data_15802_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15802
_Entry.PDB_ID 2K4K
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 2 2 ALA HA H 2 4.070 4.600 -0.530 1
1 5 . 1 1 1 A 2 2 ALA CA C 2 52.067 51.613 0.454 1
1 6 . 1 1 1 A 2 2 ALA CB C 2 19.577 22.576 -2.999 1
1 7 . 1 1 1 A 3 3 ALA H H 3 8.714 8.756 -0.042 1
1 8 . 1 1 1 A 3 3 ALA HA H 3 4.253 5.105 -0.852 1
1 12 . 1 1 1 A 3 3 ALA C C 3 173.672 175.430 -1.758 1
1 13 . 1 1 1 A 3 3 ALA CA C 3 52.067 51.523 0.544 1
1 14 . 1 1 1 A 3 3 ALA CB C 3 19.577 23.688 -4.111 1
1 15 . 1 1 1 A 3 3 ALA N N 3 124.480 120.071 4.409 1
1 16 . 1 1 1 A 4 4 LYS H H 4 8.227 8.827 -0.600 1
1 17 . 1 1 1 A 4 4 LYS HA H 4 3.976 4.716 -0.740 1
1 26 . 1 1 1 A 4 4 LYS C C 4 176.672 175.915 0.757 1
1 27 . 1 1 1 A 4 4 LYS CA C 4 57.274 55.700 1.574 1
1 28 . 1 1 1 A 4 4 LYS CB C 4 33.209 33.001 0.208 1
1 32 . 1 1 1 A 4 4 LYS N N 4 120.988 118.039 2.949 1
1 33 . 1 1 1 A 5 5 PHE H H 5 7.719 7.832 -0.113 1
1 34 . 1 1 1 A 5 5 PHE HA H 5 4.384 5.154 -0.770 1
1 38 . 1 1 1 A 5 5 PHE C C 5 175.364 174.136 1.228 1
1 39 . 1 1 1 A 5 5 PHE CA C 5 57.074 56.349 0.725 1
1 40 . 1 1 1 A 5 5 PHE CB C 5 39.669 43.786 -4.117 1
1 41 . 1 1 1 A 5 5 PHE N N 5 119.246 119.316 -0.070 1
1 42 . 1 1 1 A 6 6 GLU H H 6 8.515 8.998 -0.483 1
1 43 . 1 1 1 A 6 6 GLU HA H 6 4.370 4.903 -0.533 1
1 48 . 1 1 1 A 6 6 GLU CA C 6 55.669 55.215 0.454 1
1 49 . 1 1 1 A 6 6 GLU CB C 6 32.094 33.872 -1.778 1
1 51 . 1 1 1 A 6 6 GLU N N 6 122.193 120.183 2.010 1
1 52 . 1 1 1 A 7 7 VAL H H 7 8.636 8.523 0.113 1
1 53 . 1 1 1 A 7 7 VAL HA H 7 3.406 3.943 -0.537 1
1 61 . 1 1 1 A 7 7 VAL C C 7 176.611 176.342 0.269 1
1 62 . 1 1 1 A 7 7 VAL CA C 7 65.358 63.324 2.034 1
1 63 . 1 1 1 A 7 7 VAL CB C 7 31.391 31.438 -0.047 1
1 66 . 1 1 1 A 7 7 VAL N N 7 122.949 123.306 -0.357 1
1 67 . 1 1 1 A 8 8 GLY H H 8 9.394 9.197 0.197 1
1 68 . 1 1 1 A 8 8 GLY HA2 H 8 3.600 4.054 -0.454 1
1 69 . 1 1 1 A 8 8 GLY HA3 H 8 4.546 4.054 0.492 1
1 70 . 1 1 1 A 8 8 GLY C C 8 178.074 174.421 3.653 1
1 71 . 1 1 1 A 8 8 GLY CA C 8 45.121 44.907 0.214 1
1 72 . 1 1 1 A 8 8 GLY N N 8 116.837 115.203 1.634 1
1 73 . 1 1 1 A 9 9 SER H H 9 8.021 7.908 0.113 1
1 74 . 1 1 1 A 9 9 SER HA H 9 4.680 4.484 0.196 1
1 77 . 1 1 1 A 9 9 SER C C 9 174.234 173.021 1.213 1
1 78 . 1 1 1 A 9 9 SER CA C 9 59.387 59.362 0.025 1
1 79 . 1 1 1 A 9 9 SER CB C 9 65.584 64.699 0.885 1
1 80 . 1 1 1 A 9 9 SER N N 9 118.208 117.825 0.383 1
1 81 . 1 1 1 A 10 10 VAL H H 10 7.945 8.208 -0.263 1
1 82 . 1 1 1 A 10 10 VAL HA H 10 4.980 5.125 -0.145 1
1 90 . 1 1 1 A 10 10 VAL C C 10 171.388 174.329 -2.941 1
1 91 . 1 1 1 A 10 10 VAL CA C 10 61.021 61.024 -0.003 1
1 92 . 1 1 1 A 10 10 VAL CB C 10 33.400 34.955 -1.555 1
1 95 . 1 1 1 A 10 10 VAL N N 10 121.118 122.424 -1.306 1
1 96 . 1 1 1 A 11 11 TYR H H 11 9.008 9.121 -0.113 1
1 97 . 1 1 1 A 11 11 TYR HA H 11 4.850 5.289 -0.439 1
1 101 . 1 1 1 A 11 11 TYR C C 11 174.926 174.716 0.210 1
1 102 . 1 1 1 A 11 11 TYR CA C 11 56.803 56.201 0.602 1
1 103 . 1 1 1 A 11 11 TYR CB C 11 43.676 43.684 -0.008 1
1 104 . 1 1 1 A 11 11 TYR N N 11 125.043 125.344 -0.301 1
1 105 . 1 1 1 A 12 12 THR H H 12 8.809 8.697 0.112 1
1 106 . 1 1 1 A 12 12 THR HA H 12 5.020 5.426 -0.406 1
1 111 . 1 1 1 A 12 12 THR C C 12 174.195 174.790 -0.595 1
1 112 . 1 1 1 A 12 12 THR CA C 12 62.487 60.229 2.258 1
1 113 . 1 1 1 A 12 12 THR CB C 12 69.743 71.611 -1.868 1
1 115 . 1 1 1 A 12 12 THR N N 12 116.850 115.207 1.643 1
1 116 . 1 1 1 A 13 13 GLY H H 13 9.179 8.627 0.552 1
1 117 . 1 1 1 A 13 13 GLY HA2 H 13 3.250 4.350 -1.100 1
1 118 . 1 1 1 A 13 13 GLY HA3 H 13 4.801 4.357 0.444 1
1 119 . 1 1 1 A 13 13 GLY C C 13 174.654 171.874 2.780 1
1 120 . 1 1 1 A 13 13 GLY CA C 13 44.377 45.637 -1.260 1
1 121 . 1 1 1 A 13 13 GLY N N 13 113.654 111.895 1.759 1
1 122 . 1 1 1 A 14 14 LYS H H 14 7.770 8.533 -0.763 1
1 123 . 1 1 1 A 14 14 LYS HA H 14 5.426 5.172 0.254 1
1 132 . 1 1 1 A 14 14 LYS C C 14 171.343 175.775 -4.432 1
1 133 . 1 1 1 A 14 14 LYS CA C 14 53.879 54.492 -0.613 1
1 134 . 1 1 1 A 14 14 LYS CB C 14 36.032 35.954 0.078 1
1 138 . 1 1 1 A 14 14 LYS N N 14 118.322 120.552 -2.230 1
1 139 . 1 1 1 A 15 15 VAL H H 15 9.206 9.305 -0.099 1
1 140 . 1 1 1 A 15 15 VAL HA H 15 4.400 4.235 0.165 1
1 148 . 1 1 1 A 15 15 VAL C C 15 176.306 176.996 -0.690 1
1 149 . 1 1 1 A 15 15 VAL CA C 15 63.648 63.378 0.270 1
1 150 . 1 1 1 A 15 15 VAL CB C 15 31.769 31.459 0.310 1
1 153 . 1 1 1 A 15 15 VAL N N 15 125.308 123.527 1.781 1
1 154 . 1 1 1 A 16 16 THR H H 16 9.403 9.233 0.170 1
1 155 . 1 1 1 A 16 16 THR HA H 16 4.562 4.673 -0.111 1
1 160 . 1 1 1 A 16 16 THR C C 16 178.098 174.700 3.398 1
1 161 . 1 1 1 A 16 16 THR CA C 16 62.018 61.785 0.233 1
1 162 . 1 1 1 A 16 16 THR CB C 16 69.720 69.811 -0.091 1
1 164 . 1 1 1 A 16 16 THR N N 16 121.753 117.899 3.854 1
1 165 . 1 1 1 A 17 17 GLY H H 17 7.600 7.211 0.389 1
1 166 . 1 1 1 A 17 17 GLY HA2 H 17 4.110 4.088 0.022 1
1 167 . 1 1 1 A 17 17 GLY HA3 H 17 4.250 4.199 0.051 1
1 168 . 1 1 1 A 17 17 GLY C C 17 175.551 171.263 4.288 1
1 169 . 1 1 1 A 17 17 GLY CA C 17 46.258 45.550 0.708 1
1 170 . 1 1 1 A 17 17 GLY N N 17 109.407 108.775 0.632 1
1 171 . 1 1 1 A 18 18 LEU H H 18 8.820 8.470 0.350 1
1 172 . 1 1 1 A 18 18 LEU HA H 18 4.852 4.950 -0.098 1
1 182 . 1 1 1 A 18 18 LEU CA C 18 54.245 53.168 1.077 1
1 183 . 1 1 1 A 18 18 LEU CB C 18 44.906 46.108 -1.202 1
1 187 . 1 1 1 A 18 18 LEU N N 18 123.419 120.990 2.429 1
1 188 . 1 1 1 A 19 19 GLN H H 19 8.537 8.172 0.365 1
1 189 . 1 1 1 A 19 19 GLN HA H 19 4.520 4.617 -0.097 1
1 196 . 1 1 1 A 19 19 GLN C C 19 175.258 175.624 -0.366 1
1 197 . 1 1 1 A 19 19 GLN CA C 19 53.269 53.769 -0.500 1
1 198 . 1 1 1 A 19 19 GLN CB C 19 31.522 32.275 -0.753 1
1 200 . 1 1 1 A 19 19 GLN N N 19 120.187 121.553 -1.366 1
1 202 . 1 1 1 A 20 20 ALA H H 20 8.798 8.660 0.138 1
1 203 . 1 1 1 A 20 20 ALA HA H 20 4.010 4.038 -0.028 1
1 207 . 1 1 1 A 20 20 ALA C C 20 175.698 177.398 -1.700 1
1 208 . 1 1 1 A 20 20 ALA CA C 20 55.084 54.199 0.885 1
1 209 . 1 1 1 A 20 20 ALA CB C 20 18.277 18.630 -0.353 1
1 210 . 1 1 1 A 20 20 ALA N N 20 120.606 123.880 -3.274 1
1 211 . 1 1 1 A 21 21 TYR H H 21 6.618 7.391 -0.773 1
1 212 . 1 1 1 A 21 21 TYR HA H 21 4.540 4.728 -0.188 1
1 216 . 1 1 1 A 21 21 TYR C C 21 178.437 175.167 3.270 1
1 217 . 1 1 1 A 21 21 TYR CA C 21 55.120 56.960 -1.840 1
1 218 . 1 1 1 A 21 21 TYR CB C 21 37.891 39.972 -2.081 1
1 219 . 1 1 1 A 21 21 TYR N N 21 105.570 113.674 -8.104 1
1 220 . 1 1 1 A 22 22 GLY H H 22 7.203 6.870 0.333 1
1 221 . 1 1 1 A 22 22 GLY HA2 H 22 3.460 3.841 -0.381 1
1 222 . 1 1 1 A 22 22 GLY HA3 H 22 4.360 3.936 0.424 1
1 223 . 1 1 1 A 22 22 GLY C C 22 175.833 170.993 4.840 1
1 224 . 1 1 1 A 22 22 GLY CA C 22 46.356 45.412 0.944 1
1 225 . 1 1 1 A 22 22 GLY N N 22 109.854 108.268 1.586 1
1 226 . 1 1 1 A 23 23 ALA H H 23 8.549 8.459 0.090 1
1 227 . 1 1 1 A 23 23 ALA HA H 23 4.981 5.143 -0.162 1
1 231 . 1 1 1 A 23 23 ALA C C 23 168.810 175.686 -6.876 1
1 232 . 1 1 1 A 23 23 ALA CA C 23 49.178 50.471 -1.293 1
1 233 . 1 1 1 A 23 23 ALA CB C 23 22.797 21.767 1.030 1
1 234 . 1 1 1 A 23 23 ALA N N 23 118.749 122.139 -3.390 1
1 235 . 1 1 1 A 24 24 PHE H H 24 8.812 8.412 0.400 1
1 236 . 1 1 1 A 24 24 PHE HA H 24 5.125 4.973 0.152 1
1 240 . 1 1 1 A 24 24 PHE CA C 24 58.017 58.005 0.012 1
1 241 . 1 1 1 A 24 24 PHE CB C 24 40.475 40.517 -0.042 1
1 242 . 1 1 1 A 24 24 PHE N N 24 122.891 120.987 1.904 1
1 243 . 1 1 1 A 25 25 VAL H H 25 8.880 8.897 -0.017 1
1 244 . 1 1 1 A 25 25 VAL HA H 25 4.660 4.771 -0.111 1
1 252 . 1 1 1 A 25 25 VAL CA C 25 60.379 60.910 -0.531 1
1 253 . 1 1 1 A 25 25 VAL CB C 25 35.654 35.490 0.164 1
1 256 . 1 1 1 A 25 25 VAL N N 25 122.908 121.302 1.606 1
1 257 . 1 1 1 A 26 26 ALA H H 26 9.403 9.048 0.355 1
1 258 . 1 1 1 A 26 26 ALA HA H 26 4.750 4.417 0.333 1
1 262 . 1 1 1 A 26 26 ALA C C 26 174.445 176.649 -2.204 1
1 263 . 1 1 1 A 26 26 ALA CA C 26 51.711 52.220 -0.509 1
1 264 . 1 1 1 A 26 26 ALA CB C 26 19.319 18.640 0.679 1
1 265 . 1 1 1 A 26 26 ALA N N 26 129.425 129.488 -0.063 1
1 266 . 1 1 1 A 27 27 LEU H H 27 8.601 9.339 -0.738 1
1 267 . 1 1 1 A 27 27 LEU HA H 27 4.158 4.473 -0.315 1
1 277 . 1 1 1 A 27 27 LEU C C 27 177.814 176.050 1.764 1
1 278 . 1 1 1 A 27 27 LEU CA C 27 55.869 55.905 -0.036 1
1 279 . 1 1 1 A 27 27 LEU CB C 27 42.251 42.731 -0.480 1
1 283 . 1 1 1 A 27 27 LEU N N 27 127.169 124.899 2.270 1
1 284 . 1 1 1 A 28 28 ASP H H 28 8.172 7.838 0.334 1
1 285 . 1 1 1 A 28 28 ASP HA H 28 4.420 4.868 -0.448 1
1 288 . 1 1 1 A 28 28 ASP C C 28 177.116 175.432 1.684 1
1 289 . 1 1 1 A 28 28 ASP CA C 28 53.755 53.437 0.318 1
1 290 . 1 1 1 A 28 28 ASP CB C 28 39.833 43.750 -3.917 1
1 291 . 1 1 1 A 28 28 ASP N N 28 115.657 115.354 0.303 1
1 292 . 1 1 1 A 29 29 GLU H H 29 8.857 8.725 0.132 1
1 293 . 1 1 1 A 29 29 GLU HA H 29 4.090 4.068 0.022 1
1 298 . 1 1 1 A 29 29 GLU C C 29 175.965 176.935 -0.970 1
1 299 . 1 1 1 A 29 29 GLU CA C 29 59.470 59.120 0.350 1
1 300 . 1 1 1 A 29 29 GLU CB C 29 29.409 29.422 -0.013 1
1 302 . 1 1 1 A 29 29 GLU N N 29 114.738 123.218 -8.480 1
1 303 . 1 1 1 A 30 30 GLU H H 30 8.326 8.063 0.263 1
1 304 . 1 1 1 A 30 30 GLU HA H 30 4.640 4.540 0.100 1
1 309 . 1 1 1 A 30 30 GLU C C 30 176.817 175.293 1.524 1
1 310 . 1 1 1 A 30 30 GLU CA C 30 56.073 55.857 0.216 1
1 311 . 1 1 1 A 30 30 GLU CB C 30 32.453 31.362 1.091 1
1 313 . 1 1 1 A 30 30 GLU N N 30 115.753 117.680 -1.927 1
1 314 . 1 1 1 A 31 31 THR H H 31 7.819 7.535 0.284 1
1 315 . 1 1 1 A 31 31 THR HA H 31 4.484 4.930 -0.446 1
1 320 . 1 1 1 A 31 31 THR C C 31 176.330 172.544 3.786 1
1 321 . 1 1 1 A 31 31 THR CA C 31 63.398 60.811 2.587 1
1 322 . 1 1 1 A 31 31 THR CB C 31 69.367 72.171 -2.804 1
1 324 . 1 1 1 A 31 31 THR N N 31 118.750 114.987 3.763 1
1 325 . 1 1 1 A 32 32 GLN H H 32 8.913 8.597 0.316 1
1 326 . 1 1 1 A 32 32 GLN HA H 32 5.337 4.974 0.363 1
1 333 . 1 1 1 A 32 32 GLN C C 32 173.087 174.475 -1.388 1
1 334 . 1 1 1 A 32 32 GLN CA C 32 54.051 54.685 -0.634 1
1 335 . 1 1 1 A 32 32 GLN CB C 32 32.672 32.077 0.595 1
1 337 . 1 1 1 A 32 32 GLN N N 32 127.294 125.984 1.310 1
1 339 . 1 1 1 A 33 33 GLY H H 33 8.900 8.900 0.000 1
1 340 . 1 1 1 A 33 33 GLY HA2 H 33 3.290 4.358 -1.068 1
1 341 . 1 1 1 A 33 33 GLY HA3 H 33 4.530 4.402 0.128 1
1 342 . 1 1 1 A 33 33 GLY C C 33 174.918 172.311 2.607 1
1 343 . 1 1 1 A 33 33 GLY CA C 33 44.534 44.726 -0.192 1
1 344 . 1 1 1 A 33 33 GLY N N 33 107.639 112.078 -4.439 1
1 345 . 1 1 1 A 34 34 LEU H H 34 8.127 8.858 -0.731 1
1 346 . 1 1 1 A 34 34 LEU HA H 34 4.950 4.993 -0.043 1
1 356 . 1 1 1 A 34 34 LEU CA C 34 53.755 54.113 -0.358 1
1 357 . 1 1 1 A 34 34 LEU CB C 34 45.493 44.814 0.679 1
1 361 . 1 1 1 A 34 34 LEU N N 34 120.897 121.489 -0.592 1
1 362 . 1 1 1 A 35 35 VAL H H 35 9.386 8.826 0.560 1
1 363 . 1 1 1 A 35 35 VAL HA H 35 4.479 4.415 0.064 1
1 371 . 1 1 1 A 35 35 VAL C C 35 176.402 176.165 0.237 1
1 372 . 1 1 1 A 35 35 VAL CA C 35 59.594 63.048 -3.454 1
1 373 . 1 1 1 A 35 35 VAL CB C 35 32.590 31.597 0.993 1
1 376 . 1 1 1 A 35 35 VAL N N 35 128.897 127.898 0.999 1
1 377 . 1 1 1 A 36 36 HIS H H 36 9.194 8.533 0.661 1
1 378 . 1 1 1 A 36 36 HIS HA H 36 4.487 4.612 -0.125 1
1 381 . 1 1 1 A 36 36 HIS C C 36 174.864 176.455 -1.591 1
1 382 . 1 1 1 A 36 36 HIS CA C 36 59.426 56.576 2.850 1
1 383 . 1 1 1 A 36 36 HIS CB C 36 31.542 30.252 1.290 1
1 384 . 1 1 1 A 36 36 HIS N N 36 127.751 126.214 1.537 1
1 385 . 1 1 1 A 37 37 ILE H H 37 7.454 8.847 -1.393 1
1 386 . 1 1 1 A 37 37 ILE HA H 37 3.810 3.698 0.112 1
1 396 . 1 1 1 A 37 37 ILE C C 37 176.948 178.058 -1.110 1
1 397 . 1 1 1 A 37 37 ILE CA C 37 63.773 64.847 -1.074 1
1 398 . 1 1 1 A 37 37 ILE CB C 37 38.993 37.489 1.504 1
1 402 . 1 1 1 A 37 37 ILE N N 37 126.266 126.112 0.154 1
1 403 . 1 1 1 A 38 38 SER H H 38 8.343 8.197 0.146 1
1 404 . 1 1 1 A 38 38 SER HA H 38 4.370 4.281 0.089 1
1 407 . 1 1 1 A 38 38 SER C C 38 174.792 175.050 -0.258 1
1 408 . 1 1 1 A 38 38 SER CA C 38 60.567 60.996 -0.429 1
1 409 . 1 1 1 A 38 38 SER CB C 38 63.632 62.817 0.815 1
1 410 . 1 1 1 A 38 38 SER N N 38 118.079 118.518 -0.439 1
1 411 . 1 1 1 A 39 39 GLU H H 39 8.536 8.087 0.449 1
1 412 . 1 1 1 A 39 39 GLU HA H 39 4.503 4.553 -0.050 1
1 417 . 1 1 1 A 39 39 GLU C C 39 175.131 176.990 -1.859 1
1 418 . 1 1 1 A 39 39 GLU CA C 39 54.928 56.219 -1.291 1
1 419 . 1 1 1 A 39 39 GLU CB C 39 29.621 30.818 -1.197 1
1 421 . 1 1 1 A 39 39 GLU N N 39 118.349 118.317 0.032 1
1 422 . 1 1 1 A 40 40 VAL H H 40 7.776 7.778 -0.002 1
1 423 . 1 1 1 A 40 40 VAL HA H 40 3.616 3.868 -0.252 1
1 431 . 1 1 1 A 40 40 VAL C C 40 177.277 176.268 1.009 1
1 432 . 1 1 1 A 40 40 VAL CA C 40 66.245 64.420 1.825 1
1 433 . 1 1 1 A 40 40 VAL CB C 40 32.590 32.013 0.577 1
1 436 . 1 1 1 A 40 40 VAL N N 40 125.443 117.969 7.474 1
1 437 . 1 1 1 A 41 41 THR H H 41 7.888 7.605 0.283 1
1 438 . 1 1 1 A 41 41 THR HA H 41 4.345 4.667 -0.322 1
1 443 . 1 1 1 A 41 41 THR C C 41 173.492 174.077 -0.585 1
1 444 . 1 1 1 A 41 41 THR CA C 41 59.047 61.061 -2.014 1
1 445 . 1 1 1 A 41 41 THR CB C 41 68.992 72.527 -3.535 1
1 447 . 1 1 1 A 41 41 THR N N 41 109.905 112.816 -2.911 1
1 448 . 1 1 1 A 42 42 HIS H H 42 8.063 8.526 -0.463 1
1 449 . 1 1 1 A 42 42 HIS HA H 42 4.510 4.313 0.197 1
1 452 . 1 1 1 A 42 42 HIS C C 42 172.139 175.406 -3.267 1
1 453 . 1 1 1 A 42 42 HIS CA C 42 57.735 58.343 -0.608 1
1 454 . 1 1 1 A 42 42 HIS CB C 42 31.144 29.855 1.289 1
1 455 . 1 1 1 A 42 42 HIS N N 42 121.760 122.174 -0.414 1
1 456 . 1 1 1 A 43 43 GLY H H 43 8.286 7.437 0.849 1
1 457 . 1 1 1 A 43 43 GLY HA2 H 43 3.980 4.031 -0.051 1
1 458 . 1 1 1 A 43 43 GLY HA3 H 43 3.980 4.076 -0.096 1
1 459 . 1 1 1 A 43 43 GLY C C 43 176.307 173.746 2.561 1
1 460 . 1 1 1 A 43 43 GLY CA C 43 44.336 45.808 -1.472 1
1 461 . 1 1 1 A 43 43 GLY N N 43 110.133 104.626 5.507 1
1 462 . 1 1 1 A 44 44 PHE H H 44 8.327 9.064 -0.737 1
1 463 . 1 1 1 A 44 44 PHE HA H 44 4.489 4.234 0.255 1
1 467 . 1 1 1 A 44 44 PHE C C 44 171.877 175.015 -3.138 1
1 468 . 1 1 1 A 44 44 PHE CA C 44 58.027 58.544 -0.517 1
1 469 . 1 1 1 A 44 44 PHE CB C 44 39.850 37.394 2.456 1
1 470 . 1 1 1 A 44 44 PHE N N 44 120.049 119.290 0.759 1
1 471 . 1 1 1 A 45 45 VAL H H 45 7.939 7.911 0.028 1
1 472 . 1 1 1 A 45 45 VAL HA H 45 3.865 3.849 0.016 1
1 480 . 1 1 1 A 45 45 VAL C C 45 175.523 176.841 -1.318 1
1 481 . 1 1 1 A 45 45 VAL CA C 45 61.536 61.627 -0.091 1
1 482 . 1 1 1 A 45 45 VAL CB C 45 33.127 28.731 4.396 1
1 485 . 1 1 1 A 45 45 VAL N N 45 127.882 118.437 9.445 1
1 486 . 1 1 1 A 46 46 LYS H H 46 8.868 7.713 1.155 1
1 487 . 1 1 1 A 46 46 LYS HA H 46 4.170 3.890 0.280 1
1 496 . 1 1 1 A 46 46 LYS C C 46 175.728 175.834 -0.106 1
1 497 . 1 1 1 A 46 46 LYS CA C 46 57.198 58.491 -1.293 1
1 498 . 1 1 1 A 46 46 LYS CB C 46 33.299 31.751 1.548 1
1 502 . 1 1 1 A 46 46 LYS N N 46 127.308 122.417 4.891 1
1 503 . 1 1 1 A 47 47 ASP H H 47 7.652 7.874 -0.222 1
1 504 . 1 1 1 A 47 47 ASP HA H 47 4.710 4.923 -0.213 1
1 507 . 1 1 1 A 47 47 ASP C C 47 176.411 176.082 0.329 1
1 508 . 1 1 1 A 47 47 ASP CA C 47 53.390 53.794 -0.404 1
1 509 . 1 1 1 A 47 47 ASP CB C 47 42.635 43.655 -1.020 1
1 510 . 1 1 1 A 47 47 ASP N N 47 117.932 117.829 0.103 1
1 511 . 1 1 1 A 48 48 ILE H H 48 9.230 8.622 0.608 1
1 512 . 1 1 1 A 48 48 ILE HA H 48 3.579 4.006 -0.427 1
1 522 . 1 1 1 A 48 48 ILE C C 48 177.249 177.514 -0.265 1
1 523 . 1 1 1 A 48 48 ILE CA C 48 65.525 63.449 2.076 1
1 524 . 1 1 1 A 48 48 ILE CB C 48 38.797 37.703 1.094 1
1 528 . 1 1 1 A 48 48 ILE N N 48 129.049 125.644 3.405 1
1 529 . 1 1 1 A 49 49 ASN H H 49 8.468 9.011 -0.543 1
1 530 . 1 1 1 A 49 49 ASN HA H 49 4.690 4.587 0.103 1
1 535 . 1 1 1 A 49 49 ASN C C 49 175.779 176.628 -0.849 1
1 536 . 1 1 1 A 49 49 ASN CA C 49 55.587 55.148 0.439 1
1 537 . 1 1 1 A 49 49 ASN CB C 49 38.587 36.953 1.634 1
1 538 . 1 1 1 A 49 49 ASN N N 49 118.835 117.963 0.872 1
1 540 . 1 1 1 A 50 50 GLU H H 50 7.853 7.533 0.320 1
1 541 . 1 1 1 A 50 50 GLU HA H 50 4.040 4.090 -0.050 1
1 546 . 1 1 1 A 50 50 GLU C C 50 176.148 177.052 -0.904 1
1 547 . 1 1 1 A 50 50 GLU CA C 50 57.404 58.001 -0.597 1
1 548 . 1 1 1 A 50 50 GLU CB C 50 29.491 29.117 0.374 1
1 550 . 1 1 1 A 50 50 GLU N N 50 116.358 118.175 -1.817 1
1 551 . 1 1 1 A 51 51 HIS H H 51 7.575 7.806 -0.231 1
1 552 . 1 1 1 A 51 51 HIS HA H 51 4.431 4.711 -0.280 1
1 555 . 1 1 1 A 51 51 HIS C C 51 176.383 174.686 1.697 1
1 556 . 1 1 1 A 51 51 HIS CA C 51 57.089 56.616 0.473 1
1 557 . 1 1 1 A 51 51 HIS CB C 51 33.168 32.147 1.021 1
1 558 . 1 1 1 A 51 51 HIS N N 51 115.828 115.089 0.739 1
1 559 . 1 1 1 A 52 52 LEU H H 52 7.640 7.545 0.095 1
1 560 . 1 1 1 A 52 52 LEU HA H 52 4.796 4.875 -0.079 1
1 570 . 1 1 1 A 52 52 LEU C C 52 174.452 175.136 -0.684 1
