.404 1
1 438 . 18 1 1 A 33 33 CYS CB C 33 26.100 27.169 -1.069 1
1 439 . 18 1 1 A 33 33 CYS N N 33 117.400 117.976 -0.576 1
1 440 . 18 1 1 A 34 34 ASN H H 34 8.210 8.064 0.146 1
1 441 . 18 1 1 A 34 34 ASN HA H 34 4.370 4.468 -0.098 1
1 446 . 18 1 1 A 34 34 ASN C C 34 178.700 177.751 0.949 1
1 447 . 18 1 1 A 34 34 ASN CA C 34 56.000 56.783 -0.783 1
1 448 . 18 1 1 A 34 34 ASN CB C 34 37.800 39.258 -1.458 1
1 450 . 18 1 1 A 34 34 ASN N N 34 117.300 118.634 -1.334 1
1 452 . 18 1 1 A 35 35 ILE H H 35 7.850 7.680 0.170 1
1 453 . 18 1 1 A 35 35 ILE HA H 35 3.850 3.587 0.263 1
1 463 . 18 1 1 A 35 35 ILE C C 35 178.100 177.866 0.234 1
1 464 . 18 1 1 A 35 35 ILE CA C 35 64.800 65.320 -0.520 1
1 465 . 18 1 1 A 35 35 ILE CB C 35 38.000 37.621 0.379 1
1 469 . 18 1 1 A 35 35 ILE N N 35 120.400 119.424 0.976 1
1 470 . 18 1 1 A 36 36 GLU H H 36 7.680 8.352 -0.672 1
1 471 . 18 1 1 A 36 36 GLU HA H 36 4.120 3.945 0.175 1
1 476 . 18 1 1 A 36 36 GLU C C 36 176.300 178.371 -2.071 1
1 477 . 18 1 1 A 36 36 GLU CA C 36 58.600 59.603 -1.003 1
1 478 . 18 1 1 A 36 36 GLU CB C 36 30.000 29.413 0.587 1
1 480 . 18 1 1 A 36 36 GLU N N 36 116.500 121.204 -4.704 1
1 481 . 18 1 1 A 37 37 GLN H H 37 7.630 7.865 -0.235 1
1 482 . 18 1 1 A 37 37 GLN HA H 37 4.540 4.376 0.164 1
1 489 . 18 1 1 A 37 37 GLN C C 37 176.000 175.802 0.198 1
1 490 . 18 1 1 A 37 37 GLN CA C 37 54.900 55.515 -0.615 1
1 491 . 18 1 1 A 37 37 GLN CB C 37 29.600 28.279 1.321 1
1 494 . 18 1 1 A 37 37 GLN N N 37 115.000 115.727 -0.727 1
1 496 . 18 1 1 A 38 38 SER H H 38 7.380 7.530 -0.150 1
1 497 . 18 1 1 A 38 38 SER HA H 38 4.410 4.434 -0.024 1
1 500 . 18 1 1 A 38 38 SER C C 38 175.500 174.348 1.152 1
1 501 . 18 1 1 A 38 38 SER CA C 38 59.200 58.686 0.514 1
1 502 . 18 1 1 A 38 38 SER CB C 38 64.100 63.864 0.236 1
1 503 . 18 1 1 A 38 38 SER N N 38 115.200 116.322 -1.122 1
1 504 . 18 1 1 A 39 39 GLU H H 39 9.040 8.754 0.286 1
1 505 . 18 1 1 A 39 39 GLU HA H 39 4.450 4.745 -0.295 1
1 510 . 18 1 1 A 39 39 GLU C C 39 176.300 175.565 0.735 1
1 511 . 18 1 1 A 39 39 GLU CA C 39 57.100 55.706 1.394 1
1 512 . 18 1 1 A 39 39 GLU CB C 39 30.300 30.168 0.132 1
1 514 . 18 1 1 A 39 39 GLU N N 39 125.400 123.405 1.995 1
1 515 . 18 1 1 A 40 40 THR H H 40 7.920 6.941 0.979 1
1 516 . 18 1 1 A 40 40 THR HA H 40 4.590 4.751 -0.161 1
1 521 . 18 1 1 A 40 40 THR C C 40 173.500 173.084 0.416 1
1 522 . 18 1 1 A 40 40 THR CA C 40 60.500 60.784 -0.284 1
1 523 . 18 1 1 A 40 40 THR CB C 40 71.100 70.635 0.465 1
1 525 . 18 1 1 A 40 40 THR N N 40 112.800 114.969 -2.169 1
1 526 . 18 1 1 A 41 41 ALA H H 41 8.780 8.757 0.023 1
1 527 . 18 1 1 A 41 41 ALA HA H 41 4.870 4.534 0.336 1
1 531 . 18 1 1 A 41 41 ALA CA C 41 49.700 50.936 -1.236 1
1 532 . 18 1 1 A 41 41 ALA CB C 41 19.300 17.926 1.374 1
1 533 . 18 1 1 A 41 41 ALA N N 41 127.000 132.299 -5.299 1
1 534 . 18 1 1 A 42 42 PRO HA H 42 4.660 4.586 0.074 1
1 541 . 18 1 1 A 42 42 PRO C C 42 178.300 177.641 0.659 1
1 542 . 18 1 1 A 42 42 PRO CA C 42 62.500 62.820 -0.320 1
1 543 . 18 1 1 A 42 42 PRO CB C 42 32.600 32.614 -0.014 1
1 546 . 18 1 1 A 43 43 VAL H H 43 8.840 8.891 -0.051 1
1 547 . 18 1 1 A 43 43 VAL HA H 43 3.660 3.976 -0.316 1
1 555 . 18 1 1 A 43 43 VAL CA C 43 66.800 64.413 2.387 1
1 556 . 18 1 1 A 43 43 VAL CB C 43 31.100 31.874 -0.774 1
1 559 . 18 1 1 A 43 43 VAL N N 43 123.000 123.592 -0.592 1
1 560 . 18 1 1 A 44 44 VAL HA H 44 4.030 3.665 0.365 1
1 568 . 18 1 1 A 44 44 VAL C C 44 176.700 178.525 -1.825 1
1 569 . 18 1 1 A 44 44 VAL CA C 44 65.900 66.993 -1.093 1
1 570 . 18 1 1 A 44 44 VAL CB C 44 30.900 31.545 -0.645 1
1 573 . 18 1 1 A 45 45 VAL H H 45 7.500 7.918 -0.418 1
1 574 . 18 1 1 A 45 45 VAL HA H 45 3.760 3.546 0.214 1
1 582 . 18 1 1 A 45 45 VAL C C 45 177.500 177.673 -0.173 1
1 583 . 18 1 1 A 45 45 VAL CA C 45 66.700 66.847 -0.147 1
1 584 . 18 1 1 A 45 45 VAL CB C 45 31.000 31.278 -0.278 1
1 587 . 18 1 1 A 45 45 VAL N N 45 120.100 120.218 -0.118 1
1 588 . 18 1 1 A 46 46 LYS H H 46 7.610 7.842 -0.232 1
1 589 . 18 1 1 A 46 46 LYS HA H 46 4.140 4.023 0.117 1
1 598 . 18 1 1 A 46 46 LYS C C 46 179.500 178.727 0.773 1
1 599 . 18 1 1 A 46 46 LYS CA C 46 59.900 59.142 0.758 1
1 600 . 18 1 1 A 46 46 LYS CB C 46 31.500 32.105 -0.605 1
1 604 . 18 1 1 A 46 46 LYS N N 46 120.700 118.656 2.044 1
1 605 . 18 1 1 A 47 47 TYR H H 47 8.550 8.232 0.318 1
1 606 . 18 1 1 A 47 47 TYR HA H 47 5.000 4.209 0.791 1
1 613 . 18 1 1 A 47 47 TYR C C 47 177.300 177.179 0.121 1
1 614 . 18 1 1 A 47 47 TYR CA C 47 57.300 61.349 -4.049 1
1 615 . 18 1 1 A 47 47 TYR CB C 47 37.700 38.770 -1.070 1
1 620 . 18 1 1 A 47 47 TYR N N 47 122.700 120.763 1.937 1
1 621 . 18 1 1 A 48 48 ILE H H 48 8.250 8.395 -0.145 1
1 622 . 18 1 1 A 48 48 ILE HA H 48 3.160 3.644 -0.484 1
1 632 . 18 1 1 A 48 48 ILE C C 48 177.100 178.053 -0.953 1
1 633 . 18 1 1 A 48 48 ILE CA C 48 67.000 65.421 1.579 1
1 634 . 18 1 1 A 48 48 ILE CB C 48 37.800 38.261 -0.461 1
1 638 . 18 1 1 A 48 48 ILE N N 48 121.200 120.816 0.384 1
1 639 . 18 1 1 A 49 49 ALA H H 49 8.310 8.961 -0.651 1
1 640 . 18 1 1 A 49 49 ALA HA H 49 3.940 4.059 -0.119 1
1 644 . 18 1 1 A 49 49 ALA C C 49 179.300 179.638 -0.338 1
1 645 . 18 1 1 A 49 49 ALA CA C 49 55.500 54.998 0.502 1
1 646 . 18 1 1 A 49 49 ALA CB C 49 18.200 17.780 0.420 1
1 647 . 18 1 1 A 49 49 ALA N N 49 120.300 121.881 -1.581 1
1 648 . 18 1 1 A 50 50 PHE H H 50 8.630 8.105 0.525 1
1 649 . 18 1 1 A 50 50 PHE HA H 50 4.200 4.163 0.037 1
1 656 . 18 1 1 A 50 50 PHE C C 50 179.000 176.367 2.633 1
1 657 . 18 1 1 A 50 50 PHE CA C 50 61.300 61.409 -0.109 1
1 658 . 18 1 1 A 50 50 PHE CB C 50 39.200 39.245 -0.045 1
1 663 . 18 1 1 A 50 50 PHE N N 50 121.300 120.279 1.021 1
1 664 . 18 1 1 A 51 51 LEU H H 51 8.920 8.142 0.778 1
1 665 . 18 1 1 A 51 51 LEU HA H 51 3.630 3.919 -0.289 1
1 675 . 18 1 1 A 51 51 LEU C C 51 180.000 179.414 0.586 1
1 676 . 18 1 1 A 51 51 LEU CA C 51 58.100 57.797 0.303 1
1 677 . 18 1 1 A 51 51 LEU CB C 51 39.800 41.416 -1.616 1
1 681 . 18 1 1 A 51 51 LEU N N 51 121.900 119.069 2.831 1
1 682 . 18 1 1 A 52 52 ARG H H 52 8.410 8.617 -0.207 1
1 683 . 18 1 1 A 52 52 ARG HA H 52 4.420 4.032 0.388 1
1 691 . 18 1 1 A 52 52 ARG C C 52 179.800 179.153 0.647 1
1 692 . 18 1 1 A 52 52 ARG CA C 52 57.800 59.718 -1.918 1
1 693 . 18 1 1 A 52 52 ARG CB C 52 28.200 29.822 -1.622 1
1 695 . 18 1 1 A 52 52 ARG N N 52 120.500 119.581 0.919 1
1 697 . 18 1 1 A 53 53 SER H H 53 8.480 8.296 0.184 1
1 698 . 18 1 1 A 53 53 SER HA H 53 4.300 4.144 0.156 1
1 701 . 18 1 1 A 53 53 SER C C 53 174.600 175.449 -0.849 1
1 702 . 18 1 1 A 53 53 SER CA C 53 61.500 61.155 0.345 1
1 703 . 18 1 1 A 53 53 SER CB C 53 62.300 62.661 -0.361 1
1 704 . 18 1 1 A 53 53 SER N N 53 119.500 114.282 5.218 1
1 705 . 18 1 1 A 54 54 LYS H H 54 7.080 7.354 -0.274 1
1 706 . 18 1 1 A 54 54 LYS HA H 54 4.350 4.286 0.064 1
1 715 . 18 1 1 A 54 54 LYS C C 54 176.500 176.894 -0.394 1
1 716 . 18 1 1 A 54 54 LYS CA C 54 53.700 55.887 -2.187 1
1 717 . 18 1 1 A 54 54 LYS CB C 54 31.800 32.629 -0.829 1
1 721 . 18 1 1 A 54 54 LYS N N 54 119.200 119.288 -0.088 1
1 722 . 18 1 1 A 55 55 GLY H H 55 8.040 8.484 -0.444 1
1 723 . 18 1 1 A 55 55 GLY HA2 H 55 3.540 3.883 -0.343 1
1 724 . 18 1 1 A 55 55 GLY HA3 H 55 4.300 3.887 0.413 1
1 725 . 18 1 1 A 55 55 GLY C C 55 174.500 174.899 -0.399 1
1 726 . 18 1 1 A 55 55 GLY CA C 55 44.700 45.933 -1.233 1
1 727 . 18 1 1 A 55 55 GLY N N 55 106.600 108.160 -1.560 1
1 728 . 18 1 1 A 56 56 VAL H H 56 7.580 7.508 0.072 1
1 729 . 18 1 1 A 56 56 VAL HA H 56 3.630 3.876 -0.246 1
1 737 . 18 1 1 A 56 56 VAL C C 56 174.700 175.815 -1.115 1
1 738 . 18 1 1 A 56 56 VAL CA C 56 64.000 62.382 1.618 1
1 739 . 18 1 1 A 56 56 VAL CB C 56 31.600 31.989 -0.389 1
1 742 . 18 1 1 A 56 56 VAL N N 56 122.000 121.967 0.033 1
1 743 . 18 1 1 A 57 57 ASP H H 57 8.440 9.132 -0.692 1
1 744 . 18 1 1 A 57 57 ASP HA H 57 4.500 4.773 -0.273 1
1 747 . 18 1 1 A 57 57 ASP C C 57 176.900 176.040 0.860 1
1 748 . 18 1 1 A 57 57 ASP CA C 57 52.600 53.586 -0.986 1
1 749 . 18 1 1 A 57 57 ASP CB C 57 39.900 38.815 1.085 1
1 750 . 18 1 1 A 57 57 ASP N N 57 124.100 128.036 -3.936 1
1 751 . 18 1 1 A 58 58 LEU H H 58 9.720 8.088 1.632 1
1 752 . 18 1 1 A 58 58 LEU HA H 58 4.020 4.223 -0.203 1
1 762 . 18 1 1 A 58 58 LEU C C 58 179.400 178.822 0.578 1
1 763 . 18 1 1 A 58 58 LEU CA C 58 56.300 57.127 -0.827 1
1 764 . 18 1 1 A 58 58 LEU CB C 58 43.300 41.778 1.522 1
1 768 . 18 1 1 A 58 58 LEU N N 58 127.800 121.226 6.574 1
1 769 . 18 1 1 A 59 59 ASN H H 59 7.740 8.369 -0.629 1
1 770 . 18 1 1 A 59 59 ASN HA H 59 4.340 4.411 -0.071 1
1 775 . 18 1 1 A 59 59 ASN C C 59 176.300 178.108 -1.808 1
1 776 . 18 1 1 A 59 59 ASN CA C 59 56.300 56.006 0.294 1
1 777 . 18 1 1 A 59 59 ASN CB C 59 36.400 37.752 -1.352 1
1 779 . 18 1 1 A 59 59 ASN N N 59 119.500 117.481 2.019 1
1 781 . 18 1 1 A 60 60 ALA H H 60 7.220 8.053 -0.833 1
1 782 . 18 1 1 A 60 60 ALA HA H 60 4.030 4.149 -0.119 1
1 786 . 18 1 1 A 60 60 ALA C C 60 180.100 180.179 -0.079 1
1 787 . 18 1 1 A 60 60 ALA CA C 60 54.300 55.173 -0.873 1
1 788 . 18 1 1 A 60 60 ALA CB C 60 18.200 18.071 0.129 1
1 789 . 18 1 1 A 60 60 ALA N N 60 121.400 122.878 -1.478 1
1 790 . 18 1 1 A 61 61 LEU H H 61 7.320 8.245 -0.925 1
1 791 . 18 1 1 A 61 61 LEU HA H 61 3.840 4.031 -0.191 1
1 801 . 18 1 1 A 61 61 LEU C C 61 177.200 179.354 -2.154 1
1 802 . 18 1 1 A 61 61 LEU CA C 61 58.500 57.871 0.629 1
1 803 . 18 1 1 A 61 61 LEU CB C 61 42.600 41.881 0.719 1
1 807 . 18 1 1 A 61 61 LEU N N 61 118.600 118.513 0.087 1
1 808 . 18 1 1 A 62 62 PHE H H 62 8.360 8.330 0.030 1
1 809 . 18 1 1 A 62 62 PHE HA H 62 3.930 4.376 -0.446 1
1 817 . 18 1 1 A 62 62 PHE C C 62 178.200 177.933 0.267 1
1 818 . 18 1 1 A 62 62 PHE CA C 62 62.800 59.464 3.336 1
1 819 . 18 1 1 A 62 62 PHE CB C 62 38.500 38.564 -0.064 1
1 825 . 18 1 1 A 62 62 PHE N N 62 114.400 119.091 -4.691 1
1 826 . 18 1 1 A 63 63 ASP H H 63 8.680 8.146 0.534 1
1 827 . 18 1 1 A 63 63 ASP HA H 63 4.530 4.248 0.282 1
1 830 . 18 1 1 A 63 63 ASP C C 63 178.600 179.190 -0.590 1
1 831 . 18 1 1 A 63 63 ASP CA C 63 57.500 57.050 0.450 1
1 832 . 18 1 1 A 63 63 ASP CB C 63 39.600 40.084 -0.484 1
1 833 . 18 1 1 A 63 63 ASP N N 63 120.400 118.830 1.570 1
1 834 . 18 1 1 A 64 64 ARG H H 64 7.540 7.617 -0.077 1
1 835 . 18 1 1 A 64 64 ARG HA H 64 4.290 4.073 0.217 1
1 843 . 18 1 1 A 64 64 ARG C C 64 177.600 178.600 -1.000 1
1 844 . 18 1 1 A 64 64 ARG CA C 64 58.300 58.993 -0.693 1
1 845 . 18 1 1 A 64 64 ARG CB C 64 30.000 29.993 0.007 1
1 848 . 18 1 1 A 64 64 ARG N N 64 116.800 119.669 -2.869 1
1 850 . 18 1 1 A 65 65 ILE H H 65 7.260 7.574 -0.314 1
1 851 . 18 1 1 A 65 65 ILE HA H 65 4.130 3.696 0.434 1
1 861 . 18 1 1 A 65 65 ILE C C 65 177.000 177.063 -0.063 1
1 862 . 18 1 1 A 65 65 ILE CA C 65 62.600 65.485 -2.885 1
1 863 . 18 1 1 A 65 65 ILE CB C 65 38.700 37.838 0.862 1
1 867 . 18 1 1 A 65 65 ILE N N 65 117.000 118.652 -1.652 1
1 868 . 18 1 1 A 66 66 ILE H H 66 7.980 7.052 0.928 1
1 869 . 18 1 1 A 66 66 ILE HA H 66 4.000 3.990 0.010 1
1 879 . 18 1 1 A 66 66 ILE C C 66 176.400 175.927 0.473 1
1 880 . 18 1 1 A 66 66 ILE CA C 66 63.100 62.226 0.874 1
1 881 . 18 1 1 A 66 66 ILE CB C 66 38.800 38.033 0.767 1
1 885 . 18 1 1 A 66 66 ILE N N 66 120.700 123.095 -2.395 1
1 886 . 18 1 1 A 67 67 VAL H H 67 8.130 8.633 -0.503 1
1 887 . 18 1 1 A 67 67 VAL HA H 67 3.980 4.037 -0.057 1
1 895 . 18 1 1 A 67 67 VAL C C 67 177.300 175.573 1.727 1
1 896 . 18 1 1 A 67 67 VAL CA C 67 63.900 63.024 0.876 1