1 571 . 1 1 1 A 52 52 LEU CA C 52 53.398 53.579 -0.181 1
1 572 . 1 1 1 A 52 52 LEU CB C 52 48.805 47.353 1.452 1
1 576 . 1 1 1 A 52 52 LEU N N 52 117.932 119.173 -1.241 1
1 577 . 1 1 1 A 53 53 SER H H 53 8.151 8.875 -0.724 1
1 578 . 1 1 1 A 53 53 SER HA H 53 4.680 4.944 -0.264 1
1 581 . 1 1 1 A 53 53 SER C C 53 174.304 172.855 1.449 1
1 582 . 1 1 1 A 53 53 SER CA C 53 56.714 57.419 -0.705 1
1 583 . 1 1 1 A 53 53 SER CB C 53 65.431 65.971 -0.540 1
1 584 . 1 1 1 A 53 53 SER N N 53 113.496 118.014 -4.518 1
1 585 . 1 1 1 A 54 54 VAL H H 54 8.782 8.557 0.225 1
1 586 . 1 1 1 A 54 54 VAL HA H 54 3.230 3.788 -0.558 1
1 594 . 1 1 1 A 54 54 VAL C C 54 173.745 177.166 -3.421 1
1 595 . 1 1 1 A 54 54 VAL CA C 54 66.232 63.643 2.589 1
1 596 . 1 1 1 A 54 54 VAL CB C 54 31.067 31.730 -0.663 1
1 599 . 1 1 1 A 54 54 VAL N N 54 124.401 126.459 -2.058 1
1 600 . 1 1 1 A 55 55 GLY H H 55 9.079 9.011 0.068 1
1 601 . 1 1 1 A 55 55 GLY HA2 H 55 3.530 3.863 -0.333 1
1 602 . 1 1 1 A 55 55 GLY HA3 H 55 4.553 3.866 0.687 1
1 603 . 1 1 1 A 55 55 GLY C C 55 177.219 173.299 3.920 1
1 604 . 1 1 1 A 55 55 GLY CA C 55 44.647 46.297 -1.650 1
1 605 . 1 1 1 A 55 55 GLY N N 55 117.320 115.938 1.382 1
1 606 . 1 1 1 A 56 56 ASP H H 56 7.943 7.781 0.162 1
1 607 . 1 1 1 A 56 56 ASP HA H 56 4.460 5.157 -0.697 1
1 610 . 1 1 1 A 56 56 ASP C C 56 176.055 173.856 2.199 1
1 611 . 1 1 1 A 56 56 ASP CA C 56 55.456 52.239 3.217 1
1 612 . 1 1 1 A 56 56 ASP CB C 56 40.914 44.445 -3.531 1
1 613 . 1 1 1 A 56 56 ASP N N 56 121.782 119.684 2.098 1
1 614 . 1 1 1 A 57 57 GLU H H 57 8.649 8.662 -0.013 1
1 615 . 1 1 1 A 57 57 GLU HA H 57 5.100 5.153 -0.053 1
1 620 . 1 1 1 A 57 57 GLU C C 57 175.635 176.084 -0.449 1
1 621 . 1 1 1 A 57 57 GLU CA C 57 55.805 55.680 0.125 1
1 622 . 1 1 1 A 57 57 GLU CB C 57 30.915 31.216 -0.301 1
1 624 . 1 1 1 A 57 57 GLU N N 57 122.513 123.769 -1.256 1
1 625 . 1 1 1 A 58 58 VAL H H 58 8.809 9.243 -0.434 1
1 626 . 1 1 1 A 58 58 VAL HA H 58 4.817 4.820 -0.003 1
1 634 . 1 1 1 A 58 58 VAL C C 58 176.528 173.689 2.839 1
1 635 . 1 1 1 A 58 58 VAL CA C 58 58.719 59.166 -0.447 1
1 636 . 1 1 1 A 58 58 VAL CB C 58 35.523 35.994 -0.471 1
1 639 . 1 1 1 A 58 58 VAL N N 58 118.382 119.359 -0.977 1
1 640 . 1 1 1 A 59 59 GLN H H 59 8.255 8.851 -0.596 1
1 641 . 1 1 1 A 59 59 GLN HA H 59 5.030 5.220 -0.190 1
1 646 . 1 1 1 A 59 59 GLN CA C 59 54.843 54.572 0.271 1
1 647 . 1 1 1 A 59 59 GLN CB C 59 30.111 31.328 -1.217 1
1 649 . 1 1 1 A 59 59 GLN N N 59 120.933 123.068 -2.135 1
1 650 . 1 1 1 A 60 60 VAL H H 60 8.970 9.434 -0.464 1
1 651 . 1 1 1 A 60 60 VAL HA H 60 4.990 5.036 -0.046 1
1 659 . 1 1 1 A 60 60 VAL C C 60 175.203 173.901 1.302 1
1 660 . 1 1 1 A 60 60 VAL CA C 60 57.404 58.965 -1.561 1
1 661 . 1 1 1 A 60 60 VAL CB C 60 35.771 35.265 0.506 1
1 664 . 1 1 1 A 60 60 VAL N N 60 111.046 120.722 -9.676 1
1 665 . 1 1 1 A 61 61 LYS H H 61 8.937 8.721 0.216 1
1 666 . 1 1 1 A 61 61 LYS HA H 61 5.100 4.923 0.177 1
1 675 . 1 1 1 A 61 61 LYS C C 61 173.610 176.344 -2.734 1
1 676 . 1 1 1 A 61 61 LYS CA C 61 53.762 54.866 -1.104 1
1 677 . 1 1 1 A 61 61 LYS CB C 61 36.273 34.632 1.641 1
1 681 . 1 1 1 A 61 61 LYS N N 61 121.930 123.368 -1.438 1
1 682 . 1 1 1 A 62 62 VAL H H 62 8.429 9.288 -0.859 1
1 683 . 1 1 1 A 62 62 VAL HA H 62 4.074 4.039 0.035 1
1 691 . 1 1 1 A 62 62 VAL C C 62 176.912 175.724 1.188 1
1 692 . 1 1 1 A 62 62 VAL CA C 62 63.188 63.590 -0.402 1
1 693 . 1 1 1 A 62 62 VAL CB C 62 30.813 31.315 -0.502 1
1 696 . 1 1 1 A 62 62 VAL N N 62 126.329 127.198 -0.869 1
1 697 . 1 1 1 A 63 63 LEU H H 63 9.109 9.221 -0.112 1
1 698 . 1 1 1 A 63 63 LEU HA H 63 4.423 4.402 0.021 1
1 708 . 1 1 1 A 63 63 LEU C C 63 176.091 176.879 -0.788 1
1 709 . 1 1 1 A 63 63 LEU CA C 63 55.876 55.945 -0.069 1
1 710 . 1 1 1 A 63 63 LEU CB C 63 42.800 42.472 0.328 1
1 714 . 1 1 1 A 63 63 LEU N N 63 129.436 128.817 0.619 1
1 715 . 1 1 1 A 64 64 ALA H H 64 7.594 7.153 0.441 1
1 716 . 1 1 1 A 64 64 ALA HA H 64 4.455 4.718 -0.263 1
1 720 . 1 1 1 A 64 64 ALA C C 64 177.314 175.072 2.242 1
1 721 . 1 1 1 A 64 64 ALA CA C 64 52.557 51.632 0.925 1
1 722 . 1 1 1 A 64 64 ALA CB C 64 21.458 22.786 -1.328 1
1 723 . 1 1 1 A 64 64 ALA N N 64 117.791 116.385 1.406 1
1 724 . 1 1 1 A 65 65 VAL H H 65 8.583 8.584 -0.001 1
1 725 . 1 1 1 A 65 65 VAL HA H 65 4.470 4.817 -0.347 1
1 733 . 1 1 1 A 65 65 VAL C C 65 174.697 174.588 0.109 1
1 734 . 1 1 1 A 65 65 VAL CA C 65 61.936 60.650 1.286 1
1 735 . 1 1 1 A 65 65 VAL CB C 65 35.288 35.143 0.145 1
1 738 . 1 1 1 A 65 65 VAL N N 65 120.009 119.806 0.203 1
1 739 . 1 1 1 A 66 66 ASP H H 66 8.567 8.900 -0.333 1
1 740 . 1 1 1 A 66 66 ASP HA H 66 4.880 4.991 -0.111 1
1 743 . 1 1 1 A 66 66 ASP C C 66 174.355 176.092 -1.737 1
1 744 . 1 1 1 A 66 66 ASP CA C 66 52.681 52.542 0.139 1
1 745 . 1 1 1 A 66 66 ASP CB C 66 41.775 40.842 0.933 1
1 746 . 1 1 1 A 66 66 ASP N N 66 126.262 125.237 1.025 1
1 747 . 1 1 1 A 67 67 GLU H H 67 9.148 8.448 0.700 1
1 748 . 1 1 1 A 67 67 GLU HA H 67 4.110 3.996 0.114 1
1 753 . 1 1 1 A 67 67 GLU C C 67 177.052 178.213 -1.161 1
1 754 . 1 1 1 A 67 67 GLU CA C 67 59.044 59.348 -0.304 1
1 755 . 1 1 1 A 67 67 GLU CB C 67 29.919 29.504 0.415 1
1 757 . 1 1 1 A 67 67 GLU N N 67 125.480 125.992 -0.512 1
1 758 . 1 1 1 A 68 68 GLU H H 68 8.384 8.078 0.306 1
1 759 . 1 1 1 A 68 68 GLU HA H 68 4.140 4.085 0.055 1
1 764 . 1 1 1 A 68 68 GLU C C 68 178.383 177.466 0.917 1
1 765 . 1 1 1 A 68 68 GLU CA C 68 59.044 59.565 -0.521 1
1 766 . 1 1 1 A 68 68 GLU CB C 68 29.919 29.625 0.294 1
1 768 . 1 1 1 A 68 68 GLU N N 68 119.760 118.565 1.195 1
1 769 . 1 1 1 A 69 69 LYS H H 69 7.799 7.657 0.142 1
1 770 . 1 1 1 A 69 69 LYS HA H 69 4.375 4.524 -0.149 1
1 779 . 1 1 1 A 69 69 LYS C C 69 178.297 176.948 1.349 1
1 780 . 1 1 1 A 69 69 LYS CA C 69 55.704 55.515 0.189 1
1 781 . 1 1 1 A 69 69 LYS CB C 69 33.622 34.138 -0.516 1
1 785 . 1 1 1 A 69 69 LYS N N 69 115.476 116.888 -1.412 1
1 786 . 1 1 1 A 70 70 GLY H H 70 7.994 7.989 0.005 1
1 787 . 1 1 1 A 70 70 GLY HA2 H 70 3.940 3.924 0.016 1
1 788 . 1 1 1 A 70 70 GLY HA3 H 70 3.960 3.931 0.029 1
1 789 . 1 1 1 A 70 70 GLY C C 70 177.215 174.495 2.720 1
1 790 . 1 1 1 A 70 70 GLY CA C 70 46.773 46.401 0.372 1
1 791 . 1 1 1 A 70 70 GLY N N 70 110.245 109.825 0.420 1
1 792 . 1 1 1 A 71 71 LYS H H 71 7.560 7.660 -0.100 1
1 793 . 1 1 1 A 71 71 LYS HA H 71 4.690 4.720 -0.030 1
1 802 . 1 1 1 A 71 71 LYS C C 71 174.607 175.567 -0.960 1
1 803 . 1 1 1 A 71 71 LYS CA C 71 55.332 55.452 -0.120 1
1 804 . 1 1 1 A 71 71 LYS CB C 71 34.903 34.041 0.862 1
1 808 . 1 1 1 A 71 71 LYS N N 71 118.201 119.192 -0.991 1
1 809 . 1 1 1 A 72 72 ILE H H 72 8.867 8.524 0.343 1
1 810 . 1 1 1 A 72 72 ILE HA H 72 4.630 4.830 -0.200 1
1 820 . 1 1 1 A 72 72 ILE C C 72 175.708 174.565 1.143 1
1 821 . 1 1 1 A 72 72 ILE CA C 72 61.494 60.115 1.379 1
1 822 . 1 1 1 A 72 72 ILE CB C 72 40.652 41.955 -1.303 1
1 826 . 1 1 1 A 72 72 ILE N N 72 126.827 121.414 5.413 1
1 827 . 1 1 1 A 73 73 SER H H 73 8.815 9.074 -0.259 1
1 828 . 1 1 1 A 73 73 SER HA H 73 5.110 4.969 0.141 1
1 831 . 1 1 1 A 73 73 SER C C 73 175.122 173.964 1.158 1
1 832 . 1 1 1 A 73 73 SER CA C 73 57.487 58.458 -0.971 1
1 833 . 1 1 1 A 73 73 SER CB C 73 64.386 63.959 0.427 1
1 834 . 1 1 1 A 73 73 SER N N 73 123.640 123.833 -0.193 1
1 835 . 1 1 1 A 74 74 LEU H H 74 8.585 8.867 -0.282 1
1 836 . 1 1 1 A 74 74 LEU HA H 74 5.450 5.312 0.138 1
1 846 . 1 1 1 A 74 74 LEU C C 74 174.061 175.713 -1.652 1
1 847 . 1 1 1 A 74 74 LEU CA C 74 53.101 53.473 -0.372 1
1 848 . 1 1 1 A 74 74 LEU CB C 74 48.268 46.710 1.558 1
1 852 . 1 1 1 A 74 74 LEU N N 74 125.221 125.344 -0.123 1
1 853 . 1 1 1 A 75 75 SER H H 75 8.840 8.826 0.014 1
1 854 . 1 1 1 A 75 75 SER HA H 75 5.040 5.180 -0.140 1
1 857 . 1 1 1 A 75 75 SER C C 75 176.552 173.140 3.412 1
1 858 . 1 1 1 A 75 75 SER CA C 75 57.487 56.478 1.009 1
1 859 . 1 1 1 A 75 75 SER CB C 75 64.993 65.631 -0.638 1
1 860 . 1 1 1 A 75 75 SER N N 75 111.252 114.453 -3.201 1
1 861 . 1 1 1 A 76 76 ILE H H 76 7.790 8.893 -1.103 1
1 862 . 1 1 1 A 76 76 ILE HA H 76 4.690 4.553 0.137 1
1 872 . 1 1 1 A 76 76 ILE C C 76 175.780 177.239 -1.459 1
1 873 . 1 1 1 A 76 76 ILE CA C 76 63.631 62.020 1.611 1
1 874 . 1 1 1 A 76 76 ILE CB C 76 39.484 39.764 -0.280 1
1 878 . 1 1 1 A 76 76 ILE N N 76 129.205 126.184 3.021 1
1 879 . 1 1 1 A 77 77 ARG H H 77 8.115 8.449 -0.334 1
1 880 . 1 1 1 A 77 77 ARG HA H 77 3.760 3.842 -0.082 1
1 887 . 1 1 1 A 77 77 ARG C C 77 178.704 177.975 0.729 1
1 888 . 1 1 1 A 77 77 ARG CA C 77 58.933 58.470 0.463 1
1 889 . 1 1 1 A 77 77 ARG CB C 77 29.463 29.607 -0.144 1
1 892 . 1 1 1 A 77 77 ARG N N 77 123.257 121.979 1.278 1
1 893 . 1 1 1 A 78 78 ALA H H 78 8.304 7.678 0.626 1
1 894 . 1 1 1 A 78 78 ALA HA H 78 4.296 4.096 0.200 1
1 898 . 1 1 1 A 78 78 ALA C C 78 176.870 179.794 -2.924 1
1 899 . 1 1 1 A 78 78 ALA CA C 78 53.548 55.185 -1.637 1
1 900 . 1 1 1 A 78 78 ALA CB C 78 19.872 18.753 1.119 1
1 901 . 1 1 1 A 78 78 ALA N N 78 118.764 121.937 -3.173 1
1 902 . 1 1 1 A 79 79 THR H H 79 7.931 8.017 -0.086 1
1 903 . 1 1 1 A 79 79 THR HA H 79 4.370 4.032 0.338 1
1 908 . 1 1 1 A 79 79 THR C C 79 178.356 177.345 1.011 1
1 909 . 1 1 1 A 79 79 THR CA C 79 62.381 65.143 -2.762 1
1 910 . 1 1 1 A 79 79 THR CB C 79 69.693 68.787 0.906 1
1 912 . 1 1 1 A 79 79 THR N N 79 107.360 111.178 -3.818 1
1 913 . 1 1 1 A 80 80 GLN H H 80 7.651 8.449 -0.798 1
1 914 . 1 1 1 A 80 80 GLN HA H 80 4.527 4.035 0.492 1
1 921 . 1 1 1 A 80 80 GLN C C 80 174.249 178.350 -4.101 1
1 922 . 1 1 1 A 80 80 GLN CA C 80 54.760 59.011 -4.251 1
1 923 . 1 1 1 A 80 80 GLN CB C 80 30.565 28.095 2.470 1
1 925 . 1 1 1 A 80 80 GLN N N 80 121.588 121.010 0.578 1
1 927 . 1 1 1 A 81 81 ALA H H 81 8.498 7.300 1.198 1
1 928 . 1 1 1 A 81 81 ALA HA H 81 4.252 4.339 -0.087 1
1 932 . 1 1 1 A 81 81 ALA C C 81 175.693 178.015 -2.322 1
1 933 . 1 1 1 A 81 81 ALA CA C 81 52.345 54.124 -1.779 1
1 934 . 1 1 1 A 81 81 ALA CB C 81 19.062 18.885 0.177 1
1 935 . 1 1 1 A 81 81 ALA N N 81 126.423 121.326 5.097 1
1 936 . 1 1 1 A 82 82 ALA H H 82 8.324 7.419 0.905 1
1 937 . 1 1 1 A 82 82 ALA HA H 82 4.000 4.451 -0.451 1
1 941 . 1 1 1 A 82 82 ALA C C 82 177.065 176.152 0.913 1
1 942 . 1 1 1 A 82 82 ALA CA C 82 50.240 50.932 -0.692 1
1 943 . 1 1 1 A 82 82 ALA CB C 82 17.650 18.448 -0.798 1
1 944 . 1 1 1 A 82 82 ALA N N 82 125.114 120.634 4.480 1
1 945 . 1 1 1 A 83 83 PRO HA H 83 4.350 4.653 -0.303 1
1 952 . 1 1 1 A 83 83 PRO CA C 83 63.148 62.459 0.689 1
1 953 . 1 1 1 A 83 83 PRO CB C 83 32.054 33.085 -1.031 1
1 956 . 1 1 1 A 84 84 GLU H H 84 8.517 8.707 -0.190 1
1 957 . 1 1 1 A 84 84 GLU HA H 84 4.197 4.955 -0.758 1
1 962 . 1 1 1 A 84 84 GLU C C 84 176.948 174.450 2.498 1
1 963 . 1 1 1 A 84 84 GLU CA C 84 56.674 54.585 2.089 1
1 964 . 1 1 1 A 84 84 GLU CB C 84 30.459 33.231 -2.772 1
1 966 . 1 1 1 A 84 84 GLU N N 84 121.479 116.573 4.906 1
1 967 . 1 1 1 A 85 85 LYS H H 85 8.381 8.448 -0.067 1
1 968 . 1 1 1 A 85 85 LYS HA H 85 4.309 4.286 0.023 1
1 977 . 1 1 1 A 85 85 LYS C C 85 176.457 175.874 0.583 1
1 978 . 1 1 1 A 85 85 LYS CA C 85 56.272 56.950 -0.678 1
1 979 . 1 1 1 A 85 85 LYS CB C 85 32.961 32.691 0.270 1
1 983 . 1 1 1 A 85 85 LYS N N 85 123.266 121.727 1.539 1
1 984 . 1 1 1 A 86 86 LYS H H 86 8.403 8.728 -0.325 1
1 985 . 1 1 1 A 86 86 LYS HA H 86 4.308 4.476 -0.168 1
1 994 . 1 1 1 A 86 86 LYS C C 86 176.435 174.831 1.604 1
1 995 . 1 1 1 A 86 86 LYS CA C 86 56.272 55.847 0.425 1
1 996 . 1 1 1 A 86 86 LYS CB C 86 32.961 30.557 2.404 1
1 1000 . 1 1 1 A 86 86 LYS N N 86 123.688 127.418 -3.730 1
1 1001 . 1 1 1 A 87 87 GLU H H 87 8.540 7.905 0.635 1
1 1002 . 1 1 1 A 87 87 GLU HA H 87 4.358 4.983 -0.625 1
1 1007 . 1 1 1 A 87 87 GLU C C 87 176.556 174.787 1.769 1
1 1008 . 1 1 1 A 87 87 GLU CA C 87 56.406 54.973 1.433 1
1 1009 . 1 1 1 A 87 87 GLU CB C 87 30.607 33.547 -2.940 1
1 1011 . 1 1 1 A 87 87 GLU N N 87 122.633 123.397 -0.764 1
1 1012 . 1 1 1 A 88 88 SER H H 88 8.520 8.545 -0.025 1
1 1013 . 1 1 1 A 88 88 SER HA H 88 4.490 4.517 -0.027 1
1 1016 . 1 1 1 A 88 88 SER C C 88 175.780 174.407 1.373 1
1 1017 . 1 1 1 A 88 88 SER CA C 88 58.431 59.229 -0.798 1
1 1018 . 1 1 1 A 88 88 SER CB C 88 63.858 64.067 -0.209 1
1 1019 . 1 1 1 A 88 88 SER N N 88 118.333 119.520 -1.187 1
1 1020 . 1 1 1 A 89 89 LYS H H 89 8.339 8.412 -0.073 1
1 1021 . 1 1 1 A 89 89 LYS HA H 89 4.620 4.735 -0.115 1
1 1030 . 1 1 1 A 89 89 LYS C C 89 174.160 176.431 -2.271 1
1 1031 . 1 1 1 A 89 89 LYS CA C 89 54.265 53.249 1.016 1
1 1032 . 1 1 1 A 89 89 LYS CB C 89 32.672 34.042 -1.370 1
1 1036 . 1 1 1 A 89 89 LYS N N 89 124.433 124.141 0.292 1
1 1037 . 1 1 1 A 90 90 PRO HA H 90 4.417 4.340 0.077 1
1 1044 . 1 1 1 A 90 90 PRO CA C 90 63.064 65.719 -2.655 1
1 1045 . 1 1 1 A 90 90 PRO CB C 90 32.266 31.795 0.471 1
1 1048 . 1 1 1 A 91 91 ARG H H 91 8.502 8.281 0.221 1
1 1049 . 1 1 1 A 91 91 ARG HA H 91 4.305 4.468 -0.163 1
1 1056 . 1 1 1 A 91 91 ARG C C 91 176.831 177.150 -0.319 1
1 1057 . 1 1 1 A 91 91 ARG CA C 91 56.002 56.223 -0.221 1
1 1058 . 1 1 1 A 91 91 ARG CB C 91 30.913 30.925 -0.012 1
1 1061 . 1 1 1 A 91 91 ARG N N 91 122.193 117.131 5.062 1
1 1062 . 1 1 1 A 92 92 LYS H H 92 8.415 7.857 0.558 1
1 1063 . 1 1 1 A 92 92 LYS HA H 92 4.610 4.076 0.534 1
1 1072 . 1 1 1 A 92 92 LYS C C 92 176.262 175.882 0.380 1
1 1073 . 1 1 1 A 92 92 LYS CA C 92 54.258 61.341 -7.083 1
1 1074 . 1 1 1 A 92 92 LYS CB C 92 32.672 31.046 1.626 1
1 1078 . 1 1 1 A 92 92 LYS N N 92 124.243 120.983 3.260 1
1 1079 . 1 1 1 A 93 93 PRO HA H 93 4.415 4.385 0.030 1
1 1086 . 1 1 1 A 93 93 PRO CA C 93 62.899 64.876 -1.977 1
1 1087 . 1 1 1 A 93 93 PRO CB C 93 32.323 31.840 0.483 1
1 1090 . 1 1 1 A 94 94 LYS H H 94 8.420 8.078 0.342 1
1 1091 . 1 1 1 A 94 94 LYS HA H 94 4.290 4.028 0.262 1
1 1100 . 1 1 1 A 94 94 LYS C C 94 176.714 176.665 0.049 1
1 1101 . 1 1 1 A 94 94 LYS CA C 94 56.585 57.176 -0.591 1
1 1102 . 1 1 1 A 94 94 LYS CB C 94 33.161 30.788 2.373 1
1 1106 . 1 1 1 A 94 94 LYS N N 94 122.121 118.002 4.119 1
1 1107 . 1 1 1 A 95 95 ALA H H 95 8.348 7.823 0.525 1
1 1108 . 1 1 1 A 95 95 ALA HA H 95 4.250 4.031 0.219 1
1 1112 . 1 1 1 A 95 95 ALA C C 95 176.453 179.328 -2.875 1
1 1113 . 1 1 1 A 95 95 ALA CA C 95 52.471 54.590 -2.119 1
1 1114 . 1 1 1 A 95 95 ALA CB C 95 19.347 18.293 1.054 1
1 1115 . 1 1 1 A 95 95 ALA N N 95 125.624 121.646 3.978 1
1 1116 . 1 1 1 A 96 96 ALA H H 96 8.348 7.657 0.691 1
1 1117 . 1 1 1 A 96 96 ALA HA H 96 4.254 4.178 0.076 1
1 1121 . 1 1 1 A 96 96 ALA C C 96 176.462 178.098 -1.636 1
1 1122 . 1 1 1 A 96 96 ALA CA C 96 52.471 54.180 -1.709 1
1 1123 . 1 1 1 A 96 96 ALA CB C 96 19.347 18.538 0.809 1
1 1124 . 1 1 1 A 96 96 ALA N N 96 125.624 119.804 5.820 1
1 1125 . 1 1 1 A 97 97 GLN H H 97 8.333 8.008 0.325 1
1 1126 . 1 1 1 A 97 97 GLN HA H 97 4.362 4.395 -0.033 1
1 1133 . 1 1 1 A 97 97 GLN C C 97 177.684 176.498 1.186 1
1 1134 . 1 1 1 A 97 97 GLN CA C 97 55.848 56.653 -0.805 1
1 1135 . 1 1 1 A 97 97 GLN CB C 97 29.643 29.034 0.609 1
1 1137 . 1 1 1 A 97 97 GLN N N 97 120.049 117.707 2.342 1
1 1139 . 1 1 1 A 98 98 VAL H H 98 8.230 8.891 -0.661 1
1 1140 . 1 1 1 A 98 98 VAL HA H 98 4.145 4.503 -0.358 1
1 1148 . 1 1 1 A 98 98 VAL C C 98 176.033 175.346 0.687 1
1 1149 . 1 1 1 A 98 98 VAL CA C 98 62.444 61.055 1.389 1
1 1150 . 1 1 1 A 98 98 VAL CB C 98 32.942 33.565 -0.623 1
1 1153 . 1 1 1 A 98 98 VAL N N 98 121.607 118.875 2.732 1
1 1154 . 1 1 1 A 99 99 SER H H 99 8.375 7.653 0.722 1
1 1155 . 1 1 1 A 99 99 SER HA H 99 4.473 4.785 -0.312 1
1 1158 . 1 1 1 A 99 99 SER C C 99 176.204 172.544 3.660 1
1 1159 . 1 1 1 A 99 99 SER CA C 99 58.379 57.810 0.569 1
1 1160 . 1 1 1 A 99 99 SER CB C 99 63.914 66.943 -3.029 1
1 1161 . 1 1 1 A 99 99 SER N N 99 119.455 115.697 3.758 1
1 1162 . 1 1 1 A 100 100 GLU H H 100 8.547 8.700 -0.153 1
1 1163 . 1 1 1 A 100 100 GLU HA H 100 4.304 4.187 0.117 1
1 1168 . 1 1 1 A 100 100 GLU C C 100 174.620 178.255 -3.635 1
1 1169 . 1 1 1 A 100 100 GLU CA C 100 56.835 57.180 -0.345 1
1 1170 . 1 1 1 A 100 100 GLU CB C 100 30.365 31.154 -0.789 1
1 1172 . 1 1 1 A 100 100 GLU N N 100 123.419 123.869 -0.450 1
1 1173 . 1 1 1 A 101 101 GLU H H 101 8.432 8.973 -0.541 1
1 1174 . 1 1 1 A 101 101 GLU HA H 101 4.252 4.347 -0.095 1
1 1179 . 1 1 1 A 101 101 GLU C C 101 176.693 176.596 0.097 1
1 1180 . 1 1 1 A 101 101 GLU CA C 101 56.835 57.767 -0.932 1
1 1181 . 1 1 1 A 101 101 GLU CB C 101 30.365 29.945 0.420 1
1 1183 . 1 1 1 A 101 101 GLU N N 101 122.025 123.405 -1.380 1
1 1184 . 1 1 1 A 102 102 ALA H H 102 8.324 7.197 1.127 1
1 1185 . 1 1 1 A 102 102 ALA HA H 102 4.361 3.118 1.243 1
1 1189 . 1 1 1 A 102 102 ALA C C 102 177.065 177.443 -0.378 1
1 1190 . 1 1 1 A 102 102 ALA CA C 102 52.647 52.469 0.178 1
1 1191 . 1 1 1 A 102 102 ALA CB C 102 19.227 19.019 0.208 1
1 1192 . 1 1 1 A 102 102 ALA N N 102 125.114 123.625 1.489 1
1 1193 . 1 1 1 A 103 103 SER H H 103 8.259 8.397 -0.138 1
1 1194 . 1 1 1 A 103 103 SER HA H 103 4.473 4.343 0.130 1
1 1197 . 1 1 1 A 103 103 SER C C 103 177.772 174.485 3.287 1
1 1198 . 1 1 1 A 103 103 SER CA C 103 58.301 59.847 -1.546 1
1 1199 . 1 1 1 A 103 103 SER CB C 103 63.961 64.045 -0.084 1
1 1200 . 1 1 1 A 103 103 SER N N 103 115.109 116.805 -1.696 1
1 1201 . 1 1 1 A 104 104 THR H H 104 8.127 7.272 0.855 1
1 1202 . 1 1 1 A 104 104 THR HA H 104 4.600 4.909 -0.309 1
1 1207 . 1 1 1 A 104 104 THR C C 104 174.427 173.889 0.538 1
1 1208 . 1 1 1 A 104 104 THR CA C 104 59.954 58.905 1.049 1
1 1209 . 1 1 1 A 104 104 THR CB C 104 69.868 71.418 -1.550 1
1 1211 . 1 1 1 A 104 104 THR N N 104 117.882 110.790 7.092 1
1 1212 . 1 1 1 A 105 105 PRO HA H 105 4.414 4.545 -0.131 1
1 1219 . 1 1 1 A 105 105 PRO CA C 105 63.300 64.329 -1.029 1
1 1220 . 1 1 1 A 105 105 PRO CB C 105 32.227 32.014 0.213 1
1 1223 . 1 1 1 A 106 106 GLN H H 106 8.524 8.792 -0.268 1
1 1224 . 1 1 1 A 106 106 GLN HA H 106 4.276 4.216 0.060 1
1 1229 . 1 1 1 A 106 106 GLN C C 106 177.083 175.685 1.398 1
1 1230 . 1 1 1 A 106 106 GLN CA C 106 56.209 56.539 -0.330 1
1 1231 . 1 1 1 A 106 106 GLN CB C 106 29.490 29.190 0.300 1
1 1233 . 1 1 1 A 106 106 GLN N N 106 120.754 116.809 3.945 1
1 1234 . 1 1 1 A 107 107 GLY H H 107 8.394 7.312 1.082 1
1 1235 . 1 1 1 A 107 107 GLY HA2 H 107 3.895 4.108 -0.213 1
1 1236 . 1 1 1 A 107 107 GLY HA3 H 107 3.895 4.117 -0.222 1
1 1237 . 1 1 1 A 107 107 GLY C C 107 176.651 174.996 1.655 1
1 1238 . 1 1 1 A 107 107 GLY CA C 107 45.330 45.678 -0.348 1
1 1239 . 1 1 1 A 107 107 GLY N N 107 110.026 105.789 4.237 1
1 1240 . 1 1 1 A 108 108 PHE H H 108 8.099 8.661 -0.562 1
1 1241 . 1 1 1 A 108 108 PHE HA H 108 4.582 4.076 0.506 1
1 1245 . 1 1 1 A 108 108 PHE C C 108 173.944 174.759 -0.815 1
1 1246 . 1 1 1 A 108 108 PHE CA C 108 58.054 61.119 -3.065 1
1 1247 . 1 1 1 A 108 108 PHE CB C 108 39.708 39.525 0.183 1
1 1248 . 1 1 1 A 108 108 PHE N N 108 120.180 120.217 -0.037 1
1 1249 . 1 1 1 A 109 109 ASN H H 109 8.482 7.956 0.526 1
1 1250 . 1 1 1 A 109 109 ASN HA H 109 4.691 5.120 -0.429 1
1 1255 . 1 1 1 A 109 109 ASN C C 109 175.627 173.653 1.974 1
1 1256 . 1 1 1 A 109 109 ASN CA C 109 53.402 52.922 0.480 1
1 1257 . 1 1 1 A 109 109 ASN CB C 109 38.883 41.457 -2.574 1
1 1258 . 1 1 1 A 109 109 ASN N N 109 120.752 115.598 5.154 1
1 1260 . 1 1 1 A 110 110 THR H H 110 8.112 8.526 -0.414 1
1 1261 . 1 1 1 A 110 110 THR HA H 110 4.251 4.778 -0.527 1
1 1266 . 1 1 1 A 110 110 THR C C 110 175.275 173.669 1.606 1
1 1267 . 1 1 1 A 110 110 THR CA C 110 62.460 61.083 1.377 1
1 1268 . 1 1 1 A 110 110 THR CB C 110 69.726 69.846 -0.120 1
1 1270 . 1 1 1 A 110 110 THR N N 110 114.601 120.817 -6.216 1
1 1271 . 1 1 1 A 111 111 LEU H H 111 8.168 7.157 1.011 1
1 1272 . 1 1 1 A 111 111 LEU HA H 111 4.308 4.302 0.006 1
1 1282 . 1 1 1 A 111 111 LEU CA C 111 55.704 55.093 0.611 1
1 1283 . 1 1 1 A 111 111 LEU CB C 111 42.071 42.729 -0.658 1
1 1287 . 1 1 1 A 111 111 LEU N N 111 123.756 121.500 2.256 1
1 1288 . 1 1 1 A 112 112 LYS H H 112 8.123 8.548 -0.425 1
1 1289 . 1 1 1 A 112 112 LYS HA H 112 4.242 4.947 -0.705 1
1 1298 . 1 1 1 A 112 112 LYS C C 112 177.547 175.068 2.479 1
1 1299 . 1 1 1 A 112 112 LYS CA C 112 56.928 54.918 2.010 1
1 1300 . 1 1 1 A 112 112 LYS CB C 112 33.055 34.839 -1.784 1
1 1304 . 1 1 1 A 112 112 LYS N N 112 121.442 118.890 2.552 1
1 1305 . 1 1 1 A 113 113 ASP H H 113 8.230 8.714 -0.484 1
1 1306 . 1 1 1 A 113 113 ASP HA H 113 4.526 4.812 -0.286 1
1 1309 . 1 1 1 A 113 113 ASP C C 113 176.532 177.745 -1.213 1
1 1310 . 1 1 1 A 113 113 ASP CA C 113 54.896 55.378 -0.482 1
1 1311 . 1 1 1 A 113 113 ASP CB C 113 41.362 43.411 -2.049 1
1 1312 . 1 1 1 A 113 113 ASP N N 113 120.598 120.427 0.171 1
1 1313 . 1 1 1 A 114 114 LYS H H 114 8.127 8.296 -0.169 1
1 1314 . 1 1 1 A 114 114 LYS HA H 114 4.300 4.130 0.170 1
1 1323 . 1 1 1 A 114 114 LYS C C 114 176.303 176.848 -0.545 1
1 1324 . 1 1 1 A 114 114 LYS CA C 114 56.633 58.514 -1.881 1
1 1325 . 1 1 1 A 114 114 LYS CB C 114 32.818 32.407 0.411 1
1 1329 . 1 1 1 A 114 114 LYS N N 114 120.897 119.784 1.113 1
1 1330 . 1 1 1 A 115 115 LEU H H 115 8.244 7.899 0.345 1
1 1331 . 1 1 1 A 115 115 LEU HA H 115 4.254 4.593 -0.339 1
1 1341 . 1 1 1 A 115 115 LEU C C 115 176.909 175.681 1.228 1
1 1342 . 1 1 1 A 115 115 LEU CA C 115 56.282 53.642 2.640 1
1 1343 . 1 1 1 A 115 115 LEU CB C 115 42.188 42.972 -0.784 1
1 1347 . 1 1 1 A 115 115 LEU N N 115 123.251 121.362 1.889 1
1 1348 . 1 1 1 A 116 116 GLU H H 116 8.421 7.915 0.506 1
1 1349 . 1 1 1 A 116 116 GLU HA H 116 4.190 4.368 -0.178 1
1 1352 . 1 1 1 A 116 116 GLU C C 116 177.828 175.461 2.367 1
1 1353 . 1 1 1 A 116 116 GLU CA C 116 57.466 55.544 1.922 1
1 1354 . 1 1 1 A 116 116 GLU CB C 116 30.124 27.930 2.194 1
1 1355 . 1 1 1 A 116 116 GLU N N 116 120.575 123.696 -3.121 1
1 1356 . 1 1 1 A 117 117 GLU H H 117 8.255 8.750 -0.495 1
1 1357 . 1 1 1 A 117 117 GLU HA H 117 4.192 4.449 -0.257 1
1 1362 . 1 1 1 A 117 117 GLU CA C 117 57.491 55.656 1.835 1
1 1363 . 1 1 1 A 117 117 GLU CB C 117 30.365 32.976 -2.611 1
1 1365 . 1 1 1 A 117 117 GLU N N 117 120.933 124.446 -3.513 1
1 1366 . 1 1 1 A 118 118 TRP H H 118 8.143 8.374 -0.231 1
1 1367 . 1 1 1 A 118 118 TRP HA H 118 4.581 4.515 0.066 1
1 1372 . 1 1 1 A 118 118 TRP C C 118 176.794 175.804 0.990 1
1 1373 . 1 1 1 A 118 118 TRP CA C 118 58.363 59.379 -1.016 1
1 1374 . 1 1 1 A 118 118 TRP CB C 118 29.333 28.154 1.179 1
1 1375 . 1 1 1 A 118 118 TRP N N 118 121.592 122.211 -0.619 1
1 1376 . 1 1 1 A 119 119 ILE H H 119 7.908 8.732 -0.824 1
1 1377 . 1 1 1 A 119 119 ILE HA H 119 3.828 4.433 -0.605 1
1 1387 . 1 1 1 A 119 119 ILE C C 119 176.984 176.828 0.156 1
1 1388 . 1 1 1 A 119 119 ILE CA C 119 62.335 62.153 0.182 1
1 1389 . 1 1 1 A 119 119 ILE CB C 119 38.649 41.475 -2.826 1
1 1393 . 1 1 1 A 119 119 ILE N N 119 122.744 121.494 1.250 1
1 1394 . 1 1 1 A 120 120 GLU H H 120 8.143 8.494 -0.351 1
1 1395 . 1 1 1 A 120 120 GLU HA H 120 4.093 4.566 -0.473 1
1 1400 . 1 1 1 A 120 120 GLU C C 120 176.565 175.027 1.538 1
1 1401 . 1 1 1 A 120 120 GLU CA C 120 57.613 55.939 1.674 1
1 1402 . 1 1 1 A 120 120 GLU CB C 120 29.834 31.202 -1.368 1
1 1404 . 1 1 1 A 120 120 GLU N N 120 123.139 119.216 3.923 1
1 1405 . 1 1 1 A 121 121 MET H H 121 8.254 7.836 0.418 1
1 1406 . 1 1 1 A 121 121 MET HA H 121 4.357 5.108 -0.751 1
1 1411 . 1 1 1 A 121 121 MET CA C 121 56.625 53.993 2.632 1
1 1412 . 1 1 1 A 121 121 MET CB C 121 32.664 38.617 -5.953 1
1 1414 . 1 1 1 A 121 121 MET N N 121 120.449 119.359 1.090 1
1 1415 . 1 1 1 A 122 122 SER H H 122 8.199 8.505 -0.306 1
1 1416 . 1 1 1 A 122 122 SER HA H 122 4.280 4.781 -0.501 1
1 1419 . 1 1 1 A 122 122 SER C C 122 177.224 172.471 4.753 1
1 1420 . 1 1 1 A 122 122 SER CA C 122 59.635 57.571 2.064 1
1 1421 . 1 1 1 A 122 122 SER CB C 122 63.560 67.265 -3.705 1
1 1422 . 1 1 1 A 122 122 SER N N 122 115.857 115.286 0.571 1
1 1423 . 1 1 1 A 123 123 ASN H H 123 8.211 8.606 -0.395 1
1 1424 . 1 1 1 A 123 123 ASN HA H 123 4.737 4.656 0.081 1
1 1429 . 1 1 1 A 123 123 ASN C C 123 174.709 175.918 -1.209 1
1 1430 . 1 1 1 A 123 123 ASN CA C 123 53.507 53.362 0.145 1
1 1431 . 1 1 1 A 123 123 ASN CB C 123 38.800 39.561 -0.761 1
1 1432 . 1 1 1 A 123 123 ASN N N 123 119.923 122.263 -2.340 1
1 1434 . 1 1 1 A 124 124 ARG H H 124 7.997 8.457 -0.460 1
1 1435 . 1 1 1 A 124 124 ARG HA H 124 4.305 4.305 0.000 1
1 1442 . 1 1 1 A 124 124 ARG C C 124 175.477 176.021 -0.544 1
1 1443 . 1 1 1 A 124 124 ARG CA C 124 56.709 56.317 0.392 1
1 1444 . 1 1 1 A 124 124 ARG CB C 124 30.584 30.982 -0.398 1
1 1447 . 1 1 1 A 124 124 ARG N N 124 120.821 123.638 -2.817 1
1 1448 . 1 1 1 A 125 125 LYS H H 125 8.327 7.793 0.534 1
1 1449 . 1 1 1 A 125 125 LYS HA H 125 4.254 4.046 0.208 1
1 1458 . 1 1 1 A 125 125 LYS C C 125 176.777 177.612 -0.835 1
1 1459 . 1 1 1 A 125 125 LYS CA C 125 56.860 56.827 0.033 1
1 1460 . 1 1 1 A 125 125 LYS CB C 125 32.879 33.387 -0.508 1
1 1464 . 1 1 1 A 125 125 LYS N N 125 121.891 122.216 -0.325 1
1 1465 . 1 1 1 A 126 126 ASP H H 126 8.343 9.184 -0.841 1
1 1466 . 1 1 1 A 126 126 ASP HA H 126 4.581 4.301 0.280 1
1 1469 . 1 1 1 A 126 126 ASP C C 126 176.538 177.312 -0.774 1
1 1470 . 1 1 1 A 126 126 ASP CA C 126 54.540 57.049 -2.509 1
1 1471 . 1 1 1 A 126 126 ASP CB C 126 40.907 40.405 0.502 1
1 1472 . 1 1 1 A 126 126 ASP N N 126 119.814 128.246 -8.432 1
1 1473 . 1 1 1 A 127 127 LEU H H 127 7.946 8.003 -0.057 1
1 1474 . 1 1 1 A 127 127 LEU HA H 127 4.309 4.062 0.247 1
1 1484 . 1 1 1 A 127 127 LEU C C 127 176.043 178.362 -2.319 1
1 1485 . 1 1 1 A 127 127 LEU CA C 127 55.427 57.226 -1.799 1
1 1486 . 1 1 1 A 127 127 LEU CB C 127 42.394 42.026 0.368 1
1 1490 . 1 1 1 A 127 127 LEU N N 127 121.432 120.053 1.379 1
1 1491 . 1 1 1 A 128 128 ILE H H 128 7.967 8.031 -0.064 1
1 1492 . 1 1 1 A 128 128 ILE HA H 128 4.141 3.848 0.293 1
1 1502 . 1 1 1 A 128 128 ILE C C 128 177.200 177.221 -0.021 1
1 1503 . 1 1 1 A 128 128 ILE CA C 128 61.150 63.504 -2.354 1
1 1504 . 1 1 1 A 128 128 ILE CB C 128 38.489 37.755 0.734 1
1 1508 . 1 1 1 A 128 128 ILE N N 128 121.579 118.439 3.140 1
1 1509 . 1 1 1 A 129 129 LYS H H 129 8.331 7.640 0.691 1
1 1510 . 1 1 1 A 129 129 LYS HA H 129 4.328 4.196 0.132 1
1 1519 . 1 1 1 A 129 129 LYS C C 129 175.952 175.896 0.056 1
1 1520 . 1 1 1 A 129 129 LYS CA C 129 56.330 56.426 -0.096 1
1 1521 . 1 1 1 A 129 129 LYS CB C 129 33.010 33.069 -0.059 1
1 1525 . 1 1 1 A 129 129 LYS N N 129 126.955 122.300 4.655 1
1 1 . 2 1 1 A 2 2 ALA HA H 2 4.070 4.442 -0.372 1
1 5 . 2 1 1 A 2 2 ALA CA C 2 52.067 52.265 -0.198 1
1 6 . 2 1 1 A 2 2 ALA CB C 2 19.577 19.245 0.332 1
1 7 . 2 1 1 A 3 3 ALA H H 3 8.714 8.941 -0.227 1
1 8 . 2 1 1 A 3 3 ALA HA H 3 4.253 4.132 0.121 1
1 12 . 2 1 1 A 3 3 ALA C C 3 173.672 177.988 -4.316 1
1 13 . 2 1 1 A 3 3 ALA CA C 3 52.067 52.873 -0.806 1
1 14 . 2 1 1 A 3 3 ALA CB C 3 19.577 19.654 -0.077 1
1 15 . 2 1 1 A 3 3 ALA N N 3 124.480 124.546 -0.066 1
1 16 . 2 1 1 A 4 4 LYS H H 4 8.227 7.992 0.235 1
1 17 . 2 1 1 A 4 4 LYS HA H 4 3.976 3.839 0.137 1
1 26 . 2 1 1 A 4 4 LYS C C 4 176.672 174.594 2.078 1
1 27 . 2 1 1 A 4 4 LYS CA C 4 57.274 57.285 -0.011 1
1 28 . 2 1 1 A 4 4 LYS CB C 4 33.209 29.885 3.324 1
1 32 . 2 1 1 A 4 4 LYS N N 4 120.988 116.196 4.792 1
1 33 . 2 1 1 A 5 5 PHE H H 5 7.719 7.794 -0.075 1
1 34 . 2 1 1 A 5 5 PHE HA H 5 4.384 5.219 -0.835 1
1 38 . 2 1 1 A 5 5 PHE C C 5 175.364 174.350 1.014 1
1 39 . 2 1 1 A 5 5 PHE CA C 5 57.074 56.529 0.545 1
1 40 . 2 1 1 A 5 5 PHE CB C 5 39.669 43.921 -4.252 1
1 41 . 2 1 1 A 5 5 PHE N N 5 119.246 119.130 0.116 1
1 42 . 2 1 1 A 6 6 GLU H H 6 8.515 8.981 -0.466 1
1 43 . 2 1 1 A 6 6 GLU HA H 6 4.370 4.995 -0.625 1
1 48 . 2 1 1 A 6 6 GLU CA C 6 55.669 54.788 0.881 1
1 49 . 2 1 1 A 6 6 GLU CB C 6 32.094 33.783 -1.689 1
1 51 . 2 1 1 A 6 6 GLU N N 6 122.193 118.868 3.325 1
1 52 . 2 1 1 A 7 7 VAL H H 7 8.636 8.505 0.131 1
1 53 . 2 1 1 A 7 7 VAL HA H 7 3.406 3.958 -0.552 1
1 61 . 2 1 1 A 7 7 VAL C C 7 176.611 176.342 0.269 1
1 62 . 2 1 1 A 7 7 VAL CA C 7 65.358 63.254 2.104 1
1 63 . 2 1 1 A 7 7 VAL CB C 7 31.391 31.508 -0.117 1
1 66 . 2 1 1 A 7 7 VAL N N 7 122.949 122.282 0.667 1
1 67 . 2 1 1 A 8 8 GLY H H 8 9.394 9.162 0.232 1
1 68 . 2 1 1 A 8 8 GLY HA2 H 8 3.600 4.031 -0.431 1
1 69 . 2 1 1 A 8 8 GLY HA3 H 8 4.546 4.033 0.513 1
1 70 . 2 1 1 A 8 8 GLY C C 8 178.074 174.159 3.915 1
1 71 . 2 1 1 A 8 8 GLY CA C 8 45.121 44.921 0.200 1
1 72 . 2 1 1 A 8 8 GLY N N 8 116.837 115.119 1.718 1
1 73 . 2 1 1 A 9 9 SER H H 9 8.021 7.839 0.182 1
1 74 . 2 1 1 A 9 9 SER HA H 9 4.680 4.472 0.208 1
1 77 . 2 1 1 A 9 9 SER C C 9 174.234 173.266 0.968 1
1 78 . 2 1 1 A 9 9 SER CA C 9 59.387 59.394 -0.007 1
1 79 . 2 1 1 A 9 9 SER CB C 9 65.584 64.642 0.942 1
1 80 . 2 1 1 A 9 9 SER N N 9 118.208 117.689 0.519 1
1 81 . 2 1 1 A 10 10 VAL H H 10 7.945 8.239 -0.294 1
1 82 . 2 1 1 A 10 10 VAL HA H 10 4.980 5.025 -0.045 1
1 90 . 2 1 1 A 10 10 VAL C C 10 171.388 173.091 -1.703 1
1 91 . 2 1 1 A 10 10 VAL CA C 10 61.021 60.062 0.959 1
1 92 . 2 1 1 A 10 10 VAL CB C 10 33.400 34.910 -1.510 1
1 95 . 2 1 1 A 10 10 VAL N N 10 121.118 121.630 -0.512 1
1 96 . 2 1 1 A 11 11 TYR H H 11 9.008 9.172 -0.164 1
1 97 . 2 1 1 A 11 11 TYR HA H 11 4.850 5.339 -0.489 1
1 101 . 2 1 1 A 11 11 TYR C C 11 174.926 174.682 0.244 1
1 102 . 2 1 1 A 11 11 TYR CA C 11 56.803 56.293 0.510 1
1 103 . 2 1 1 A 11 11 TYR CB C 11 43.676 43.868 -0.192 1
1 104 . 2 1 1 A 11 11 TYR N N 11 125.043 125.881 -0.838 1
1 105 . 2 1 1 A 12 12 THR H H 12 8.809 8.679 0.130 1
1 106 . 2 1 1 A 12 12 THR HA H 12 5.020 5.394 -0.374 1
1 111 . 2 1 1 A 12 12 THR C C 12 174.195 174.562 -0.367 1
1 112 . 2 1 1 A 12 12 THR CA C 12 62.487 59.752 2.735 1
1 113 . 2 1 1 A 12 12 THR CB C 12 69.743 71.900 -2.157 1
1 115 . 2 1 1 A 12 12 THR N N 12 116.850 115.280 1.570 1
1 116 . 2 1 1 A 13 13 GLY H H 13 9.179 8.606 0.573 1
1 117 . 2 1 1 A 13 13 GLY HA2 H 13 3.250 4.342 -1.092 1
1 118 . 2 1 1 A 13 13 GLY HA3 H 13 4.801 4.363 0.438 1
1 119 . 2 1 1 A 13 13 GLY C C 13 174.654 172.042 2.612 1
1 120 . 2 1 1 A 13 13 GLY CA C 13 44.377 45.364 -0.987 1
1 121 . 2 1 1 A 13 13 GLY N N 13 113.654 111.366 2.288 1
1 122 . 2 1 1 A 14 14 LYS H H 14 7.770 8.700 -0.930 1
1 123 . 2 1 1 A 14 14 LYS HA H 14 5.426 5.201 0.225 1
1 132 . 2 1 1 A 14 14 LYS C C 14 171.343 175.659 -4.316 1
1 133 . 2 1 1 A 14 14 LYS CA C 14 53.879 54.869 -0.990 1
1 134 . 2 1 1 A 14 14 LYS CB C 14 36.032 35.944 0.088 1
1 138 . 2 1 1 A 14 14 LYS N N 14 118.322 120.684 -2.362 1
1 139 . 2 1 1 A 15 15 VAL H H 15 9.206 9.217 -0.011 1
1 140 . 2 1 1 A 15 15 VAL HA H 15 4.400 4.248 0.152 1
1 148 . 2 1 1 A 15 15 VAL C C 15 176.306 177.185 -0.879 1
1 149 . 2 1 1 A 15 15 VAL CA C 15 63.648 63.476 0.172 1
1 150 . 2 1 1 A 15 15 VAL CB C 15 31.769 31.737 0.032 1
1 153 . 2 1 1 A 15 15 VAL N N 15 125.308 127.256 -1.948 1
1 154 . 2 1 1 A 16 16 THR H H 16 9.403 9.354 0.049 1
1 155 . 2 1 1 A 16 16 THR HA H 16 4.562 4.696 -0.134 1
1 160 . 2 1 1 A 16 16 THR C C 16 178.098 174.667 3.431 1
1 161 . 2 1 1 A 16 16 THR CA C 16 62.018 61.497 0.521 1
1 162 . 2 1 1 A 16 16 THR CB C 16 69.720 69.896 -0.176 1
1 164 . 2 1 1 A 16 16 THR N N 16 121.753 117.686 4.067 1
1 165 . 2 1 1 A 17 17 GLY H H 17 7.600 7.075 0.525 1
1 166 . 2 1 1 A 17 17 GLY HA2 H 17 4.110 4.125 -0.015 1
1 167 . 2 1 1 A 17 17 GLY HA3 H 17 4.250 4.233 0.017 1
1 168 . 2 1 1 A 17 17 GLY C C 17 175.551 171.413 4.138 1
1 169 . 2 1 1 A 17 17 GLY CA C 17 46.258 45.504 0.754 1
1 170 . 2 1 1 A 17 17 GLY N N 17 109.407 108.737 0.670 1
1 171 . 2 1 1 A 18 18 LEU H H 18 8.820 8.470 0.350 1
1 172 . 2 1 1 A 18 18 LEU HA H 18 4.852 5.048 -0.196 1
1 182 . 2 1 1 A 18 18 LEU CA C 18 54.245 53.168 1.077 1
1 183 . 2 1 1 A 18 18 LEU CB C 18 44.906 46.134 -1.228 1
1 187 . 2 1 1 A 18 18 LEU N N 18 123.419 121.267 2.152 1
1 188 . 2 1 1 A 19 19 GLN H H 19 8.537 8.194 0.343 1
1 189 . 2 1 1 A 19 19 GLN HA H 19 4.520 4.739 -0.219 1
1 196 . 2 1 1 A 19 19 GLN C C 19 175.258 175.773 -0.515 1
1 197 . 2 1 1 A 19 19 GLN CA C 19 53.269 53.922 -0.653 1
1 198 . 2 1 1 A 19 19 GLN CB C 19 31.522 32.642 -1.120 1
1 200 . 2 1 1 A 19 19 GLN N N 19 120.187 121.418 -1.231 1
1 202 . 2 1 1 A 20 20 ALA H H 20 8.798 8.682 0.116 1
1 203 . 2 1 1 A 20 20 ALA HA H 20 4.010 4.119 -0.109 1
1 207 . 2 1 1 A 20 20 ALA C C 20 175.698 177.235 -1.537 1
1 208 . 2 1 1 A 20 20 ALA CA C 20 55.084 54.127 0.957 1
1 209 . 2 1 1 A 20 20 ALA CB C 20 18.277 18.594 -0.317 1
1 210 . 2 1 1 A 20 20 ALA N N 20 120.606 123.952 -3.346 1
1 211 . 2 1 1 A 21 21 TYR H H 21 6.618 7.743 -1.125 1
1 212 . 2 1 1 A 21 21 TYR HA H 21 4.540 4.814 -0.274 1
1 216 . 2 1 1 A 21 21 TYR C C 21 178.437 175.002 3.435 1
1 217 . 2 1 1 A 21 21 TYR CA C 21 55.120 56.804 -1.684 1
1 218 . 2 1 1 A 21 21 TYR CB C 21 37.891 40.468 -2.577 1
1 219 . 2 1 1 A 21 21 TYR N N 21 105.570 113.403 -7.833 1
1 220 . 2 1 1 A 22 22 GLY H H 22 7.203 6.986 0.217 1
1 221 . 2 1 1 A 22 22 GLY HA2 H 22 3.460 3.677 -0.217 1
1 222 . 2 1 1 A 22 22 GLY HA3 H 22 4.360 3.896 0.464 1
1 223 . 2 1 1 A 22 22 GLY C C 22 175.833 171.058 4.775 1
1 224 . 2 1 1 A 22 22 GLY CA C 22 46.356 45.247 1.109 1
1 225 . 2 1 1 A 22 22 GLY N N 22 109.854 108.478 1.376 1
1 226 . 2 1 1 A 23 23 ALA H H 23 8.549 8.496 0.053 1
1 227 . 2 1 1 A 23 23 ALA HA H 23 4.981 5.135 -0.154 1
1 231 . 2 1 1 A 23 23 ALA C C 23 168.810 175.594 -6.784 1
1 232 . 2 1 1 A 23 23 ALA CA C 23 49.178 50.537 -1.359 1
1 233 . 2 1 1 A 23 23 ALA CB C 23 22.797 22.210 0.587 1
1 234 . 2 1 1 A 23 23 ALA N N 23 118.749 122.054 -3.305 1