1 897 . 18 1 1 A 67 67 VAL CB C 67 32.500 32.304 0.196 1
1 900 . 18 1 1 A 67 67 VAL N N 67 121.600 128.243 -6.643 1
1 901 . 18 1 1 A 68 68 ASN H H 68 8.170 8.758 -0.588 1
1 902 . 18 1 1 A 68 68 ASN HA H 68 4.680 5.017 -0.337 1
1 907 . 18 1 1 A 68 68 ASN CA C 68 54.200 52.884 1.316 1
1 908 . 18 1 1 A 68 68 ASN CB C 68 39.100 39.210 -0.110 1
1 910 . 18 1 1 A 68 68 ASN N N 68 120.500 127.245 -6.745 1
1 912 . 18 1 1 A 69 69 LYS H H 69 8.230 8.691 -0.461 1
1 913 . 18 1 1 A 69 69 LYS HA H 69 4.260 4.386 -0.126 1
1 922 . 18 1 1 A 69 69 LYS C C 69 176.900 176.100 0.800 1
1 923 . 18 1 1 A 69 69 LYS CA C 69 57.000 55.378 1.622 1
1 924 . 18 1 1 A 69 69 LYS CB C 69 32.800 31.157 1.643 1
1 928 . 18 1 1 A 69 69 LYS N N 69 121.300 126.062 -4.762 1
1 929 . 18 1 1 A 70 70 LEU H H 70 8.150 8.747 -0.597 1
1 930 . 18 1 1 A 70 70 LEU HA H 70 4.300 4.039 0.261 1
1 940 . 18 1 1 A 70 70 LEU C C 70 178.900 176.166 2.734 1
1 941 . 18 1 1 A 70 70 LEU CA C 70 55.400 56.965 -1.565 1
1 942 . 18 1 1 A 70 70 LEU CB C 70 42.100 40.680 1.420 1
1 946 . 18 1 1 A 70 70 LEU N N 70 121.900 124.213 -2.313 1
1 947 . 18 1 1 A 71 71 GLU H H 71 8.210 8.486 -0.276 1
1 948 . 18 1 1 A 71 71 GLU HA H 71 4.180 4.602 -0.422 1
1 953 . 18 1 1 A 71 71 GLU C C 71 176.300 175.500 0.800 1
1 954 . 18 1 1 A 71 71 GLU CA C 71 56.600 56.249 0.351 1
1 955 . 18 1 1 A 71 71 GLU CB C 71 30.200 29.797 0.403 1
1 957 . 18 1 1 A 71 71 GLU N N 71 120.900 119.905 0.995 1
1 958 . 18 1 1 A 72 72 HIS H H 72 8.380 8.872 -0.492 1
1 959 . 18 1 1 A 72 72 HIS HA H 72 4.600 4.757 -0.157 1
1 962 . 18 1 1 A 72 72 HIS C C 72 174.600 176.359 -1.759 1
1 963 . 18 1 1 A 72 72 HIS CA C 72 55.600 57.049 -1.449 1
1 964 . 18 1 1 A 72 72 HIS CB C 72 29.600 31.506 -1.906 1
1 965 . 18 1 1 A 72 72 HIS N N 72 119.300 122.771 -3.471 1
1 966 . 18 1 1 A 73 73 HIS H H 73 8.410 8.621 -0.211 1
1 967 . 18 1 1 A 73 73 HIS HA H 73 4.610 4.184 0.426 1
1 970 . 18 1 1 A 73 73 HIS C C 73 173.700 176.318 -2.618 1
1 971 . 18 1 1 A 73 73 HIS CA C 73 55.700 59.910 -4.210 1
1 972 . 18 1 1 A 73 73 HIS CB C 73 29.600 29.833 -0.233 1
1 973 . 18 1 1 A 73 73 HIS N N 73 119.410 117.014 2.396 1
1 974 . 18 1 1 A 74 74 HIS H H 74 8.310 8.142 0.168 1
1 975 . 18 1 1 A 74 74 HIS HA H 74 4.630 4.350 0.280 1
1 978 . 18 1 1 A 74 74 HIS CA C 74 57.100 59.347 -2.247 1
1 979 . 18 1 1 A 74 74 HIS CB C 74 29.800 29.352 0.448 1
1 14 . 19 1 1 A 2 2 GLU H H 2 9.070 8.730 0.340 1
1 15 . 19 1 1 A 2 2 GLU HA H 2 4.520 4.482 0.038 1
1 20 . 19 1 1 A 2 2 GLU C C 2 176.300 176.971 -0.671 1
1 21 . 19 1 1 A 2 2 GLU CA C 2 55.800 56.765 -0.965 1
1 22 . 19 1 1 A 2 2 GLU CB C 2 31.000 30.147 0.853 1
1 24 . 19 1 1 A 2 2 GLU N N 2 123.100 120.420 2.680 1
1 25 . 19 1 1 A 3 3 LEU H H 3 8.750 8.747 0.003 1
1 26 . 19 1 1 A 3 3 LEU HA H 3 3.750 4.130 -0.380 1
1 36 . 19 1 1 A 3 3 LEU C C 3 177.400 178.712 -1.312 1
1 37 . 19 1 1 A 3 3 LEU CA C 3 58.300 58.429 -0.129 1
1 38 . 19 1 1 A 3 3 LEU CB C 3 41.500 41.309 0.191 1
1 42 . 19 1 1 A 3 3 LEU N N 3 122.600 125.107 -2.507 1
1 43 . 19 1 1 A 4 4 SER H H 4 8.350 8.029 0.321 1
1 44 . 19 1 1 A 4 4 SER HA H 4 3.890 4.124 -0.234 1
1 47 . 19 1 1 A 4 4 SER C C 4 175.100 176.053 -0.953 1
1 48 . 19 1 1 A 4 4 SER CA C 4 61.500 62.201 -0.701 1
1 49 . 19 1 1 A 4 4 SER CB C 4 62.000 62.742 -0.742 1
1 50 . 19 1 1 A 4 4 SER N N 4 112.900 116.892 -3.992 1
1 51 . 19 1 1 A 5 5 ASN H H 5 7.180 8.266 -1.086 1
1 52 . 19 1 1 A 5 5 ASN HA H 5 4.470 4.495 -0.025 1
1 57 . 19 1 1 A 5 5 ASN C C 5 177.400 177.714 -0.314 1
1 58 . 19 1 1 A 5 5 ASN CA C 5 56.000 56.709 -0.709 1
1 59 . 19 1 1 A 5 5 ASN CB C 5 39.400 39.083 0.317 1
1 61 . 19 1 1 A 5 5 ASN N N 5 116.600 119.754 -3.154 1
1 63 . 19 1 1 A 6 6 GLU H H 6 7.950 7.718 0.232 1
1 64 . 19 1 1 A 6 6 GLU HA H 6 4.070 4.085 -0.015 1
1 69 . 19 1 1 A 6 6 GLU C C 6 178.500 179.638 -1.138 1
1 70 . 19 1 1 A 6 6 GLU CA C 6 58.100 59.171 -1.071 1
1 71 . 19 1 1 A 6 6 GLU CB C 6 29.300 29.899 -0.599 1
1 73 . 19 1 1 A 6 6 GLU N N 6 117.600 118.871 -1.271 1
1 74 . 19 1 1 A 7 7 LEU H H 7 8.140 8.232 -0.092 1
1 75 . 19 1 1 A 7 7 LEU HA H 7 3.640 3.978 -0.338 1
1 85 . 19 1 1 A 7 7 LEU C C 7 177.700 179.308 -1.608 1
1 86 . 19 1 1 A 7 7 LEU CA C 7 58.300 57.982 0.318 1
1 87 . 19 1 1 A 7 7 LEU CB C 7 40.600 41.372 -0.772 1
1 91 . 19 1 1 A 7 7 LEU N N 7 118.500 120.605 -2.105 1
1 92 . 19 1 1 A 8 8 LYS H H 8 7.090 8.001 -0.911 1
1 93 . 19 1 1 A 8 8 LYS HA H 8 4.080 3.954 0.126 1
1 102 . 19 1 1 A 8 8 LYS C C 8 178.300 178.822 -0.522 1
1 103 . 19 1 1 A 8 8 LYS CA C 8 59.700 60.071 -0.371 1
1 104 . 19 1 1 A 8 8 LYS CB C 8 32.300 32.325 -0.025 1
1 108 . 19 1 1 A 8 8 LYS N N 8 118.200 120.504 -2.304 1
1 109 . 19 1 1 A 9 9 VAL H H 9 7.940 8.061 -0.121 1
1 110 . 19 1 1 A 9 9 VAL HA H 9 3.440 3.512 -0.072 1
1 118 . 19 1 1 A 9 9 VAL C C 9 179.500 177.855 1.645 1
1 119 . 19 1 1 A 9 9 VAL CA C 9 66.700 66.341 0.359 1
1 120 . 19 1 1 A 9 9 VAL CB C 9 31.600 31.571 0.029 1
1 123 . 19 1 1 A 9 9 VAL N N 9 117.600 119.322 -1.722 1
1 124 . 19 1 1 A 10 10 GLU H H 10 7.830 8.658 -0.828 1
1 125 . 19 1 1 A 10 10 GLU HA H 10 4.130 3.904 0.226 1
1 130 . 19 1 1 A 10 10 GLU C C 10 178.700 179.223 -0.523 1
1 131 . 19 1 1 A 10 10 GLU CA C 10 58.300 59.628 -1.328 1
1 132 . 19 1 1 A 10 10 GLU CB C 10 28.500 29.749 -1.249 1
1 134 . 19 1 1 A 10 10 GLU N N 10 118.300 118.372 -0.072 1
1 135 . 19 1 1 A 11 11 ARG H H 11 8.330 7.773 0.557 1
1 136 . 19 1 1 A 11 11 ARG HA H 11 3.770 4.081 -0.311 1
1 144 . 19 1 1 A 11 11 ARG C C 11 174.600 178.839 -4.239 1
1 145 . 19 1 1 A 11 11 ARG CA C 11 61.300 58.910 2.390 1
1 146 . 19 1 1 A 11 11 ARG CB C 11 28.500 29.953 -1.453 1
1 149 . 19 1 1 A 11 11 ARG N N 11 121.400 120.033 1.367 1
1 151 . 19 1 1 A 12 12 ILE H H 12 8.540 8.249 0.291 1
1 152 . 19 1 1 A 12 12 ILE HA H 12 3.780 3.758 0.022 1
1 162 . 19 1 1 A 12 12 ILE C C 12 181.400 177.781 3.619 1
1 163 . 19 1 1 A 12 12 ILE CA C 12 64.800 65.062 -0.262 1
1 164 . 19 1 1 A 12 12 ILE CB C 12 37.700 37.579 0.121 1
1 168 . 19 1 1 A 12 12 ILE N N 12 118.700 119.609 -0.909 1
1 169 . 19 1 1 A 13 13 ARG H H 13 8.470 8.545 -0.075 1
1 170 . 19 1 1 A 13 13 ARG HA H 13 4.060 3.974 0.086 1
1 178 . 19 1 1 A 13 13 ARG C C 13 178.600 178.519 0.081 1
1 179 . 19 1 1 A 13 13 ARG CA C 13 59.600 59.222 0.378 1
1 180 . 19 1 1 A 13 13 ARG CB C 13 30.000 30.042 -0.042 1
1 183 . 19 1 1 A 13 13 ARG N N 13 124.600 121.443 3.157 1
1 185 . 19 1 1 A 14 14 LEU H H 14 7.430 8.319 -0.889 1
1 186 . 19 1 1 A 14 14 LEU HA H 14 4.240 4.318 -0.078 1
1 196 . 19 1 1 A 14 14 LEU C C 14 176.000 176.500 -0.500 1
1 197 . 19 1 1 A 14 14 LEU CA C 14 55.300 54.785 0.515 1
1 198 . 19 1 1 A 14 14 LEU CB C 14 43.000 42.037 0.963 1
1 202 . 19 1 1 A 14 14 LEU N N 14 118.500 118.730 -0.230 1
1 203 . 19 1 1 A 15 15 SER H H 15 8.260 7.886 0.374 1
1 204 . 19 1 1 A 15 15 SER HA H 15 4.030 4.141 -0.111 1
1 207 . 19 1 1 A 15 15 SER C C 15 174.000 173.366 0.634 1
1 208 . 19 1 1 A 15 15 SER CA C 15 58.700 58.999 -0.299 1
1 209 . 19 1 1 A 15 15 SER CB C 15 61.300 60.853 0.447 1
1 210 . 19 1 1 A 15 15 SER N N 15 112.500 114.096 -1.596 1
1 211 . 19 1 1 A 16 16 LEU H H 16 7.310 7.540 -0.230 1
1 212 . 19 1 1 A 16 16 LEU HA H 16 4.880 4.600 0.280 1
1 222 . 19 1 1 A 16 16 LEU C C 16 177.900 176.961 0.939 1
1 223 . 19 1 1 A 16 16 LEU CA C 16 52.600 53.617 -1.017 1
1 224 . 19 1 1 A 16 16 LEU CB C 16 43.500 43.370 0.130 1
1 228 . 19 1 1 A 16 16 LEU N N 16 117.800 121.553 -3.753 1
1 229 . 19 1 1 A 17 17 THR H H 17 8.640 8.677 -0.037 1
1 230 . 19 1 1 A 17 17 THR HA H 17 4.250 4.694 -0.444 1
1 235 . 19 1 1 A 17 17 THR C C 17 174.900 175.750 -0.850 1
1 236 . 19 1 1 A 17 17 THR CA C 17 60.500 61.180 -0.680 1
1 237 . 19 1 1 A 17 17 THR CB C 17 70.500 70.227 0.273 1
1 239 . 19 1 1 A 17 17 THR N N 17 115.200 114.920 0.280 1
1 240 . 19 1 1 A 18 18 ALA H H 18 8.820 9.087 -0.267 1
1 241 . 19 1 1 A 18 18 ALA HA H 18 3.680 3.960 -0.280 1
1 245 . 19 1 1 A 18 18 ALA C C 18 178.900 179.542 -0.642 1
1 246 . 19 1 1 A 18 18 ALA CA C 18 55.200 55.214 -0.014 1
1 247 . 19 1 1 A 18 18 ALA CB C 18 17.800 18.041 -0.241 1
1 248 . 19 1 1 A 18 18 ALA N N 18 125.600 126.488 -0.888 1
1 249 . 19 1 1 A 19 19 LYS H H 19 8.280 7.981 0.299 1
1 250 . 19 1 1 A 19 19 LYS HA H 19 3.740 3.943 -0.203 1
1 259 . 19 1 1 A 19 19 LYS C C 19 177.900 178.526 -0.626 1
1 260 . 19 1 1 A 19 19 LYS CA C 19 59.800 59.469 0.331 1
1 261 . 19 1 1 A 19 19 LYS CB C 19 33.300 32.371 0.929 1
1 265 . 19 1 1 A 19 19 LYS N N 19 115.800 119.232 -3.432 1
1 266 . 19 1 1 A 20 20 SER H H 20 7.860 7.747 0.113 1
1 267 . 19 1 1 A 20 20 SER HA H 20 4.210 4.218 -0.008 1
1 271 . 19 1 1 A 20 20 SER C C 20 177.200 177.520 -0.320 1
1 272 . 19 1 1 A 20 20 SER CA C 20 61.900 61.666 0.234 1
1 273 . 19 1 1 A 20 20 SER CB C 20 63.000 63.099 -0.099 1
1 274 . 19 1 1 A 20 20 SER N N 20 114.600 114.481 0.119 1
1 275 . 19 1 1 A 21 21 VAL H H 21 7.830 7.919 -0.089 1
1 276 . 19 1 1 A 21 21 VAL HA H 21 3.280 3.539 -0.259 1
1 284 . 19 1 1 A 21 21 VAL C C 21 177.500 177.992 -0.492 1
1 285 . 19 1 1 A 21 21 VAL CA C 21 66.800 66.591 0.209 1
1 286 . 19 1 1 A 21 21 VAL CB C 21 31.400 31.540 -0.140 1
1 289 . 19 1 1 A 21 21 VAL N N 21 122.600 121.068 1.532 1
1 290 . 19 1 1 A 22 22 ALA H H 22 8.230 8.741 -0.511 1
1 291 . 19 1 1 A 22 22 ALA HA H 22 3.510 3.907 -0.397 1
1 295 . 19 1 1 A 22 22 ALA C C 22 179.500 180.088 -0.588 1
1 296 . 19 1 1 A 22 22 ALA CA C 22 55.500 55.979 -0.479 1
1 297 . 19 1 1 A 22 22 ALA CB C 22 16.900 18.667 -1.767 1
1 298 . 19 1 1 A 22 22 ALA N N 22 121.200 122.261 -1.061 1
1 299 . 19 1 1 A 23 23 GLU H H 23 7.900 8.136 -0.236 1
1 300 . 19 1 1 A 23 23 GLU HA H 23 3.990 4.016 -0.026 1
1 305 . 19 1 1 A 23 23 GLU C C 23 180.000 179.223 0.777 1
1 306 . 19 1 1 A 23 23 GLU CA C 23 59.300 59.463 -0.163 1
1 307 . 19 1 1 A 23 23 GLU CB C 23 29.300 29.216 0.084 1
1 309 . 19 1 1 A 23 23 GLU N N 23 115.300 117.744 -2.444 1
1 310 . 19 1 1 A 24 24 GLU H H 24 7.950 7.738 0.212 1
1 311 . 19 1 1 A 24 24 GLU HA H 24 4.060 4.099 -0.039 1
1 316 . 19 1 1 A 24 24 GLU C C 24 179.100 179.220 -0.120 1
1 317 . 19 1 1 A 24 24 GLU CA C 24 59.700 58.998 0.702 1
1 318 . 19 1 1 A 24 24 GLU CB C 24 29.500 29.330 0.170 1
1 320 . 19 1 1 A 24 24 GLU N N 24 120.100 120.088 0.012 1
1 321 . 19 1 1 A 25 25 MET H H 25 8.150 8.581 -0.431 1
1 322 . 19 1 1 A 25 25 MET HA H 25 4.110 4.339 -0.229 1
1 330 . 19 1 1 A 25 25 MET C C 25 176.600 176.553 0.047 1
1 331 . 19 1 1 A 25 25 MET CA C 25 57.100 56.849 0.251 1
1 332 . 19 1 1 A 25 25 MET CB C 25 34.900 32.683 2.217 1
1 335 . 19 1 1 A 25 25 MET N N 25 115.500 117.435 -1.935 1
1 336 . 19 1 1 A 26 26 GLY H H 26 7.940 8.782 -0.842 1
1 337 . 19 1 1 A 26 26 GLY HA2 H 26 3.860 3.577 0.283 1
1 338 . 19 1 1 A 26 26 GLY HA3 H 26 3.960 3.803 0.157 1
1 339 . 19 1 1 A 26 26 GLY C C 26 175.100 173.700 1.400 1
1 340 . 19 1 1 A 26 26 GLY CA C 26 46.600 45.525 1.075 1
1 341 . 19 1 1 A 26 26 GLY N N 26 109.000 106.719 2.281 1
1 342 . 19 1 1 A 27 27 ILE H H 27 7.880 7.350 0.530 1
1 343 . 19 1 1 A 27 27 ILE HA H 27 4.790 4.839 -0.049 1
1 353 . 19 1 1 A 27 27 ILE C C 27 174.300 174.931 -0.631 1
1 354 . 19 1 1 A 27 27 ILE CA C 27 59.000 58.628 0.372 1
1 355 . 19 1 1 A 27 27 ILE CB C 27 40.900 41.366 -0.466 1
1 359 . 19 1 1 A 27 27 ILE N N 27 112.700 115.769 -3.069 1
1 360 . 19 1 1 A 28 28 SER H H 28 8.570 8.662 -0.092 1
1 361 . 19 1 1 A 28 28 SER HA H 28 4.540 4.496 0.044 1
1 364 . 19 1 1 A 28 28 SER C C 28 175.600 175.138 0.462 1