1 235 . 2 1 1 A 24 24 PHE H H 24 8.812 8.580 0.232 1
1 236 . 2 1 1 A 24 24 PHE HA H 24 5.125 4.911 0.214 1
1 240 . 2 1 1 A 24 24 PHE CA C 24 58.017 57.808 0.209 1
1 241 . 2 1 1 A 24 24 PHE CB C 24 40.475 40.547 -0.072 1
1 242 . 2 1 1 A 24 24 PHE N N 24 122.891 121.045 1.846 1
1 243 . 2 1 1 A 25 25 VAL H H 25 8.880 9.001 -0.121 1
1 244 . 2 1 1 A 25 25 VAL HA H 25 4.660 4.536 0.124 1
1 252 . 2 1 1 A 25 25 VAL CA C 25 60.379 61.094 -0.715 1
1 253 . 2 1 1 A 25 25 VAL CB C 25 35.654 34.985 0.669 1
1 256 . 2 1 1 A 25 25 VAL N N 25 122.908 121.145 1.763 1
1 257 . 2 1 1 A 26 26 ALA H H 26 9.403 8.766 0.637 1
1 258 . 2 1 1 A 26 26 ALA HA H 26 4.750 4.376 0.374 1
1 262 . 2 1 1 A 26 26 ALA C C 26 174.445 176.840 -2.395 1
1 263 . 2 1 1 A 26 26 ALA CA C 26 51.711 52.650 -0.939 1
1 264 . 2 1 1 A 26 26 ALA CB C 26 19.319 19.055 0.264 1
1 265 . 2 1 1 A 26 26 ALA N N 26 129.425 130.704 -1.279 1
1 266 . 2 1 1 A 27 27 LEU H H 27 8.601 9.255 -0.654 1
1 267 . 2 1 1 A 27 27 LEU HA H 27 4.158 4.593 -0.435 1
1 277 . 2 1 1 A 27 27 LEU C C 27 177.814 176.341 1.473 1
1 278 . 2 1 1 A 27 27 LEU CA C 27 55.869 55.723 0.146 1
1 279 . 2 1 1 A 27 27 LEU CB C 27 42.251 43.613 -1.362 1
1 283 . 2 1 1 A 27 27 LEU N N 27 127.169 122.430 4.739 1
1 284 . 2 1 1 A 28 28 ASP H H 28 8.172 7.936 0.236 1
1 285 . 2 1 1 A 28 28 ASP HA H 28 4.420 4.823 -0.403 1
1 288 . 2 1 1 A 28 28 ASP C C 28 177.116 175.359 1.757 1
1 289 . 2 1 1 A 28 28 ASP CA C 28 53.755 53.462 0.293 1
1 290 . 2 1 1 A 28 28 ASP CB C 28 39.833 43.551 -3.718 1
1 291 . 2 1 1 A 28 28 ASP N N 28 115.657 117.405 -1.748 1
1 292 . 2 1 1 A 29 29 GLU H H 29 8.857 8.575 0.282 1
1 293 . 2 1 1 A 29 29 GLU HA H 29 4.090 4.116 -0.026 1
1 298 . 2 1 1 A 29 29 GLU C C 29 175.965 177.001 -1.036 1
1 299 . 2 1 1 A 29 29 GLU CA C 29 59.470 58.925 0.545 1
1 300 . 2 1 1 A 29 29 GLU CB C 29 29.409 29.278 0.131 1
1 302 . 2 1 1 A 29 29 GLU N N 29 114.738 121.865 -7.127 1
1 303 . 2 1 1 A 30 30 GLU H H 30 8.326 8.176 0.150 1
1 304 . 2 1 1 A 30 30 GLU HA H 30 4.640 4.556 0.084 1
1 309 . 2 1 1 A 30 30 GLU C C 30 176.817 175.896 0.921 1
1 310 . 2 1 1 A 30 30 GLU CA C 30 56.073 55.848 0.225 1
1 311 . 2 1 1 A 30 30 GLU CB C 30 32.453 30.923 1.530 1
1 313 . 2 1 1 A 30 30 GLU N N 30 115.753 114.708 1.045 1
1 314 . 2 1 1 A 31 31 THR H H 31 7.819 7.543 0.276 1
1 315 . 2 1 1 A 31 31 THR HA H 31 4.484 5.161 -0.677 1
1 320 . 2 1 1 A 31 31 THR C C 31 176.330 173.059 3.271 1
1 321 . 2 1 1 A 31 31 THR CA C 31 63.398 61.125 2.273 1
1 322 . 2 1 1 A 31 31 THR CB C 31 69.367 72.787 -3.420 1
1 324 . 2 1 1 A 31 31 THR N N 31 118.750 115.723 3.027 1
1 325 . 2 1 1 A 32 32 GLN H H 32 8.913 8.726 0.187 1
1 326 . 2 1 1 A 32 32 GLN HA H 32 5.337 4.719 0.618 1
1 333 . 2 1 1 A 32 32 GLN C C 32 173.087 174.518 -1.431 1
1 334 . 2 1 1 A 32 32 GLN CA C 32 54.051 55.186 -1.135 1
1 335 . 2 1 1 A 32 32 GLN CB C 32 32.672 33.033 -0.361 1
1 337 . 2 1 1 A 32 32 GLN N N 32 127.294 124.998 2.296 1
1 339 . 2 1 1 A 33 33 GLY H H 33 8.900 8.451 0.449 1
1 340 . 2 1 1 A 33 33 GLY HA2 H 33 3.290 4.371 -1.081 1
1 341 . 2 1 1 A 33 33 GLY HA3 H 33 4.530 4.431 0.099 1
1 342 . 2 1 1 A 33 33 GLY C C 33 174.918 172.276 2.642 1
1 343 . 2 1 1 A 33 33 GLY CA C 33 44.534 45.166 -0.632 1
1 344 . 2 1 1 A 33 33 GLY N N 33 107.639 110.554 -2.915 1
1 345 . 2 1 1 A 34 34 LEU H H 34 8.127 8.605 -0.478 1
1 346 . 2 1 1 A 34 34 LEU HA H 34 4.950 4.957 -0.007 1
1 356 . 2 1 1 A 34 34 LEU CA C 34 53.755 54.036 -0.281 1
1 357 . 2 1 1 A 34 34 LEU CB C 34 45.493 44.632 0.861 1
1 361 . 2 1 1 A 34 34 LEU N N 34 120.897 121.669 -0.772 1
1 362 . 2 1 1 A 35 35 VAL H H 35 9.386 8.625 0.761 1
1 363 . 2 1 1 A 35 35 VAL HA H 35 4.479 4.559 -0.080 1
1 371 . 2 1 1 A 35 35 VAL C C 35 176.402 175.851 0.551 1
1 372 . 2 1 1 A 35 35 VAL CA C 35 59.594 62.551 -2.957 1
1 373 . 2 1 1 A 35 35 VAL CB C 35 32.590 32.129 0.461 1
1 376 . 2 1 1 A 35 35 VAL N N 35 128.897 126.884 2.013 1
1 377 . 2 1 1 A 36 36 HIS H H 36 9.194 9.029 0.165 1
1 378 . 2 1 1 A 36 36 HIS HA H 36 4.487 4.555 -0.068 1
1 381 . 2 1 1 A 36 36 HIS C C 36 174.864 176.656 -1.792 1
1 382 . 2 1 1 A 36 36 HIS CA C 36 59.426 56.539 2.887 1
1 383 . 2 1 1 A 36 36 HIS CB C 36 31.542 30.604 0.938 1
1 384 . 2 1 1 A 36 36 HIS N N 36 127.751 127.077 0.674 1
1 385 . 2 1 1 A 37 37 ILE H H 37 7.454 8.970 -1.516 1
1 386 . 2 1 1 A 37 37 ILE HA H 37 3.810 3.692 0.118 1
1 396 . 2 1 1 A 37 37 ILE C C 37 176.948 177.942 -0.994 1
1 397 . 2 1 1 A 37 37 ILE CA C 37 63.773 64.920 -1.147 1
1 398 . 2 1 1 A 37 37 ILE CB C 37 38.993 37.473 1.520 1
1 402 . 2 1 1 A 37 37 ILE N N 37 126.266 125.650 0.616 1
1 403 . 2 1 1 A 38 38 SER H H 38 8.343 8.258 0.085 1
1 404 . 2 1 1 A 38 38 SER HA H 38 4.370 4.272 0.098 1
1 407 . 2 1 1 A 38 38 SER C C 38 174.792 175.047 -0.255 1
1 408 . 2 1 1 A 38 38 SER CA C 38 60.567 60.790 -0.223 1
1 409 . 2 1 1 A 38 38 SER CB C 38 63.632 62.901 0.731 1
1 410 . 2 1 1 A 38 38 SER N N 38 118.079 118.514 -0.435 1
1 411 . 2 1 1 A 39 39 GLU H H 39 8.536 8.054 0.482 1
1 412 . 2 1 1 A 39 39 GLU HA H 39 4.503 4.577 -0.074 1
1 417 . 2 1 1 A 39 39 GLU C C 39 175.131 176.969 -1.838 1
1 418 . 2 1 1 A 39 39 GLU CA C 39 54.928 56.228 -1.300 1
1 419 . 2 1 1 A 39 39 GLU CB C 39 29.621 30.778 -1.157 1
1 421 . 2 1 1 A 39 39 GLU N N 39 118.349 118.532 -0.183 1
1 422 . 2 1 1 A 40 40 VAL H H 40 7.776 7.693 0.083 1
1 423 . 2 1 1 A 40 40 VAL HA H 40 3.616 3.874 -0.258 1
1 431 . 2 1 1 A 40 40 VAL C C 40 177.277 176.244 1.033 1
1 432 . 2 1 1 A 40 40 VAL CA C 40 66.245 64.374 1.871 1
1 433 . 2 1 1 A 40 40 VAL CB C 40 32.590 32.047 0.543 1
1 436 . 2 1 1 A 40 40 VAL N N 40 125.443 117.773 7.670 1
1 437 . 2 1 1 A 41 41 THR H H 41 7.888 7.689 0.199 1
1 438 . 2 1 1 A 41 41 THR HA H 41 4.345 4.883 -0.538 1
1 443 . 2 1 1 A 41 41 THR C C 41 173.492 174.292 -0.800 1
1 444 . 2 1 1 A 41 41 THR CA C 41 59.047 61.348 -2.301 1
1 445 . 2 1 1 A 41 41 THR CB C 41 68.992 72.752 -3.760 1
1 447 . 2 1 1 A 41 41 THR N N 41 109.905 112.803 -2.898 1
1 448 . 2 1 1 A 42 42 HIS H H 42 8.063 7.904 0.159 1
1 449 . 2 1 1 A 42 42 HIS HA H 42 4.510 4.575 -0.065 1
1 452 . 2 1 1 A 42 42 HIS C C 42 172.139 174.786 -2.647 1
1 453 . 2 1 1 A 42 42 HIS CA C 42 57.735 55.051 2.684 1
1 454 . 2 1 1 A 42 42 HIS CB C 42 31.144 29.079 2.065 1
1 455 . 2 1 1 A 42 42 HIS N N 42 121.760 121.655 0.105 1
1 456 . 2 1 1 A 43 43 GLY H H 43 8.286 7.431 0.855 1
1 457 . 2 1 1 A 43 43 GLY HA2 H 43 3.980 3.892 0.088 1
1 458 . 2 1 1 A 43 43 GLY HA3 H 43 3.980 4.028 -0.048 1
1 459 . 2 1 1 A 43 43 GLY C C 43 176.307 171.667 4.640 1
1 460 . 2 1 1 A 43 43 GLY CA C 43 44.336 45.746 -1.410 1
1 461 . 2 1 1 A 43 43 GLY N N 43 110.133 107.734 2.399 1
1 462 . 2 1 1 A 44 44 PHE H H 44 8.327 8.385 -0.058 1
1 463 . 2 1 1 A 44 44 PHE HA H 44 4.489 4.465 0.024 1
1 467 . 2 1 1 A 44 44 PHE C C 44 171.877 175.955 -4.078 1
1 468 . 2 1 1 A 44 44 PHE CA C 44 58.027 58.362 -0.335 1
1 469 . 2 1 1 A 44 44 PHE CB C 44 39.850 39.788 0.062 1
1 470 . 2 1 1 A 44 44 PHE N N 44 120.049 119.903 0.146 1
1 471 . 2 1 1 A 45 45 VAL H H 45 7.939 8.627 -0.688 1
1 472 . 2 1 1 A 45 45 VAL HA H 45 3.865 3.731 0.134 1
1 480 . 2 1 1 A 45 45 VAL C C 45 175.523 175.816 -0.293 1
1 481 . 2 1 1 A 45 45 VAL CA C 45 61.536 61.068 0.468 1
1 482 . 2 1 1 A 45 45 VAL CB C 45 33.127 33.072 0.055 1
1 485 . 2 1 1 A 45 45 VAL N N 45 127.882 120.572 7.310 1
1 486 . 2 1 1 A 46 46 LYS H H 46 8.868 8.844 0.024 1
1 487 . 2 1 1 A 46 46 LYS HA H 46 4.170 4.039 0.131 1
1 496 . 2 1 1 A 46 46 LYS C C 46 175.728 176.275 -0.547 1
1 497 . 2 1 1 A 46 46 LYS CA C 46 57.198 59.068 -1.870 1
1 498 . 2 1 1 A 46 46 LYS CB C 46 33.299 32.795 0.504 1
1 502 . 2 1 1 A 46 46 LYS N N 46 127.308 127.890 -0.582 1
1 503 . 2 1 1 A 47 47 ASP H H 47 7.652 8.015 -0.363 1
1 504 . 2 1 1 A 47 47 ASP HA H 47 4.710 4.984 -0.274 1
1 507 . 2 1 1 A 47 47 ASP C C 47 176.411 176.205 0.206 1
1 508 . 2 1 1 A 47 47 ASP CA C 47 53.390 53.840 -0.450 1
1 509 . 2 1 1 A 47 47 ASP CB C 47 42.635 44.052 -1.417 1
1 510 . 2 1 1 A 47 47 ASP N N 47 117.932 115.875 2.057 1
1 511 . 2 1 1 A 48 48 ILE H H 48 9.230 8.655 0.575 1
1 512 . 2 1 1 A 48 48 ILE HA H 48 3.579 3.986 -0.407 1
1 522 . 2 1 1 A 48 48 ILE C C 48 177.249 177.585 -0.336 1
1 523 . 2 1 1 A 48 48 ILE CA C 48 65.525 63.644 1.881 1
1 524 . 2 1 1 A 48 48 ILE CB C 48 38.797 37.802 0.995 1
1 528 . 2 1 1 A 48 48 ILE N N 48 129.049 125.358 3.691 1
1 529 . 2 1 1 A 49 49 ASN H H 49 8.468 9.104 -0.636 1
1 530 . 2 1 1 A 49 49 ASN HA H 49 4.690 4.652 0.038 1
1 535 . 2 1 1 A 49 49 ASN C C 49 175.779 176.512 -0.733 1
1 536 . 2 1 1 A 49 49 ASN CA C 49 55.587 55.081 0.506 1
1 537 . 2 1 1 A 49 49 ASN CB C 49 38.587 36.875 1.712 1
1 538 . 2 1 1 A 49 49 ASN N N 49 118.835 117.657 1.178 1
1 540 . 2 1 1 A 50 50 GLU H H 50 7.853 7.840 0.013 1
1 541 . 2 1 1 A 50 50 GLU HA H 50 4.040 4.096 -0.056 1
1 546 . 2 1 1 A 50 50 GLU C C 50 176.148 177.103 -0.955 1
1 547 . 2 1 1 A 50 50 GLU CA C 50 57.404 57.474 -0.070 1
1 548 . 2 1 1 A 50 50 GLU CB C 50 29.491 29.486 0.005 1
1 550 . 2 1 1 A 50 50 GLU N N 50 116.358 118.169 -1.811 1
1 551 . 2 1 1 A 51 51 HIS H H 51 7.575 7.886 -0.311 1
1 552 . 2 1 1 A 51 51 HIS HA H 51 4.431 4.712 -0.281 1
1 555 . 2 1 1 A 51 51 HIS C C 51 176.383 174.710 1.673 1
1 556 . 2 1 1 A 51 51 HIS CA C 51 57.089 56.412 0.677 1
1 557 . 2 1 1 A 51 51 HIS CB C 51 33.168 31.822 1.346 1
1 558 . 2 1 1 A 51 51 HIS N N 51 115.828 115.193 0.635 1
1 559 . 2 1 1 A 52 52 LEU H H 52 7.640 7.603 0.037 1
1 560 . 2 1 1 A 52 52 LEU HA H 52 4.796 4.655 0.141 1
1 570 . 2 1 1 A 52 52 LEU C C 52 174.452 174.279 0.173 1
1 571 . 2 1 1 A 52 52 LEU CA C 52 53.398 53.672 -0.274 1
1 572 . 2 1 1 A 52 52 LEU CB C 52 48.805 44.384 4.421 1
1 576 . 2 1 1 A 52 52 LEU N N 52 117.932 119.800 -1.868 1
1 577 . 2 1 1 A 53 53 SER H H 53 8.151 8.670 -0.519 1
1 578 . 2 1 1 A 53 53 SER HA H 53 4.680 4.934 -0.254 1
1 581 . 2 1 1 A 53 53 SER C C 53 174.304 172.995 1.309 1
1 582 . 2 1 1 A 53 53 SER CA C 53 56.714 57.605 -0.891 1
1 583 . 2 1 1 A 53 53 SER CB C 53 65.431 66.345 -0.914 1
1 584 . 2 1 1 A 53 53 SER N N 53 113.496 117.387 -3.891 1
1 585 . 2 1 1 A 54 54 VAL H H 54 8.782 8.556 0.226 1
1 586 . 2 1 1 A 54 54 VAL HA H 54 3.230 3.789 -0.559 1
1 594 . 2 1 1 A 54 54 VAL C C 54 173.745 177.225 -3.480 1
1 595 . 2 1 1 A 54 54 VAL CA C 54 66.232 63.621 2.611 1
1 596 . 2 1 1 A 54 54 VAL CB C 54 31.067 31.651 -0.584 1
1 599 . 2 1 1 A 54 54 VAL N N 54 124.401 126.183 -1.782 1
1 600 . 2 1 1 A 55 55 GLY H H 55 9.079 8.840 0.239 1
1 601 . 2 1 1 A 55 55 GLY HA2 H 55 3.530 3.851 -0.321 1
1 602 . 2 1 1 A 55 55 GLY HA3 H 55 4.553 3.853 0.700 1
1 603 . 2 1 1 A 55 55 GLY C C 55 177.219 173.226 3.993 1
1 604 . 2 1 1 A 55 55 GLY CA C 55 44.647 46.293 -1.646 1
1 605 . 2 1 1 A 55 55 GLY N N 55 117.320 116.021 1.299 1
1 606 . 2 1 1 A 56 56 ASP H H 56 7.943 7.752 0.191 1
1 607 . 2 1 1 A 56 56 ASP HA H 56 4.460 5.147 -0.687 1
1 610 . 2 1 1 A 56 56 ASP C C 56 176.055 173.728 2.327 1
1 611 . 2 1 1 A 56 56 ASP CA C 56 55.456 52.475 2.981 1
1 612 . 2 1 1 A 56 56 ASP CB C 56 40.914 44.848 -3.934 1
1 613 . 2 1 1 A 56 56 ASP N N 56 121.782 119.684 2.098 1
1 614 . 2 1 1 A 57 57 GLU H H 57 8.649 8.907 -0.258 1
1 615 . 2 1 1 A 57 57 GLU HA H 57 5.100 5.211 -0.111 1
1 620 . 2 1 1 A 57 57 GLU C C 57 175.635 175.535 0.100 1
1 621 . 2 1 1 A 57 57 GLU CA C 57 55.805 54.959 0.846 1
1 622 . 2 1 1 A 57 57 GLU CB C 57 30.915 32.611 -1.696 1
1 624 . 2 1 1 A 57 57 GLU N N 57 122.513 123.692 -1.179 1
1 625 . 2 1 1 A 58 58 VAL H H 58 8.809 9.037 -0.228 1
1 626 . 2 1 1 A 58 58 VAL HA H 58 4.817 4.850 -0.033 1
1 634 . 2 1 1 A 58 58 VAL C C 58 176.528 174.210 2.318 1
1 635 . 2 1 1 A 58 58 VAL CA C 58 58.719 59.061 -0.342 1
1 636 . 2 1 1 A 58 58 VAL CB C 58 35.523 35.816 -0.293 1
1 639 . 2 1 1 A 58 58 VAL N N 58 118.382 120.350 -1.968 1
1 640 . 2 1 1 A 59 59 GLN H H 59 8.255 8.384 -0.129 1
1 641 . 2 1 1 A 59 59 GLN HA H 59 5.030 5.004 0.026 1
1 646 . 2 1 1 A 59 59 GLN CA C 59 54.843 55.971 -1.128 1
1 647 . 2 1 1 A 59 59 GLN CB C 59 30.111 29.681 0.430 1
1 649 . 2 1 1 A 59 59 GLN N N 59 120.933 122.261 -1.328 1
1 650 . 2 1 1 A 60 60 VAL H H 60 8.970 9.238 -0.268 1
1 651 . 2 1 1 A 60 60 VAL HA H 60 4.990 4.834 0.156 1
1 659 . 2 1 1 A 60 60 VAL C C 60 175.203 174.034 1.169 1
1 660 . 2 1 1 A 60 60 VAL CA C 60 57.404 59.640 -2.236 1
1 661 . 2 1 1 A 60 60 VAL CB C 60 35.771 35.284 0.487 1
1 664 . 2 1 1 A 60 60 VAL N N 60 111.046 118.523 -7.477 1
1 665 . 2 1 1 A 61 61 LYS H H 61 8.937 8.504 0.433 1
1 666 . 2 1 1 A 61 61 LYS HA H 61 5.100 4.646 0.454 1
1 675 . 2 1 1 A 61 61 LYS C C 61 173.610 176.530 -2.920 1
1 676 . 2 1 1 A 61 61 LYS CA C 61 53.762 55.620 -1.858 1
1 677 . 2 1 1 A 61 61 LYS CB C 61 36.273 33.626 2.647 1
1 681 . 2 1 1 A 61 61 LYS N N 61 121.930 124.843 -2.913 1
1 682 . 2 1 1 A 62 62 VAL H H 62 8.429 9.256 -0.827 1
1 683 . 2 1 1 A 62 62 VAL HA H 62 4.074 4.039 0.035 1
1 691 . 2 1 1 A 62 62 VAL C C 62 176.912 175.960 0.952 1
1 692 . 2 1 1 A 62 62 VAL CA C 62 63.188 63.515 -0.327 1
1 693 . 2 1 1 A 62 62 VAL CB C 62 30.813 31.233 -0.420 1
1 696 . 2 1 1 A 62 62 VAL N N 62 126.329 127.134 -0.805 1
1 697 . 2 1 1 A 63 63 LEU H H 63 9.109 9.101 0.008 1
1 698 . 2 1 1 A 63 63 LEU HA H 63 4.423 4.458 -0.035 1
1 708 . 2 1 1 A 63 63 LEU C C 63 176.091 176.137 -0.046 1
1 709 . 2 1 1 A 63 63 LEU CA C 63 55.876 56.390 -0.514 1
1 710 . 2 1 1 A 63 63 LEU CB C 63 42.800 43.609 -0.809 1
1 714 . 2 1 1 A 63 63 LEU N N 63 129.436 129.908 -0.472 1
1 715 . 2 1 1 A 64 64 ALA H H 64 7.594 7.398 0.196 1
1 716 . 2 1 1 A 64 64 ALA HA H 64 4.455 4.739 -0.284 1
1 720 . 2 1 1 A 64 64 ALA C C 64 177.314 175.238 2.076 1
1 721 . 2 1 1 A 64 64 ALA CA C 64 52.557 51.653 0.904 1
1 722 . 2 1 1 A 64 64 ALA CB C 64 21.458 22.695 -1.237 1
1 723 . 2 1 1 A 64 64 ALA N N 64 117.791 118.574 -0.783 1
1 724 . 2 1 1 A 65 65 VAL H H 65 8.583 8.624 -0.041 1
1 725 . 2 1 1 A 65 65 VAL HA H 65 4.470 4.839 -0.369 1
1 733 . 2 1 1 A 65 65 VAL C C 65 174.697 174.437 0.260 1
1 734 . 2 1 1 A 65 65 VAL CA C 65 61.936 60.805 1.131 1
1 735 . 2 1 1 A 65 65 VAL CB C 65 35.288 35.965 -0.677 1
1 738 . 2 1 1 A 65 65 VAL N N 65 120.009 119.860 0.149 1
1 739 . 2 1 1 A 66 66 ASP H H 66 8.567 8.965 -0.398 1
1 740 . 2 1 1 A 66 66 ASP HA H 66 4.880 5.023 -0.143 1
1 743 . 2 1 1 A 66 66 ASP C C 66 174.355 175.603 -1.248 1
1 744 . 2 1 1 A 66 66 ASP CA C 66 52.681 53.358 -0.677 1
1 745 . 2 1 1 A 66 66 ASP CB C 66 41.775 42.518 -0.743 1
1 746 . 2 1 1 A 66 66 ASP N N 66 126.262 125.164 1.098 1
1 747 . 2 1 1 A 67 67 GLU H H 67 9.148 8.959 0.189 1
1 748 . 2 1 1 A 67 67 GLU HA H 67 4.110 4.261 -0.151 1
1 753 . 2 1 1 A 67 67 GLU C C 67 177.052 178.556 -1.504 1
1 754 . 2 1 1 A 67 67 GLU CA C 67 59.044 58.322 0.722 1
1 755 . 2 1 1 A 67 67 GLU CB C 67 29.919 29.556 0.363 1
1 757 . 2 1 1 A 67 67 GLU N N 67 125.480 124.898 0.582 1
1 758 . 2 1 1 A 68 68 GLU H H 68 8.384 8.014 0.370 1
1 759 . 2 1 1 A 68 68 GLU HA H 68 4.140 4.197 -0.057 1
1 764 . 2 1 1 A 68 68 GLU C C 68 178.383 179.156 -0.773 1
1 765 . 2 1 1 A 68 68 GLU CA C 68 59.044 59.047 -0.003 1
1 766 . 2 1 1 A 68 68 GLU CB C 68 29.919 29.911 0.008 1
1 768 . 2 1 1 A 68 68 GLU N N 68 119.760 120.266 -0.506 1
1 769 . 2 1 1 A 69 69 LYS H H 69 7.799 8.033 -0.234 1
1 770 . 2 1 1 A 69 69 LYS HA H 69 4.375 4.130 0.245 1
1 779 . 2 1 1 A 69 69 LYS C C 69 178.297 177.458 0.839 1
1 780 . 2 1 1 A 69 69 LYS CA C 69 55.704 56.718 -1.014 1
1 781 . 2 1 1 A 69 69 LYS CB C 69 33.622 32.623 0.999 1
1 785 . 2 1 1 A 69 69 LYS N N 69 115.476 116.963 -1.487 1
1 786 . 2 1 1 A 70 70 GLY H H 70 7.994 8.297 -0.303 1
1 787 . 2 1 1 A 70 70 GLY HA2 H 70 3.940 3.965 -0.025 1
1 788 . 2 1 1 A 70 70 GLY HA3 H 70 3.960 3.971 -0.011 1
1 789 . 2 1 1 A 70 70 GLY C C 70 177.215 174.119 3.096 1
1 790 . 2 1 1 A 70 70 GLY CA C 70 46.773 46.673 0.100 1
1 791 . 2 1 1 A 70 70 GLY N N 70 110.245 108.134 2.111 1
1 792 . 2 1 1 A 71 71 LYS H H 71 7.560 8.041 -0.481 1
1 793 . 2 1 1 A 71 71 LYS HA H 71 4.690 4.972 -0.282 1
1 802 . 2 1 1 A 71 71 LYS C C 71 174.607 175.148 -0.541 1
1 803 . 2 1 1 A 71 71 LYS CA C 71 55.332 54.463 0.869 1
1 804 . 2 1 1 A 71 71 LYS CB C 71 34.903 36.250 -1.347 1
1 808 . 2 1 1 A 71 71 LYS N N 71 118.201 118.735 -0.534 1
1 809 . 2 1 1 A 72 72 ILE H H 72 8.867 8.761 0.106 1
1 810 . 2 1 1 A 72 72 ILE HA H 72 4.630 4.976 -0.346 1
1 820 . 2 1 1 A 72 72 ILE C C 72 175.708 174.709 0.999 1
1 821 . 2 1 1 A 72 72 ILE CA C 72 61.494 60.182 1.312 1
1 822 . 2 1 1 A 72 72 ILE CB C 72 40.652 41.989 -1.337 1
1 826 . 2 1 1 A 72 72 ILE N N 72 126.827 121.757 5.070 1
1 827 . 2 1 1 A 73 73 SER H H 73 8.815 9.088 -0.273 1
1 828 . 2 1 1 A 73 73 SER HA H 73 5.110 5.457 -0.347 1
1 831 . 2 1 1 A 73 73 SER C C 73 175.122 173.067 2.055 1
1 832 . 2 1 1 A 73 73 SER CA C 73 57.487 57.489 -0.002 1
1 833 . 2 1 1 A 73 73 SER CB C 73 64.386 65.608 -1.222 1
1 834 . 2 1 1 A 73 73 SER N N 73 123.640 124.798 -1.158 1
1 835 . 2 1 1 A 74 74 LEU H H 74 8.585 8.766 -0.181 1
1 836 . 2 1 1 A 74 74 LEU HA H 74 5.450 5.308 0.142 1
1 846 . 2 1 1 A 74 74 LEU C C 74 174.061 175.552 -1.491 1
1 847 . 2 1 1 A 74 74 LEU CA C 74 53.101 53.496 -0.395 1
1 848 . 2 1 1 A 74 74 LEU CB C 74 48.268 46.685 1.583 1
1 852 . 2 1 1 A 74 74 LEU N N 74 125.221 124.293 0.928 1
1 853 . 2 1 1 A 75 75 SER H H 75 8.840 8.691 0.149 1
1 854 . 2 1 1 A 75 75 SER HA H 75 5.040 5.314 -0.274 1
1 857 . 2 1 1 A 75 75 SER C C 75 176.552 174.022 2.530 1
1 858 . 2 1 1 A 75 75 SER CA C 75 57.487 56.275 1.212 1
1 859 . 2 1 1 A 75 75 SER CB C 75 64.993 66.020 -1.027 1
1 860 . 2 1 1 A 75 75 SER N N 75 111.252 113.152 -1.900 1
1 861 . 2 1 1 A 76 76 ILE H H 76 7.790 8.813 -1.023 1
1 862 . 2 1 1 A 76 76 ILE HA H 76 4.690 4.509 0.181 1
1 872 . 2 1 1 A 76 76 ILE C C 76 175.780 177.081 -1.301 1
1 873 . 2 1 1 A 76 76 ILE CA C 76 63.631 61.561 2.070 1
1 874 . 2 1 1 A 76 76 ILE CB C 76 39.484 39.257 0.227 1
1 878 . 2 1 1 A 76 76 ILE N N 76 129.205 121.099 8.106 1
1 879 . 2 1 1 A 77 77 ARG H H 77 8.115 8.528 -0.413 1
1 880 . 2 1 1 A 77 77 ARG HA H 77 3.760 4.046 -0.286 1
1 887 . 2 1 1 A 77 77 ARG C C 77 178.704 178.002 0.702 1
1 888 . 2 1 1 A 77 77 ARG CA C 77 58.933 58.529 0.404 1
1 889 . 2 1 1 A 77 77 ARG CB C 77 29.463 29.852 -0.389 1
1 892 . 2 1 1 A 77 77 ARG N N 77 123.257 122.057 1.200 1
1 893 . 2 1 1 A 78 78 ALA H H 78 8.304 7.735 0.569 1
1 894 . 2 1 1 A 78 78 ALA HA H 78 4.296 4.142 0.154 1
1 898 . 2 1 1 A 78 78 ALA C C 78 176.870 178.645 -1.775 1
1 899 . 2 1 1 A 78 78 ALA CA C 78 53.548 54.617 -1.069 1
1 900 . 2 1 1 A 78 78 ALA CB C 78 19.872 18.251 1.621 1
1 901 . 2 1 1 A 78 78 ALA N N 78 118.764 122.125 -3.361 1
1 902 . 2 1 1 A 79 79 THR H H 79 7.931 7.651 0.280 1
1 903 . 2 1 1 A 79 79 THR HA H 79 4.370 4.539 -0.169 1
1 908 . 2 1 1 A 79 79 THR C C 79 178.356 174.965 3.391 1
1 909 . 2 1 1 A 79 79 THR CA C 79 62.381 62.057 0.324 1
1 910 . 2 1 1 A 79 79 THR CB C 79 69.693 70.264 -0.571 1
1 912 . 2 1 1 A 79 79 THR N N 79 107.360 104.820 2.540 1
1 913 . 2 1 1 A 80 80 GLN H H 80 7.651 7.706 -0.055 1
1 914 . 2 1 1 A 80 80 GLN HA H 80 4.527 4.426 0.101 1
1 921 . 2 1 1 A 80 80 GLN C C 80 174.249 176.218 -1.969 1
1 922 . 2 1 1 A 80 80 GLN CA C 80 54.760 55.842 -1.082 1
1 923 . 2 1 1 A 80 80 GLN CB C 80 30.565 29.485 1.080 1
1 925 . 2 1 1 A 80 80 GLN N N 80 121.588 122.909 -1.321 1
1 927 . 2 1 1 A 81 81 ALA H H 81 8.498 8.747 -0.249 1
1 928 . 2 1 1 A 81 81 ALA HA H 81 4.252 3.886 0.366 1
1 932 . 2 1 1 A 81 81 ALA C C 81 175.693 176.147 -0.454 1
1 933 . 2 1 1 A 81 81 ALA CA C 81 52.345 53.117 -0.772 1
1 934 . 2 1 1 A 81 81 ALA CB C 81 19.062 17.957 1.105 1
1 935 . 2 1 1 A 81 81 ALA N N 81 126.423 121.529 4.894 1
1 936 . 2 1 1 A 82 82 ALA H H 82 8.324 7.554 0.770 1
1 937 . 2 1 1 A 82 82 ALA HA H 82 4.000 4.825 -0.825 1
1 941 . 2 1 1 A 82 82 ALA C C 82 177.065 174.462 2.603 1
1 942 . 2 1 1 A 82 82 ALA CA C 82 50.240 50.225 0.015 1
1 943 . 2 1 1 A 82 82 ALA CB C 82 17.650 22.012 -4.362 1
1 944 . 2 1 1 A 82 82 ALA N N 82 125.114 116.933 8.181 1
1 945 . 2 1 1 A 83 83 PRO HA H 83 4.350 4.778 -0.428 1
1 952 . 2 1 1 A 83 83 PRO CA C 83 63.148 62.843 0.305 1
1 953 . 2 1 1 A 83 83 PRO CB C 83 32.054 32.765 -0.711 1
1 956 . 2 1 1 A 84 84 GLU H H 84 8.517 8.787 -0.270 1
1 957 . 2 1 1 A 84 84 GLU HA H 84 4.197 4.773 -0.576 1
1 962 . 2 1 1 A 84 84 GLU C C 84 176.948 176.407 0.541 1
1 963 . 2 1 1 A 84 84 GLU CA C 84 56.674 54.806 1.868 1
1 964 . 2 1 1 A 84 84 GLU CB C 84 30.459 31.469 -1.010 1
1 966 . 2 1 1 A 84 84 GLU N N 84 121.479 122.242 -0.763 1
1 967 . 2 1 1 A 85 85 LYS H H 85 8.381 8.718 -0.337 1
1 968 . 2 1 1 A 85 85 LYS HA H 85 4.309 3.832 0.477 1
1 977 . 2 1 1 A 85 85 LYS C C 85 176.457 178.447 -1.990 1
1 978 . 2 1 1 A 85 85 LYS CA C 85 56.272 59.194 -2.922 1
1 979 . 2 1 1 A 85 85 LYS CB C 85 32.961 32.308 0.653 1
1 983 . 2 1 1 A 85 85 LYS N N 85 123.266 127.245 -3.979 1
1 984 . 2 1 1 A 86 86 LYS H H 86 8.403 8.339 0.064 1
1 985 . 2 1 1 A 86 86 LYS HA H 86 4.308 4.178 0.130 1
1 994 . 2 1 1 A 86 86 LYS C C 86 176.435 177.146 -0.711 1
1 995 . 2 1 1 A 86 86 LYS CA C 86 56.272 58.264 -1.992 1
1 996 . 2 1 1 A 86 86 LYS CB C 86 32.961 31.797 1.164 1
1 1000 . 2 1 1 A 86 86 LYS N N 86 123.688 117.381 6.307 1
1 1001 . 2 1 1 A 87 87 GLU H H 87 8.540 7.981 0.559 1
1 1002 . 2 1 1 A 87 87 GLU HA H 87 4.358 4.401 -0.043 1
1 1007 . 2 1 1 A 87 87 GLU C C 87 176.556 176.197 0.359 1
1 1008 . 2 1 1 A 87 87 GLU CA C 87 56.406 56.711 -0.305 1
1 1009 . 2 1 1 A 87 87 GLU CB C 87 30.607 30.290 0.317 1
1 1011 . 2 1 1 A 87 87 GLU N N 87 122.633 121.731 0.902 1
1 1012 . 2 1 1 A 88 88 SER H H 88 8.520 8.805 -0.285 1
1 1013 . 2 1 1 A 88 88 SER HA H 88 4.490 4.732 -0.242 1
1 1016 . 2 1 1 A 88 88 SER C C 88 175.780 172.941 2.839 1
1 1017 . 2 1 1 A 88 88 SER CA C 88 58.431 57.993 0.438 1
1 1018 . 2 1 1 A 88 88 SER CB C 88 63.858 64.707 -0.849 1
1 1019 . 2 1 1 A 88 88 SER N N 88 118.333 116.458 1.875 1
1 1020 . 2 1 1 A 89 89 LYS H H 89 8.339 7.574 0.765 1
1 1021 . 2 1 1 A 89 89 LYS HA H 89 4.620 4.787 -0.167 1
1 1030 . 2 1 1 A 89 89 LYS C C 89 174.160 173.945 0.215 1
1 1031 . 2 1 1 A 89 89 LYS CA C 89 54.265 53.101 1.164 1
1 1032 . 2 1 1 A 89 89 LYS CB C 89 32.672 35.097 -2.425 1
1 1036 . 2 1 1 A 89 89 LYS N N 89 124.433 119.398 5.035 1
1 1037 . 2 1 1 A 90 90 PRO HA H 90 4.417 4.487 -0.070 1
1 1044 . 2 1 1 A 90 90 PRO CA C 90 63.064 63.165 -0.101 1
1 1045 . 2 1 1 A 90 90 PRO CB C 90 32.266 32.746 -0.480 1
1 1048 . 2 1 1 A 91 91 ARG H H 91 8.502 9.273 -0.771 1
1 1049 . 2 1 1 A 91 91 ARG HA H 91 4.305 4.631 -0.326 1
1 1056 . 2 1 1 A 91 91 ARG C C 91 176.831 174.722 2.109 1
1 1057 . 2 1 1 A 91 91 ARG CA C 91 56.002 55.356 0.646 1
1 1058 . 2 1 1 A 91 91 ARG CB C 91 30.913 33.021 -2.108 1
1 1061 . 2 1 1 A 91 91 ARG N N 91 122.193 125.046 -2.853 1
1 1062 . 2 1 1 A 92 92 LYS H H 92 8.415 8.494 -0.079 1
1 1063 . 2 1 1 A 92 92 LYS HA H 92 4.610 4.319 0.291 1
1 1072 . 2 1 1 A 92 92 LYS C C 92 176.262 177.022 -0.760 1
1 1073 . 2 1 1 A 92 92 LYS CA C 92 54.258 54.963 -0.705 1
1 1074 . 2 1 1 A 92 92 LYS CB C 92 32.672 31.893 0.779 1
1 1078 . 2 1 1 A 92 92 LYS N N 92 124.243 125.680 -1.437 1
1 1079 . 2 1 1 A 93 93 PRO HA H 93 4.415 4.212 0.203 1
1 1086 . 2 1 1 A 93 93 PRO CA C 93 62.899 65.782 -2.883 1
1 1087 . 2 1 1 A 93 93 PRO CB C 93 32.323 31.869 0.454 1
1 1090 . 2 1 1 A 94 94 LYS H H 94 8.420 8.709 -0.289 1
1 1091 . 2 1 1 A 94 94 LYS HA H 94 4.290 4.167 0.123 1
1 1100 . 2 1 1 A 94 94 LYS C C 94 176.714 177.213 -0.499 1
1 1101 . 2 1 1 A 94 94 LYS CA C 94 56.585 58.438 -1.853 1
1 1102 . 2 1 1 A 94 94 LYS CB C 94 33.161 32.003 1.158 1
1 1106 . 2 1 1 A 94 94 LYS N N 94 122.121 117.601 4.520 1
1 1107 . 2 1 1 A 95 95 ALA H H 95 8.348 8.309 0.039 1
1 1108 . 2 1 1 A 95 95 ALA HA H 95 4.250 4.582 -0.332 1
1 1112 . 2 1 1 A 95 95 ALA C C 95 176.453 177.178 -0.725 1
1 1113 . 2 1 1 A 95 95 ALA CA C 95 52.471 51.173 1.298 1
1 1114 . 2 1 1 A 95 95 ALA CB C 95 19.347 20.230 -0.883 1
1 1115 . 2 1 1 A 95 95 ALA N N 95 125.624 120.949 4.675 1
1 1116 . 2 1 1 A 96 96 ALA H H 96 8.348 7.960 0.388 1
1 1117 . 2 1 1 A 96 96 ALA HA H 96 4.254 4.505 -0.251 1
1 1121 . 2 1 1 A 96 96 ALA C C 96 176.462 176.773 -0.311 1
1 1122 . 2 1 1 A 96 96 ALA CA C 96 52.471 51.138 1.333 1
1 1123 . 2 1 1 A 96 96 ALA CB C 96 19.347 19.846 -0.499 1
1 1124 . 2 1 1 A 96 96 ALA N N 96 125.624 121.991 3.633 1
1 1125 . 2 1 1 A 97 97 GLN H H 97 8.333 7.752 0.581 1
1 1126 . 2 1 1 A 97 97 GLN HA H 97 4.362 4.349 0.013 1
1 1133 . 2 1 1 A 97 97 GLN C C 97 177.684 176.463 1.221 1
1 1134 . 2 1 1 A 97 97 GLN CA C 97 55.848 56.681 -0.833 1
1 1135 . 2 1 1 A 97 97 GLN CB C 97 29.643 29.448 0.195 1
1 1137 . 2 1 1 A 97 97 GLN N N 97 120.049 117.970 2.079 1
1 1139 . 2 1 1 A 98 98 VAL H H 98 8.230 8.687 -0.457 1
1 1140 . 2 1 1 A 98 98 VAL HA H 98 4.145 4.468 -0.323 1
1 1148 . 2 1 1 A 98 98 VAL C C 98 176.033 176.357 -0.324 1
1 1149 . 2 1 1 A 98 98 VAL CA C 98 62.444 61.271 1.173 1
1 1150 . 2 1 1 A 98 98 VAL CB C 98 32.942 33.322 -0.380 1
1 1153 . 2 1 1 A 98 98 VAL N N 98 121.607 118.472 3.135 1
1 1154 . 2 1 1 A 99 99 SER H H 99 8.375 7.726 0.649 1
1 1155 . 2 1 1 A 99 99 SER HA H 99 4.473 4.386 0.087 1
1 1158 . 2 1 1 A 99 99 SER C C 99 176.204 174.127 2.077 1
1 1159 . 2 1 1 A 99 99 SER CA C 99 58.379 59.337 -0.958 1
1 1160 . 2 1 1 A 99 99 SER CB C 99 63.914 63.977 -0.063 1
1 1161 . 2 1 1 A 99 99 SER N N 99 119.455 120.606 -1.151 1
1 1162 . 2 1 1 A 100 100 GLU H H 100 8.547 8.661 -0.114 1
1 1163 . 2 1 1 A 100 100 GLU HA H 100 4.304 5.125 -0.821 1
1 1168 . 2 1 1 A 100 100 GLU C C 100 174.620 174.025 0.595 1
1 1169 . 2 1 1 A 100 100 GLU CA C 100 56.835 54.876 1.959 1
1 1170 . 2 1 1 A 100 100 GLU CB C 100 30.365 33.912 -3.547 1
1 1172 . 2 1 1 A 100 100 GLU N N 100 123.419 120.181 3.238 1
1 1173 . 2 1 1 A 101 101 GLU H H 101 8.432 8.663 -0.231 1
1 1174 . 2 1 1 A 101 101 GLU HA H 101 4.252 4.950 -0.698 1
1 1179 . 2 1 1 A 101 101 GLU C C 101 176.693 174.712 1.981 1
1 1180 . 2 1 1 A 101 101 GLU CA C 101 56.835 55.389 1.446 1
1 1181 . 2 1 1 A 101 101 GLU CB C 101 30.365 33.743 -3.378 1
1 1183 . 2 1 1 A 101 101 GLU N N 101 122.025 120.309 1.716 1
1 1184 . 2 1 1 A 102 102 ALA H H 102 8.324 8.347 -0.023 1
1 1185 . 2 1 1 A 102 102 ALA HA H 102 4.361 4.636 -0.275 1
1 1189 . 2 1 1 A 102 102 ALA C C 102 177.065 176.680 0.385 1
1 1190 . 2 1 1 A 102 102 ALA CA C 102 52.647 51.181 1.466 1
1 1191 . 2 1 1 A 102 102 ALA CB C 102 19.227 23.376 -4.149 1
1 1192 . 2 1 1 A 102 102 ALA N N 102 125.114 125.676 -0.562 1
1 1193 . 2 1 1 A 103 103 SER H H 103 8.259 8.495 -0.236 1
1 1194 . 2 1 1 A 103 103 SER HA H 103 4.473 4.600 -0.127 1
1 1197 . 2 1 1 A 103 103 SER C C 103 177.772 174.027 3.745 1
1 1198 . 2 1 1 A 103 103 SER CA C 103 58.301 58.590 -0.289 1
1 1199 . 2 1 1 A 103 103 SER CB C 103 63.961 62.776 1.185 1
1 1200 . 2 1 1 A 103 103 SER N N 103 115.109 113.121 1.988 1
1 1201 . 2 1 1 A 104 104 THR H H 104 8.127 7.433 0.694 1
1 1202 . 2 1 1 A 104 104 THR HA H 104 4.600 4.423 0.177 1
1 1207 . 2 1 1 A 104 104 THR C C 104 174.427 174.851 -0.424 1
1 1208 . 2 1 1 A 104 104 THR CA C 104 59.954 60.665 -0.711 1
1 1209 . 2 1 1 A 104 104 THR CB C 104 69.868 68.986 0.882 1
1 1211 . 2 1 1 A 104 104 THR N N 104 117.882 114.661 3.221 1
1 1212 . 2 1 1 A 105 105 PRO HA H 105 4.414 4.294 0.120 1
1 1219 . 2 1 1 A 105 105 PRO CA C 105 63.300 65.123 -1.823 1
1 1220 . 2 1 1 A 105 105 PRO CB C 105 32.227 31.955 0.272 1
1 1223 . 2 1 1 A 106 106 GLN H H 106 8.524 8.054 0.470 1
1 1224 . 2 1 1 A 106 106 GLN HA H 106 4.276 4.000 0.276 1
1 1229 . 2 1 1 A 106 106 GLN C C 106 177.083 175.294 1.789 1
1 1230 . 2 1 1 A 106 106 GLN CA C 106 56.209 56.973 -0.764 1
1 1231 . 2 1 1 A 106 106 GLN CB C 106 29.490 27.780 1.710 1
1 1233 . 2 1 1 A 106 106 GLN N N 106 120.754 116.995 3.759 1
1 1234 . 2 1 1 A 107 107 GLY H H 107 8.394 8.643 -0.249 1
1 1235 . 2 1 1 A 107 107 GLY HA2 H 107 3.895 3.937 -0.042 1
1 1236 . 2 1 1 A 107 107 GLY HA3 H 107 3.895 3.949 -0.054 1
1 1237 . 2 1 1 A 107 107 GLY C C 107 176.651 173.875 2.776 1
1 1238 . 2 1 1 A 107 107 GLY CA C 107 45.330 46.241 -0.911 1
1 1239 . 2 1 1 A 107 107 GLY N N 107 110.026 105.451 4.575 1
1 1240 . 2 1 1 A 108 108 PHE H H 108 8.099 8.147 -0.048 1
1 1241 . 2 1 1 A 108 108 PHE HA H 108 4.582 4.864 -0.282 1
1 1245 . 2 1 1 A 108 108 PHE C C 108 173.944 177.077 -3.133 1
1 1246 . 2 1 1 A 108 108 PHE CA C 108 58.054 59.018 -0.964 1
1 1247 . 2 1 1 A 108 108 PHE CB C 108 39.708 41.151 -1.443 1
1 1248 . 2 1 1 A 108 108 PHE N N 108 120.180 119.169 1.011 1
1 1249 . 2 1 1 A 109 109 ASN H H 109 8.482 8.185 0.297 1
1 1250 . 2 1 1 A 109 109 ASN HA H 109 4.691 4.547 0.144 1
1 1255 . 2 1 1 A 109 109 ASN C C 109 175.627 175.765 -0.138 1
1 1256 . 2 1 1 A 109 109 ASN CA C 109 53.402 55.206 -1.804 1
1 1257 . 2 1 1 A 109 109 ASN CB C 109 38.883 38.645 0.238 1
1 1258 . 2 1 1 A 109 109 ASN N N 109 120.752 116.881 3.871 1
1 1260 . 2 1 1 A 110 110 THR H H 110 8.112 7.107 1.005 1
1 1261 . 2 1 1 A 110 110 THR HA H 110 4.251 4.117 0.134 1
1 1266 . 2 1 1 A 110 110 THR C C 110 175.275 174.838 0.437 1
1 1267 . 2 1 1 A 110 110 THR CA C 110 62.460 64.369 -1.909 1
1 1268 . 2 1 1 A 110 110 THR CB C 110 69.726 69.168 0.558 1
1 1270 . 2 1 1 A 110 110 THR N N 110 114.601 114.544 0.057 1
1 1271 . 2 1 1 A 111 111 LEU H H 111 8.168 8.535 -0.367 1
1 1272 . 2 1 1 A 111 111 LEU HA H 111 4.308 4.338 -0.030 1
1 1282 . 2 1 1 A 111 111 LEU CA C 111 55.704 54.913 0.791 1
1 1283 . 2 1 1 A 111 111 LEU CB C 111 42.071 42.353 -0.282 1
1 1287 . 2 1 1 A 111 111 LEU N N 111 123.756 127.882 -4.126 1
1 1288 . 2 1 1 A 112 112 LYS H H 112 8.123 8.745 -0.622 1
1 1289 . 2 1 1 A 112 112 LYS HA H 112 4.242 3.969 0.273 1
1 1298 . 2 1 1 A 112 112 LYS C C 112 177.547 176.110 1.437 1
1 1299 . 2 1 1 A 112 112 LYS CA C 112 56.928 58.599 -1.671 1
1 1300 . 2 1 1 A 112 112 LYS CB C 112 33.055 32.019 1.036 1
1 1304 . 2 1 1 A 112 112 LYS N N 112 121.442 121.451 -0.009 1
1 1305 . 2 1 1 A 113 113 ASP H H 113 8.230 7.654 0.576 1
1 1306 . 2 1 1 A 113 113 ASP HA H 113 4.526 4.175 0.351 1
1 1309 . 2 1 1 A 113 113 ASP C C 113 176.532 176.827 -0.295 1
1 1310 . 2 1 1 A 113 113 ASP CA C 113 54.896 55.599 -0.703 1
1 1311 . 2 1 1 A 113 113 ASP CB C 113 41.362 40.418 0.944 1
1 1312 . 2 1 1 A 113 113 ASP N N 113 120.598 120.775 -0.177 1
1 1313 . 2 1 1 A 114 114 LYS H H 114 8.127 8.819 -0.692 1
1 1314 . 2 1 1 A 114 114 LYS HA H 114 4.300 4.107 0.193 1
1 1323 . 2 1 1 A 114 114 LYS C C 114 176.303 176.128 0.175 1
1 1324 . 2 1 1 A 114 114 LYS CA C 114 56.633 57.056 -0.423 1
1 1325 . 2 1 1 A 114 114 LYS CB C 114 32.818 31.309 1.509 1
1 1329 . 2 1 1 A 114 114 LYS N N 114 120.897 125.648 -4.751 1
1 1330 . 2 1 1 A 115 115 LEU H H 115 8.244 7.698 0.546 1
1 1331 . 2 1 1 A 115 115 LEU HA H 115 4.254 4.516 -0.262 1
1 1341 . 2 1 1 A 115 115 LEU C C 115 176.909 177.736 -0.827 1
1 1342 . 2 1 1 A 115 115 LEU CA C 115 56.282 55.567 0.715 1
1 1343 . 2 1 1 A 115 115 LEU CB C 115 42.188 45.250 -3.062 1
1 1347 . 2 1 1 A 115 115 LEU N N 115 123.251 119.889 3.362 1
1 1348 . 2 1 1 A 116 116 GLU H H 116 8.421 7.945 0.476 1
1 1349 . 2 1 1 A 116 116 GLU HA H 116 4.190 3.895 0.295 1
1 1352 . 2 1 1 A 116 116 GLU C C 116 177.828 175.177 2.651 1
1 1353 . 2 1 1 A 116 116 GLU CA C 116 57.466 58.183 -0.717 1
1 1354 . 2 1 1 A 116 116 GLU CB C 116 30.124 30.105 0.019 1
1 1355 . 2 1 1 A 116 116 GLU N N 116 120.575 118.407 2.168 1
1 1356 . 2 1 1 A 117 117 GLU H H 117 8.255 7.317 0.938 1
1 1357 . 2 1 1 A 117 117 GLU HA H 117 4.192 4.283 -0.091 1
1 1362 . 2 1 1 A 117 117 GLU CA C 117 57.491 53.999 3.492 1
1 1363 . 2 1 1 A 117 117 GLU CB C 117 30.365 33.914 -3.549 1
1 1365 . 2 1 1 A 117 117 GLU N N 117 120.933 115.676 5.257 1
1 1366 . 2 1 1 A 118 118 TRP H H 118 8.143 8.766 -0.623 1
1 1367 . 2 1 1 A 118 118 TRP HA H 118 4.581 5.069 -0.488 1
1 1372 . 2 1 1 A 118 118 TRP C C 118 176.794 175.760 1.034 1
1 1373 . 2 1 1 A 118 118 TRP CA C 118 58.363 56.551 1.812 1
1 1374 . 2 1 1 A 118 118 TRP CB C 118 29.333 29.456 -0.123 1
1 1375 . 2 1 1 A 118 118 TRP N N 118 121.592 119.941 1.651 1
1 1376 . 2 1 1 A 119 119 ILE H H 119 7.908 7.572 0.336 1
1 1377 . 2 1 1 A 119 119 ILE HA H 119 3.828 5.044 -1.216 1
1 1387 . 2 1 1 A 119 119 ILE C C 119 176.984 175.157 1.827 1
1 1388 . 2 1 1 A 119 119 ILE CA C 119 62.335 58.795 3.540 1
1 1389 . 2 1 1 A 119 119 ILE CB C 119 38.649 41.499 -2.850 1
1 1393 . 2 1 1 A 119 119 ILE N N 119 122.744 116.157 6.587 1
1 1394 . 2 1 1 A 120 120 GLU H H 120 8.143 8.827 -0.684 1
1 1395 . 2 1 1 A 120 120 GLU HA H 120 4.093 4.582 -0.489 1
1 1400 . 2 1 1 A 120 120 GLU C C 120 176.565 177.780 -1.215 1
1 1401 . 2 1 1 A 120 120 GLU CA C 120 57.613 55.630 1.983 1
1 1402 . 2 1 1 A 120 120 GLU CB C 120 29.834 30.957 -1.123 1
1 1404 . 2 1 1 A 120 120 GLU N N 120 123.139 121.929 1.210 1
1 1405 . 2 1 1 A 121 121 MET H H 121 8.254 8.600 -0.346 1
1 1406 . 2 1 1 A 121 121 MET HA H 121 4.357 4.247 0.110 1
1 1411 . 2 1 1 A 121 121 MET CA C 121 56.625 57.560 -0.935 1
1 1412 . 2 1 1 A 121 121 MET CB C 121 32.664 32.738 -0.074 1
1 1414 . 2 1 1 A 121 121 MET N N 121 120.449 120.203 0.246 1
1 1415 . 2 1 1 A 122 122 SER H H 122 8.199 7.759 0.440 1
1 1416 . 2 1 1 A 122 122 SER HA H 122 4.280 4.900 -0.620 1
1 1419 . 2 1 1 A 122 122 SER C C 122 177.224 172.851 4.373 1
1 1420 . 2 1 1 A 122 122 SER CA C 122 59.635 57.808 1.827 1
1 1421 . 2 1 1 A 122 122 SER CB C 122 63.560 67.033 -3.473 1
1 1422 . 2 1 1 A 122 122 SER N N 122 115.857 113.583 2.274 1
1 1423 . 2 1 1 A 123 123 ASN H H 123 8.211 8.514 -0.303 1
1 1424 . 2 1 1 A 123 123 ASN HA H 123 4.737 4.728 0.009 1