1 365 . 19 1 1 A 28 28 SER CA C 28 56.800 57.949 -1.149 1
1 366 . 19 1 1 A 28 28 SER CB C 28 65.500 64.209 1.291 1
1 367 . 19 1 1 A 28 28 SER N N 28 115.400 119.166 -3.766 1
1 368 . 19 1 1 A 29 29 ARG H H 29 8.980 8.848 0.132 1
1 369 . 19 1 1 A 29 29 ARG HA H 29 3.660 3.987 -0.327 1
1 377 . 19 1 1 A 29 29 ARG C C 29 178.700 177.718 0.982 1
1 378 . 19 1 1 A 29 29 ARG CA C 29 59.500 60.103 -0.603 1
1 379 . 19 1 1 A 29 29 ARG CB C 29 29.500 29.844 -0.344 1
1 382 . 19 1 1 A 29 29 ARG N N 29 122.000 124.559 -2.559 1
1 384 . 19 1 1 A 30 30 GLN H H 30 8.580 8.028 0.552 1
1 385 . 19 1 1 A 30 30 GLN HA H 30 3.860 4.035 -0.175 1
1 392 . 19 1 1 A 30 30 GLN C C 30 178.100 178.123 -0.023 1
1 393 . 19 1 1 A 30 30 GLN CA C 30 59.200 59.158 0.042 1
1 394 . 19 1 1 A 30 30 GLN CB C 30 28.100 28.322 -0.222 1
1 397 . 19 1 1 A 30 30 GLN N N 30 118.700 118.541 0.159 1
1 399 . 19 1 1 A 31 31 GLN H H 31 7.990 7.889 0.101 1
1 400 . 19 1 1 A 31 31 GLN HA H 31 3.980 4.058 -0.078 1
1 407 . 19 1 1 A 31 31 GLN C C 31 178.700 178.552 0.148 1
1 408 . 19 1 1 A 31 31 GLN CA C 31 59.100 58.793 0.307 1
1 409 . 19 1 1 A 31 31 GLN CB C 31 28.700 27.909 0.791 1
1 412 . 19 1 1 A 31 31 GLN N N 31 119.600 118.576 1.024 1
1 414 . 19 1 1 A 32 32 LEU H H 32 7.630 7.845 -0.215 1
1 415 . 19 1 1 A 32 32 LEU HA H 32 3.740 4.084 -0.344 1
1 425 . 19 1 1 A 32 32 LEU C C 32 178.300 178.438 -0.138 1
1 426 . 19 1 1 A 32 32 LEU CA C 32 57.700 58.020 -0.320 1
1 427 . 19 1 1 A 32 32 LEU CB C 32 41.500 41.312 0.188 1
1 431 . 19 1 1 A 32 32 LEU N N 32 120.700 121.906 -1.206 1
1 432 . 19 1 1 A 33 33 CYS H H 33 8.240 8.150 0.090 1
1 433 . 19 1 1 A 33 33 CYS HA H 33 3.990 4.125 -0.135 1
1 436 . 19 1 1 A 33 33 CYS C C 33 177.000 176.962 0.038 1
1 437 . 19 1 1 A 33 33 CYS CA C 33 63.100 63.275 -0.175 1
1 438 . 19 1 1 A 33 33 CYS CB C 33 26.100 27.079 -0.979 1
1 439 . 19 1 1 A 33 33 CYS N N 33 117.400 117.053 0.347 1
1 440 . 19 1 1 A 34 34 ASN H H 34 8.210 8.320 -0.110 1
1 441 . 19 1 1 A 34 34 ASN HA H 34 4.370 4.464 -0.094 1
1 446 . 19 1 1 A 34 34 ASN C C 34 178.700 177.825 0.875 1
1 447 . 19 1 1 A 34 34 ASN CA C 34 56.000 56.551 -0.551 1
1 448 . 19 1 1 A 34 34 ASN CB C 34 37.800 39.381 -1.581 1
1 450 . 19 1 1 A 34 34 ASN N N 34 117.300 119.809 -2.509 1
1 452 . 19 1 1 A 35 35 ILE H H 35 7.850 7.903 -0.053 1
1 453 . 19 1 1 A 35 35 ILE HA H 35 3.850 3.606 0.244 1
1 463 . 19 1 1 A 35 35 ILE C C 35 178.100 177.807 0.293 1
1 464 . 19 1 1 A 35 35 ILE CA C 35 64.800 65.512 -0.712 1
1 465 . 19 1 1 A 35 35 ILE CB C 35 38.000 37.911 0.089 1
1 469 . 19 1 1 A 35 35 ILE N N 35 120.400 119.598 0.802 1
1 470 . 19 1 1 A 36 36 GLU H H 36 7.680 7.784 -0.104 1
1 471 . 19 1 1 A 36 36 GLU HA H 36 4.120 4.112 0.008 1
1 476 . 19 1 1 A 36 36 GLU C C 36 176.300 177.920 -1.620 1
1 477 . 19 1 1 A 36 36 GLU CA C 36 58.600 59.433 -0.833 1
1 478 . 19 1 1 A 36 36 GLU CB C 36 30.000 29.806 0.194 1
1 480 . 19 1 1 A 36 36 GLU N N 36 116.500 119.911 -3.411 1
1 481 . 19 1 1 A 37 37 GLN H H 37 7.630 7.503 0.127 1
1 482 . 19 1 1 A 37 37 GLN HA H 37 4.540 4.652 -0.112 1
1 489 . 19 1 1 A 37 37 GLN C C 37 176.000 175.893 0.107 1
1 490 . 19 1 1 A 37 37 GLN CA C 37 54.900 55.078 -0.178 1
1 491 . 19 1 1 A 37 37 GLN CB C 37 29.600 28.940 0.660 1
1 494 . 19 1 1 A 37 37 GLN N N 37 115.000 115.856 -0.856 1
1 496 . 19 1 1 A 38 38 SER H H 38 7.380 7.869 -0.489 1
1 497 . 19 1 1 A 38 38 SER HA H 38 4.410 4.474 -0.064 1
1 500 . 19 1 1 A 38 38 SER C C 38 175.500 174.640 0.860 1
1 501 . 19 1 1 A 38 38 SER CA C 38 59.200 59.002 0.198 1
1 502 . 19 1 1 A 38 38 SER CB C 38 64.100 63.150 0.950 1
1 503 . 19 1 1 A 38 38 SER N N 38 115.200 113.573 1.627 1
1 504 . 19 1 1 A 39 39 GLU H H 39 9.040 7.848 1.192 1
1 505 . 19 1 1 A 39 39 GLU HA H 39 4.450 4.449 0.001 1
1 510 . 19 1 1 A 39 39 GLU C C 39 176.300 175.138 1.162 1
1 511 . 19 1 1 A 39 39 GLU CA C 39 57.100 55.544 1.556 1
1 512 . 19 1 1 A 39 39 GLU CB C 39 30.300 29.486 0.814 1
1 514 . 19 1 1 A 39 39 GLU N N 39 125.400 118.119 7.281 1
1 515 . 19 1 1 A 40 40 THR H H 40 7.920 8.557 -0.637 1
1 516 . 19 1 1 A 40 40 THR HA H 40 4.590 4.449 0.141 1
1 521 . 19 1 1 A 40 40 THR C C 40 173.500 174.232 -0.732 1
1 522 . 19 1 1 A 40 40 THR CA C 40 60.500 61.313 -0.813 1
1 523 . 19 1 1 A 40 40 THR CB C 40 71.100 70.585 0.515 1
1 525 . 19 1 1 A 40 40 THR N N 40 112.800 112.241 0.559 1
1 526 . 19 1 1 A 41 41 ALA H H 41 8.780 8.453 0.327 1
1 527 . 19 1 1 A 41 41 ALA HA H 41 4.870 4.655 0.215 1
1 531 . 19 1 1 A 41 41 ALA CA C 41 49.700 50.481 -0.781 1
1 532 . 19 1 1 A 41 41 ALA CB C 41 19.300 18.677 0.623 1
1 533 . 19 1 1 A 41 41 ALA N N 41 127.000 123.581 3.419 1
1 534 . 19 1 1 A 42 42 PRO HA H 42 4.660 4.622 0.038 1
1 541 . 19 1 1 A 42 42 PRO C C 42 178.300 177.815 0.485 1
1 542 . 19 1 1 A 42 42 PRO CA C 42 62.500 62.887 -0.387 1
1 543 . 19 1 1 A 42 42 PRO CB C 42 32.600 32.790 -0.190 1
1 546 . 19 1 1 A 43 43 VAL H H 43 8.840 8.898 -0.058 1
1 547 . 19 1 1 A 43 43 VAL HA H 43 3.660 3.950 -0.290 1
1 555 . 19 1 1 A 43 43 VAL CA C 43 66.800 64.397 2.403 1
1 556 . 19 1 1 A 43 43 VAL CB C 43 31.100 31.865 -0.765 1
1 559 . 19 1 1 A 43 43 VAL N N 43 123.000 124.222 -1.222 1
1 560 . 19 1 1 A 44 44 VAL HA H 44 4.030 3.723 0.307 1
1 568 . 19 1 1 A 44 44 VAL C C 44 176.700 178.555 -1.855 1
1 569 . 19 1 1 A 44 44 VAL CA C 44 65.900 67.010 -1.110 1
1 570 . 19 1 1 A 44 44 VAL CB C 44 30.900 31.548 -0.648 1
1 573 . 19 1 1 A 45 45 VAL H H 45 7.500 7.884 -0.384 1
1 574 . 19 1 1 A 45 45 VAL HA H 45 3.760 3.598 0.162 1
1 582 . 19 1 1 A 45 45 VAL C C 45 177.500 177.724 -0.224 1
1 583 . 19 1 1 A 45 45 VAL CA C 45 66.700 66.737 -0.037 1
1 584 . 19 1 1 A 45 45 VAL CB C 45 31.000 31.395 -0.395 1
1 587 . 19 1 1 A 45 45 VAL N N 45 120.100 120.335 -0.235 1
1 588 . 19 1 1 A 46 46 LYS H H 46 7.610 7.793 -0.183 1
1 589 . 19 1 1 A 46 46 LYS HA H 46 4.140 4.000 0.140 1
1 598 . 19 1 1 A 46 46 LYS C C 46 179.500 178.662 0.838 1
1 599 . 19 1 1 A 46 46 LYS CA C 46 59.900 59.298 0.602 1
1 600 . 19 1 1 A 46 46 LYS CB C 46 31.500 32.104 -0.604 1
1 604 . 19 1 1 A 46 46 LYS N N 46 120.700 118.582 2.118 1
1 605 . 19 1 1 A 47 47 TYR H H 47 8.550 7.762 0.788 1
1 606 . 19 1 1 A 47 47 TYR HA H 47 5.000 4.283 0.717 1
1 613 . 19 1 1 A 47 47 TYR C C 47 177.300 177.559 -0.259 1
1 614 . 19 1 1 A 47 47 TYR CA C 47 57.300 61.334 -4.034 1
1 615 . 19 1 1 A 47 47 TYR CB C 47 37.700 38.381 -0.681 1
1 620 . 19 1 1 A 47 47 TYR N N 47 122.700 120.718 1.982 1
1 621 . 19 1 1 A 48 48 ILE H H 48 8.250 8.422 -0.172 1
1 622 . 19 1 1 A 48 48 ILE HA H 48 3.160 3.798 -0.638 1
1 632 . 19 1 1 A 48 48 ILE C C 48 177.100 178.409 -1.309 1
1 633 . 19 1 1 A 48 48 ILE CA C 48 67.000 65.662 1.338 1
1 634 . 19 1 1 A 48 48 ILE CB C 48 37.800 37.715 0.085 1
1 638 . 19 1 1 A 48 48 ILE N N 48 121.200 120.556 0.644 1
1 639 . 19 1 1 A 49 49 ALA H H 49 8.310 8.129 0.181 1
1 640 . 19 1 1 A 49 49 ALA HA H 49 3.940 4.099 -0.159 1
1 644 . 19 1 1 A 49 49 ALA C C 49 179.300 179.443 -0.143 1
1 645 . 19 1 1 A 49 49 ALA CA C 49 55.500 55.038 0.462 1
1 646 . 19 1 1 A 49 49 ALA CB C 49 18.200 18.360 -0.160 1
1 647 . 19 1 1 A 49 49 ALA N N 49 120.300 122.163 -1.863 1
1 648 . 19 1 1 A 50 50 PHE H H 50 8.630 8.288 0.342 1
1 649 . 19 1 1 A 50 50 PHE HA H 50 4.200 4.306 -0.106 1
1 656 . 19 1 1 A 50 50 PHE C C 50 179.000 176.957 2.043 1
1 657 . 19 1 1 A 50 50 PHE CA C 50 61.300 61.455 -0.155 1
1 658 . 19 1 1 A 50 50 PHE CB C 50 39.200 39.469 -0.269 1
1 663 . 19 1 1 A 50 50 PHE N N 50 121.300 120.095 1.205 1
1 664 . 19 1 1 A 51 51 LEU H H 51 8.920 8.651 0.269 1
1 665 . 19 1 1 A 51 51 LEU HA H 51 3.630 3.979 -0.349 1
1 675 . 19 1 1 A 51 51 LEU C C 51 180.000 179.498 0.502 1
1 676 . 19 1 1 A 51 51 LEU CA C 51 58.100 57.922 0.178 1
1 677 . 19 1 1 A 51 51 LEU CB C 51 39.800 41.552 -1.752 1
1 681 . 19 1 1 A 51 51 LEU N N 51 121.900 118.935 2.965 1
1 682 . 19 1 1 A 52 52 ARG H H 52 8.410 8.189 0.221 1
1 683 . 19 1 1 A 52 52 ARG HA H 52 4.420 3.979 0.441 1
1 691 . 19 1 1 A 52 52 ARG C C 52 179.800 179.318 0.482 1
1 692 . 19 1 1 A 52 52 ARG CA C 52 57.800 59.563 -1.763 1
1 693 . 19 1 1 A 52 52 ARG CB C 52 28.200 29.675 -1.475 1
1 695 . 19 1 1 A 52 52 ARG N N 52 120.500 120.824 -0.324 1
1 697 . 19 1 1 A 53 53 SER H H 53 8.480 8.132 0.348 1
1 698 . 19 1 1 A 53 53 SER HA H 53 4.300 4.184 0.116 1
1 701 . 19 1 1 A 53 53 SER C C 53 174.600 175.197 -0.597 1
1 702 . 19 1 1 A 53 53 SER CA C 53 61.500 61.533 -0.033 1
1 703 . 19 1 1 A 53 53 SER CB C 53 62.300 62.854 -0.554 1
1 704 . 19 1 1 A 53 53 SER N N 53 119.500 117.186 2.314 1
1 705 . 19 1 1 A 54 54 LYS H H 54 7.080 7.341 -0.261 1
1 706 . 19 1 1 A 54 54 LYS HA H 54 4.350 4.292 0.058 1
1 715 . 19 1 1 A 54 54 LYS C C 54 176.500 176.879 -0.379 1
1 716 . 19 1 1 A 54 54 LYS CA C 54 53.700 55.889 -2.189 1
1 717 . 19 1 1 A 54 54 LYS CB C 54 31.800 32.701 -0.901 1
1 721 . 19 1 1 A 54 54 LYS N N 54 119.200 118.267 0.933 1
1 722 . 19 1 1 A 55 55 GLY H H 55 8.040 8.518 -0.478 1
1 723 . 19 1 1 A 55 55 GLY HA2 H 55 3.540 3.895 -0.355 1
1 724 . 19 1 1 A 55 55 GLY HA3 H 55 4.300 3.896 0.404 1
1 725 . 19 1 1 A 55 55 GLY C C 55 174.500 174.929 -0.429 1
1 726 . 19 1 1 A 55 55 GLY CA C 55 44.700 45.999 -1.299 1
1 727 . 19 1 1 A 55 55 GLY N N 55 106.600 108.207 -1.607 1
1 728 . 19 1 1 A 56 56 VAL H H 56 7.580 7.490 0.090 1
1 729 . 19 1 1 A 56 56 VAL HA H 56 3.630 3.870 -0.240 1
1 737 . 19 1 1 A 56 56 VAL C C 56 174.700 175.818 -1.118 1
1 738 . 19 1 1 A 56 56 VAL CA C 56 64.000 62.478 1.522 1
1 739 . 19 1 1 A 56 56 VAL CB C 56 31.600 32.032 -0.432 1
1 742 . 19 1 1 A 56 56 VAL N N 56 122.000 121.891 0.109 1
1 743 . 19 1 1 A 57 57 ASP H H 57 8.440 8.818 -0.378 1
1 744 . 19 1 1 A 57 57 ASP HA H 57 4.500 4.729 -0.229 1
1 747 . 19 1 1 A 57 57 ASP C C 57 176.900 176.089 0.811 1
1 748 . 19 1 1 A 57 57 ASP CA C 57 52.600 53.533 -0.933 1
1 749 . 19 1 1 A 57 57 ASP CB C 57 39.900 38.803 1.097 1
1 750 . 19 1 1 A 57 57 ASP N N 57 124.100 127.067 -2.967 1
1 751 . 19 1 1 A 58 58 LEU H H 58 9.720 8.713 1.007 1
1 752 . 19 1 1 A 58 58 LEU HA H 58 4.020 4.060 -0.040 1
1 762 . 19 1 1 A 58 58 LEU C C 58 179.400 178.183 1.217 1
1 763 . 19 1 1 A 58 58 LEU CA C 58 56.300 58.347 -2.047 1
1 764 . 19 1 1 A 58 58 LEU CB C 58 43.300 41.531 1.769 1
1 768 . 19 1 1 A 58 58 LEU N N 58 127.800 122.512 5.288 1
1 769 . 19 1 1 A 59 59 ASN H H 59 7.740 8.611 -0.871 1
1 770 . 19 1 1 A 59 59 ASN HA H 59 4.340 4.413 -0.073 1
1 775 . 19 1 1 A 59 59 ASN C C 59 176.300 177.671 -1.371 1
1 776 . 19 1 1 A 59 59 ASN CA C 59 56.300 56.051 0.249 1
1 777 . 19 1 1 A 59 59 ASN CB C 59 36.400 37.882 -1.482 1
1 779 . 19 1 1 A 59 59 ASN N N 59 119.500 115.758 3.742 1
1 781 . 19 1 1 A 60 60 ALA H H 60 7.220 7.668 -0.448 1
1 782 . 19 1 1 A 60 60 ALA HA H 60 4.030 4.143 -0.113 1
1 786 . 19 1 1 A 60 60 ALA C C 60 180.100 180.089 0.011 1
1 787 . 19 1 1 A 60 60 ALA CA C 60 54.300 54.855 -0.555 1
1 788 . 19 1 1 A 60 60 ALA CB C 60 18.200 18.287 -0.087 1
1 789 . 19 1 1 A 60 60 ALA N N 60 121.400 122.478 -1.078 1
1 790 . 19 1 1 A 61 61 LEU H H 61 7.320 7.961 -0.641 1
1 791 . 19 1 1 A 61 61 LEU HA H 61 3.840 4.073 -0.233 1
1 801 . 19 1 1 A 61 61 LEU C C 61 177.200 178.421 -1.221 1
1 802 . 19 1 1 A 61 61 LEU CA C 61 58.500 58.206 0.294 1
1 803 . 19 1 1 A 61 61 LEU CB C 61 42.600 42.051 0.549 1
1 807 . 19 1 1 A 61 61 LEU N N 61 118.600 120.574 -1.974 1
1 808 . 19 1 1 A 62 62 PHE H H 62 8.360 8.356 0.004 1
1 809 . 19 1 1 A 62 62 PHE HA H 62 3.930 4.089 -0.159 1
1 817 . 19 1 1 A 62 62 PHE C C 62 178.200 177.752 0.448 1