1 1429 . 2 1 1 A 123 123 ASN C C 123 174.709 174.248 0.461 1
1 1430 . 2 1 1 A 123 123 ASN CA C 123 53.507 51.732 1.775 1
1 1431 . 2 1 1 A 123 123 ASN CB C 123 38.800 36.630 2.170 1
1 1432 . 2 1 1 A 123 123 ASN N N 123 119.923 121.176 -1.253 1
1 1434 . 2 1 1 A 124 124 ARG H H 124 7.997 8.133 -0.136 1
1 1435 . 2 1 1 A 124 124 ARG HA H 124 4.305 4.246 0.059 1
1 1442 . 2 1 1 A 124 124 ARG C C 124 175.477 176.497 -1.020 1
1 1443 . 2 1 1 A 124 124 ARG CA C 124 56.709 56.231 0.478 1
1 1444 . 2 1 1 A 124 124 ARG CB C 124 30.584 30.498 0.086 1
1 1447 . 2 1 1 A 124 124 ARG N N 124 120.821 125.309 -4.488 1
1 1448 . 2 1 1 A 125 125 LYS H H 125 8.327 8.558 -0.231 1
1 1449 . 2 1 1 A 125 125 LYS HA H 125 4.254 4.329 -0.075 1
1 1458 . 2 1 1 A 125 125 LYS C C 125 176.777 175.979 0.798 1
1 1459 . 2 1 1 A 125 125 LYS CA C 125 56.860 56.821 0.039 1
1 1460 . 2 1 1 A 125 125 LYS CB C 125 32.879 33.490 -0.611 1
1 1464 . 2 1 1 A 125 125 LYS N N 125 121.891 125.669 -3.778 1
1 1465 . 2 1 1 A 126 126 ASP H H 126 8.343 9.027 -0.684 1
1 1466 . 2 1 1 A 126 126 ASP HA H 126 4.581 4.759 -0.178 1
1 1469 . 2 1 1 A 126 126 ASP C C 126 176.538 175.598 0.940 1
1 1470 . 2 1 1 A 126 126 ASP CA C 126 54.540 55.549 -1.009 1
1 1471 . 2 1 1 A 126 126 ASP CB C 126 40.907 43.919 -3.012 1
1 1472 . 2 1 1 A 126 126 ASP N N 126 119.814 122.637 -2.823 1
1 1473 . 2 1 1 A 127 127 LEU H H 127 7.946 7.679 0.267 1
1 1474 . 2 1 1 A 127 127 LEU HA H 127 4.309 4.271 0.038 1
1 1484 . 2 1 1 A 127 127 LEU C C 127 176.043 175.832 0.211 1
1 1485 . 2 1 1 A 127 127 LEU CA C 127 55.427 55.611 -0.184 1
1 1486 . 2 1 1 A 127 127 LEU CB C 127 42.394 42.350 0.044 1
1 1490 . 2 1 1 A 127 127 LEU N N 127 121.432 119.633 1.799 1
1 1491 . 2 1 1 A 128 128 ILE H H 128 7.967 8.458 -0.491 1
1 1492 . 2 1 1 A 128 128 ILE HA H 128 4.141 4.868 -0.727 1
1 1502 . 2 1 1 A 128 128 ILE C C 128 177.200 173.628 3.572 1
1 1503 . 2 1 1 A 128 128 ILE CA C 128 61.150 59.285 1.865 1
1 1504 . 2 1 1 A 128 128 ILE CB C 128 38.489 41.421 -2.932 1
1 1508 . 2 1 1 A 128 128 ILE N N 128 121.579 125.477 -3.898 1
1 1509 . 2 1 1 A 129 129 LYS H H 129 8.331 8.785 -0.454 1
1 1510 . 2 1 1 A 129 129 LYS HA H 129 4.328 4.846 -0.518 1
1 1519 . 2 1 1 A 129 129 LYS C C 129 175.952 174.920 1.032 1
1 1520 . 2 1 1 A 129 129 LYS CA C 129 56.330 54.773 1.557 1
1 1521 . 2 1 1 A 129 129 LYS CB C 129 33.010 36.498 -3.488 1
1 1525 . 2 1 1 A 129 129 LYS N N 129 126.955 126.741 0.214 1
1 1 . 3 1 1 A 2 2 ALA HA H 2 4.070 4.668 -0.598 1
1 5 . 3 1 1 A 2 2 ALA CA C 2 52.067 51.778 0.289 1
1 6 . 3 1 1 A 2 2 ALA CB C 2 19.577 21.385 -1.808 1
1 7 . 3 1 1 A 3 3 ALA H H 3 8.714 7.778 0.936 1
1 8 . 3 1 1 A 3 3 ALA HA H 3 4.253 4.573 -0.320 1
1 12 . 3 1 1 A 3 3 ALA C C 3 173.672 177.418 -3.746 1
1 13 . 3 1 1 A 3 3 ALA CA C 3 52.067 50.977 1.090 1
1 14 . 3 1 1 A 3 3 ALA CB C 3 19.577 20.681 -1.104 1
1 15 . 3 1 1 A 3 3 ALA N N 3 124.480 118.214 6.266 1
1 16 . 3 1 1 A 4 4 LYS H H 4 8.227 8.545 -0.318 1
1 17 . 3 1 1 A 4 4 LYS HA H 4 3.976 4.138 -0.162 1
1 26 . 3 1 1 A 4 4 LYS C C 4 176.672 176.658 0.014 1
1 27 . 3 1 1 A 4 4 LYS CA C 4 57.274 58.573 -1.299 1
1 28 . 3 1 1 A 4 4 LYS CB C 4 33.209 32.562 0.647 1
1 32 . 3 1 1 A 4 4 LYS N N 4 120.988 117.757 3.231 1
1 33 . 3 1 1 A 5 5 PHE H H 5 7.719 7.918 -0.199 1
1 34 . 3 1 1 A 5 5 PHE HA H 5 4.384 5.021 -0.637 1
1 38 . 3 1 1 A 5 5 PHE C C 5 175.364 173.408 1.956 1
1 39 . 3 1 1 A 5 5 PHE CA C 5 57.074 56.241 0.833 1
1 40 . 3 1 1 A 5 5 PHE CB C 5 39.669 40.445 -0.776 1
1 41 . 3 1 1 A 5 5 PHE N N 5 119.246 114.548 4.698 1
1 42 . 3 1 1 A 6 6 GLU H H 6 8.515 8.556 -0.041 1
1 43 . 3 1 1 A 6 6 GLU HA H 6 4.370 4.714 -0.344 1
1 48 . 3 1 1 A 6 6 GLU CA C 6 55.669 53.942 1.727 1
1 49 . 3 1 1 A 6 6 GLU CB C 6 32.094 33.829 -1.735 1
1 51 . 3 1 1 A 6 6 GLU N N 6 122.193 118.576 3.617 1
1 52 . 3 1 1 A 7 7 VAL H H 7 8.636 8.312 0.324 1
1 53 . 3 1 1 A 7 7 VAL HA H 7 3.406 3.811 -0.405 1
1 61 . 3 1 1 A 7 7 VAL C C 7 176.611 176.256 0.355 1
1 62 . 3 1 1 A 7 7 VAL CA C 7 65.358 63.254 2.104 1
1 63 . 3 1 1 A 7 7 VAL CB C 7 31.391 31.344 0.047 1
1 66 . 3 1 1 A 7 7 VAL N N 7 122.949 120.095 2.854 1
1 67 . 3 1 1 A 8 8 GLY H H 8 9.394 8.834 0.560 1
1 68 . 3 1 1 A 8 8 GLY HA2 H 8 3.600 4.015 -0.415 1
1 69 . 3 1 1 A 8 8 GLY HA3 H 8 4.546 4.017 0.529 1
1 70 . 3 1 1 A 8 8 GLY C C 8 178.074 174.245 3.829 1
1 71 . 3 1 1 A 8 8 GLY CA C 8 45.121 44.877 0.244 1
1 72 . 3 1 1 A 8 8 GLY N N 8 116.837 115.162 1.675 1
1 73 . 3 1 1 A 9 9 SER H H 9 8.021 7.950 0.071 1
1 74 . 3 1 1 A 9 9 SER HA H 9 4.680 4.564 0.116 1
1 77 . 3 1 1 A 9 9 SER C C 9 174.234 173.096 1.138 1
1 78 . 3 1 1 A 9 9 SER CA C 9 59.387 59.565 -0.178 1
1 79 . 3 1 1 A 9 9 SER CB C 9 65.584 64.649 0.935 1
1 80 . 3 1 1 A 9 9 SER N N 9 118.208 118.264 -0.056 1
1 81 . 3 1 1 A 10 10 VAL H H 10 7.945 8.406 -0.461 1
1 82 . 3 1 1 A 10 10 VAL HA H 10 4.980 5.222 -0.242 1
1 90 . 3 1 1 A 10 10 VAL C C 10 171.388 174.399 -3.011 1
1 91 . 3 1 1 A 10 10 VAL CA C 10 61.021 61.234 -0.213 1
1 92 . 3 1 1 A 10 10 VAL CB C 10 33.400 34.428 -1.028 1
1 95 . 3 1 1 A 10 10 VAL N N 10 121.118 122.744 -1.626 1
1 96 . 3 1 1 A 11 11 TYR H H 11 9.008 9.259 -0.251 1
1 97 . 3 1 1 A 11 11 TYR HA H 11 4.850 5.285 -0.435 1
1 101 . 3 1 1 A 11 11 TYR C C 11 174.926 174.705 0.221 1
1 102 . 3 1 1 A 11 11 TYR CA C 11 56.803 56.078 0.725 1
1 103 . 3 1 1 A 11 11 TYR CB C 11 43.676 43.577 0.099 1
1 104 . 3 1 1 A 11 11 TYR N N 11 125.043 125.492 -0.449 1
1 105 . 3 1 1 A 12 12 THR H H 12 8.809 8.576 0.233 1
1 106 . 3 1 1 A 12 12 THR HA H 12 5.020 5.460 -0.440 1
1 111 . 3 1 1 A 12 12 THR C C 12 174.195 174.424 -0.229 1
1 112 . 3 1 1 A 12 12 THR CA C 12 62.487 60.302 2.185 1
1 113 . 3 1 1 A 12 12 THR CB C 12 69.743 72.405 -2.662 1
1 115 . 3 1 1 A 12 12 THR N N 12 116.850 115.006 1.844 1
1 116 . 3 1 1 A 13 13 GLY H H 13 9.179 8.475 0.704 1
1 117 . 3 1 1 A 13 13 GLY HA2 H 13 3.250 4.375 -1.125 1
1 118 . 3 1 1 A 13 13 GLY HA3 H 13 4.801 4.390 0.411 1
1 119 . 3 1 1 A 13 13 GLY C C 13 174.654 172.065 2.589 1
1 120 . 3 1 1 A 13 13 GLY CA C 13 44.377 45.511 -1.134 1
1 121 . 3 1 1 A 13 13 GLY N N 13 113.654 111.942 1.712 1
1 122 . 3 1 1 A 14 14 LYS H H 14 7.770 8.707 -0.937 1
1 123 . 3 1 1 A 14 14 LYS HA H 14 5.426 5.251 0.175 1
1 132 . 3 1 1 A 14 14 LYS C C 14 171.343 175.705 -4.362 1
1 133 . 3 1 1 A 14 14 LYS CA C 14 53.879 54.753 -0.874 1
1 134 . 3 1 1 A 14 14 LYS CB C 14 36.032 35.837 0.195 1
1 138 . 3 1 1 A 14 14 LYS N N 14 118.322 120.850 -2.528 1
1 139 . 3 1 1 A 15 15 VAL H H 15 9.206 9.275 -0.069 1
1 140 . 3 1 1 A 15 15 VAL HA H 15 4.400 4.299 0.101 1
1 148 . 3 1 1 A 15 15 VAL C C 15 176.306 177.204 -0.898 1
1 149 . 3 1 1 A 15 15 VAL CA C 15 63.648 63.490 0.158 1
1 150 . 3 1 1 A 15 15 VAL CB C 15 31.769 31.781 -0.012 1
1 153 . 3 1 1 A 15 15 VAL N N 15 125.308 127.290 -1.982 1
1 154 . 3 1 1 A 16 16 THR H H 16 9.403 9.410 -0.007 1
1 155 . 3 1 1 A 16 16 THR HA H 16 4.562 4.748 -0.186 1
1 160 . 3 1 1 A 16 16 THR C C 16 178.098 174.689 3.409 1
1 161 . 3 1 1 A 16 16 THR CA C 16 62.018 61.503 0.515 1
1 162 . 3 1 1 A 16 16 THR CB C 16 69.720 69.936 -0.216 1
1 164 . 3 1 1 A 16 16 THR N N 16 121.753 117.688 4.065 1
1 165 . 3 1 1 A 17 17 GLY H H 17 7.600 7.112 0.488 1
1 166 . 3 1 1 A 17 17 GLY HA2 H 17 4.110 4.135 -0.025 1
1 167 . 3 1 1 A 17 17 GLY HA3 H 17 4.250 4.242 0.008 1
1 168 . 3 1 1 A 17 17 GLY C C 17 175.551 171.382 4.169 1
1 169 . 3 1 1 A 17 17 GLY CA C 17 46.258 45.547 0.711 1
1 170 . 3 1 1 A 17 17 GLY N N 17 109.407 108.770 0.637 1
1 171 . 3 1 1 A 18 18 LEU H H 18 8.820 8.516 0.304 1
1 172 . 3 1 1 A 18 18 LEU HA H 18 4.852 5.070 -0.218 1
1 182 . 3 1 1 A 18 18 LEU CA C 18 54.245 53.240 1.005 1
1 183 . 3 1 1 A 18 18 LEU CB C 18 44.906 46.308 -1.402 1
1 187 . 3 1 1 A 18 18 LEU N N 18 123.419 121.229 2.190 1
1 188 . 3 1 1 A 19 19 GLN H H 19 8.537 8.269 0.268 1
1 189 . 3 1 1 A 19 19 GLN HA H 19 4.520 4.779 -0.259 1
1 196 . 3 1 1 A 19 19 GLN C C 19 175.258 175.840 -0.582 1
1 197 . 3 1 1 A 19 19 GLN CA C 19 53.269 54.025 -0.756 1
1 198 . 3 1 1 A 19 19 GLN CB C 19 31.522 32.898 -1.376 1
1 200 . 3 1 1 A 19 19 GLN N N 19 120.187 121.590 -1.403 1
1 202 . 3 1 1 A 20 20 ALA H H 20 8.798 8.745 0.053 1
1 203 . 3 1 1 A 20 20 ALA HA H 20 4.010 4.092 -0.082 1
1 207 . 3 1 1 A 20 20 ALA C C 20 175.698 177.401 -1.703 1
1 208 . 3 1 1 A 20 20 ALA CA C 20 55.084 54.192 0.892 1
1 209 . 3 1 1 A 20 20 ALA CB C 20 18.277 18.601 -0.324 1
1 210 . 3 1 1 A 20 20 ALA N N 20 120.606 123.979 -3.373 1
1 211 . 3 1 1 A 21 21 TYR H H 21 6.618 8.093 -1.475 1
1 212 . 3 1 1 A 21 21 TYR HA H 21 4.540 4.663 -0.123 1
1 216 . 3 1 1 A 21 21 TYR C C 21 178.437 175.320 3.117 1
1 217 . 3 1 1 A 21 21 TYR CA C 21 55.120 58.216 -3.096 1
1 218 . 3 1 1 A 21 21 TYR CB C 21 37.891 39.885 -1.994 1
1 219 . 3 1 1 A 21 21 TYR N N 21 105.570 118.922 -13.352 1
1 220 . 3 1 1 A 22 22 GLY H H 22 7.203 7.196 0.007 1
1 221 . 3 1 1 A 22 22 GLY HA2 H 22 3.460 3.871 -0.411 1
1 222 . 3 1 1 A 22 22 GLY HA3 H 22 4.360 3.942 0.418 1
1 223 . 3 1 1 A 22 22 GLY C C 22 175.833 171.336 4.497 1
1 224 . 3 1 1 A 22 22 GLY CA C 22 46.356 45.356 1.000 1
1 225 . 3 1 1 A 22 22 GLY N N 22 109.854 107.700 2.154 1
1 226 . 3 1 1 A 23 23 ALA H H 23 8.549 8.509 0.040 1
1 227 . 3 1 1 A 23 23 ALA HA H 23 4.981 5.305 -0.324 1
1 231 . 3 1 1 A 23 23 ALA C C 23 168.810 175.968 -7.158 1
1 232 . 3 1 1 A 23 23 ALA CA C 23 49.178 50.745 -1.567 1
1 233 . 3 1 1 A 23 23 ALA CB C 23 22.797 21.377 1.420 1
1 234 . 3 1 1 A 23 23 ALA N N 23 118.749 122.288 -3.539 1
1 235 . 3 1 1 A 24 24 PHE H H 24 8.812 8.555 0.257 1
1 236 . 3 1 1 A 24 24 PHE HA H 24 5.125 4.983 0.142 1
1 240 . 3 1 1 A 24 24 PHE CA C 24 58.017 58.113 -0.096 1
1 241 . 3 1 1 A 24 24 PHE CB C 24 40.475 40.564 -0.089 1
1 242 . 3 1 1 A 24 24 PHE N N 24 122.891 121.597 1.294 1
1 243 . 3 1 1 A 25 25 VAL H H 25 8.880 9.114 -0.234 1
1 244 . 3 1 1 A 25 25 VAL HA H 25 4.660 4.740 -0.080 1
1 252 . 3 1 1 A 25 25 VAL CA C 25 60.379 61.151 -0.772 1
1 253 . 3 1 1 A 25 25 VAL CB C 25 35.654 35.221 0.433 1
1 256 . 3 1 1 A 25 25 VAL N N 25 122.908 121.202 1.706 1
1 257 . 3 1 1 A 26 26 ALA H H 26 9.403 8.856 0.547 1
1 258 . 3 1 1 A 26 26 ALA HA H 26 4.750 4.379 0.371 1
1 262 . 3 1 1 A 26 26 ALA C C 26 174.445 176.940 -2.495 1
1 263 . 3 1 1 A 26 26 ALA CA C 26 51.711 52.529 -0.818 1
1 264 . 3 1 1 A 26 26 ALA CB C 26 19.319 19.421 -0.102 1
1 265 . 3 1 1 A 26 26 ALA N N 26 129.425 130.312 -0.887 1
1 266 . 3 1 1 A 27 27 LEU H H 27 8.601 9.162 -0.561 1
1 267 . 3 1 1 A 27 27 LEU HA H 27 4.158 4.598 -0.440 1
1 277 . 3 1 1 A 27 27 LEU C C 27 177.814 176.107 1.707 1
1 278 . 3 1 1 A 27 27 LEU CA C 27 55.869 55.481 0.388 1
1 279 . 3 1 1 A 27 27 LEU CB C 27 42.251 43.920 -1.669 1
1 283 . 3 1 1 A 27 27 LEU N N 27 127.169 121.834 5.335 1
1 284 . 3 1 1 A 28 28 ASP H H 28 8.172 7.998 0.174 1
1 285 . 3 1 1 A 28 28 ASP HA H 28 4.420 4.838 -0.418 1
1 288 . 3 1 1 A 28 28 ASP C C 28 177.116 175.224 1.892 1
1 289 . 3 1 1 A 28 28 ASP CA C 28 53.755 52.775 0.980 1
1 290 . 3 1 1 A 28 28 ASP CB C 28 39.833 43.958 -4.125 1
1 291 . 3 1 1 A 28 28 ASP N N 28 115.657 116.895 -1.238 1
1 292 . 3 1 1 A 29 29 GLU H H 29 8.857 8.437 0.420 1
1 293 . 3 1 1 A 29 29 GLU HA H 29 4.090 4.123 -0.033 1
1 298 . 3 1 1 A 29 29 GLU C C 29 175.965 177.066 -1.101 1
1 299 . 3 1 1 A 29 29 GLU CA C 29 59.470 58.876 0.594 1
1 300 . 3 1 1 A 29 29 GLU CB C 29 29.409 29.209 0.200 1
1 302 . 3 1 1 A 29 29 GLU N N 29 114.738 121.954 -7.216 1
1 303 . 3 1 1 A 30 30 GLU H H 30 8.326 8.092 0.234 1
1 304 . 3 1 1 A 30 30 GLU HA H 30 4.640 4.546 0.094 1
1 309 . 3 1 1 A 30 30 GLU C C 30 176.817 175.842 0.975 1
1 310 . 3 1 1 A 30 30 GLU CA C 30 56.073 55.784 0.289 1
1 311 . 3 1 1 A 30 30 GLU CB C 30 32.453 31.022 1.431 1
1 313 . 3 1 1 A 30 30 GLU N N 30 115.753 114.747 1.006 1
1 314 . 3 1 1 A 31 31 THR H H 31 7.819 7.267 0.552 1
1 315 . 3 1 1 A 31 31 THR HA H 31 4.484 5.058 -0.574 1
1 320 . 3 1 1 A 31 31 THR C C 31 176.330 172.999 3.331 1
1 321 . 3 1 1 A 31 31 THR CA C 31 63.398 61.072 2.326 1
1 322 . 3 1 1 A 31 31 THR CB C 31 69.367 72.209 -2.842 1
1 324 . 3 1 1 A 31 31 THR N N 31 118.750 115.593 3.157 1
1 325 . 3 1 1 A 32 32 GLN H H 32 8.913 8.773 0.140 1
1 326 . 3 1 1 A 32 32 GLN HA H 32 5.337 4.849 0.488 1
1 333 . 3 1 1 A 32 32 GLN C C 32 173.087 174.527 -1.440 1
1 334 . 3 1 1 A 32 32 GLN CA C 32 54.051 55.248 -1.197 1
1 335 . 3 1 1 A 32 32 GLN CB C 32 32.672 33.058 -0.386 1
1 337 . 3 1 1 A 32 32 GLN N N 32 127.294 124.872 2.422 1
1 339 . 3 1 1 A 33 33 GLY H H 33 8.900 8.542 0.358 1
1 340 . 3 1 1 A 33 33 GLY HA2 H 33 3.290 4.533 -1.243 1
1 341 . 3 1 1 A 33 33 GLY HA3 H 33 4.530 4.534 -0.004 1
1 342 . 3 1 1 A 33 33 GLY C C 33 174.918 172.409 2.509 1
1 343 . 3 1 1 A 33 33 GLY CA C 33 44.534 45.435 -0.901 1
1 344 . 3 1 1 A 33 33 GLY N N 33 107.639 110.460 -2.821 1
1 345 . 3 1 1 A 34 34 LEU H H 34 8.127 8.947 -0.820 1
1 346 . 3 1 1 A 34 34 LEU HA H 34 4.950 5.043 -0.093 1
1 356 . 3 1 1 A 34 34 LEU CA C 34 53.755 54.077 -0.322 1
1 357 . 3 1 1 A 34 34 LEU CB C 34 45.493 44.721 0.772 1
1 361 . 3 1 1 A 34 34 LEU N N 34 120.897 121.226 -0.329 1
1 362 . 3 1 1 A 35 35 VAL H H 35 9.386 8.837 0.549 1
1 363 . 3 1 1 A 35 35 VAL HA H 35 4.479 4.418 0.061 1
1 371 . 3 1 1 A 35 35 VAL C C 35 176.402 176.194 0.208 1
1 372 . 3 1 1 A 35 35 VAL CA C 35 59.594 63.055 -3.461 1
1 373 . 3 1 1 A 35 35 VAL CB C 35 32.590 31.562 1.028 1
1 376 . 3 1 1 A 35 35 VAL N N 35 128.897 127.911 0.986 1
1 377 . 3 1 1 A 36 36 HIS H H 36 9.194 8.423 0.771 1
1 378 . 3 1 1 A 36 36 HIS HA H 36 4.487 4.495 -0.008 1
1 381 . 3 1 1 A 36 36 HIS C C 36 174.864 176.414 -1.550 1
1 382 . 3 1 1 A 36 36 HIS CA C 36 59.426 56.231 3.195 1
1 383 . 3 1 1 A 36 36 HIS CB C 36 31.542 30.401 1.141 1
1 384 . 3 1 1 A 36 36 HIS N N 36 127.751 126.043 1.708 1
1 385 . 3 1 1 A 37 37 ILE H H 37 7.454 8.555 -1.101 1
1 386 . 3 1 1 A 37 37 ILE HA H 37 3.810 3.599 0.211 1
1 396 . 3 1 1 A 37 37 ILE C C 37 176.948 177.788 -0.840 1
1 397 . 3 1 1 A 37 37 ILE CA C 37 63.773 64.773 -1.000 1
1 398 . 3 1 1 A 37 37 ILE CB C 37 38.993 37.299 1.694 1
1 402 . 3 1 1 A 37 37 ILE N N 37 126.266 125.825 0.441 1
1 403 . 3 1 1 A 38 38 SER H H 38 8.343 8.039 0.304 1
1 404 . 3 1 1 A 38 38 SER HA H 38 4.370 4.197 0.173 1
1 407 . 3 1 1 A 38 38 SER C C 38 174.792 174.870 -0.078 1
1 408 . 3 1 1 A 38 38 SER CA C 38 60.567 60.860 -0.293 1
1 409 . 3 1 1 A 38 38 SER CB C 38 63.632 62.724 0.908 1
1 410 . 3 1 1 A 38 38 SER N N 38 118.079 117.953 0.126 1
1 411 . 3 1 1 A 39 39 GLU H H 39 8.536 7.961 0.575 1
1 412 . 3 1 1 A 39 39 GLU HA H 39 4.503 4.566 -0.063 1
1 417 . 3 1 1 A 39 39 GLU C C 39 175.131 176.933 -1.802 1
1 418 . 3 1 1 A 39 39 GLU CA C 39 54.928 56.349 -1.421 1
1 419 . 3 1 1 A 39 39 GLU CB C 39 29.621 30.459 -0.838 1
1 421 . 3 1 1 A 39 39 GLU N N 39 118.349 118.394 -0.045 1
1 422 . 3 1 1 A 40 40 VAL H H 40 7.776 7.667 0.109 1
1 423 . 3 1 1 A 40 40 VAL HA H 40 3.616 3.947 -0.331 1
1 431 . 3 1 1 A 40 40 VAL C C 40 177.277 176.205 1.072 1
1 432 . 3 1 1 A 40 40 VAL CA C 40 66.245 64.260 1.985 1
1 433 . 3 1 1 A 40 40 VAL CB C 40 32.590 32.249 0.341 1
1 436 . 3 1 1 A 40 40 VAL N N 40 125.443 117.680 7.763 1
1 437 . 3 1 1 A 41 41 THR H H 41 7.888 7.613 0.275 1
1 438 . 3 1 1 A 41 41 THR HA H 41 4.345 5.007 -0.662 1
1 443 . 3 1 1 A 41 41 THR C C 41 173.492 172.924 0.568 1
1 444 . 3 1 1 A 41 41 THR CA C 41 59.047 61.380 -2.333 1
1 445 . 3 1 1 A 41 41 THR CB C 41 68.992 73.210 -4.218 1
1 447 . 3 1 1 A 41 41 THR N N 41 109.905 112.813 -2.908 1
1 448 . 3 1 1 A 42 42 HIS H H 42 8.063 8.810 -0.747 1
1 449 . 3 1 1 A 42 42 HIS HA H 42 4.510 4.708 -0.198 1
1 452 . 3 1 1 A 42 42 HIS C C 42 172.139 173.639 -1.500 1
1 453 . 3 1 1 A 42 42 HIS CA C 42 57.735 54.492 3.243 1
1 454 . 3 1 1 A 42 42 HIS CB C 42 31.144 28.384 2.760 1
1 455 . 3 1 1 A 42 42 HIS N N 42 121.760 125.400 -3.640 1
1 456 . 3 1 1 A 43 43 GLY H H 43 8.286 7.616 0.670 1
1 457 . 3 1 1 A 43 43 GLY HA2 H 43 3.980 4.059 -0.079 1
1 458 . 3 1 1 A 43 43 GLY HA3 H 43 3.980 4.063 -0.083 1
1 459 . 3 1 1 A 43 43 GLY C C 43 176.307 172.216 4.091 1
1 460 . 3 1 1 A 43 43 GLY CA C 43 44.336 45.793 -1.457 1
1 461 . 3 1 1 A 43 43 GLY N N 43 110.133 109.936 0.197 1
1 462 . 3 1 1 A 44 44 PHE H H 44 8.327 8.556 -0.229 1
1 463 . 3 1 1 A 44 44 PHE HA H 44 4.489 4.503 -0.014 1
1 467 . 3 1 1 A 44 44 PHE C C 44 171.877 174.276 -2.399 1
1 468 . 3 1 1 A 44 44 PHE CA C 44 58.027 56.755 1.272 1
1 469 . 3 1 1 A 44 44 PHE CB C 44 39.850 39.058 0.792 1
1 470 . 3 1 1 A 44 44 PHE N N 44 120.049 120.784 -0.735 1
1 471 . 3 1 1 A 45 45 VAL H H 45 7.939 8.267 -0.328 1
1 472 . 3 1 1 A 45 45 VAL HA H 45 3.865 3.221 0.644 1
1 480 . 3 1 1 A 45 45 VAL C C 45 175.523 176.535 -1.012 1
1 481 . 3 1 1 A 45 45 VAL CA C 45 61.536 62.029 -0.493 1