1 818 . 19 1 1 A 62 62 PHE CA C 62 62.800 60.565 2.235 1
1 819 . 19 1 1 A 62 62 PHE CB C 62 38.500 39.008 -0.508 1
1 825 . 19 1 1 A 62 62 PHE N N 62 114.400 117.269 -2.869 1
1 826 . 19 1 1 A 63 63 ASP H H 63 8.680 8.667 0.013 1
1 827 . 19 1 1 A 63 63 ASP HA H 63 4.530 4.374 0.156 1
1 830 . 19 1 1 A 63 63 ASP C C 63 178.600 178.770 -0.170 1
1 831 . 19 1 1 A 63 63 ASP CA C 63 57.500 57.611 -0.111 1
1 832 . 19 1 1 A 63 63 ASP CB C 63 39.600 41.737 -2.137 1
1 833 . 19 1 1 A 63 63 ASP N N 63 120.400 119.822 0.578 1
1 834 . 19 1 1 A 64 64 ARG H H 64 7.540 7.770 -0.230 1
1 835 . 19 1 1 A 64 64 ARG HA H 64 4.290 4.193 0.097 1
1 843 . 19 1 1 A 64 64 ARG C C 64 177.600 178.929 -1.329 1
1 844 . 19 1 1 A 64 64 ARG CA C 64 58.300 58.610 -0.310 1
1 845 . 19 1 1 A 64 64 ARG CB C 64 30.000 30.060 -0.060 1
1 848 . 19 1 1 A 64 64 ARG N N 64 116.800 119.711 -2.911 1
1 850 . 19 1 1 A 65 65 ILE H H 65 7.260 7.777 -0.517 1
1 851 . 19 1 1 A 65 65 ILE HA H 65 4.130 3.715 0.415 1
1 861 . 19 1 1 A 65 65 ILE C C 65 177.000 177.145 -0.145 1
1 862 . 19 1 1 A 65 65 ILE CA C 65 62.600 65.199 -2.599 1
1 863 . 19 1 1 A 65 65 ILE CB C 65 38.700 37.657 1.043 1
1 867 . 19 1 1 A 65 65 ILE N N 65 117.000 118.762 -1.762 1
1 868 . 19 1 1 A 66 66 ILE H H 66 7.980 8.375 -0.395 1
1 869 . 19 1 1 A 66 66 ILE HA H 66 4.000 4.002 -0.002 1
1 879 . 19 1 1 A 66 66 ILE C C 66 176.400 175.202 1.198 1
1 880 . 19 1 1 A 66 66 ILE CA C 66 63.100 61.762 1.338 1
1 881 . 19 1 1 A 66 66 ILE CB C 66 38.800 37.055 1.745 1
1 885 . 19 1 1 A 66 66 ILE N N 66 120.700 122.642 -1.942 1
1 886 . 19 1 1 A 67 67 VAL H H 67 8.130 8.637 -0.507 1
1 887 . 19 1 1 A 67 67 VAL HA H 67 3.980 4.950 -0.970 1
1 895 . 19 1 1 A 67 67 VAL C C 67 177.300 175.097 2.203 1
1 896 . 19 1 1 A 67 67 VAL CA C 67 63.900 60.041 3.859 1
1 897 . 19 1 1 A 67 67 VAL CB C 67 32.500 34.191 -1.691 1
1 900 . 19 1 1 A 67 67 VAL N N 67 121.600 128.127 -6.527 1
1 901 . 19 1 1 A 68 68 ASN H H 68 8.170 8.840 -0.670 1
1 902 . 19 1 1 A 68 68 ASN HA H 68 4.680 4.864 -0.184 1
1 907 . 19 1 1 A 68 68 ASN CA C 68 54.200 52.348 1.852 1
1 908 . 19 1 1 A 68 68 ASN CB C 68 39.100 39.358 -0.258 1
1 910 . 19 1 1 A 68 68 ASN N N 68 120.500 125.715 -5.215 1
1 912 . 19 1 1 A 69 69 LYS H H 69 8.230 8.989 -0.759 1
1 913 . 19 1 1 A 69 69 LYS HA H 69 4.260 3.886 0.374 1
1 922 . 19 1 1 A 69 69 LYS C C 69 176.900 175.767 1.133 1
1 923 . 19 1 1 A 69 69 LYS CA C 69 57.000 57.222 -0.222 1
1 924 . 19 1 1 A 69 69 LYS CB C 69 32.800 30.036 2.764 1
1 928 . 19 1 1 A 69 69 LYS N N 69 121.300 116.785 4.515 1
1 929 . 19 1 1 A 70 70 LEU H H 70 8.150 8.393 -0.243 1
1 930 . 19 1 1 A 70 70 LEU HA H 70 4.300 3.760 0.540 1
1 940 . 19 1 1 A 70 70 LEU C C 70 178.900 176.491 2.409 1
1 941 . 19 1 1 A 70 70 LEU CA C 70 55.400 55.751 -0.351 1
1 942 . 19 1 1 A 70 70 LEU CB C 70 42.100 40.658 1.442 1
1 946 . 19 1 1 A 70 70 LEU N N 70 121.900 112.783 9.117 1
1 947 . 19 1 1 A 71 71 GLU H H 71 8.210 8.299 -0.089 1
1 948 . 19 1 1 A 71 71 GLU HA H 71 4.180 4.477 -0.297 1
1 953 . 19 1 1 A 71 71 GLU C C 71 176.300 179.132 -2.832 1
1 954 . 19 1 1 A 71 71 GLU CA C 71 56.600 57.456 -0.856 1
1 955 . 19 1 1 A 71 71 GLU CB C 71 30.200 30.558 -0.358 1
1 957 . 19 1 1 A 71 71 GLU N N 71 120.900 118.848 2.052 1
1 958 . 19 1 1 A 72 72 HIS H H 72 8.380 8.110 0.270 1
1 959 . 19 1 1 A 72 72 HIS HA H 72 4.600 4.419 0.181 1
1 962 . 19 1 1 A 72 72 HIS C C 72 174.600 175.403 -0.803 1
1 963 . 19 1 1 A 72 72 HIS CA C 72 55.600 58.265 -2.665 1
1 964 . 19 1 1 A 72 72 HIS CB C 72 29.600 29.104 0.496 1
1 965 . 19 1 1 A 72 72 HIS N N 72 119.300 116.801 2.499 1
1 966 . 19 1 1 A 73 73 HIS H H 73 8.410 6.719 1.691 1
1 967 . 19 1 1 A 73 73 HIS HA H 73 4.610 4.546 0.064 1
1 970 . 19 1 1 A 73 73 HIS C C 73 173.700 174.638 -0.938 1
1 971 . 19 1 1 A 73 73 HIS CA C 73 55.700 56.486 -0.786 1
1 972 . 19 1 1 A 73 73 HIS CB C 73 29.600 29.741 -0.141 1
1 973 . 19 1 1 A 73 73 HIS N N 73 119.410 119.828 -0.418 1
1 974 . 19 1 1 A 74 74 HIS H H 74 8.310 8.250 0.060 1
1 975 . 19 1 1 A 74 74 HIS HA H 74 4.630 4.555 0.075 1
1 978 . 19 1 1 A 74 74 HIS CA C 74 57.100 55.642 1.458 1
1 979 . 19 1 1 A 74 74 HIS CB C 74 29.800 32.780 -2.980 1
1 14 . 20 1 1 A 2 2 GLU H H 2 9.070 8.342 0.728 1
1 15 . 20 1 1 A 2 2 GLU HA H 2 4.520 4.520 0.000 1
1 20 . 20 1 1 A 2 2 GLU C C 2 176.300 177.981 -1.681 1
1 21 . 20 1 1 A 2 2 GLU CA C 2 55.800 55.659 0.141 1
1 22 . 20 1 1 A 2 2 GLU CB C 2 31.000 30.927 0.073 1
1 24 . 20 1 1 A 2 2 GLU N N 2 123.100 121.938 1.162 1
1 25 . 20 1 1 A 3 3 LEU H H 3 8.750 8.868 -0.118 1
1 26 . 20 1 1 A 3 3 LEU HA H 3 3.750 3.953 -0.203 1
1 36 . 20 1 1 A 3 3 LEU C C 3 177.400 179.066 -1.666 1
1 37 . 20 1 1 A 3 3 LEU CA C 3 58.300 57.851 0.449 1
1 38 . 20 1 1 A 3 3 LEU CB C 3 41.500 41.484 0.016 1
1 42 . 20 1 1 A 3 3 LEU N N 3 122.600 123.633 -1.033 1
1 43 . 20 1 1 A 4 4 SER H H 4 8.350 8.091 0.259 1
1 44 . 20 1 1 A 4 4 SER HA H 4 3.890 4.099 -0.209 1
1 47 . 20 1 1 A 4 4 SER C C 4 175.100 177.221 -2.121 1
1 48 . 20 1 1 A 4 4 SER CA C 4 61.500 61.436 0.064 1
1 49 . 20 1 1 A 4 4 SER CB C 4 62.000 63.004 -1.004 1
1 50 . 20 1 1 A 4 4 SER N N 4 112.900 114.103 -1.203 1
1 51 . 20 1 1 A 5 5 ASN H H 5 7.180 8.281 -1.101 1
1 52 . 20 1 1 A 5 5 ASN HA H 5 4.470 4.496 -0.026 1
1 57 . 20 1 1 A 5 5 ASN C C 5 177.400 177.668 -0.268 1
1 58 . 20 1 1 A 5 5 ASN CA C 5 56.000 56.714 -0.714 1
1 59 . 20 1 1 A 5 5 ASN CB C 5 39.400 39.112 0.288 1
1 61 . 20 1 1 A 5 5 ASN N N 5 116.600 119.384 -2.784 1
1 63 . 20 1 1 A 6 6 GLU H H 6 7.950 7.671 0.279 1
1 64 . 20 1 1 A 6 6 GLU HA H 6 4.070 4.068 0.002 1
1 69 . 20 1 1 A 6 6 GLU C C 6 178.500 179.440 -0.940 1
1 70 . 20 1 1 A 6 6 GLU CA C 6 58.100 59.275 -1.175 1
1 71 . 20 1 1 A 6 6 GLU CB C 6 29.300 29.560 -0.260 1
1 73 . 20 1 1 A 6 6 GLU N N 6 117.600 118.935 -1.335 1
1 74 . 20 1 1 A 7 7 LEU H H 7 8.140 8.322 -0.182 1
1 75 . 20 1 1 A 7 7 LEU HA H 7 3.640 3.999 -0.359 1
1 85 . 20 1 1 A 7 7 LEU C C 7 177.700 179.392 -1.692 1
1 86 . 20 1 1 A 7 7 LEU CA C 7 58.300 58.006 0.294 1
1 87 . 20 1 1 A 7 7 LEU CB C 7 40.600 41.266 -0.666 1
1 91 . 20 1 1 A 7 7 LEU N N 7 118.500 120.289 -1.789 1
1 92 . 20 1 1 A 8 8 LYS H H 8 7.090 8.065 -0.975 1
1 93 . 20 1 1 A 8 8 LYS HA H 8 4.080 3.952 0.128 1
1 102 . 20 1 1 A 8 8 LYS C C 8 178.300 178.936 -0.636 1
1 103 . 20 1 1 A 8 8 LYS CA C 8 59.700 60.058 -0.358 1
1 104 . 20 1 1 A 8 8 LYS CB C 8 32.300 32.340 -0.040 1
1 108 . 20 1 1 A 8 8 LYS N N 8 118.200 120.455 -2.255 1
1 109 . 20 1 1 A 9 9 VAL H H 9 7.940 8.229 -0.289 1
1 110 . 20 1 1 A 9 9 VAL HA H 9 3.440 3.517 -0.077 1
1 118 . 20 1 1 A 9 9 VAL C C 9 179.500 177.683 1.817 1
1 119 . 20 1 1 A 9 9 VAL CA C 9 66.700 66.233 0.467 1
1 120 . 20 1 1 A 9 9 VAL CB C 9 31.600 31.639 -0.039 1
1 123 . 20 1 1 A 9 9 VAL N N 9 117.600 119.406 -1.806 1
1 124 . 20 1 1 A 10 10 GLU H H 10 7.830 8.420 -0.590 1
1 125 . 20 1 1 A 10 10 GLU HA H 10 4.130 3.952 0.178 1
1 130 . 20 1 1 A 10 10 GLU C C 10 178.700 179.099 -0.399 1
1 131 . 20 1 1 A 10 10 GLU CA C 10 58.300 59.457 -1.157 1
1 132 . 20 1 1 A 10 10 GLU CB C 10 28.500 28.989 -0.489 1
1 134 . 20 1 1 A 10 10 GLU N N 10 118.300 118.473 -0.173 1
1 135 . 20 1 1 A 11 11 ARG H H 11 8.330 8.021 0.309 1
1 136 . 20 1 1 A 11 11 ARG HA H 11 3.770 4.078 -0.308 1
1 144 . 20 1 1 A 11 11 ARG C C 11 174.600 178.967 -4.367 1
1 145 . 20 1 1 A 11 11 ARG CA C 11 61.300 59.012 2.288 1
1 146 . 20 1 1 A 11 11 ARG CB C 11 28.500 29.852 -1.352 1
1 149 . 20 1 1 A 11 11 ARG N N 11 121.400 120.344 1.056 1
1 151 . 20 1 1 A 12 12 ILE H H 12 8.540 8.093 0.447 1
1 152 . 20 1 1 A 12 12 ILE HA H 12 3.780 3.749 0.031 1
1 162 . 20 1 1 A 12 12 ILE C C 12 181.400 177.612 3.788 1
1 163 . 20 1 1 A 12 12 ILE CA C 12 64.800 65.165 -0.365 1
1 164 . 20 1 1 A 12 12 ILE CB C 12 37.700 37.380 0.320 1
1 168 . 20 1 1 A 12 12 ILE N N 12 118.700 119.828 -1.128 1
1 169 . 20 1 1 A 13 13 ARG H H 13 8.470 8.511 -0.041 1
1 170 . 20 1 1 A 13 13 ARG HA H 13 4.060 4.022 0.038 1
1 178 . 20 1 1 A 13 13 ARG C C 13 178.600 178.110 0.490 1
1 179 . 20 1 1 A 13 13 ARG CA C 13 59.600 59.394 0.206 1
1 180 . 20 1 1 A 13 13 ARG CB C 13 30.000 29.799 0.201 1
1 183 . 20 1 1 A 13 13 ARG N N 13 124.600 121.777 2.823 1
1 185 . 20 1 1 A 14 14 LEU H H 14 7.430 7.803 -0.373 1
1 186 . 20 1 1 A 14 14 LEU HA H 14 4.240 4.371 -0.131 1
1 196 . 20 1 1 A 14 14 LEU C C 14 176.000 176.177 -0.177 1
1 197 . 20 1 1 A 14 14 LEU CA C 14 55.300 54.442 0.858 1
1 198 . 20 1 1 A 14 14 LEU CB C 14 43.000 42.222 0.778 1
1 202 . 20 1 1 A 14 14 LEU N N 14 118.500 118.027 0.473 1
1 203 . 20 1 1 A 15 15 SER H H 15 8.260 7.998 0.262 1
1 204 . 20 1 1 A 15 15 SER HA H 15 4.030 4.117 -0.087 1
1 207 . 20 1 1 A 15 15 SER C C 15 174.000 173.233 0.767 1
1 208 . 20 1 1 A 15 15 SER CA C 15 58.700 59.023 -0.323 1
1 209 . 20 1 1 A 15 15 SER CB C 15 61.300 61.542 -0.242 1
1 210 . 20 1 1 A 15 15 SER N N 15 112.500 114.959 -2.459 1
1 211 . 20 1 1 A 16 16 LEU H H 16 7.310 7.773 -0.463 1
1 212 . 20 1 1 A 16 16 LEU HA H 16 4.880 4.716 0.164 1
1 222 . 20 1 1 A 16 16 LEU C C 16 177.900 176.445 1.455 1
1 223 . 20 1 1 A 16 16 LEU CA C 16 52.600 53.157 -0.557 1
1 224 . 20 1 1 A 16 16 LEU CB C 16 43.500 43.230 0.270 1
1 228 . 20 1 1 A 16 16 LEU N N 16 117.800 121.847 -4.047 1
1 229 . 20 1 1 A 17 17 THR H H 17 8.640 8.795 -0.155 1
1 230 . 20 1 1 A 17 17 THR HA H 17 4.250 4.620 -0.370 1
1 235 . 20 1 1 A 17 17 THR C C 17 174.900 175.674 -0.774 1
1 236 . 20 1 1 A 17 17 THR CA C 17 60.500 61.313 -0.813 1
1 237 . 20 1 1 A 17 17 THR CB C 17 70.500 69.988 0.512 1
1 239 . 20 1 1 A 17 17 THR N N 17 115.200 115.727 -0.527 1
1 240 . 20 1 1 A 18 18 ALA H H 18 8.820 9.047 -0.227 1
1 241 . 20 1 1 A 18 18 ALA HA H 18 3.680 3.958 -0.278 1
1 245 . 20 1 1 A 18 18 ALA C C 18 178.900 179.583 -0.683 1
1 246 . 20 1 1 A 18 18 ALA CA C 18 55.200 55.221 -0.021 1
1 247 . 20 1 1 A 18 18 ALA CB C 18 17.800 18.000 -0.200 1
1 248 . 20 1 1 A 18 18 ALA N N 18 125.600 126.759 -1.159 1
1 249 . 20 1 1 A 19 19 LYS H H 19 8.280 7.974 0.306 1
1 250 . 20 1 1 A 19 19 LYS HA H 19 3.740 3.943 -0.203 1
1 259 . 20 1 1 A 19 19 LYS C C 19 177.900 178.933 -1.033 1
1 260 . 20 1 1 A 19 19 LYS CA C 19 59.800 59.485 0.315 1
1 261 . 20 1 1 A 19 19 LYS CB C 19 33.300 32.406 0.894 1
1 265 . 20 1 1 A 19 19 LYS N N 19 115.800 119.189 -3.389 1
1 266 . 20 1 1 A 20 20 SER H H 20 7.860 8.050 -0.190 1
1 267 . 20 1 1 A 20 20 SER HA H 20 4.210 4.149 0.061 1
1 271 . 20 1 1 A 20 20 SER C C 20 177.200 176.418 0.782 1
1 272 . 20 1 1 A 20 20 SER CA C 20 61.900 62.554 -0.654 1
1 273 . 20 1 1 A 20 20 SER CB C 20 63.000 63.147 -0.147 1
1 274 . 20 1 1 A 20 20 SER N N 20 114.600 117.075 -2.475 1
1 275 . 20 1 1 A 21 21 VAL H H 21 7.830 7.746 0.084 1
1 276 . 20 1 1 A 21 21 VAL HA H 21 3.280 3.535 -0.255 1
1 284 . 20 1 1 A 21 21 VAL C C 21 177.500 178.140 -0.640 1
1 285 . 20 1 1 A 21 21 VAL CA C 21 66.800 66.554 0.246 1
1 286 . 20 1 1 A 21 21 VAL CB C 21 31.400 31.543 -0.143 1
1 289 . 20 1 1 A 21 21 VAL N N 21 122.600 121.770 0.830 1
1 290 . 20 1 1 A 22 22 ALA H H 22 8.230 8.524 -0.294 1
1 291 . 20 1 1 A 22 22 ALA HA H 22 3.510 3.943 -0.433 1
1 295 . 20 1 1 A 22 22 ALA C C 22 179.500 179.722 -0.222 1
1 296 . 20 1 1 A 22 22 ALA CA C 22 55.500 55.511 -0.011 1
1 297 . 20 1 1 A 22 22 ALA CB C 22 16.900 17.933 -1.033 1
1 298 . 20 1 1 A 22 22 ALA N N 22 121.200 122.137 -0.937 1
1 299 . 20 1 1 A 23 23 GLU H H 23 7.900 8.287 -0.387 1
1 300 . 20 1 1 A 23 23 GLU HA H 23 3.990 4.035 -0.045 1
1 305 . 20 1 1 A 23 23 GLU C C 23 180.000 178.605 1.395 1
1 306 . 20 1 1 A 23 23 GLU CA C 23 59.300 59.512 -0.212 1
1 307 . 20 1 1 A 23 23 GLU CB C 23 29.300 29.382 -0.082 1
1 309 . 20 1 1 A 23 23 GLU N N 23 115.300 118.599 -3.299 1
1 310 . 20 1 1 A 24 24 GLU H H 24 7.950 8.106 -0.156 1
1 311 . 20 1 1 A 24 24 GLU HA H 24 4.060 4.119 -0.059 1
1 316 . 20 1 1 A 24 24 GLU C C 24 179.100 179.027 0.073 1
1 317 . 20 1 1 A 24 24 GLU CA C 24 59.700 59.190 0.510 1
1 318 . 20 1 1 A 24 24 GLU CB C 24 29.500 29.038 0.462 1
1 320 . 20 1 1 A 24 24 GLU N N 24 120.100 119.665 0.435 1
1 321 . 20 1 1 A 25 25 MET H H 25 8.150 8.303 -0.153 1
1 322 . 20 1 1 A 25 25 MET HA H 25 4.110 4.321 -0.211 1
1 330 . 20 1 1 A 25 25 MET C C 25 176.600 176.595 0.005 1
1 331 . 20 1 1 A 25 25 MET CA C 25 57.100 56.660 0.440 1
1 332 . 20 1 1 A 25 25 MET CB C 25 34.900 32.679 2.221 1
1 335 . 20 1 1 A 25 25 MET N N 25 115.500 116.775 -1.275 1
1 336 . 20 1 1 A 26 26 GLY H H 26 7.940 8.171 -0.231 1
1 337 . 20 1 1 A 26 26 GLY HA2 H 26 3.860 3.960 -0.100 1
1 338 . 20 1 1 A 26 26 GLY HA3 H 26 3.960 3.961 -0.001 1
1 339 . 20 1 1 A 26 26 GLY C C 26 175.100 173.765 1.335 1
1 340 . 20 1 1 A 26 26 GLY CA C 26 46.600 45.506 1.094 1
1 341 . 20 1 1 A 26 26 GLY N N 26 109.000 107.100 1.900 1
1 342 . 20 1 1 A 27 27 ILE H H 27 7.880 7.376 0.504 1
1 343 . 20 1 1 A 27 27 ILE HA H 27 4.790 4.825 -0.035 1
1 353 . 20 1 1 A 27 27 ILE C C 27 174.300 174.874 -0.574 1
1 354 . 20 1 1 A 27 27 ILE CA C 27 59.000 58.573 0.427 1
1 355 . 20 1 1 A 27 27 ILE CB C 27 40.900 41.463 -0.563 1
1 359 . 20 1 1 A 27 27 ILE N N 27 112.700 115.878 -3.178 1
1 360 . 20 1 1 A 28 28 SER H H 28 8.570 8.521 0.049 1
1 361 . 20 1 1 A 28 28 SER HA H 28 4.540 4.530 0.010 1
1 364 . 20 1 1 A 28 28 SER C C 28 175.600 175.529 0.071 1
1 365 . 20 1 1 A 28 28 SER CA C 28 56.800 58.772 -1.972 1
1 366 . 20 1 1 A 28 28 SER CB C 28 65.500 63.480 2.020 1
1 367 . 20 1 1 A 28 28 SER N N 28 115.400 117.645 -2.245 1
1 368 . 20 1 1 A 29 29 ARG H H 29 8.980 8.793 0.187 1
1 369 . 20 1 1 A 29 29 ARG HA H 29 3.660 3.982 -0.322 1
1 377 . 20 1 1 A 29 29 ARG C C 29 178.700 178.066 0.634 1
1 378 . 20 1 1 A 29 29 ARG CA C 29 59.500 59.944 -0.444 1
1 379 . 20 1 1 A 29 29 ARG CB C 29 29.500 29.877 -0.377 1
1 382 . 20 1 1 A 29 29 ARG N N 29 122.000 124.947 -2.947 1
1 384 . 20 1 1 A 30 30 GLN H H 30 8.580 7.542 1.038 1
1 385 . 20 1 1 A 30 30 GLN HA H 30 3.860 4.110 -0.250 1
1 392 . 20 1 1 A 30 30 GLN C C 30 178.100 178.651 -0.551 1
1 393 . 20 1 1 A 30 30 GLN CA C 30 59.200 58.945 0.255 1
1 394 . 20 1 1 A 30 30 GLN CB C 30 28.100 28.324 -0.224 1
1 397 . 20 1 1 A 30 30 GLN N N 30 118.700 118.294 0.406 1
1 399 . 20 1 1 A 31 31 GLN H H 31 7.990 7.846 0.144 1
1 400 . 20 1 1 A 31 31 GLN HA H 31 3.980 4.054 -0.074 1
1 407 . 20 1 1 A 31 31 GLN C C 31 178.700 178.111 0.589 1
1 408 . 20 1 1 A 31 31 GLN CA C 31 59.100 58.605 0.495 1
1 409 . 20 1 1 A 31 31 GLN CB C 31 28.700 27.972 0.728 1
1 412 . 20 1 1 A 31 31 GLN N N 31 119.600 119.785 -0.185 1
1 414 . 20 1 1 A 32 32 LEU H H 32 7.630 7.691 -0.061 1
1 415 . 20 1 1 A 32 32 LEU HA H 32 3.740 4.131 -0.391 1
1 425 . 20 1 1 A 32 32 LEU C C 32 178.300 178.824 -0.524 1
1 426 . 20 1 1 A 32 32 LEU CA C 32 57.700 57.576 0.124 1
1 427 . 20 1 1 A 32 32 LEU CB C 32 41.500 41.288 0.212 1
1 431 . 20 1 1 A 32 32 LEU N N 32 120.700 120.897 -0.197 1
1 432 . 20 1 1 A 33 33 CYS H H 33 8.240 8.137 0.103 1
1 433 . 20 1 1 A 33 33 CYS HA H 33 3.990 4.063 -0.073 1
1 436 . 20 1 1 A 33 33 CYS C C 33 177.000 177.271 -0.271 1
1 437 . 20 1 1 A 33 33 CYS CA C 33 63.100 63.234 -0.134 1
1 438 . 20 1 1 A 33 33 CYS CB C 33 26.100 26.703 -0.603 1
1 439 . 20 1 1 A 33 33 CYS N N 33 117.400 117.797 -0.397 1
1 440 . 20 1 1 A 34 34 ASN H H 34 8.210 7.595 0.615 1
1 441 . 20 1 1 A 34 34 ASN HA H 34 4.370 4.449 -0.079 1
1 446 . 20 1 1 A 34 34 ASN C C 34 178.700 178.199 0.501 1
1 447 . 20 1 1 A 34 34 ASN CA C 34 56.000 56.578 -0.578 1
1 448 . 20 1 1 A 34 34 ASN CB C 34 37.800 37.796 0.004 1
1 450 . 20 1 1 A 34 34 ASN N N 34 117.300 118.228 -0.928 1
1 452 . 20 1 1 A 35 35 ILE H H 35 7.850 7.514 0.336 1
1 453 . 20 1 1 A 35 35 ILE HA H 35 3.850 3.595 0.255 1
1 463 . 20 1 1 A 35 35 ILE C C 35 178.100 177.951 0.149 1
1 464 . 20 1 1 A 35 35 ILE CA C 35 64.800 65.338 -0.538 1
1 465 . 20 1 1 A 35 35 ILE CB C 35 38.000 37.673 0.327 1
1 469 . 20 1 1 A 35 35 ILE N N 35 120.400 120.531 -0.131 1
1 470 . 20 1 1 A 36 36 GLU H H 36 7.680 8.068 -0.388 1
1 471 . 20 1 1 A 36 36 GLU HA H 36 4.120 4.061 0.059 1
1 476 . 20 1 1 A 36 36 GLU C C 36 176.300 178.537 -2.237 1
1 477 . 20 1 1 A 36 36 GLU CA C 36 58.600 59.510 -0.910 1
1 478 . 20 1 1 A 36 36 GLU CB C 36 30.000 29.564 0.436 1
1 480 . 20 1 1 A 36 36 GLU N N 36 116.500 119.809 -3.309 1
1 481 . 20 1 1 A 37 37 GLN H H 37 7.630 7.973 -0.343 1
1 482 . 20 1 1 A 37 37 GLN HA H 37 4.540 4.370 0.170 1
1 489 . 20 1 1 A 37 37 GLN C C 37 176.000 175.697 0.303 1
1 490 . 20 1 1 A 37 37 GLN CA C 37 54.900 55.273 -0.373 1
1 491 . 20 1 1 A 37 37 GLN CB C 37 29.600 28.051 1.549 1
1 494 . 20 1 1 A 37 37 GLN N N 37 115.000 115.253 -0.253 1
1 496 . 20 1 1 A 38 38 SER H H 38 7.380 7.296 0.084 1
1 497 . 20 1 1 A 38 38 SER HA H 38 4.410 4.289 0.121 1
1 500 . 20 1 1 A 38 38 SER C C 38 175.500 174.510 0.990 1
1 501 . 20 1 1 A 38 38 SER CA C 38 59.200 58.377 0.823 1
1 502 . 20 1 1 A 38 38 SER CB C 38 64.100 63.500 0.600 1
1 503 . 20 1 1 A 38 38 SER N N 38 115.200 116.407 -1.207 1
1 504 . 20 1 1 A 39 39 GLU H H 39 9.040 8.897 0.143 1
1 505 . 20 1 1 A 39 39 GLU HA H 39 4.450 4.564 -0.114 1
1 510 . 20 1 1 A 39 39 GLU C C 39 176.300 175.161 1.139 1
1 511 . 20 1 1 A 39 39 GLU CA C 39 57.100 56.258 0.842 1
1 512 . 20 1 1 A 39 39 GLU CB C 39 30.300 30.741 -0.441 1
1 514 . 20 1 1 A 39 39 GLU N N 39 125.400 124.958 0.442 1
1 515 . 20 1 1 A 40 40 THR H H 40 7.920 7.694 0.226 1
1 516 . 20 1 1 A 40 40 THR HA H 40 4.590 4.791 -0.201 1
1 521 . 20 1 1 A 40 40 THR C C 40 173.500 173.547 -0.047 1
1 522 . 20 1 1 A 40 40 THR CA C 40 60.500 61.722 -1.222 1
1 523 . 20 1 1 A 40 40 THR CB C 40 71.100 70.233 0.867 1
1 525 . 20 1 1 A 40 40 THR N N 40 112.800 115.540 -2.740 1
1 526 . 20 1 1 A 41 41 ALA H H 41 8.780 8.890 -0.110 1
1 527 . 20 1 1 A 41 41 ALA HA H 41 4.870 4.893 -0.023 1
1 531 . 20 1 1 A 41 41 ALA CA C 41 49.700 50.002 -0.302 1
1 532 . 20 1 1 A 41 41 ALA CB C 41 19.300 19.725 -0.425 1
1 533 . 20 1 1 A 41 41 ALA N N 41 127.000 129.818 -2.818 1
1 534 . 20 1 1 A 42 42 PRO HA H 42 4.660 4.603 0.057 1
1 541 . 20 1 1 A 42 42 PRO C C 42 178.300 177.757 0.543 1
1 542 . 20 1 1 A 42 42 PRO CA C 42 62.500 62.859 -0.359 1
1 543 . 20 1 1 A 42 42 PRO CB C 42 32.600 32.631 -0.031 1
1 546 . 20 1 1 A 43 43 VAL H H 43 8.840 8.661 0.179 1
1 547 . 20 1 1 A 43 43 VAL HA H 43 3.660 3.761 -0.101 1
1 555 . 20 1 1 A 43 43 VAL CA C 43 66.800 65.090 1.710 1
1 556 . 20 1 1 A 43 43 VAL CB C 43 31.100 31.603 -0.503 1
1 559 . 20 1 1 A 43 43 VAL N N 43 123.000 122.957 0.043 1
1 560 . 20 1 1 A 44 44 VAL HA H 44 4.030 3.669 0.361 1
1 568 . 20 1 1 A 44 44 VAL C C 44 176.700 178.566 -1.866 1
1 569 . 20 1 1 A 44 44 VAL CA C 44 65.900 66.991 -1.091 1
1 570 . 20 1 1 A 44 44 VAL CB C 44 30.900 31.568 -0.668 1
1 573 . 20 1 1 A 45 45 VAL H H 45 7.500 7.930 -0.430 1
1 574 . 20 1 1 A 45 45 VAL HA H 45 3.760 3.583 0.177 1
1 582 . 20 1 1 A 45 45 VAL C C 45 177.500 177.636 -0.136 1
1 583 . 20 1 1 A 45 45 VAL CA C 45 66.700 66.829 -0.129 1
1 584 . 20 1 1 A 45 45 VAL CB C 45 31.000 31.404 -0.404 1
1 587 . 20 1 1 A 45 45 VAL N N 45 120.100 120.234 -0.134 1
1 588 . 20 1 1 A 46 46 LYS H H 46 7.610 7.803 -0.193 1
1 589 . 20 1 1 A 46 46 LYS HA H 46 4.140 4.024 0.116 1
1 598 . 20 1 1 A 46 46 LYS C C 46 179.500 178.774 0.726 1
1 599 . 20 1 1 A 46 46 LYS CA C 46 59.900 59.164 0.736 1
1 600 . 20 1 1 A 46 46 LYS CB C 46 31.500 32.101 -0.601 1
1 604 . 20 1 1 A 46 46 LYS N N 46 120.700 118.545 2.155 1
1 605 . 20 1 1 A 47 47 TYR H H 47 8.550 8.097 0.453 1
1 606 . 20 1 1 A 47 47 TYR HA H 47 5.000 4.235 0.765 1
1 613 . 20 1 1 A 47 47 TYR C C 47 177.300 177.262 0.038 1
1 614 . 20 1 1 A 47 47 TYR CA C 47 57.300 61.431 -4.131 1
1 615 . 20 1 1 A 47 47 TYR CB C 47 37.700 38.755 -1.055 1
1 620 . 20 1 1 A 47 47 TYR N N 47 122.700 120.739 1.961 1
1 621 . 20 1 1 A 48 48 ILE H H 48 8.250 8.266 -0.016 1
1 622 . 20 1 1 A 48 48 ILE HA H 48 3.160 3.613 -0.453 1
1 632 . 20 1 1 A 48 48 ILE C C 48 177.100 177.998 -0.898 1
1 633 . 20 1 1 A 48 48 ILE CA C 48 67.000 65.472 1.528 1
1 634 . 20 1 1 A 48 48 ILE CB C 48 37.800 38.423 -0.623 1
1 638 . 20 1 1 A 48 48 ILE N N 48 121.200 120.695 0.505 1
1 639 . 20 1 1 A 49 49 ALA H H 49 8.310 8.688 -0.378 1
1 640 . 20 1 1 A 49 49 ALA HA H 49 3.940 4.111 -0.171 1
1 644 . 20 1 1 A 49 49 ALA C C 49 179.300 179.599 -0.299 1
1 645 . 20 1 1 A 49 49 ALA CA C 49 55.500 55.044 0.456 1
1 646 . 20 1 1 A 49 49 ALA CB C 49 18.200 18.224 -0.024 1
1 647 . 20 1 1 A 49 49 ALA N N 49 120.300 122.166 -1.866 1
1 648 . 20 1 1 A 50 50 PHE H H 50 8.630 8.033 0.597 1
1 649 . 20 1 1 A 50 50 PHE HA H 50 4.200 4.204 -0.004 1
1 656 . 20 1 1 A 50 50 PHE C C 50 179.000 176.701 2.299 1
1 657 . 20 1 1 A 50 50 PHE CA C 50 61.300 61.391 -0.091 1
1 658 . 20 1 1 A 50 50 PHE CB C 50 39.200 39.272 -0.072 1
1 663 . 20 1 1 A 50 50 PHE N N 50 121.300 119.982 1.318 1
1 664 . 20 1 1 A 51 51 LEU H H 51 8.920 8.083 0.837 1
1 665 . 20 1 1 A 51 51 LEU HA H 51 3.630 3.774 -0.144 1
1 675 . 20 1 1 A 51 51 LEU C C 51 180.000 179.063 0.937 1
1 676 . 20 1 1 A 51 51 LEU CA C 51 58.100 57.569 0.531 1
1 677 . 20 1 1 A 51 51 LEU CB C 51 39.800 41.263 -1.463 1
1 681 . 20 1 1 A 51 51 LEU N N 51 121.900 118.593 3.307 1
1 682 . 20 1 1 A 52 52 ARG H H 52 8.410 8.366 0.044 1
1 683 . 20 1 1 A 52 52 ARG HA H 52 4.420 3.931 0.489 1
1 691 . 20 1 1 A 52 52 ARG C C 52 179.800 178.954 0.846 1
1 692 . 20 1 1 A 52 52 ARG CA C 52 57.800 59.667 -1.867 1
1 693 . 20 1 1 A 52 52 ARG CB C 52 28.200 29.980 -1.780 1
1 695 . 20 1 1 A 52 52 ARG N N 52 120.500 120.759 -0.259 1
1 697 . 20 1 1 A 53 53 SER H H 53 8.480 8.167 0.313 1
1 698 . 20 1 1 A 53 53 SER HA H 53 4.300 4.160 0.140 1
1 701 . 20 1 1 A 53 53 SER C C 53 174.600 175.364 -0.764 1
1 702 . 20 1 1 A 53 53 SER CA C 53 61.500 61.029 0.471 1
1 703 . 20 1 1 A 53 53 SER CB C 53 62.300 62.754 -0.454 1
1 704 . 20 1 1 A 53 53 SER N N 53 119.500 115.335 4.165 1
1 705 . 20 1 1 A 54 54 LYS H H 54 7.080 7.375 -0.295 1
1 706 . 20 1 1 A 54 54 LYS HA H 54 4.350 4.259 0.091 1
1 715 . 20 1 1 A 54 54 LYS C C 54 176.500 176.846 -0.346 1
1 716 . 20 1 1 A 54 54 LYS CA C 54 53.700 55.734 -2.034 1
1 717 . 20 1 1 A 54 54 LYS CB C 54 31.800 32.804 -1.004 1
1 721 . 20 1 1 A 54 54 LYS N N 54 119.200 119.044 0.156 1
1 722 . 20 1 1 A 55 55 GLY H H 55 8.040 8.250 -0.210 1
1 723 . 20 1 1 A 55 55 GLY HA2 H 55 3.540 3.928 -0.388 1
1 724 . 20 1 1 A 55 55 GLY HA3 H 55 4.300 3.933 0.367 1
1 725 . 20 1 1 A 55 55 GLY C C 55 174.500 175.112 -0.612 1
1 726 . 20 1 1 A 55 55 GLY CA C 55 44.700 46.462 -1.762 1
1 727 . 20 1 1 A 55 55 GLY N N 55 106.600 107.818 -1.218 1
1 728 . 20 1 1 A 56 56 VAL H H 56 7.580 7.674 -0.094 1
1 729 . 20 1 1 A 56 56 VAL HA H 56 3.630 4.031 -0.401 1
1 737 . 20 1 1 A 56 56 VAL C C 56 174.700 175.011 -0.311 1
1 738 . 20 1 1 A 56 56 VAL CA C 56 64.000 65.290 -1.290 1
1 739 . 20 1 1 A 56 56 VAL CB C 56 31.600 32.080 -0.480 1
1 742 . 20 1 1 A 56 56 VAL N N 56 122.000 117.560 4.440 1
1 743 . 20 1 1 A 57 57 ASP H H 57 8.440 8.032 0.408 1
1 744 . 20 1 1 A 57 57 ASP HA H 57 4.500 4.380 0.120 1