1 482 . 3 1 1 A 45 45 VAL CB C 45 33.127 29.222 3.905 1
1 485 . 3 1 1 A 45 45 VAL N N 45 127.882 128.134 -0.252 1
1 486 . 3 1 1 A 46 46 LYS H H 46 8.868 7.759 1.109 1
1 487 . 3 1 1 A 46 46 LYS HA H 46 4.170 3.348 0.822 1
1 496 . 3 1 1 A 46 46 LYS C C 46 175.728 175.759 -0.031 1
1 497 . 3 1 1 A 46 46 LYS CA C 46 57.198 58.279 -1.081 1
1 498 . 3 1 1 A 46 46 LYS CB C 46 33.299 32.117 1.182 1
1 502 . 3 1 1 A 46 46 LYS N N 46 127.308 123.435 3.873 1
1 503 . 3 1 1 A 47 47 ASP H H 47 7.652 7.849 -0.197 1
1 504 . 3 1 1 A 47 47 ASP HA H 47 4.710 4.886 -0.176 1
1 507 . 3 1 1 A 47 47 ASP C C 47 176.411 176.060 0.351 1
1 508 . 3 1 1 A 47 47 ASP CA C 47 53.390 53.867 -0.477 1
1 509 . 3 1 1 A 47 47 ASP CB C 47 42.635 43.430 -0.795 1
1 510 . 3 1 1 A 47 47 ASP N N 47 117.932 117.928 0.004 1
1 511 . 3 1 1 A 48 48 ILE H H 48 9.230 8.671 0.559 1
1 512 . 3 1 1 A 48 48 ILE HA H 48 3.579 3.988 -0.409 1
1 522 . 3 1 1 A 48 48 ILE C C 48 177.249 177.496 -0.247 1
1 523 . 3 1 1 A 48 48 ILE CA C 48 65.525 63.431 2.094 1
1 524 . 3 1 1 A 48 48 ILE CB C 48 38.797 37.673 1.124 1
1 528 . 3 1 1 A 48 48 ILE N N 48 129.049 125.807 3.242 1
1 529 . 3 1 1 A 49 49 ASN H H 49 8.468 8.948 -0.480 1
1 530 . 3 1 1 A 49 49 ASN HA H 49 4.690 4.568 0.122 1
1 535 . 3 1 1 A 49 49 ASN C C 49 175.779 176.349 -0.570 1
1 536 . 3 1 1 A 49 49 ASN CA C 49 55.587 54.898 0.689 1
1 537 . 3 1 1 A 49 49 ASN CB C 49 38.587 36.730 1.857 1
1 538 . 3 1 1 A 49 49 ASN N N 49 118.835 117.922 0.913 1
1 540 . 3 1 1 A 50 50 GLU H H 50 7.853 7.587 0.266 1
1 541 . 3 1 1 A 50 50 GLU HA H 50 4.040 4.096 -0.056 1
1 546 . 3 1 1 A 50 50 GLU C C 50 176.148 177.089 -0.941 1
1 547 . 3 1 1 A 50 50 GLU CA C 50 57.404 57.457 -0.053 1
1 548 . 3 1 1 A 50 50 GLU CB C 50 29.491 29.356 0.135 1
1 550 . 3 1 1 A 50 50 GLU N N 50 116.358 118.178 -1.820 1
1 551 . 3 1 1 A 51 51 HIS H H 51 7.575 7.833 -0.258 1
1 552 . 3 1 1 A 51 51 HIS HA H 51 4.431 4.717 -0.286 1
1 555 . 3 1 1 A 51 51 HIS C C 51 176.383 174.805 1.578 1
1 556 . 3 1 1 A 51 51 HIS CA C 51 57.089 56.415 0.674 1
1 557 . 3 1 1 A 51 51 HIS CB C 51 33.168 31.810 1.358 1
1 558 . 3 1 1 A 51 51 HIS N N 51 115.828 115.227 0.601 1
1 559 . 3 1 1 A 52 52 LEU H H 52 7.640 7.571 0.069 1
1 560 . 3 1 1 A 52 52 LEU HA H 52 4.796 4.677 0.119 1
1 570 . 3 1 1 A 52 52 LEU C C 52 174.452 174.302 0.150 1
1 571 . 3 1 1 A 52 52 LEU CA C 52 53.398 53.550 -0.152 1
1 572 . 3 1 1 A 52 52 LEU CB C 52 48.805 44.331 4.474 1
1 576 . 3 1 1 A 52 52 LEU N N 52 117.932 119.851 -1.919 1
1 577 . 3 1 1 A 53 53 SER H H 53 8.151 8.734 -0.583 1
1 578 . 3 1 1 A 53 53 SER HA H 53 4.680 5.017 -0.337 1
1 581 . 3 1 1 A 53 53 SER C C 53 174.304 172.758 1.546 1
1 582 . 3 1 1 A 53 53 SER CA C 53 56.714 57.484 -0.770 1
1 583 . 3 1 1 A 53 53 SER CB C 53 65.431 66.466 -1.035 1
1 584 . 3 1 1 A 53 53 SER N N 53 113.496 117.419 -3.923 1
1 585 . 3 1 1 A 54 54 VAL H H 54 8.782 8.576 0.206 1
1 586 . 3 1 1 A 54 54 VAL HA H 54 3.230 3.808 -0.578 1
1 594 . 3 1 1 A 54 54 VAL C C 54 173.745 177.121 -3.376 1
1 595 . 3 1 1 A 54 54 VAL CA C 54 66.232 63.488 2.744 1
1 596 . 3 1 1 A 54 54 VAL CB C 54 31.067 32.051 -0.984 1
1 599 . 3 1 1 A 54 54 VAL N N 54 124.401 126.097 -1.696 1
1 600 . 3 1 1 A 55 55 GLY H H 55 9.079 8.814 0.265 1
1 601 . 3 1 1 A 55 55 GLY HA2 H 55 3.530 3.861 -0.331 1
1 602 . 3 1 1 A 55 55 GLY HA3 H 55 4.553 3.864 0.689 1
1 603 . 3 1 1 A 55 55 GLY C C 55 177.219 173.248 3.971 1
1 604 . 3 1 1 A 55 55 GLY CA C 55 44.647 46.304 -1.657 1
1 605 . 3 1 1 A 55 55 GLY N N 55 117.320 116.273 1.047 1
1 606 . 3 1 1 A 56 56 ASP H H 56 7.943 7.772 0.171 1
1 607 . 3 1 1 A 56 56 ASP HA H 56 4.460 5.177 -0.717 1
1 610 . 3 1 1 A 56 56 ASP C C 56 176.055 173.730 2.325 1
1 611 . 3 1 1 A 56 56 ASP CA C 56 55.456 52.470 2.986 1
1 612 . 3 1 1 A 56 56 ASP CB C 56 40.914 44.770 -3.856 1
1 613 . 3 1 1 A 56 56 ASP N N 56 121.782 119.643 2.139 1
1 614 . 3 1 1 A 57 57 GLU H H 57 8.649 8.784 -0.135 1
1 615 . 3 1 1 A 57 57 GLU HA H 57 5.100 5.231 -0.131 1
1 620 . 3 1 1 A 57 57 GLU C C 57 175.635 175.878 -0.243 1
1 621 . 3 1 1 A 57 57 GLU CA C 57 55.805 55.490 0.315 1
1 622 . 3 1 1 A 57 57 GLU CB C 57 30.915 31.432 -0.517 1
1 624 . 3 1 1 A 57 57 GLU N N 57 122.513 123.764 -1.251 1
1 625 . 3 1 1 A 58 58 VAL H H 58 8.809 9.144 -0.335 1
1 626 . 3 1 1 A 58 58 VAL HA H 58 4.817 4.813 0.004 1
1 634 . 3 1 1 A 58 58 VAL C C 58 176.528 173.975 2.553 1
1 635 . 3 1 1 A 58 58 VAL CA C 58 58.719 59.209 -0.490 1
1 636 . 3 1 1 A 58 58 VAL CB C 58 35.523 35.934 -0.411 1
1 639 . 3 1 1 A 58 58 VAL N N 58 118.382 119.662 -1.280 1
1 640 . 3 1 1 A 59 59 GLN H H 59 8.255 8.440 -0.185 1
1 641 . 3 1 1 A 59 59 GLN HA H 59 5.030 4.955 0.075 1
1 646 . 3 1 1 A 59 59 GLN CA C 59 54.843 55.710 -0.867 1
1 647 . 3 1 1 A 59 59 GLN CB C 59 30.111 29.932 0.179 1
1 649 . 3 1 1 A 59 59 GLN N N 59 120.933 122.298 -1.365 1
1 650 . 3 1 1 A 60 60 VAL H H 60 8.970 9.411 -0.441 1
1 651 . 3 1 1 A 60 60 VAL HA H 60 4.990 5.004 -0.014 1
1 659 . 3 1 1 A 60 60 VAL C C 60 175.203 173.847 1.356 1
1 660 . 3 1 1 A 60 60 VAL CA C 60 57.404 59.097 -1.693 1
1 661 . 3 1 1 A 60 60 VAL CB C 60 35.771 35.462 0.309 1
1 664 . 3 1 1 A 60 60 VAL N N 60 111.046 118.508 -7.462 1
1 665 . 3 1 1 A 61 61 LYS H H 61 8.937 8.842 0.095 1
1 666 . 3 1 1 A 61 61 LYS HA H 61 5.100 5.087 0.013 1
1 675 . 3 1 1 A 61 61 LYS C C 61 173.610 176.260 -2.650 1
1 676 . 3 1 1 A 61 61 LYS CA C 61 53.762 54.922 -1.160 1
1 677 . 3 1 1 A 61 61 LYS CB C 61 36.273 34.844 1.429 1
1 681 . 3 1 1 A 61 61 LYS N N 61 121.930 123.358 -1.428 1
1 682 . 3 1 1 A 62 62 VAL H H 62 8.429 9.211 -0.782 1
1 683 . 3 1 1 A 62 62 VAL HA H 62 4.074 4.022 0.052 1
1 691 . 3 1 1 A 62 62 VAL C C 62 176.912 175.831 1.081 1
1 692 . 3 1 1 A 62 62 VAL CA C 62 63.188 63.544 -0.356 1
1 693 . 3 1 1 A 62 62 VAL CB C 62 30.813 31.843 -1.030 1
1 696 . 3 1 1 A 62 62 VAL N N 62 126.329 127.168 -0.839 1
1 697 . 3 1 1 A 63 63 LEU H H 63 9.109 9.338 -0.229 1
1 698 . 3 1 1 A 63 63 LEU HA H 63 4.423 4.505 -0.082 1
1 708 . 3 1 1 A 63 63 LEU C C 63 176.091 175.947 0.144 1
1 709 . 3 1 1 A 63 63 LEU CA C 63 55.876 56.147 -0.271 1
1 710 . 3 1 1 A 63 63 LEU CB C 63 42.800 44.684 -1.884 1
1 714 . 3 1 1 A 63 63 LEU N N 63 129.436 129.125 0.311 1
1 715 . 3 1 1 A 64 64 ALA H H 64 7.594 7.251 0.343 1
1 716 . 3 1 1 A 64 64 ALA HA H 64 4.455 4.648 -0.193 1
1 720 . 3 1 1 A 64 64 ALA C C 64 177.314 175.115 2.199 1
1 721 . 3 1 1 A 64 64 ALA CA C 64 52.557 51.657 0.900 1
1 722 . 3 1 1 A 64 64 ALA CB C 64 21.458 22.600 -1.142 1
1 723 . 3 1 1 A 64 64 ALA N N 64 117.791 118.563 -0.772 1
1 724 . 3 1 1 A 65 65 VAL H H 65 8.583 8.496 0.087 1
1 725 . 3 1 1 A 65 65 VAL HA H 65 4.470 4.450 0.020 1
1 733 . 3 1 1 A 65 65 VAL C C 65 174.697 175.504 -0.807 1
1 734 . 3 1 1 A 65 65 VAL CA C 65 61.936 61.208 0.728 1
1 735 . 3 1 1 A 65 65 VAL CB C 65 35.288 34.894 0.394 1
1 738 . 3 1 1 A 65 65 VAL N N 65 120.009 118.987 1.022 1
1 739 . 3 1 1 A 66 66 ASP H H 66 8.567 9.018 -0.451 1
1 740 . 3 1 1 A 66 66 ASP HA H 66 4.880 4.291 0.589 1
1 743 . 3 1 1 A 66 66 ASP C C 66 174.355 176.300 -1.945 1
1 744 . 3 1 1 A 66 66 ASP CA C 66 52.681 57.731 -5.050 1
1 745 . 3 1 1 A 66 66 ASP CB C 66 41.775 40.899 0.876 1
1 746 . 3 1 1 A 66 66 ASP N N 66 126.262 127.632 -1.370 1
1 747 . 3 1 1 A 67 67 GLU H H 67 9.148 8.188 0.960 1
1 748 . 3 1 1 A 67 67 GLU HA H 67 4.110 4.018 0.092 1
1 753 . 3 1 1 A 67 67 GLU C C 67 177.052 177.427 -0.375 1
1 754 . 3 1 1 A 67 67 GLU CA C 67 59.044 57.450 1.594 1
1 755 . 3 1 1 A 67 67 GLU CB C 67 29.919 28.787 1.132 1
1 757 . 3 1 1 A 67 67 GLU N N 67 125.480 118.546 6.934 1
1 758 . 3 1 1 A 68 68 GLU H H 68 8.384 8.270 0.114 1
1 759 . 3 1 1 A 68 68 GLU HA H 68 4.140 4.641 -0.501 1
1 764 . 3 1 1 A 68 68 GLU C C 68 178.383 177.502 0.881 1
1 765 . 3 1 1 A 68 68 GLU CA C 68 59.044 56.870 2.174 1
1 766 . 3 1 1 A 68 68 GLU CB C 68 29.919 32.189 -2.270 1
1 768 . 3 1 1 A 68 68 GLU N N 68 119.760 118.281 1.479 1
1 769 . 3 1 1 A 69 69 LYS H H 69 7.799 8.115 -0.316 1
1 770 . 3 1 1 A 69 69 LYS HA H 69 4.375 4.506 -0.131 1
1 779 . 3 1 1 A 69 69 LYS C C 69 178.297 176.790 1.507 1
1 780 . 3 1 1 A 69 69 LYS CA C 69 55.704 56.037 -0.333 1
1 781 . 3 1 1 A 69 69 LYS CB C 69 33.622 33.389 0.233 1
1 785 . 3 1 1 A 69 69 LYS N N 69 115.476 119.508 -4.032 1
1 786 . 3 1 1 A 70 70 GLY H H 70 7.994 7.756 0.238 1
1 787 . 3 1 1 A 70 70 GLY HA2 H 70 3.940 3.948 -0.008 1
1 788 . 3 1 1 A 70 70 GLY HA3 H 70 3.960 3.950 0.010 1
1 789 . 3 1 1 A 70 70 GLY C C 70 177.215 174.173 3.042 1
1 790 . 3 1 1 A 70 70 GLY CA C 70 46.773 46.619 0.154 1
1 791 . 3 1 1 A 70 70 GLY N N 70 110.245 108.837 1.408 1
1 792 . 3 1 1 A 71 71 LYS H H 71 7.560 7.712 -0.152 1
1 793 . 3 1 1 A 71 71 LYS HA H 71 4.690 4.998 -0.308 1
1 802 . 3 1 1 A 71 71 LYS C C 71 174.607 175.017 -0.410 1
1 803 . 3 1 1 A 71 71 LYS CA C 71 55.332 54.414 0.918 1
1 804 . 3 1 1 A 71 71 LYS CB C 71 34.903 36.415 -1.512 1
1 808 . 3 1 1 A 71 71 LYS N N 71 118.201 118.374 -0.173 1
1 809 . 3 1 1 A 72 72 ILE H H 72 8.867 8.773 0.094 1
1 810 . 3 1 1 A 72 72 ILE HA H 72 4.630 4.805 -0.175 1
1 820 . 3 1 1 A 72 72 ILE C C 72 175.708 174.762 0.946 1
1 821 . 3 1 1 A 72 72 ILE CA C 72 61.494 60.294 1.200 1
1 822 . 3 1 1 A 72 72 ILE CB C 72 40.652 41.596 -0.944 1
1 826 . 3 1 1 A 72 72 ILE N N 72 126.827 122.009 4.818 1
1 827 . 3 1 1 A 73 73 SER H H 73 8.815 8.997 -0.182 1
1 828 . 3 1 1 A 73 73 SER HA H 73 5.110 5.218 -0.108 1
1 831 . 3 1 1 A 73 73 SER C C 73 175.122 173.636 1.486 1
1 832 . 3 1 1 A 73 73 SER CA C 73 57.487 58.650 -1.163 1
1 833 . 3 1 1 A 73 73 SER CB C 73 64.386 64.020 0.366 1
1 834 . 3 1 1 A 73 73 SER N N 73 123.640 123.980 -0.340 1
1 835 . 3 1 1 A 74 74 LEU H H 74 8.585 8.792 -0.207 1
1 836 . 3 1 1 A 74 74 LEU HA H 74 5.450 5.259 0.191 1
1 846 . 3 1 1 A 74 74 LEU C C 74 174.061 175.562 -1.501 1
1 847 . 3 1 1 A 74 74 LEU CA C 74 53.101 53.353 -0.252 1
1 848 . 3 1 1 A 74 74 LEU CB C 74 48.268 46.605 1.663 1
1 852 . 3 1 1 A 74 74 LEU N N 74 125.221 124.619 0.602 1
1 853 . 3 1 1 A 75 75 SER H H 75 8.840 8.642 0.198 1
1 854 . 3 1 1 A 75 75 SER HA H 75 5.040 5.319 -0.279 1
1 857 . 3 1 1 A 75 75 SER C C 75 176.552 173.741 2.811 1
1 858 . 3 1 1 A 75 75 SER CA C 75 57.487 56.445 1.042 1
1 859 . 3 1 1 A 75 75 SER CB C 75 64.993 66.505 -1.512 1
1 860 . 3 1 1 A 75 75 SER N N 75 111.252 112.678 -1.426 1
1 861 . 3 1 1 A 76 76 ILE H H 76 7.790 8.908 -1.118 1
1 862 . 3 1 1 A 76 76 ILE HA H 76 4.690 4.549 0.141 1
1 872 . 3 1 1 A 76 76 ILE C C 76 175.780 177.199 -1.419 1
1 873 . 3 1 1 A 76 76 ILE CA C 76 63.631 62.143 1.488 1
1 874 . 3 1 1 A 76 76 ILE CB C 76 39.484 39.714 -0.230 1
1 878 . 3 1 1 A 76 76 ILE N N 76 129.205 120.332 8.873 1
1 879 . 3 1 1 A 77 77 ARG H H 77 8.115 8.546 -0.431 1
1 880 . 3 1 1 A 77 77 ARG HA H 77 3.760 4.124 -0.364 1
1 887 . 3 1 1 A 77 77 ARG C C 77 178.704 178.064 0.640 1
1 888 . 3 1 1 A 77 77 ARG CA C 77 58.933 58.706 0.227 1
1 889 . 3 1 1 A 77 77 ARG CB C 77 29.463 29.700 -0.237 1
1 892 . 3 1 1 A 77 77 ARG N N 77 123.257 121.933 1.324 1
1 893 . 3 1 1 A 78 78 ALA H H 78 8.304 7.923 0.381 1
1 894 . 3 1 1 A 78 78 ALA HA H 78 4.296 4.120 0.176 1
1 898 . 3 1 1 A 78 78 ALA C C 78 176.870 179.821 -2.951 1
1 899 . 3 1 1 A 78 78 ALA CA C 78 53.548 55.127 -1.579 1
1 900 . 3 1 1 A 78 78 ALA CB C 78 19.872 18.810 1.062 1
1 901 . 3 1 1 A 78 78 ALA N N 78 118.764 122.564 -3.800 1
1 902 . 3 1 1 A 79 79 THR H H 79 7.931 8.152 -0.221 1
1 903 . 3 1 1 A 79 79 THR HA H 79 4.370 4.043 0.327 1
1 908 . 3 1 1 A 79 79 THR C C 79 178.356 177.231 1.125 1
1 909 . 3 1 1 A 79 79 THR CA C 79 62.381 65.357 -2.976 1
1 910 . 3 1 1 A 79 79 THR CB C 79 69.693 68.327 1.366 1
1 912 . 3 1 1 A 79 79 THR N N 79 107.360 111.456 -4.096 1
1 913 . 3 1 1 A 80 80 GLN H H 80 7.651 8.779 -1.128 1
1 914 . 3 1 1 A 80 80 GLN HA H 80 4.527 4.226 0.301 1
1 921 . 3 1 1 A 80 80 GLN C C 80 174.249 176.534 -2.285 1
1 922 . 3 1 1 A 80 80 GLN CA C 80 54.760 57.574 -2.814 1
1 923 . 3 1 1 A 80 80 GLN CB C 80 30.565 28.876 1.689 1
1 925 . 3 1 1 A 80 80 GLN N N 80 121.588 120.262 1.326 1
1 927 . 3 1 1 A 81 81 ALA H H 81 8.498 7.712 0.786 1
1 928 . 3 1 1 A 81 81 ALA HA H 81 4.252 4.475 -0.223 1
1 932 . 3 1 1 A 81 81 ALA C C 81 175.693 176.621 -0.928 1
1 933 . 3 1 1 A 81 81 ALA CA C 81 52.345 51.073 1.272 1
1 934 . 3 1 1 A 81 81 ALA CB C 81 19.062 20.261 -1.199 1
1 935 . 3 1 1 A 81 81 ALA N N 81 126.423 121.210 5.213 1
1 936 . 3 1 1 A 82 82 ALA H H 82 8.324 7.284 1.040 1
1 937 . 3 1 1 A 82 82 ALA HA H 82 4.000 4.396 -0.396 1
1 941 . 3 1 1 A 82 82 ALA C C 82 177.065 177.751 -0.686 1
1 942 . 3 1 1 A 82 82 ALA CA C 82 50.240 50.801 -0.561 1
1 943 . 3 1 1 A 82 82 ALA CB C 82 17.650 18.244 -0.594 1
1 944 . 3 1 1 A 82 82 ALA N N 82 125.114 121.416 3.698 1
1 945 . 3 1 1 A 83 83 PRO HA H 83 4.350 4.371 -0.021 1
1 952 . 3 1 1 A 83 83 PRO CA C 83 63.148 64.318 -1.170 1
1 953 . 3 1 1 A 83 83 PRO CB C 83 32.054 32.122 -0.068 1
1 956 . 3 1 1 A 84 84 GLU H H 84 8.517 7.505 1.012 1
1 957 . 3 1 1 A 84 84 GLU HA H 84 4.197 4.862 -0.665 1
1 962 . 3 1 1 A 84 84 GLU C C 84 176.948 174.549 2.399 1
1 963 . 3 1 1 A 84 84 GLU CA C 84 56.674 55.461 1.213 1
1 964 . 3 1 1 A 84 84 GLU CB C 84 30.459 33.340 -2.881 1
1 966 . 3 1 1 A 84 84 GLU N N 84 121.479 115.931 5.548 1
1 967 . 3 1 1 A 85 85 LYS H H 85 8.381 8.823 -0.442 1
1 968 . 3 1 1 A 85 85 LYS HA H 85 4.309 5.113 -0.804 1
1 977 . 3 1 1 A 85 85 LYS C C 85 176.457 174.396 2.061 1
1 978 . 3 1 1 A 85 85 LYS CA C 85 56.272 54.661 1.611 1
1 979 . 3 1 1 A 85 85 LYS CB C 85 32.961 36.696 -3.735 1
1 983 . 3 1 1 A 85 85 LYS N N 85 123.266 122.801 0.465 1
1 984 . 3 1 1 A 86 86 LYS H H 86 8.403 8.850 -0.447 1
1 985 . 3 1 1 A 86 86 LYS HA H 86 4.308 5.225 -0.917 1
1 994 . 3 1 1 A 86 86 LYS C C 86 176.435 174.547 1.888 1
1 995 . 3 1 1 A 86 86 LYS CA C 86 56.272 54.318 1.954 1
1 996 . 3 1 1 A 86 86 LYS CB C 86 32.961 37.252 -4.291 1
1 1000 . 3 1 1 A 86 86 LYS N N 86 123.688 117.167 6.521 1
1 1001 . 3 1 1 A 87 87 GLU H H 87 8.540 9.024 -0.484 1
1 1002 . 3 1 1 A 87 87 GLU HA H 87 4.358 5.153 -0.795 1
1 1007 . 3 1 1 A 87 87 GLU C C 87 176.556 174.511 2.045 1
1 1008 . 3 1 1 A 87 87 GLU CA C 87 56.406 54.769 1.637 1
1 1009 . 3 1 1 A 87 87 GLU CB C 87 30.607 34.037 -3.430 1
1 1011 . 3 1 1 A 87 87 GLU N N 87 122.633 119.282 3.351 1
1 1012 . 3 1 1 A 88 88 SER H H 88 8.520 8.559 -0.039 1
1 1013 . 3 1 1 A 88 88 SER HA H 88 4.490 5.022 -0.532 1
1 1016 . 3 1 1 A 88 88 SER C C 88 175.780 173.185 2.595 1
1 1017 . 3 1 1 A 88 88 SER CA C 88 58.431 56.686 1.745 1
1 1018 . 3 1 1 A 88 88 SER CB C 88 63.858 66.294 -2.436 1
1 1019 . 3 1 1 A 88 88 SER N N 88 118.333 114.504 3.829 1
1 1020 . 3 1 1 A 89 89 LYS H H 89 8.339 8.400 -0.061 1
1 1021 . 3 1 1 A 89 89 LYS HA H 89 4.620 4.586 0.034 1
1 1030 . 3 1 1 A 89 89 LYS C C 89 174.160 174.541 -0.381 1
1 1031 . 3 1 1 A 89 89 LYS CA C 89 54.265 54.507 -0.242 1
1 1032 . 3 1 1 A 89 89 LYS CB C 89 32.672 31.669 1.003 1
1 1036 . 3 1 1 A 89 89 LYS N N 89 124.433 122.800 1.633 1
1 1037 . 3 1 1 A 90 90 PRO HA H 90 4.417 4.654 -0.237 1
1 1044 . 3 1 1 A 90 90 PRO CA C 90 63.064 62.922 0.142 1
1 1045 . 3 1 1 A 90 90 PRO CB C 90 32.266 32.770 -0.504 1
1 1048 . 3 1 1 A 91 91 ARG H H 91 8.502 8.915 -0.413 1
1 1049 . 3 1 1 A 91 91 ARG HA H 91 4.305 4.480 -0.175 1
1 1056 . 3 1 1 A 91 91 ARG C C 91 176.831 175.433 1.398 1
1 1057 . 3 1 1 A 91 91 ARG CA C 91 56.002 56.484 -0.482 1
1 1058 . 3 1 1 A 91 91 ARG CB C 91 30.913 30.764 0.149 1
1 1061 . 3 1 1 A 91 91 ARG N N 91 122.193 118.596 3.597 1
1 1062 . 3 1 1 A 92 92 LYS H H 92 8.415 7.493 0.922 1
1 1063 . 3 1 1 A 92 92 LYS HA H 92 4.610 4.753 -0.143 1
1 1072 . 3 1 1 A 92 92 LYS C C 92 176.262 173.827 2.435 1
1 1073 . 3 1 1 A 92 92 LYS CA C 92 54.258 53.089 1.169 1
1 1074 . 3 1 1 A 92 92 LYS CB C 92 32.672 34.678 -2.006 1
1 1078 . 3 1 1 A 92 92 LYS N N 92 124.243 118.519 5.724 1
1 1079 . 3 1 1 A 93 93 PRO HA H 93 4.415 4.676 -0.261 1
1 1086 . 3 1 1 A 93 93 PRO CA C 93 62.899 62.722 0.177 1
1 1087 . 3 1 1 A 93 93 PRO CB C 93 32.323 32.926 -0.603 1
1 1090 . 3 1 1 A 94 94 LYS H H 94 8.420 8.602 -0.182 1
1 1091 . 3 1 1 A 94 94 LYS HA H 94 4.290 4.910 -0.620 1
1 1100 . 3 1 1 A 94 94 LYS C C 94 176.714 174.998 1.716 1
1 1101 . 3 1 1 A 94 94 LYS CA C 94 56.585 54.742 1.843 1
1 1102 . 3 1 1 A 94 94 LYS CB C 94 33.161 37.251 -4.090 1
1 1106 . 3 1 1 A 94 94 LYS N N 94 122.121 120.600 1.521 1
1 1107 . 3 1 1 A 95 95 ALA H H 95 8.348 8.586 -0.238 1
1 1108 . 3 1 1 A 95 95 ALA HA H 95 4.250 4.805 -0.555 1
1 1112 . 3 1 1 A 95 95 ALA C C 95 176.453 178.318 -1.865 1
1 1113 . 3 1 1 A 95 95 ALA CA C 95 52.471 51.109 1.362 1
1 1114 . 3 1 1 A 95 95 ALA CB C 95 19.347 19.771 -0.424 1
1 1115 . 3 1 1 A 95 95 ALA N N 95 125.624 123.509 2.115 1