1 747 . 20 1 1 A 57 57 ASP C C 57 176.900 176.446 0.454 1
1 748 . 20 1 1 A 57 57 ASP CA C 57 52.600 55.213 -2.613 1
1 749 . 20 1 1 A 57 57 ASP CB C 57 39.900 38.766 1.134 1
1 750 . 20 1 1 A 57 57 ASP N N 57 124.100 118.096 6.004 1
1 751 . 20 1 1 A 58 58 LEU H H 58 9.720 7.939 1.781 1
1 752 . 20 1 1 A 58 58 LEU HA H 58 4.020 3.891 0.129 1
1 762 . 20 1 1 A 58 58 LEU C C 58 179.400 178.152 1.248 1
1 763 . 20 1 1 A 58 58 LEU CA C 58 56.300 58.291 -1.991 1
1 764 . 20 1 1 A 58 58 LEU CB C 58 43.300 41.436 1.864 1
1 768 . 20 1 1 A 58 58 LEU N N 58 127.800 118.905 8.895 1
1 769 . 20 1 1 A 59 59 ASN H H 59 7.740 8.551 -0.811 1
1 770 . 20 1 1 A 59 59 ASN HA H 59 4.340 4.701 -0.361 1
1 775 . 20 1 1 A 59 59 ASN C C 59 176.300 177.678 -1.378 1
1 776 . 20 1 1 A 59 59 ASN CA C 59 56.300 55.822 0.478 1
1 777 . 20 1 1 A 59 59 ASN CB C 59 36.400 38.240 -1.840 1
1 779 . 20 1 1 A 59 59 ASN N N 59 119.500 118.760 0.740 1
1 781 . 20 1 1 A 60 60 ALA H H 60 7.220 7.416 -0.196 1
1 782 . 20 1 1 A 60 60 ALA HA H 60 4.030 4.167 -0.137 1
1 786 . 20 1 1 A 60 60 ALA C C 60 180.100 180.189 -0.089 1
1 787 . 20 1 1 A 60 60 ALA CA C 60 54.300 55.003 -0.703 1
1 788 . 20 1 1 A 60 60 ALA CB C 60 18.200 18.165 0.035 1
1 789 . 20 1 1 A 60 60 ALA N N 60 121.400 122.016 -0.616 1
1 790 . 20 1 1 A 61 61 LEU H H 61 7.320 8.539 -1.219 1
1 791 . 20 1 1 A 61 61 LEU HA H 61 3.840 3.938 -0.098 1
1 801 . 20 1 1 A 61 61 LEU C C 61 177.200 179.032 -1.832 1
1 802 . 20 1 1 A 61 61 LEU CA C 61 58.500 57.767 0.733 1
1 803 . 20 1 1 A 61 61 LEU CB C 61 42.600 41.868 0.732 1
1 807 . 20 1 1 A 61 61 LEU N N 61 118.600 119.029 -0.429 1
1 808 . 20 1 1 A 62 62 PHE H H 62 8.360 7.950 0.410 1
1 809 . 20 1 1 A 62 62 PHE HA H 62 3.930 4.276 -0.346 1
1 817 . 20 1 1 A 62 62 PHE C C 62 178.200 177.853 0.347 1
1 818 . 20 1 1 A 62 62 PHE CA C 62 62.800 59.615 3.185 1
1 819 . 20 1 1 A 62 62 PHE CB C 62 38.500 38.896 -0.396 1
1 825 . 20 1 1 A 62 62 PHE N N 62 114.400 118.375 -3.975 1
1 826 . 20 1 1 A 63 63 ASP H H 63 8.680 8.506 0.174 1
1 827 . 20 1 1 A 63 63 ASP HA H 63 4.530 4.371 0.159 1
1 830 . 20 1 1 A 63 63 ASP C C 63 178.600 178.708 -0.108 1
1 831 . 20 1 1 A 63 63 ASP CA C 63 57.500 57.635 -0.135 1
1 832 . 20 1 1 A 63 63 ASP CB C 63 39.600 41.541 -1.941 1
1 833 . 20 1 1 A 63 63 ASP N N 63 120.400 120.190 0.210 1
1 834 . 20 1 1 A 64 64 ARG H H 64 7.540 7.610 -0.070 1
1 835 . 20 1 1 A 64 64 ARG HA H 64 4.290 4.107 0.183 1
1 843 . 20 1 1 A 64 64 ARG C C 64 177.600 178.936 -1.336 1
1 844 . 20 1 1 A 64 64 ARG CA C 64 58.300 58.456 -0.156 1
1 845 . 20 1 1 A 64 64 ARG CB C 64 30.000 30.386 -0.386 1
1 848 . 20 1 1 A 64 64 ARG N N 64 116.800 117.934 -1.134 1
1 850 . 20 1 1 A 65 65 ILE H H 65 7.260 7.972 -0.712 1
1 851 . 20 1 1 A 65 65 ILE HA H 65 4.130 3.760 0.370 1
1 861 . 20 1 1 A 65 65 ILE C C 65 177.000 178.125 -1.125 1
1 862 . 20 1 1 A 65 65 ILE CA C 65 62.600 65.129 -2.529 1
1 863 . 20 1 1 A 65 65 ILE CB C 65 38.700 38.248 0.452 1
1 867 . 20 1 1 A 65 65 ILE N N 65 117.000 120.348 -3.348 1
1 868 . 20 1 1 A 66 66 ILE H H 66 7.980 7.332 0.648 1
1 869 . 20 1 1 A 66 66 ILE HA H 66 4.000 4.177 -0.177 1
1 879 . 20 1 1 A 66 66 ILE C C 66 176.400 177.338 -0.938 1
1 880 . 20 1 1 A 66 66 ILE CA C 66 63.100 63.529 -0.429 1
1 881 . 20 1 1 A 66 66 ILE CB C 66 38.800 39.435 -0.635 1
1 885 . 20 1 1 A 66 66 ILE N N 66 120.700 115.305 5.395 1
1 886 . 20 1 1 A 67 67 VAL H H 67 8.130 8.747 -0.617 1
1 887 . 20 1 1 A 67 67 VAL HA H 67 3.980 3.751 0.229 1
1 895 . 20 1 1 A 67 67 VAL C C 67 177.300 174.700 2.600 1
1 896 . 20 1 1 A 67 67 VAL CA C 67 63.900 64.312 -0.412 1
1 897 . 20 1 1 A 67 67 VAL CB C 67 32.500 30.070 2.430 1
1 900 . 20 1 1 A 67 67 VAL N N 67 121.600 117.623 3.977 1
1 901 . 20 1 1 A 68 68 ASN H H 68 8.170 7.931 0.239 1
1 902 . 20 1 1 A 68 68 ASN HA H 68 4.680 4.775 -0.095 1
1 907 . 20 1 1 A 68 68 ASN CA C 68 54.200 51.425 2.775 1
1 908 . 20 1 1 A 68 68 ASN CB C 68 39.100 39.180 -0.080 1
1 910 . 20 1 1 A 68 68 ASN N N 68 120.500 120.333 0.167 1
1 912 . 20 1 1 A 69 69 LYS H H 69 8.230 8.921 -0.691 1
1 913 . 20 1 1 A 69 69 LYS HA H 69 4.260 3.798 0.462 1
1 922 . 20 1 1 A 69 69 LYS C C 69 176.900 174.931 1.969 1
1 923 . 20 1 1 A 69 69 LYS CA C 69 57.000 57.076 -0.076 1
1 924 . 20 1 1 A 69 69 LYS CB C 69 32.800 30.991 1.809 1
1 928 . 20 1 1 A 69 69 LYS N N 69 121.300 119.353 1.947 1
1 929 . 20 1 1 A 70 70 LEU H H 70 8.150 7.509 0.641 1
1 930 . 20 1 1 A 70 70 LEU HA H 70 4.300 4.637 -0.337 1
1 940 . 20 1 1 A 70 70 LEU C C 70 178.900 175.584 3.316 1
1 941 . 20 1 1 A 70 70 LEU CA C 70 55.400 53.392 2.008 1
1 942 . 20 1 1 A 70 70 LEU CB C 70 42.100 44.032 -1.932 1
1 946 . 20 1 1 A 70 70 LEU N N 70 121.900 119.902 1.998 1
1 947 . 20 1 1 A 71 71 GLU H H 71 8.210 8.889 -0.679 1
1 948 . 20 1 1 A 71 71 GLU HA H 71 4.180 3.909 0.271 1
1 953 . 20 1 1 A 71 71 GLU C C 71 176.300 175.017 1.283 1
1 954 . 20 1 1 A 71 71 GLU CA C 71 56.600 57.635 -1.035 1
1 955 . 20 1 1 A 71 71 GLU CB C 71 30.200 29.194 1.006 1
1 957 . 20 1 1 A 71 71 GLU N N 71 120.900 119.330 1.570 1
1 958 . 20 1 1 A 72 72 HIS H H 72 8.380 7.502 0.878 1
1 959 . 20 1 1 A 72 72 HIS HA H 72 4.600 5.042 -0.442 1
1 962 . 20 1 1 A 72 72 HIS C C 72 174.600 172.470 2.130 1
1 963 . 20 1 1 A 72 72 HIS CA C 72 55.600 54.274 1.326 1
1 964 . 20 1 1 A 72 72 HIS CB C 72 29.600 32.268 -2.668 1
1 965 . 20 1 1 A 72 72 HIS N N 72 119.300 113.844 5.456 1
1 966 . 20 1 1 A 73 73 HIS H H 73 8.410 8.410 0.000 1
1 967 . 20 1 1 A 73 73 HIS HA H 73 4.610 4.754 -0.144 1
1 970 . 20 1 1 A 73 73 HIS C C 73 173.700 172.137 1.563 1
1 971 . 20 1 1 A 73 73 HIS CA C 73 55.700 54.235 1.465 1
1 972 . 20 1 1 A 73 73 HIS CB C 73 29.600 32.259 -2.659 1
1 973 . 20 1 1 A 73 73 HIS N N 73 119.410 114.885 4.525 1
1 974 . 20 1 1 A 74 74 HIS H H 74 8.310 8.378 -0.068 1
1 975 . 20 1 1 A 74 74 HIS HA H 74 4.630 4.428 0.202 1
1 978 . 20 1 1 A 74 74 HIS CA C 74 57.100 55.452 1.648 1
1 979 . 20 1 1 A 74 74 HIS CB C 74 29.800 30.344 -0.544 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 69 1.172 1
2 1 1 1 "RMS(OBS, PRED)" CA 73 1.154 1
3 1 1 1 "RMS(OBS, PRED)" CB 71 0.951 1
4 1 1 1 "RMS(OBS, PRED)" H 71 0.486 1
5 1 1 1 "RMS(OBS, PRED)" HA 75 0.260 1
6 1 1 1 "RMS(OBS, PRED)" N 70 2.525 1
7 1 2 1 "RMS(OBS, PRED)" C 69 1.121 1
8 1 2 1 "RMS(OBS, PRED)" CA 73 1.234 1
9 1 2 1 "RMS(OBS, PRED)" CB 71 0.882 1
10 1 2 1 "RMS(OBS, PRED)" H 71 0.554 1
11 1 2 1 "RMS(OBS, PRED)" HA 75 0.281 1
12 1 2 1 "RMS(OBS, PRED)" N 70 2.398 1
13 1 3 1 "RMS(OBS, PRED)" C 69 1.104 1
14 1 3 1 "RMS(OBS, PRED)" CA 73 1.132 1
15 1 3 1 "RMS(OBS, PRED)" CB 71 0.978 1
16 1 3 1 "RMS(OBS, PRED)" H 71 0.514 1
17 1 3 1 "RMS(OBS, PRED)" HA 75 0.257 1
18 1 3 1 "RMS(OBS, PRED)" N 70 2.684 1
19 1 4 1 "RMS(OBS, PRED)" C 69 1.146 1
20 1 4 1 "RMS(OBS, PRED)" CA 73 1.225 1
21 1 4 1 "RMS(OBS, PRED)" CB 71 0.933 1
22 1 4 1 "RMS(OBS, PRED)" H 71 0.501 1
23 1 4 1 "RMS(OBS, PRED)" HA 75 0.288 1
24 1 4 1 "RMS(OBS, PRED)" N 70 2.605 1
25 1 5 1 "RMS(OBS, PRED)" C 69 1.200 1
26 1 5 1 "RMS(OBS, PRED)" CA 73 1.192 1
27 1 5 1 "RMS(OBS, PRED)" CB 71 0.795 1
28 1 5 1 "RMS(OBS, PRED)" H 71 0.455 1
29 1 5 1 "RMS(OBS, PRED)" HA 75 0.273 1
30 1 5 1 "RMS(OBS, PRED)" N 70 2.275 1
31 1 6 1 "RMS(OBS, PRED)" C 69 1.267 1
32 1 6 1 "RMS(OBS, PRED)" CA 73 1.224 1
33 1 6 1 "RMS(OBS, PRED)" CB 71 1.041 1
34 1 6 1 "RMS(OBS, PRED)" H 71 0.490 1
35 1 6 1 "RMS(OBS, PRED)" HA 75 0.310 1
36 1 6 1 "RMS(OBS, PRED)" N 70 2.329 1
37 1 7 1 "RMS(OBS, PRED)" C 69 1.193 1
38 1 7 1 "RMS(OBS, PRED)" CA 73 1.288 1
39 1 7 1 "RMS(OBS, PRED)" CB 71 0.989 1
40 1 7 1 "RMS(OBS, PRED)" H 71 0.542 1
41 1 7 1 "RMS(OBS, PRED)" HA 75 0.299 1
42 1 7 1 "RMS(OBS, PRED)" N 70 2.723 1
43 1 8 1 "RMS(OBS, PRED)" C 69 1.127 1
44 1 8 1 "RMS(OBS, PRED)" CA 73 1.255 1
45 1 8 1 "RMS(OBS, PRED)" CB 71 1.129 1
46 1 8 1 "RMS(OBS, PRED)" H 71 0.525 1
47 1 8 1 "RMS(OBS, PRED)" HA 75 0.272 1
48 1 8 1 "RMS(OBS, PRED)" N 70 2.502 1
49 1 9 1 "RMS(OBS, PRED)" C 69 1.133 1
50 1 9 1 "RMS(OBS, PRED)" CA 73 1.304 1
51 1 9 1 "RMS(OBS, PRED)" CB 71 0.971 1
52 1 9 1 "RMS(OBS, PRED)" H 71 0.509 1
53 1 9 1 "RMS(OBS, PRED)" HA 75 0.276 1
54 1 9 1 "RMS(OBS, PRED)" N 70 2.613 1
55 1 10 1 "RMS(OBS, PRED)" C 69 1.230 1
56 1 10 1 "RMS(OBS, PRED)" CA 73 1.183 1
57 1 10 1 "RMS(OBS, PRED)" CB 71 0.895 1
58 1 10 1 "RMS(OBS, PRED)" H 71 0.540 1
59 1 10 1 "RMS(OBS, PRED)" HA 75 0.275 1
60 1 10 1 "RMS(OBS, PRED)" N 70 2.543 1
61 1 11 1 "RMS(OBS, PRED)" C 69 1.182 1
62 1 11 1 "RMS(OBS, PRED)" CA 73 1.210 1
63 1 11 1 "RMS(OBS, PRED)" CB 71 1.042 1
64 1 11 1 "RMS(OBS, PRED)" H 71 0.470 1
65 1 11 1 "RMS(OBS, PRED)" HA 75 0.306 1
66 1 11 1 "RMS(OBS, PRED)" N 70 2.374 1
67 1 12 1 "RMS(OBS, PRED)" C 69 1.228 1
68 1 12 1 "RMS(OBS, PRED)" CA 73 1.165 1
69 1 12 1 "RMS(OBS, PRED)" CB 71 0.956 1
70 1 12 1 "RMS(OBS, PRED)" H 71 0.508 1
71 1 12 1 "RMS(OBS, PRED)" HA 75 0.279 1
72 1 12 1 "RMS(OBS, PRED)" N 70 2.362 1
73 1 13 1 "RMS(OBS, PRED)" C 69 1.143 1
74 1 13 1 "RMS(OBS, PRED)" CA 73 1.280 1
75 1 13 1 "RMS(OBS, PRED)" CB 71 1.051 1
76 1 13 1 "RMS(OBS, PRED)" H 71 0.504 1
77 1 13 1 "RMS(OBS, PRED)" HA 75 0.303 1
78 1 13 1 "RMS(OBS, PRED)" N 70 2.825 1
79 1 14 1 "RMS(OBS, PRED)" C 69 1.200 1
80 1 14 1 "RMS(OBS, PRED)" CA 73 1.291 1
81 1 14 1 "RMS(OBS, PRED)" CB 71 1.008 1
82 1 14 1 "RMS(OBS, PRED)" H 71 0.496 1
83 1 14 1 "RMS(OBS, PRED)" HA 75 0.272 1
84 1 14 1 "RMS(OBS, PRED)" N 70 2.602 1
85 1 15 1 "RMS(OBS, PRED)" C 69 1.226 1
86 1 15 1 "RMS(OBS, PRED)" CA 73 1.151 1
87 1 15 1 "RMS(OBS, PRED)" CB 71 0.858 1
88 1 15 1 "RMS(OBS, PRED)" H 71 0.541 1
89 1 15 1 "RMS(OBS, PRED)" HA 75 0.279 1
90 1 15 1 "RMS(OBS, PRED)" N 70 2.370 1
91 1 16 1 "RMS(OBS, PRED)" C 69 1.146 1
92 1 16 1 "RMS(OBS, PRED)" CA 73 1.202 1
93 1 16 1 "RMS(OBS, PRED)" CB 71 0.895 1
94 1 16 1 "RMS(OBS, PRED)" H 71 0.452 1
95 1 16 1 "RMS(OBS, PRED)" HA 75 0.249 1
96 1 16 1 "RMS(OBS, PRED)" N 70 2.482 1
97 1 17 1 "RMS(OBS, PRED)" C 69 1.272 1
98 1 17 1 "RMS(OBS, PRED)" CA 73 1.159 1
99 1 17 1 "RMS(OBS, PRED)" CB 71 0.942 1
100 1 17 1 "RMS(OBS, PRED)" H 71 0.491 1
101 1 17 1 "RMS(OBS, PRED)" HA 75 0.264 1
102 1 17 1 "RMS(OBS, PRED)" N 70 2.444 1
103 1 18 1 "RMS(OBS, PRED)" C 69 1.242 1
104 1 18 1 "RMS(OBS, PRED)" CA 73 1.309 1
105 1 18 1 "RMS(OBS, PRED)" CB 71 0.883 1
106 1 18 1 "RMS(OBS, PRED)" H 71 0.512 1
107 1 18 1 "RMS(OBS, PRED)" HA 75 0.269 1
108 1 18 1 "RMS(OBS, PRED)" N 70 2.786 1
109 1 19 1 "RMS(OBS, PRED)" C 69 1.205 1
110 1 19 1 "RMS(OBS, PRED)" CA 73 1.228 1
111 1 19 1 "RMS(OBS, PRED)" CB 71 1.011 1
112 1 19 1 "RMS(OBS, PRED)" H 71 0.500 1
113 1 19 1 "RMS(OBS, PRED)" HA 75 0.272 1
114 1 19 1 "RMS(OBS, PRED)" N 70 2.773 1
115 1 20 1 "RMS(OBS, PRED)" C 69 1.356 1
116 1 20 1 "RMS(OBS, PRED)" CA 73 1.226 1
117 1 20 1 "RMS(OBS, PRED)" CB 71 1.020 1
118 1 20 1 "RMS(OBS, PRED)" H 71 0.506 1
119 1 20 1 "RMS(OBS, PRED)" HA 75 0.246 1
120 1 20 1 "RMS(OBS, PRED)" N 70 2.587 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 14 . 1 1 A 2 2 GLU H H 2 9.070 8.445 0.625 2
1 15 . 1 1 A 2 2 GLU HA H 2 4.520 4.404 0.116 2
1 20 . 1 1 A 2 2 GLU C C 2 176.300 177.257 -0.957 2
1 21 . 1 1 A 2 2 GLU CA C 2 55.800 56.476 -0.676 2
1 22 . 1 1 A 2 2 GLU CB C 2 31.000 30.047 0.953 2
1 24 . 1 1 A 2 2 GLU N N 2 123.100 121.109 1.991 2
1 25 . 1 1 A 3 3 LEU H H 3 8.750 8.641 0.109 2
1 26 . 1 1 A 3 3 LEU HA H 3 3.750 4.083 -0.333 2
1 36 . 1 1 A 3 3 LEU C C 3 177.400 178.508 -1.108 2
1 37 . 1 1 A 3 3 LEU CA C 3 58.300 58.120 0.180 2
1 38 . 1 1 A 3 3 LEU CB C 3 41.500 41.440 0.060 2
1 42 . 1 1 A 3 3 LEU N N 3 122.600 125.352 -2.752 2
1 43 . 1 1 A 4 4 SER H H 4 8.350 8.084 0.266 2
1 44 . 1 1 A 4 4 SER HA H 4 3.890 4.156 -0.266 2
1 47 . 1 1 A 4 4 SER C C 4 175.100 176.654 -1.554 2
1 48 . 1 1 A 4 4 SER CA C 4 61.500 61.553 -0.053 2
1 49 . 1 1 A 4 4 SER CB C 4 62.000 62.696 -0.696 2
1 50 . 1 1 A 4 4 SER N N 4 112.900 115.214 -2.314 2
1 51 . 1 1 A 5 5 ASN H H 5 7.180 8.261 -1.081 2
1 52 . 1 1 A 5 5 ASN HA H 5 4.470 4.435 0.035 2
1 57 . 1 1 A 5 5 ASN C C 5 177.400 177.773 -0.373 2
1 58 . 1 1 A 5 5 ASN CA C 5 56.000 56.849 -0.849 2
1 59 . 1 1 A 5 5 ASN CB C 5 39.400 39.117 0.283 2
1 61 . 1 1 A 5 5 ASN N N 5 116.600 119.973 -3.373 2
1 63 . 1 1 A 6 6 GLU H H 6 7.950 7.915 0.035 2
1 64 . 1 1 A 6 6 GLU HA H 6 4.070 4.086 -0.016 2
1 69 . 1 1 A 6 6 GLU C C 6 178.500 179.098 -0.598 2
1 70 . 1 1 A 6 6 GLU CA C 6 58.100 59.109 -1.009 2
1 71 . 1 1 A 6 6 GLU CB C 6 29.300 29.533 -0.233 2
1 73 . 1 1 A 6 6 GLU N N 6 117.600 118.883 -1.283 2
1 74 . 1 1 A 7 7 LEU H H 7 8.140 8.263 -0.123 2
1 75 . 1 1 A 7 7 LEU HA H 7 3.640 4.089 -0.449 2
1 85 . 1 1 A 7 7 LEU C C 7 177.700 178.760 -1.060 2
1 86 . 1 1 A 7 7 LEU CA C 7 58.300 57.898 0.402 2
1 87 . 1 1 A 7 7 LEU CB C 7 40.600 41.630 -1.030 2
1 91 . 1 1 A 7 7 LEU N N 7 118.500 121.222 -2.722 2
1 92 . 1 1 A 8 8 LYS H H 8 7.090 8.106 -1.016 2
1 93 . 1 1 A 8 8 LYS HA H 8 4.080 4.004 0.076 2
1 102 . 1 1 A 8 8 LYS C C 8 178.300 178.922 -0.622 2
1 103 . 1 1 A 8 8 LYS CA C 8 59.700 59.500 0.200 2
1 104 . 1 1 A 8 8 LYS CB C 8 32.300 32.301 -0.001 2
1 108 . 1 1 A 8 8 LYS N N 8 118.200 119.487 -1.287 2
1 109 . 1 1 A 9 9 VAL H H 9 7.940 7.935 0.005 2
1 110 . 1 1 A 9 9 VAL HA H 9 3.440 3.528 -0.088 2
1 118 . 1 1 A 9 9 VAL C C 9 179.500 177.727 1.773 2
1 119 . 1 1 A 9 9 VAL CA C 9 66.700 66.492 0.208 2
1 120 . 1 1 A 9 9 VAL CB C 9 31.600 31.417 0.183 2
1 123 . 1 1 A 9 9 VAL N N 9 117.600 119.727 -2.127 2
1 124 . 1 1 A 10 10 GLU H H 10 7.830 8.247 -0.417 2
1 125 . 1 1 A 10 10 GLU HA H 10 4.130 3.956 0.174 2
1 130 . 1 1 A 10 10 GLU C C 10 178.700 179.194 -0.494 2
1 131 . 1 1 A 10 10 GLU CA C 10 58.300 59.576 -1.276 2
1 132 . 1 1 A 10 10 GLU CB C 10 28.500 29.286 -0.786 2
1 134 . 1 1 A 10 10 GLU N N 10 118.300 118.685 -0.385 2
1 135 . 1 1 A 11 11 ARG H H 11 8.330 7.590 0.740 2
1 136 . 1 1 A 11 11 ARG HA H 11 3.770 4.096 -0.326 2
1 144 . 1 1 A 11 11 ARG C C 11 174.600 178.876 -4.276 2
1 145 . 1 1 A 11 11 ARG CA C 11 61.300 58.911 2.389 2
1 146 . 1 1 A 11 11 ARG CB C 11 28.500 29.925 -1.425 2
1 149 . 1 1 A 11 11 ARG N N 11 121.400 119.947 1.453 2
1 151 . 1 1 A 12 12 ILE H H 12 8.540 8.199 0.341 2
1 152 . 1 1 A 12 12 ILE HA H 12 3.780 3.748 0.032 2
1 162 . 1 1 A 12 12 ILE C C 12 181.400 177.810 3.590 2
1 163 . 1 1 A 12 12 ILE CA C 12 64.800 65.074 -0.274 2
1 164 . 1 1 A 12 12 ILE CB C 12 37.700 37.473 0.227 2
1 168 . 1 1 A 12 12 ILE N N 12 118.700 119.853 -1.153 2
1 169 . 1 1 A 13 13 ARG H H 13 8.470 8.448 0.022 2
1 170 . 1 1 A 13 13 ARG HA H 13 4.060 4.005 0.055 2
1 178 . 1 1 A 13 13 ARG C C 13 178.600 178.274 0.326 2
1 179 . 1 1 A 13 13 ARG CA C 13 59.600 59.322 0.278 2
1 180 . 1 1 A 13 13 ARG CB C 13 30.000 29.954 0.046 2
1 183 . 1 1 A 13 13 ARG N N 13 124.600 121.227 3.373 2
1 185 . 1 1 A 14 14 LEU H H 14 7.430 8.006 -0.576 2
1 186 . 1 1 A 14 14 LEU HA H 14 4.240 4.339 -0.099 2
1 196 . 1 1 A 14 14 LEU C C 14 176.000 176.252 -0.252 2
1 197 . 1 1 A 14 14 LEU CA C 14 55.300 54.664 0.636 2
1 198 . 1 1 A 14 14 LEU CB C 14 43.000 42.046 0.954 2
1 202 . 1 1 A 14 14 LEU N N 14 118.500 118.344 0.156 2
1 203 . 1 1 A 15 15 SER H H 15 8.260 8.013 0.247 2
1 204 . 1 1 A 15 15 SER HA H 15 4.030 4.176 -0.146 2
1 207 . 1 1 A 15 15 SER C C 15 174.000 173.426 0.574 2
1 208 . 1 1 A 15 15 SER CA C 15 58.700 58.973 -0.273 2
1 209 . 1 1 A 15 15 SER CB C 15 61.300 61.174 0.126 2
1 210 . 1 1 A 15 15 SER N N 15 112.500 114.426 -1.926 2
1 211 . 1 1 A 16 16 LEU H H 16 7.310 7.624 -0.314 2
1 212 . 1 1 A 16 16 LEU HA H 16 4.880 4.649 0.231 2
1 222 . 1 1 A 16 16 LEU C C 16 177.900 176.851 1.049 2
1 223 . 1 1 A 16 16 LEU CA C 16 52.600 53.698 -1.098 2
1 224 . 1 1 A 16 16 LEU CB C 16 43.500 43.427 0.073 2
1 228 . 1 1 A 16 16 LEU N N 16 117.800 121.643 -3.843 2
1 229 . 1 1 A 17 17 THR H H 17 8.640 8.641 -0.001 2
1 230 . 1 1 A 17 17 THR HA H 17 4.250 4.785 -0.535 2
1 235 . 1 1 A 17 17 THR C C 17 174.900 175.663 -0.763 2
1 236 . 1 1 A 17 17 THR CA C 17 60.500 60.553 -0.053 2
1 237 . 1 1 A 17 17 THR CB C 17 70.500 70.756 -0.256 2
1 239 . 1 1 A 17 17 THR N N 17 115.200 114.684 0.516 2
1 240 . 1 1 A 18 18 ALA H H 18 8.820 9.073 -0.253 2
1 241 . 1 1 A 18 18 ALA HA H 18 3.680 3.987 -0.307 2
1 245 . 1 1 A 18 18 ALA C C 18 178.900 179.614 -0.714 2
1 246 . 1 1 A 18 18 ALA CA C 18 55.200 55.199 0.001 2
1 247 . 1 1 A 18 18 ALA CB C 18 17.800 18.059 -0.259 2
1 248 . 1 1 A 18 18 ALA N N 18 125.600 126.054 -0.454 2
1 249 . 1 1 A 19 19 LYS H H 19 8.280 8.012 0.268 2
1 250 . 1 1 A 19 19 LYS HA H 19 3.740 3.979 -0.239 2
1 259 . 1 1 A 19 19 LYS C C 19 177.900 178.761 -0.861 2
1 260 . 1 1 A 19 19 LYS CA C 19 59.800 59.385 0.415 2
1 261 . 1 1 A 19 19 LYS CB C 19 33.300 32.320 0.980 2
1 265 . 1 1 A 19 19 LYS N N 19 115.800 118.742 -2.942 2
1 266 . 1 1 A 20 20 SER H H 20 7.860 7.948 -0.088 2
1 267 . 1 1 A 20 20 SER HA H 20 4.210 4.187 0.023 2
1 271 . 1 1 A 20 20 SER C C 20 177.200 177.129 0.071 2
1 272 . 1 1 A 20 20 SER CA C 20 61.900 61.834 0.066 2
1 273 . 1 1 A 20 20 SER CB C 20 63.000 62.892 0.108 2
1 274 . 1 1 A 20 20 SER N N 20 114.600 115.342 -0.742 2
1 275 . 1 1 A 21 21 VAL H H 21 7.830 7.879 -0.049 2
1 276 . 1 1 A 21 21 VAL HA H 21 3.280 3.560 -0.280 2
1 284 . 1 1 A 21 21 VAL C C 21 177.500 178.108 -0.608 2
1 285 . 1 1 A 21 21 VAL CA C 21 66.800 66.565 0.235 2
1 286 . 1 1 A 21 21 VAL CB C 21 31.400 31.541 -0.141 2
1 289 . 1 1 A 21 21 VAL N N 21 122.600 121.591 1.009 2
1 290 . 1 1 A 22 22 ALA H H 22 8.230 8.452 -0.222 2
1 291 . 1 1 A 22 22 ALA HA H 22 3.510 3.933 -0.423 2
1 295 . 1 1 A 22 22 ALA C C 22 179.500 179.587 -0.087 2
1 296 . 1 1 A 22 22 ALA CA C 22 55.500 55.635 -0.135 2
1 297 . 1 1 A 22 22 ALA CB C 22 16.900 18.125 -1.225 2
1 298 . 1 1 A 22 22 ALA N N 22 121.200 122.079 -0.879 2
1 299 . 1 1 A 23 23 GLU H H 23 7.900 8.270 -0.370 2
1 300 . 1 1 A 23 23 GLU HA H 23 3.990 4.031 -0.041 2
1 305 . 1 1 A 23 23 GLU C C 23 180.000 178.906 1.094 2
1 306 . 1 1 A 23 23 GLU CA C 23 59.300 59.520 -0.220 2
1 307 . 1 1 A 23 23 GLU CB C 23 29.300 29.321 -0.021 2
1 309 . 1 1 A 23 23 GLU N N 23 115.300 118.307 -3.007 2
1 310 . 1 1 A 24 24 GLU H H 24 7.950 7.991 -0.041 2
1 311 . 1 1 A 24 24 GLU HA H 24 4.060 4.088 -0.028 2
1 316 . 1 1 A 24 24 GLU C C 24 179.100 179.214 -0.114 2
1 317 . 1 1 A 24 24 GLU CA C 24 59.700 59.196 0.504 2
1 318 . 1 1 A 24 24 GLU CB C 24 29.500 29.437 0.063 2
1 320 . 1 1 A 24 24 GLU N N 24 120.100 119.873 0.227 2
1 321 . 1 1 A 25 25 MET H H 25 8.150 8.389 -0.239 2
1 322 . 1 1 A 25 25 MET HA H 25 4.110 4.324 -0.214 2
1 330 . 1 1 A 25 25 MET C C 25 176.600 176.662 -0.062 2
1 331 . 1 1 A 25 25 MET CA C 25 57.100 56.765 0.335 2
1 332 . 1 1 A 25 25 MET CB C 25 34.900 32.690 2.210 2
1 335 . 1 1 A 25 25 MET N N 25 115.500 117.341 -1.841 2
1 336 . 1 1 A 26 26 GLY H H 26 7.940 8.699 -0.759 2
1 337 . 1 1 A 26 26 GLY HA2 H 26 3.860 3.931 -0.071 2
1 338 . 1 1 A 26 26 GLY HA3 H 26 3.960 3.947 0.013 2
1 339 . 1 1 A 26 26 GLY C C 26 175.100 173.831 1.269 2
1 340 . 1 1 A 26 26 GLY CA C 26 46.600 45.809 0.791 2
1 341 . 1 1 A 26 26 GLY N N 26 109.000 106.868 2.132 2
1 342 . 1 1 A 27 27 ILE H H 27 7.880 7.396 0.484 2
1 343 . 1 1 A 27 27 ILE HA H 27 4.790 4.819 -0.029 2
1 353 . 1 1 A 27 27 ILE C C 27 174.300 174.930 -0.630 2
1 354 . 1 1 A 27 27 ILE CA C 27 59.000 58.573 0.427 2
1 355 . 1 1 A 27 27 ILE CB C 27 40.900 41.469 -0.569 2
1 359 . 1 1 A 27 27 ILE N N 27 112.700 115.755 -3.055 2
1 360 . 1 1 A 28 28 SER H H 28 8.570 8.718 -0.148 2
1 361 . 1 1 A 28 28 SER HA H 28 4.540 4.610 -0.070 2
1 364 . 1 1 A 28 28 SER C C 28 175.600 175.625 -0.025 2
1 365 . 1 1 A 28 28 SER CA C 28 56.800 57.918 -1.118 2
1 366 . 1 1 A 28 28 SER CB C 28 65.500 64.347 1.153 2
1 367 . 1 1 A 28 28 SER N N 28 115.400 118.420 -3.020 2
1 368 . 1 1 A 29 29 ARG H H 29 8.980 8.969 0.011 2
1 369 . 1 1 A 29 29 ARG HA H 29 3.660 3.966 -0.306 2
1 377 . 1 1 A 29 29 ARG C C 29 178.700 178.416 0.284 2
1 378 . 1 1 A 29 29 ARG CA C 29 59.500 60.138 -0.638 2
1 379 . 1 1 A 29 29 ARG CB C 29 29.500 29.799 -0.299 2
1 382 . 1 1 A 29 29 ARG N N 29 122.000 124.289 -2.289 2
1 384 . 1 1 A 30 30 GLN H H 30 8.580 7.981 0.599 2
1 385 . 1 1 A 30 30 GLN HA H 30 3.860 4.034 -0.174 2
1 392 . 1 1 A 30 30 GLN C C 30 178.100 178.404 -0.304 2
1 393 . 1 1 A 30 30 GLN CA C 30 59.200 59.144 0.057 2
1 394 . 1 1 A 30 30 GLN CB C 30 28.100 28.354 -0.254 2
1 397 . 1 1 A 30 30 GLN N N 30 118.700 118.968 -0.268 2
1 399 . 1 1 A 31 31 GLN H H 31 7.990 7.796 0.194 2
1 400 . 1 1 A 31 31 GLN HA H 31 3.980 4.038 -0.058 2
1 407 . 1 1 A 31 31 GLN C C 31 178.700 178.409 0.291 2
1 408 . 1 1 A 31 31 GLN CA C 31 59.100 58.705 0.395 2
1 409 . 1 1 A 31 31 GLN CB C 31 28.700 28.076 0.624 2
1 412 . 1 1 A 31 31 GLN N N 31 119.600 119.020 0.580 2
1 414 . 1 1 A 32 32 LEU H H 32 7.630 7.672 -0.042 2
1 415 . 1 1 A 32 32 LEU HA H 32 3.740 4.109 -0.369 2
1 425 . 1 1 A 32 32 LEU C C 32 178.300 178.667 -0.367 2
1 426 . 1 1 A 32 32 LEU CA C 32 57.700 57.754 -0.054 2
1 427 . 1 1 A 32 32 LEU CB C 32 41.500 41.349 0.151 2
1 431 . 1 1 A 32 32 LEU N N 32 120.700 121.610 -0.910 2
1 432 . 1 1 A 33 33 CYS H H 33 8.240 8.463 -0.223 2
1 433 . 1 1 A 33 33 CYS HA H 33 3.990 4.115 -0.125 2
1 436 . 1 1 A 33 33 CYS C C 33 177.000 177.010 -0.010 2
1 437 . 1 1 A 33 33 CYS CA C 33 63.100 63.074 0.026 2
1 438 . 1 1 A 33 33 CYS CB C 33 26.100 26.995 -0.895 2
1 439 . 1 1 A 33 33 CYS N N 33 117.400 117.669 -0.269 2
1 440 . 1 1 A 34 34 ASN H H 34 8.210 7.963 0.247 2
1 441 . 1 1 A 34 34 ASN HA H 34 4.370 4.458 -0.088 2
1 446 . 1 1 A 34 34 ASN C C 34 178.700 178.027 0.673 2
1 447 . 1 1 A 34 34 ASN CA C 34 56.000 56.616 -0.616 2
1 448 . 1 1 A 34 34 ASN CB C 34 37.800 38.755 -0.955 2
1 450 . 1 1 A 34 34 ASN N N 34 117.300 118.911 -1.611 2
1 452 . 1 1 A 35 35 ILE H H 35 7.850 7.574 0.276 2
1 453 . 1 1 A 35 35 ILE HA H 35 3.850 3.612 0.238 2
1 463 . 1 1 A 35 35 ILE C C 35 178.100 177.918 0.182 2
1 464 . 1 1 A 35 35 ILE CA C 35 64.800 65.454 -0.654 2
1 465 . 1 1 A 35 35 ILE CB C 35 38.000 37.807 0.193 2
1 469 . 1 1 A 35 35 ILE N N 35 120.400 120.017 0.383 2
1 470 . 1 1 A 36 36 GLU H H 36 7.680 8.021 -0.341 2
1 471 . 1 1 A 36 36 GLU HA H 36 4.120 4.056 0.064 2
1 476 . 1 1 A 36 36 GLU C C 36 176.300 178.045 -1.745 2
1 477 . 1 1 A 36 36 GLU CA C 36 58.600 59.287 -0.687 2
1 478 . 1 1 A 36 36 GLU CB C 36 30.000 29.432 0.568 2
1 480 . 1 1 A 36 36 GLU N N 36 116.500 120.385 -3.885 2
1 481 . 1 1 A 37 37 GLN H H 37 7.630 7.709 -0.079 2
1 482 . 1 1 A 37 37 GLN HA H 37 4.540 4.426 0.114 2
1 489 . 1 1 A 37 37 GLN C C 37 176.000 175.785 0.215 2
1 490 . 1 1 A 37 37 GLN CA C 37 54.900 55.518 -0.618 2
1 491 . 1 1 A 37 37 GLN CB C 37 29.600 28.796 0.804 2
1 494 . 1 1 A 37 37 GLN N N 37 115.000 117.051 -2.051 2
1 496 . 1 1 A 38 38 SER H H 38 7.380 7.757 -0.377 2
1 497 . 1 1 A 38 38 SER HA H 38 4.410 4.455 -0.045 2
1 500 . 1 1 A 38 38 SER C C 38 175.500 174.179 1.321 2
1 501 . 1 1 A 38 38 SER CA C 38 59.200 58.644 0.556 2
1 502 . 1 1 A 38 38 SER CB C 38 64.100 63.961 0.139 2
1 503 . 1 1 A 38 38 SER N N 38 115.200 115.697 -0.497 2
1 504 . 1 1 A 39 39 GLU H H 39 9.040 8.549 0.491 2
1 505 . 1 1 A 39 39 GLU HA H 39 4.450 4.469 -0.019 2
1 510 . 1 1 A 39 39 GLU C C 39 176.300 175.896 0.404 2
1 511 . 1 1 A 39 39 GLU CA C 39 57.100 57.098 0.002 2
1 512 . 1 1 A 39 39 GLU CB C 39 30.300 30.312 -0.012 2
1 514 . 1 1 A 39 39 GLU N N 39 125.400 123.118 2.282 2
1 515 . 1 1 A 40 40 THR H H 40 7.920 8.152 -0.232 2
1 516 . 1 1 A 40 40 THR HA H 40 4.590 4.548 0.042 2
1 521 . 1 1 A 40 40 THR C C 40 173.500 173.873 -0.373 2
1 522 . 1 1 A 40 40 THR CA C 40 60.500 61.571 -1.071 2
1 523 . 1 1 A 40 40 THR CB C 40 71.100 69.894 1.206 2
1 525 . 1 1 A 40 40 THR N N 40 112.800 114.856 -2.056 2
1 526 . 1 1 A 41 41 ALA H H 41 8.780 8.512 0.268 2
1 527 . 1 1 A 41 41 ALA HA H 41 4.870 4.667 0.203 2
1 531 . 1 1 A 41 41 ALA CA C 41 49.700 50.272 -0.572 2
1 532 . 1 1 A 41 41 ALA CB C 41 19.300 18.878 0.422 2
1 533 . 1 1 A 41 41 ALA N N 41 127.000 127.083 -0.083 2
1 534 . 1 1 A 42 42 PRO HA H 42 4.660 4.602 0.058 2
1 541 . 1 1 A 42 42 PRO C C 42 178.300 177.659 0.641 2
1 542 . 1 1 A 42 42 PRO CA C 42 62.500 62.805 -0.305 2
1 543 . 1 1 A 42 42 PRO CB C 42 32.600 32.711 -0.111 2
1 546 . 1 1 A 43 43 VAL H H 43 8.840 8.702 0.138 2
1 547 . 1 1 A 43 43 VAL HA H 43 3.660 3.807 -0.147 2
1 555 . 1 1 A 43 43 VAL CA C 43 66.800 65.053 1.747 2
1 556 . 1 1 A 43 43 VAL CB C 43 31.100 31.581 -0.481 2
1 559 . 1 1 A 43 43 VAL N N 43 123.000 123.143 -0.143 2
1 560 . 1 1 A 44 44 VAL HA H 44 4.030 3.718 0.312 2
1 568 . 1 1 A 44 44 VAL C C 44 176.700 178.258 -1.558 2
1 569 . 1 1 A 44 44 VAL CA C 44 65.900 66.364 -0.464 2
1 570 . 1 1 A 44 44 VAL CB C 44 30.900 31.466 -0.567 2
1 573 . 1 1 A 45 45 VAL H H 45 7.500 8.005 -0.505 2
1 574 . 1 1 A 45 45 VAL HA H 45 3.760 3.603 0.157 2
1 582 . 1 1 A 45 45 VAL C C 45 177.500 177.764 -0.264 2
1 583 . 1 1 A 45 45 VAL CA C 45 66.700 66.767 -0.067 2
1 584 . 1 1 A 45 45 VAL CB C 45 31.000 31.394 -0.394 2
1 587 . 1 1 A 45 45 VAL N N 45 120.100 120.710 -0.610 2
1 588 . 1 1 A 46 46 LYS H H 46 7.610 7.650 -0.040 2
1 589 . 1 1 A 46 46 LYS HA H 46 4.140 4.039 0.101 2
1 598 . 1 1 A 46 46 LYS C C 46 179.500 178.660 0.840 2
1 599 . 1 1 A 46 46 LYS CA C 46 59.900 59.117 0.783 2
1 600 . 1 1 A 46 46 LYS CB C 46 31.500 32.090 -0.590 2
1 604 . 1 1 A 46 46 LYS N N 46 120.700 118.611 2.089 2
1 605 . 1 1 A 47 47 TYR H H 47 8.550 8.075 0.475 2
1 606 . 1 1 A 47 47 TYR HA H 47 5.000 4.209 0.791 2
1 613 . 1 1 A 47 47 TYR C C 47 177.300 177.328 -0.028 2
1 614 . 1 1 A 47 47 TYR CA C 47 57.300 61.425 -4.125 2
1 615 . 1 1 A 47 47 TYR CB C 47 37.700 38.670 -0.970 2
1 620 . 1 1 A 47 47 TYR N N 47 122.700 120.836 1.864 2
1 621 . 1 1 A 48 48 ILE H H 48 8.250 8.151 0.099 2
1 622 . 1 1 A 48 48 ILE HA H 48 3.160 3.673 -0.513 2
1 632 . 1 1 A 48 48 ILE C C 48 177.100 178.036 -0.936 2
1 633 . 1 1 A 48 48 ILE CA C 48 67.000 65.529 1.471 2
1 634 . 1 1 A 48 48 ILE CB C 48 37.800 38.380 -0.580 2
1 638 . 1 1 A 48 48 ILE N N 48 121.200 120.661 0.539 2
1 639 . 1 1 A 49 49 ALA H H 49 8.310 8.329 -0.019 2
1 640 . 1 1 A 49 49 ALA HA H 49 3.940 4.063 -0.123 2
1 644 . 1 1 A 49 49 ALA C C 49 179.300 179.450 -0.150 2
1 645 . 1 1 A 49 49 ALA CA C 49 55.500 54.986 0.514 2
1 646 . 1 1 A 49 49 ALA CB C 49 18.200 18.227 -0.027 2
1 647 . 1 1 A 49 49 ALA N N 49 120.300 121.439 -1.139 2
1 648 . 1 1 A 50 50 PHE H H 50 8.630 8.101 0.529 2
1 649 . 1 1 A 50 50 PHE HA H 50 4.200 4.188 0.012 2
1 656 . 1 1 A 50 50 PHE C C 50 179.000 176.653 2.347 2
1 657 . 1 1 A 50 50 PHE CA C 50 61.300 61.401 -0.101 2
1 658 . 1 1 A 50 50 PHE CB C 50 39.200 39.235 -0.035 2
1 663 . 1 1 A 50 50 PHE N N 50 121.300 120.355 0.945 2
1 664 . 1 1 A 51 51 LEU H H 51 8.920 8.175 0.745 2
1 665 . 1 1 A 51 51 LEU HA H 51 3.630 3.849 -0.219 2
1 675 . 1 1 A 51 51 LEU C C 51 180.000 179.191 0.809 2
1 676 . 1 1 A 51 51 LEU CA C 51 58.100 57.674 0.426 2
1 677 . 1 1 A 51 51 LEU CB C 51 39.800 41.353 -1.553 2
1 681 . 1 1 A 51 51 LEU N N 51 121.900 118.837 3.063 2
1 682 . 1 1 A 52 52 ARG H H 52 8.410 8.199 0.211 2
1 683 . 1 1 A 52 52 ARG HA H 52 4.420 3.954 0.466 2
1 691 . 1 1 A 52 52 ARG C C 52 179.800 179.049 0.751 2
1 692 . 1 1 A 52 52 ARG CA C 52 57.800 59.632 -1.832 2
1 693 . 1 1 A 52 52 ARG CB C 52 28.200 29.910 -1.710 2
1 695 . 1 1 A 52 52 ARG N N 52 120.500 120.299 0.201 2
1 697 . 1 1 A 53 53 SER H H 53 8.480 8.085 0.395 2
1 698 . 1 1 A 53 53 SER HA H 53 4.300 4.145 0.155 2
1 701 . 1 1 A 53 53 SER C C 53 174.600 175.410 -0.810 2
1 702 . 1 1 A 53 53 SER CA C 53 61.500 61.304 0.196 2
1 703 . 1 1 A 53 53 SER CB C 53 62.300 62.688 -0.388 2
1 704 . 1 1 A 53 53 SER N N 53 119.500 115.710 3.790 2
1 705 . 1 1 A 54 54 LYS H H 54 7.080 7.394 -0.314 2
1 706 . 1 1 A 54 54 LYS HA H 54 4.350 4.273 0.077 2
1 715 . 1 1 A 54 54 LYS C C 54 176.500 176.859 -0.359 2
1 716 . 1 1 A 54 54 LYS CA C 54 53.700 55.803 -2.103 2
1 717 . 1 1 A 54 54 LYS CB C 54 31.800 32.651 -0.851 2
1 721 . 1 1 A 54 54 LYS N N 54 119.200 118.358 0.842 2
1 722 . 1 1 A 55 55 GLY H H 55 8.040 8.328 -0.288 2
1 723 . 1 1 A 55 55 GLY HA2 H 55 3.540 3.904 -0.364 2
1 724 . 1 1 A 55 55 GLY HA3 H 55 4.300 3.908 0.392 2
1 725 . 1 1 A 55 55 GLY C C 55 174.500 174.909 -0.409 2
1 726 . 1 1 A 55 55 GLY CA C 55 44.700 46.026 -1.326 2
1 727 . 1 1 A 55 55 GLY N N 55 106.600 108.032 -1.432 2
1 728 . 1 1 A 56 56 VAL H H 56 7.580 7.562 0.018 2
1 729 . 1 1 A 56 56 VAL HA H 56 3.630 3.896 -0.266 2
1 737 . 1 1 A 56 56 VAL C C 56 174.700 175.354 -0.654 2
1 738 . 1 1 A 56 56 VAL CA C 56 64.000 63.449 0.551 2
1 739 . 1 1 A 56 56 VAL CB C 56 31.600 32.038 -0.438 2
1 742 . 1 1 A 56 56 VAL N N 56 122.000 120.532 1.468 2
1 743 . 1 1 A 57 57 ASP H H 57 8.440 8.565 -0.125 2
1 744 . 1 1 A 57 57 ASP HA H 57 4.500 4.574 -0.074 2
1 747 . 1 1 A 57 57 ASP C C 57 176.900 176.338 0.562 2
1 748 . 1 1 A 57 57 ASP CA C 57 52.600 54.149 -1.549 2
1 749 . 1 1 A 57 57 ASP CB C 57 39.900 39.473 0.427 2
1 750 . 1 1 A 57 57 ASP N N 57 124.100 124.460 -0.360 2
1 751 . 1 1 A 58 58 LEU H H 58 9.720 8.218 1.502 2
1 752 . 1 1 A 58 58 LEU HA H 58 4.020 4.253 -0.233 2
1 762 . 1 1 A 58 58 LEU C C 58 179.400 178.416 0.984 2
1 763 . 1 1 A 58 58 LEU CA C 58 56.300 56.711 -0.411 2
1 764 . 1 1 A 58 58 LEU CB C 58 43.300 41.887 1.413 2
1 768 . 1 1 A 58 58 LEU N N 58 127.800 122.671 5.129 2
1 769 . 1 1 A 59 59 ASN H H 59 7.740 8.423 -0.683 2
1 770 . 1 1 A 59 59 ASN HA H 59 4.340 4.436 -0.096 2
1 775 . 1 1 A 59 59 ASN C C 59 176.300 177.714 -1.414 2
1 776 . 1 1 A 59 59 ASN CA C 59 56.300 56.160 0.140 2
1 777 . 1 1 A 59 59 ASN CB C 59 36.400 37.877 -1.477 2
1 779 . 1 1 A 59 59 ASN N N 59 119.500 117.750 1.750 2
1 781 . 1 1 A 60 60 ALA H H 60 7.220 7.736 -0.516 2
1 782 . 1 1 A 60 60 ALA HA H 60 4.030 4.144 -0.114 2
1 786 . 1 1 A 60 60 ALA C C 60 180.100 180.167 -0.067 2
1 787 . 1 1 A 60 60 ALA CA C 60 54.300 55.009 -0.709 2
1 788 . 1 1 A 60 60 ALA CB C 60 18.200 18.331 -0.131 2
1 789 . 1 1 A 60 60 ALA N N 60 121.400 122.415 -1.015 2
1 790 . 1 1 A 61 61 LEU H H 61 7.320 8.188 -0.868 2
1 791 . 1 1 A 61 61 LEU HA H 61 3.840 4.072 -0.232 2
1 801 . 1 1 A 61 61 LEU C C 61 177.200 178.667 -1.467 2
1 802 . 1 1 A 61 61 LEU CA C 61 58.500 58.078 0.422 2
1 803 . 1 1 A 61 61 LEU CB C 61 42.600 41.936 0.664 2
1 807 . 1 1 A 61 61 LEU N N 61 118.600 119.872 -1.272 2
1 808 . 1 1 A 62 62 PHE H H 62 8.360 8.386 -0.026 2
1 809 . 1 1 A 62 62 PHE HA H 62 3.930 4.179 -0.249 2
1 817 . 1 1 A 62 62 PHE C C 62 178.200 177.933 0.267 2
1 818 . 1 1 A 62 62 PHE CA C 62 62.800 60.447 2.353 2
1 819 . 1 1 A 62 62 PHE CB C 62 38.500 38.634 -0.134 2
1 825 . 1 1 A 62 62 PHE N N 62 114.400 117.843 -3.443 2
1 826 . 1 1 A 63 63 ASP H H 63 8.680 8.505 0.175 2
1 827 . 1 1 A 63 63 ASP HA H 63 4.530 4.316 0.214 2
1 830 . 1 1 A 63 63 ASP C C 63 178.600 178.737 -0.137 2
1 831 . 1 1 A 63 63 ASP CA C 63 57.500 57.342 0.158 2
1 832 . 1 1 A 63 63 ASP CB C 63 39.600 40.796 -1.196 2
1 833 . 1 1 A 63 63 ASP N N 63 120.400 119.317 1.083 2
1 834 . 1 1 A 64 64 ARG H H 64 7.540 7.750 -0.210 2
1 835 . 1 1 A 64 64 ARG HA H 64 4.290 4.135 0.155 2
1 843 . 1 1 A 64 64 ARG C C 64 177.600 178.627 -1.027 2
1 844 . 1 1 A 64 64 ARG CA C 64 58.300 58.848 -0.548 2
1 845 . 1 1 A 64 64 ARG CB C 64 30.000 30.030 -0.030 2
1 848 . 1 1 A 64 64 ARG N N 64 116.800 119.522 -2.722 2
1 850 . 1 1 A 65 65 ILE H H 65 7.260 7.682 -0.422 2
1 851 . 1 1 A 65 65 ILE HA H 65 4.130 3.773 0.357 2
1 861 . 1 1 A 65 65 ILE C C 65 177.000 177.127 -0.127 2
1 862 . 1 1 A 65 65 ILE CA C 65 62.600 65.021 -2.421 2
1 863 . 1 1 A 65 65 ILE CB C 65 38.700 37.904 0.796 2
1 867 . 1 1 A 65 65 ILE N N 65 117.000 118.811 -1.811 2
1 868 . 1 1 A 66 66 ILE H H 66 7.980 7.848 0.132 2
1 869 . 1 1 A 66 66 ILE HA H 66 4.000 4.060 -0.060 2
1 879 . 1 1 A 66 66 ILE C C 66 176.400 175.741 0.659 2
1 880 . 1 1 A 66 66 ILE CA C 66 63.100 62.205 0.895 2
1 881 . 1 1 A 66 66 ILE CB C 66 38.800 38.027 0.773 2
1 885 . 1 1 A 66 66 ILE N N 66 120.700 119.775 0.925 2
1 886 . 1 1 A 67 67 VAL H H 67 8.130 8.355 -0.225 2
1 887 . 1 1 A 67 67 VAL HA H 67 3.980 4.341 -0.361 2
1 895 . 1 1 A 67 67 VAL C C 67 177.300 175.381 1.919 2
1 896 . 1 1 A 67 67 VAL CA C 67 63.900 61.839 2.061 2
1 897 . 1 1 A 67 67 VAL CB C 67 32.500 32.737 -0.237 2
1 900 . 1 1 A 67 67 VAL N N 67 121.600 122.950 -1.350 2
1 901 . 1 1 A 68 68 ASN H H 68 8.170 8.661 -0.491 2
1 902 . 1 1 A 68 68 ASN HA H 68 4.680 4.795 -0.115 2
1 907 . 1 1 A 68 68 ASN CA C 68 54.200 53.581 0.619 2
1 908 . 1 1 A 68 68 ASN CB C 68 39.100 39.235 -0.135 2
1 910 . 1 1 A 68 68 ASN N N 68 120.500 123.302 -2.802 2
1 912 . 1 1 A 69 69 LYS H H 69 8.230 8.536 -0.306 2
1 913 . 1 1 A 69 69 LYS HA H 69 4.260 4.302 -0.042 2
1 922 . 1 1 A 69 69 LYS C C 69 176.900 176.243 0.657 2
1 923 . 1 1 A 69 69 LYS CA C 69 57.000 56.589 0.411 2
1 924 . 1 1 A 69 69 LYS CB C 69 32.800 32.587 0.213 2
1 928 . 1 1 A 69 69 LYS N N 69 121.300 121.661 -0.361 2
1 929 . 1 1 A 70 70 LEU H H 70 8.150 8.350 -0.200 2
1 930 . 1 1 A 70 70 LEU HA H 70 4.300 4.344 -0.044 2
1 940 . 1 1 A 70 70 LEU C C 70 178.900 176.320 2.580 2
1 941 . 1 1 A 70 70 LEU CA C 70 55.400 55.055 0.345 2
1 942 . 1 1 A 70 70 LEU CB C 70 42.100 42.205 -0.105 2
1 946 . 1 1 A 70 70 LEU N N 70 121.900 122.445 -0.546 2
1 947 . 1 1 A 71 71 GLU H H 71 8.210 8.327 -0.117 2
1 948 . 1 1 A 71 71 GLU HA H 71 4.180 4.393 -0.213 2
1 953 . 1 1 A 71 71 GLU C C 71 176.300 176.243 0.057 2
1 954 . 1 1 A 71 71 GLU CA C 71 56.600 56.644 -0.044 2
1 955 . 1 1 A 71 71 GLU CB C 71 30.200 30.077 0.123 2
1 957 . 1 1 A 71 71 GLU N N 71 120.900 120.433 0.467 2
1 958 . 1 1 A 72 72 HIS H H 72 8.380 8.285 0.095 2
1 959 . 1 1 A 72 72 HIS HA H 72 4.600 4.664 -0.064 2
1 962 . 1 1 A 72 72 HIS C C 72 174.600 174.411 0.189 2
1 963 . 1 1 A 72 72 HIS CA C 72 55.600 56.043 -0.443 2
1 964 . 1 1 A 72 72 HIS CB C 72 29.600 30.487 -0.887 2
1 965 . 1 1 A 72 72 HIS N N 72 119.300 119.217 0.083 2
1 966 . 1 1 A 73 73 HIS H H 73 8.410 8.209 0.201 2
1 967 . 1 1 A 73 73 HIS HA H 73 4.610 4.464 0.146 2
1 970 . 1 1 A 73 73 HIS C C 73 173.700 174.472 -0.772 2
1 971 . 1 1 A 73 73 HIS CA C 73 55.700 56.155 -0.455 2
1 972 . 1 1 A 73 73 HIS CB C 73 29.600 30.260 -0.660 2
1 973 . 1 1 A 73 73 HIS N N 73 119.410 118.889 0.521 2
1 974 . 1 1 A 74 74 HIS H H 74 8.310 8.455 -0.145 2
1 975 . 1 1 A 74 74 HIS HA H 74 4.630 4.560 0.070 2
1 978 . 1 1 A 74 74 HIS CA C 74 57.100 56.146 0.954 2
1 979 . 1 1 A 74 74 HIS CB C 74 29.800 30.414 -0.614 2
stop_
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