1 1116 . 3 1 1 A 96 96 ALA H H 96 8.348 8.070 0.278 1
1 1117 . 3 1 1 A 96 96 ALA HA H 96 4.254 4.269 -0.015 1
1 1121 . 3 1 1 A 96 96 ALA C C 96 176.462 177.777 -1.315 1
1 1122 . 3 1 1 A 96 96 ALA CA C 96 52.471 52.756 -0.285 1
1 1123 . 3 1 1 A 96 96 ALA CB C 96 19.347 19.252 0.095 1
1 1124 . 3 1 1 A 96 96 ALA N N 96 125.624 121.179 4.445 1
1 1125 . 3 1 1 A 97 97 GLN H H 97 8.333 8.009 0.324 1
1 1126 . 3 1 1 A 97 97 GLN HA H 97 4.362 4.437 -0.075 1
1 1133 . 3 1 1 A 97 97 GLN C C 97 177.684 175.525 2.159 1
1 1134 . 3 1 1 A 97 97 GLN CA C 97 55.848 56.353 -0.505 1
1 1135 . 3 1 1 A 97 97 GLN CB C 97 29.643 29.671 -0.028 1
1 1137 . 3 1 1 A 97 97 GLN N N 97 120.049 118.231 1.818 1
1 1139 . 3 1 1 A 98 98 VAL H H 98 8.230 8.515 -0.285 1
1 1140 . 3 1 1 A 98 98 VAL HA H 98 4.145 4.657 -0.512 1
1 1148 . 3 1 1 A 98 98 VAL C C 98 176.033 176.267 -0.234 1
1 1149 . 3 1 1 A 98 98 VAL CA C 98 62.444 58.912 3.532 1
1 1150 . 3 1 1 A 98 98 VAL CB C 98 32.942 35.173 -2.231 1
1 1153 . 3 1 1 A 98 98 VAL N N 98 121.607 116.253 5.354 1
1 1154 . 3 1 1 A 99 99 SER H H 99 8.375 8.944 -0.569 1
1 1155 . 3 1 1 A 99 99 SER HA H 99 4.473 4.070 0.403 1
1 1158 . 3 1 1 A 99 99 SER C C 99 176.204 176.585 -0.381 1
1 1159 . 3 1 1 A 99 99 SER CA C 99 58.379 62.255 -3.876 1
1 1160 . 3 1 1 A 99 99 SER CB C 99 63.914 62.971 0.943 1
1 1161 . 3 1 1 A 99 99 SER N N 99 119.455 119.259 0.196 1
1 1162 . 3 1 1 A 100 100 GLU H H 100 8.547 8.039 0.508 1
1 1163 . 3 1 1 A 100 100 GLU HA H 100 4.304 4.191 0.113 1
1 1168 . 3 1 1 A 100 100 GLU C C 100 174.620 176.414 -1.794 1
1 1169 . 3 1 1 A 100 100 GLU CA C 100 56.835 58.221 -1.386 1
1 1170 . 3 1 1 A 100 100 GLU CB C 100 30.365 29.326 1.039 1
1 1172 . 3 1 1 A 100 100 GLU N N 100 123.419 119.853 3.566 1
1 1173 . 3 1 1 A 101 101 GLU H H 101 8.432 8.147 0.285 1
1 1174 . 3 1 1 A 101 101 GLU HA H 101 4.252 4.591 -0.339 1
1 1179 . 3 1 1 A 101 101 GLU C C 101 176.693 176.768 -0.075 1
1 1180 . 3 1 1 A 101 101 GLU CA C 101 56.835 55.410 1.425 1
1 1181 . 3 1 1 A 101 101 GLU CB C 101 30.365 30.594 -0.229 1
1 1183 . 3 1 1 A 101 101 GLU N N 101 122.025 120.339 1.686 1
1 1184 . 3 1 1 A 102 102 ALA H H 102 8.324 8.076 0.248 1
1 1185 . 3 1 1 A 102 102 ALA HA H 102 4.361 4.271 0.090 1
1 1189 . 3 1 1 A 102 102 ALA C C 102 177.065 177.446 -0.381 1
1 1190 . 3 1 1 A 102 102 ALA CA C 102 52.647 52.529 0.118 1
1 1191 . 3 1 1 A 102 102 ALA CB C 102 19.227 18.501 0.726 1
1 1192 . 3 1 1 A 102 102 ALA N N 102 125.114 124.763 0.351 1
1 1193 . 3 1 1 A 103 103 SER H H 103 8.259 7.677 0.582 1
1 1194 . 3 1 1 A 103 103 SER HA H 103 4.473 4.528 -0.055 1
1 1197 . 3 1 1 A 103 103 SER C C 103 177.772 174.504 3.268 1
1 1198 . 3 1 1 A 103 103 SER CA C 103 58.301 59.025 -0.724 1
1 1199 . 3 1 1 A 103 103 SER CB C 103 63.961 64.341 -0.380 1
1 1200 . 3 1 1 A 103 103 SER N N 103 115.109 114.642 0.467 1
1 1201 . 3 1 1 A 104 104 THR H H 104 8.127 8.476 -0.349 1
1 1202 . 3 1 1 A 104 104 THR HA H 104 4.600 4.361 0.239 1
1 1207 . 3 1 1 A 104 104 THR C C 104 174.427 172.883 1.544 1
1 1208 . 3 1 1 A 104 104 THR CA C 104 59.954 61.474 -1.520 1
1 1209 . 3 1 1 A 104 104 THR CB C 104 69.868 69.518 0.350 1
1 1211 . 3 1 1 A 104 104 THR N N 104 117.882 117.418 0.464 1
1 1212 . 3 1 1 A 105 105 PRO HA H 105 4.414 4.537 -0.123 1
1 1219 . 3 1 1 A 105 105 PRO CA C 105 63.300 62.688 0.612 1
1 1220 . 3 1 1 A 105 105 PRO CB C 105 32.227 32.604 -0.377 1
1 1223 . 3 1 1 A 106 106 GLN H H 106 8.524 9.110 -0.586 1
1 1224 . 3 1 1 A 106 106 GLN HA H 106 4.276 4.120 0.156 1
1 1229 . 3 1 1 A 106 106 GLN C C 106 177.083 175.985 1.098 1
1 1230 . 3 1 1 A 106 106 GLN CA C 106 56.209 57.803 -1.594 1
1 1231 . 3 1 1 A 106 106 GLN CB C 106 29.490 29.711 -0.221 1
1 1233 . 3 1 1 A 106 106 GLN N N 106 120.754 119.625 1.129 1
1 1234 . 3 1 1 A 107 107 GLY H H 107 8.394 7.460 0.934 1
1 1235 . 3 1 1 A 107 107 GLY HA2 H 107 3.895 4.002 -0.107 1
1 1236 . 3 1 1 A 107 107 GLY HA3 H 107 3.895 4.024 -0.129 1
1 1237 . 3 1 1 A 107 107 GLY C C 107 176.651 171.034 5.617 1
1 1238 . 3 1 1 A 107 107 GLY CA C 107 45.330 45.702 -0.372 1
1 1239 . 3 1 1 A 107 107 GLY N N 107 110.026 104.424 5.602 1
1 1240 . 3 1 1 A 108 108 PHE H H 108 8.099 8.634 -0.535 1
1 1241 . 3 1 1 A 108 108 PHE HA H 108 4.582 5.188 -0.606 1
1 1245 . 3 1 1 A 108 108 PHE C C 108 173.944 172.480 1.464 1
1 1246 . 3 1 1 A 108 108 PHE CA C 108 58.054 56.319 1.735 1
1 1247 . 3 1 1 A 108 108 PHE CB C 108 39.708 40.911 -1.203 1
1 1248 . 3 1 1 A 108 108 PHE N N 108 120.180 114.903 5.277 1
1 1249 . 3 1 1 A 109 109 ASN H H 109 8.482 8.821 -0.339 1
1 1250 . 3 1 1 A 109 109 ASN HA H 109 4.691 4.749 -0.058 1
1 1255 . 3 1 1 A 109 109 ASN C C 109 175.627 176.039 -0.412 1
1 1256 . 3 1 1 A 109 109 ASN CA C 109 53.402 53.485 -0.083 1
1 1257 . 3 1 1 A 109 109 ASN CB C 109 38.883 39.947 -1.064 1
1 1258 . 3 1 1 A 109 109 ASN N N 109 120.752 118.607 2.145 1
1 1260 . 3 1 1 A 110 110 THR H H 110 8.112 8.739 -0.627 1
1 1261 . 3 1 1 A 110 110 THR HA H 110 4.251 4.508 -0.257 1
1 1266 . 3 1 1 A 110 110 THR C C 110 175.275 174.651 0.624 1
1 1267 . 3 1 1 A 110 110 THR CA C 110 62.460 61.417 1.043 1
1 1268 . 3 1 1 A 110 110 THR CB C 110 69.726 70.181 -0.455 1
1 1270 . 3 1 1 A 110 110 THR N N 110 114.601 115.371 -0.770 1
1 1271 . 3 1 1 A 111 111 LEU H H 111 8.168 7.596 0.572 1
1 1272 . 3 1 1 A 111 111 LEU HA H 111 4.308 4.272 0.036 1
1 1282 . 3 1 1 A 111 111 LEU CA C 111 55.704 54.789 0.915 1
1 1283 . 3 1 1 A 111 111 LEU CB C 111 42.071 41.955 0.116 1
1 1287 . 3 1 1 A 111 111 LEU N N 111 123.756 124.449 -0.693 1
1 1288 . 3 1 1 A 112 112 LYS H H 112 8.123 8.753 -0.630 1
1 1289 . 3 1 1 A 112 112 LYS HA H 112 4.242 4.122 0.120 1
1 1298 . 3 1 1 A 112 112 LYS C C 112 177.547 175.347 2.200 1
1 1299 . 3 1 1 A 112 112 LYS CA C 112 56.928 58.277 -1.349 1
1 1300 . 3 1 1 A 112 112 LYS CB C 112 33.055 33.152 -0.097 1
1 1304 . 3 1 1 A 112 112 LYS N N 112 121.442 124.983 -3.541 1
1 1305 . 3 1 1 A 113 113 ASP H H 113 8.230 7.749 0.481 1
1 1306 . 3 1 1 A 113 113 ASP HA H 113 4.526 4.984 -0.458 1
1 1309 . 3 1 1 A 113 113 ASP C C 113 176.532 174.288 2.244 1
1 1310 . 3 1 1 A 113 113 ASP CA C 113 54.896 52.939 1.957 1
1 1311 . 3 1 1 A 113 113 ASP CB C 113 41.362 44.563 -3.201 1
1 1312 . 3 1 1 A 113 113 ASP N N 113 120.598 118.295 2.303 1
1 1313 . 3 1 1 A 114 114 LYS H H 114 8.127 8.533 -0.406 1
1 1314 . 3 1 1 A 114 114 LYS HA H 114 4.300 4.308 -0.008 1
1 1323 . 3 1 1 A 114 114 LYS C C 114 176.303 176.215 0.088 1
1 1324 . 3 1 1 A 114 114 LYS CA C 114 56.633 57.072 -0.439 1
1 1325 . 3 1 1 A 114 114 LYS CB C 114 32.818 32.947 -0.129 1
1 1329 . 3 1 1 A 114 114 LYS N N 114 120.897 122.632 -1.735 1
1 1330 . 3 1 1 A 115 115 LEU H H 115 8.244 8.683 -0.439 1
1 1331 . 3 1 1 A 115 115 LEU HA H 115 4.254 4.066 0.188 1
1 1341 . 3 1 1 A 115 115 LEU C C 115 176.909 177.533 -0.624 1
1 1342 . 3 1 1 A 115 115 LEU CA C 115 56.282 54.077 2.205 1
1 1343 . 3 1 1 A 115 115 LEU CB C 115 42.188 45.046 -2.858 1
1 1347 . 3 1 1 A 115 115 LEU N N 115 123.251 125.234 -1.983 1
1 1348 . 3 1 1 A 116 116 GLU H H 116 8.421 8.129 0.292 1
1 1349 . 3 1 1 A 116 116 GLU HA H 116 4.190 4.163 0.027 1
1 1352 . 3 1 1 A 116 116 GLU C C 116 177.828 175.957 1.871 1
1 1353 . 3 1 1 A 116 116 GLU CA C 116 57.466 58.089 -0.623 1
1 1354 . 3 1 1 A 116 116 GLU CB C 116 30.124 29.840 0.284 1
1 1355 . 3 1 1 A 116 116 GLU N N 116 120.575 118.401 2.174 1
1 1356 . 3 1 1 A 117 117 GLU H H 117 8.255 7.492 0.763 1
1 1357 . 3 1 1 A 117 117 GLU HA H 117 4.192 4.875 -0.683 1
1 1362 . 3 1 1 A 117 117 GLU CA C 117 57.491 54.406 3.085 1
1 1363 . 3 1 1 A 117 117 GLU CB C 117 30.365 34.527 -4.162 1
1 1365 . 3 1 1 A 117 117 GLU N N 117 120.933 116.943 3.990 1
1 1366 . 3 1 1 A 118 118 TRP H H 118 8.143 8.370 -0.227 1
1 1367 . 3 1 1 A 118 118 TRP HA H 118 4.581 5.022 -0.441 1
1 1372 . 3 1 1 A 118 118 TRP C C 118 176.794 176.765 0.029 1
1 1373 . 3 1 1 A 118 118 TRP CA C 118 58.363 56.354 2.009 1
1 1374 . 3 1 1 A 118 118 TRP CB C 118 29.333 33.816 -4.483 1
1 1375 . 3 1 1 A 118 118 TRP N N 118 121.592 120.045 1.547 1
1 1376 . 3 1 1 A 119 119 ILE H H 119 7.908 8.697 -0.789 1
1 1377 . 3 1 1 A 119 119 ILE HA H 119 3.828 4.115 -0.287 1
1 1387 . 3 1 1 A 119 119 ILE C C 119 176.984 175.751 1.233 1
1 1388 . 3 1 1 A 119 119 ILE CA C 119 62.335 62.729 -0.394 1
1 1389 . 3 1 1 A 119 119 ILE CB C 119 38.649 37.541 1.108 1
1 1393 . 3 1 1 A 119 119 ILE N N 119 122.744 120.815 1.929 1
1 1394 . 3 1 1 A 120 120 GLU H H 120 8.143 7.798 0.345 1
1 1395 . 3 1 1 A 120 120 GLU HA H 120 4.093 4.744 -0.651 1
1 1400 . 3 1 1 A 120 120 GLU C C 120 176.565 176.220 0.345 1
1 1401 . 3 1 1 A 120 120 GLU CA C 120 57.613 55.526 2.087 1
1 1402 . 3 1 1 A 120 120 GLU CB C 120 29.834 33.008 -3.174 1
1 1404 . 3 1 1 A 120 120 GLU N N 120 123.139 121.245 1.894 1
1 1405 . 3 1 1 A 121 121 MET H H 121 8.254 8.690 -0.436 1
1 1406 . 3 1 1 A 121 121 MET HA H 121 4.357 4.346 0.011 1
1 1411 . 3 1 1 A 121 121 MET CA C 121 56.625 57.961 -1.336 1
1 1412 . 3 1 1 A 121 121 MET CB C 121 32.664 32.532 0.132 1
1 1414 . 3 1 1 A 121 121 MET N N 121 120.449 123.921 -3.472 1
1 1415 . 3 1 1 A 122 122 SER H H 122 8.199 7.778 0.421 1
1 1416 . 3 1 1 A 122 122 SER HA H 122 4.280 4.421 -0.141 1
1 1419 . 3 1 1 A 122 122 SER C C 122 177.224 173.764 3.460 1
1 1420 . 3 1 1 A 122 122 SER CA C 122 59.635 59.152 0.483 1
1 1421 . 3 1 1 A 122 122 SER CB C 122 63.560 63.964 -0.404 1
1 1422 . 3 1 1 A 122 122 SER N N 122 115.857 115.120 0.737 1
1 1423 . 3 1 1 A 123 123 ASN H H 123 8.211 8.597 -0.386 1
1 1424 . 3 1 1 A 123 123 ASN HA H 123 4.737 5.222 -0.485 1
1 1429 . 3 1 1 A 123 123 ASN C C 123 174.709 172.976 1.733 1
1 1430 . 3 1 1 A 123 123 ASN CA C 123 53.507 52.232 1.275 1
1 1431 . 3 1 1 A 123 123 ASN CB C 123 38.800 42.490 -3.690 1
1 1432 . 3 1 1 A 123 123 ASN N N 123 119.923 121.357 -1.434 1
1 1434 . 3 1 1 A 124 124 ARG H H 124 7.997 8.499 -0.502 1
1 1435 . 3 1 1 A 124 124 ARG HA H 124 4.305 4.850 -0.545 1
1 1442 . 3 1 1 A 124 124 ARG C C 124 175.477 174.881 0.596 1
1 1443 . 3 1 1 A 124 124 ARG CA C 124 56.709 54.183 2.526 1
1 1444 . 3 1 1 A 124 124 ARG CB C 124 30.584 34.234 -3.650 1
1 1447 . 3 1 1 A 124 124 ARG N N 124 120.821 124.568 -3.747 1
1 1448 . 3 1 1 A 125 125 LYS H H 125 8.327 8.563 -0.236 1
1 1449 . 3 1 1 A 125 125 LYS HA H 125 4.254 4.186 0.068 1
1 1458 . 3 1 1 A 125 125 LYS C C 125 176.777 177.665 -0.888 1
1 1459 . 3 1 1 A 125 125 LYS CA C 125 56.860 57.233 -0.373 1
1 1460 . 3 1 1 A 125 125 LYS CB C 125 32.879 33.140 -0.261 1
1 1464 . 3 1 1 A 125 125 LYS N N 125 121.891 123.533 -1.642 1
1 1465 . 3 1 1 A 126 126 ASP H H 126 8.343 9.297 -0.954 1
1 1466 . 3 1 1 A 126 126 ASP HA H 126 4.581 4.510 0.071 1
1 1469 . 3 1 1 A 126 126 ASP C C 126 176.538 177.352 -0.814 1
1 1470 . 3 1 1 A 126 126 ASP CA C 126 54.540 57.021 -2.481 1
1 1471 . 3 1 1 A 126 126 ASP CB C 126 40.907 40.445 0.462 1
1 1472 . 3 1 1 A 126 126 ASP N N 126 119.814 128.634 -8.820 1
1 1473 . 3 1 1 A 127 127 LEU H H 127 7.946 8.014 -0.068 1
1 1474 . 3 1 1 A 127 127 LEU HA H 127 4.309 4.077 0.232 1
1 1484 . 3 1 1 A 127 127 LEU C C 127 176.043 178.576 -2.533 1
1 1485 . 3 1 1 A 127 127 LEU CA C 127 55.427 57.238 -1.811 1
1 1486 . 3 1 1 A 127 127 LEU CB C 127 42.394 41.854 0.540 1
1 1490 . 3 1 1 A 127 127 LEU N N 127 121.432 120.102 1.330 1
1 1491 . 3 1 1 A 128 128 ILE H H 128 7.967 7.596 0.371 1
1 1492 . 3 1 1 A 128 128 ILE HA H 128 4.141 3.900 0.241 1
1 1502 . 3 1 1 A 128 128 ILE C C 128 177.200 176.864 0.336 1
1 1503 . 3 1 1 A 128 128 ILE CA C 128 61.150 64.199 -3.049 1
1 1504 . 3 1 1 A 128 128 ILE CB C 128 38.489 37.175 1.314 1
1 1508 . 3 1 1 A 128 128 ILE N N 128 121.579 115.068 6.511 1
1 1509 . 3 1 1 A 129 129 LYS H H 129 8.331 7.411 0.920 1
1 1510 . 3 1 1 A 129 129 LYS HA H 129 4.328 4.304 0.024 1
1 1519 . 3 1 1 A 129 129 LYS C C 129 175.952 177.174 -1.222 1
1 1520 . 3 1 1 A 129 129 LYS CA C 129 56.330 56.231 0.099 1
1 1521 . 3 1 1 A 129 129 LYS CB C 129 33.010 32.720 0.290 1
1 1525 . 3 1 1 A 129 129 LYS N N 129 126.955 123.811 3.144 1
1 1 . 4 1 1 A 2 2 ALA HA H 2 4.070 4.134 -0.064 1
1 5 . 4 1 1 A 2 2 ALA CA C 2 52.067 54.720 -2.653 1
1 6 . 4 1 1 A 2 2 ALA CB C 2 19.577 18.930 0.647 1
1 7 . 4 1 1 A 3 3 ALA H H 3 8.714 7.195 1.519 1
1 8 . 4 1 1 A 3 3 ALA HA H 3 4.253 4.582 -0.329 1
1 12 . 4 1 1 A 3 3 ALA C C 3 173.672 177.415 -3.743 1
1 13 . 4 1 1 A 3 3 ALA CA C 3 52.067 51.027 1.040 1
1 14 . 4 1 1 A 3 3 ALA CB C 3 19.577 21.217 -1.640 1
1 15 . 4 1 1 A 3 3 ALA N N 3 124.480 116.452 8.028 1
1 16 . 4 1 1 A 4 4 LYS H H 4 8.227 8.961 -0.734 1
1 17 . 4 1 1 A 4 4 LYS HA H 4 3.976 4.121 -0.145 1
1 26 . 4 1 1 A 4 4 LYS C C 4 176.672 175.589 1.083 1
1 27 . 4 1 1 A 4 4 LYS CA C 4 57.274 58.111 -0.837 1
1 28 . 4 1 1 A 4 4 LYS CB C 4 33.209 31.821 1.388 1
1 32 . 4 1 1 A 4 4 LYS N N 4 120.988 116.311 4.677 1
1 33 . 4 1 1 A 5 5 PHE H H 5 7.719 7.765 -0.046 1
1 34 . 4 1 1 A 5 5 PHE HA H 5 4.384 5.151 -0.767 1
1 38 . 4 1 1 A 5 5 PHE C C 5 175.364 174.217 1.147 1
1 39 . 4 1 1 A 5 5 PHE CA C 5 57.074 56.370 0.704 1
1 40 . 4 1 1 A 5 5 PHE CB C 5 39.669 43.436 -3.767 1
1 41 . 4 1 1 A 5 5 PHE N N 5 119.246 118.536 0.710 1
1 42 . 4 1 1 A 6 6 GLU H H 6 8.515 8.404 0.111 1
1 43 . 4 1 1 A 6 6 GLU HA H 6 4.370 5.021 -0.651 1
1 48 . 4 1 1 A 6 6 GLU CA C 6 55.669 54.203 1.466 1
1 49 . 4 1 1 A 6 6 GLU CB C 6 32.094 33.716 -1.622 1
1 51 . 4 1 1 A 6 6 GLU N N 6 122.193 118.833 3.360 1
1 52 . 4 1 1 A 7 7 VAL H H 7 8.636 8.596 0.040 1
1 53 . 4 1 1 A 7 7 VAL HA H 7 3.406 3.505 -0.099 1
1 61 . 4 1 1 A 7 7 VAL C C 7 176.611 177.087 -0.476 1
1 62 . 4 1 1 A 7 7 VAL CA C 7 65.358 65.618 -0.260 1
1 63 . 4 1 1 A 7 7 VAL CB C 7 31.391 31.472 -0.081 1
1 66 . 4 1 1 A 7 7 VAL N N 7 122.949 122.452 0.497 1
1 67 . 4 1 1 A 8 8 GLY H H 8 9.394 9.109 0.285 1
1 68 . 4 1 1 A 8 8 GLY HA2 H 8 3.600 4.057 -0.457 1
1 69 . 4 1 1 A 8 8 GLY HA3 H 8 4.546 4.062 0.484 1
1 70 . 4 1 1 A 8 8 GLY C C 8 178.074 174.464 3.610 1
1 71 . 4 1 1 A 8 8 GLY CA C 8 45.121 44.859 0.262 1
1 72 . 4 1 1 A 8 8 GLY N N 8 116.837 115.966 0.871 1
1 73 . 4 1 1 A 9 9 SER H H 9 8.021 8.018 0.003 1
1 74 . 4 1 1 A 9 9 SER HA H 9 4.680 4.522 0.158 1
1 77 . 4 1 1 A 9 9 SER C C 9 174.234 173.121 1.113 1
1 78 . 4 1 1 A 9 9 SER CA C 9 59.387 59.549 -0.162 1
1 79 . 4 1 1 A 9 9 SER CB C 9 65.584 64.541 1.043 1
1 80 . 4 1 1 A 9 9 SER N N 9 118.208 117.888 0.320 1
1 81 . 4 1 1 A 10 10 VAL H H 10 7.945 8.470 -0.525 1
1 82 . 4 1 1 A 10 10 VAL HA H 10 4.980 5.124 -0.144 1
1 90 . 4 1 1 A 10 10 VAL C C 10 171.388 174.510 -3.122 1
1 91 . 4 1 1 A 10 10 VAL CA C 10 61.021 61.101 -0.080 1
1 92 . 4 1 1 A 10 10 VAL CB C 10 33.400 34.991 -1.591 1
1 95 . 4 1 1 A 10 10 VAL N N 10 121.118 122.711 -1.593 1
1 96 . 4 1 1 A 11 11 TYR H H 11 9.008 9.279 -0.271 1
1 97 . 4 1 1 A 11 11 TYR HA H 11 4.850 4.964 -0.114 1
1 101 . 4 1 1 A 11 11 TYR C C 11 174.926 173.614 1.312 1
1 102 . 4 1 1 A 11 11 TYR CA C 11 56.803 56.635 0.168 1
1 103 . 4 1 1 A 11 11 TYR CB C 11 43.676 40.882 2.794 1
1 104 . 4 1 1 A 11 11 TYR N N 11 125.043 128.156 -3.113 1
1 105 . 4 1 1 A 12 12 THR H H 12 8.809 8.004 0.805 1
1 106 . 4 1 1 A 12 12 THR HA H 12 5.020 5.352 -0.332 1
1 111 . 4 1 1 A 12 12 THR C C 12 174.195 173.690 0.505 1
1 112 . 4 1 1 A 12 12 THR CA C 12 62.487 60.188 2.299 1
1 113 . 4 1 1 A 12 12 THR CB C 12 69.743 72.277 -2.534 1
1 115 . 4 1 1 A 12 12 THR N N 12 116.850 115.570 1.280 1
1 116 . 4 1 1 A 13 13 GLY H H 13 9.179 8.272 0.907 1
1 117 . 4 1 1 A 13 13 GLY HA2 H 13 3.250 4.110 -0.860 1
1 118 . 4 1 1 A 13 13 GLY HA3 H 13 4.801 4.142 0.659 1
1 119 . 4 1 1 A 13 13 GLY C C 13 174.654 171.795 2.859 1
1 120 . 4 1 1 A 13 13 GLY CA C 13 44.377 45.211 -0.834 1
1 121 . 4 1 1 A 13 13 GLY N N 13 113.654 111.007 2.647 1
1 122 . 4 1 1 A 14 14 LYS H H 14 7.770 8.707 -0.937 1
1 123 . 4 1 1 A 14 14 LYS HA H 14 5.426 5.209 0.217 1
1 132 . 4 1 1 A 14 14 LYS C C 14 171.343 175.862 -4.519 1
1 133 . 4 1 1 A 14 14 LYS CA C 14 53.879 54.596 -0.717 1
1 134 . 4 1 1 A 14 14 LYS CB C 14 36.032 35.178 0.854 1
1 138 . 4 1 1 A 14 14 LYS N N 14 118.322 120.639 -2.317 1
1 139 . 4 1 1 A 15 15 VAL H H 15 9.206 9.202 0.004 1
1 140 . 4 1 1 A 15 15 VAL HA H 15 4.400 4.226 0.174 1
1 148 . 4 1 1 A 15 15 VAL C C 15 176.306 177.056 -0.750 1
1 149 . 4 1 1 A 15 15 VAL CA C 15 63.648 63.450 0.198 1
1 150 . 4 1 1 A 15 15 VAL CB C 15 31.769 31.571 0.198 1
1 153 . 4 1 1 A 15 15 VAL N N 15 125.308 127.254 -1.946 1
1 154 . 4 1 1 A 16 16 THR H H 16 9.403 9.285 0.118 1
1 155 . 4 1 1 A 16 16 THR HA H 16 4.562 4.666 -0.104 1
1 160 . 4 1 1 A 16 16 THR C C 16 178.098 174.677 3.421 1
1 161 . 4 1 1 A 16 16 THR CA C 16 62.018 61.600 0.418 1
1 162 . 4 1 1 A 16 16 THR CB C 16 69.720 69.856 -0.136 1
1 164 . 4 1 1 A 16 16 THR N N 16 121.753 117.788 3.965 1
1 165 . 4 1 1 A 17 17 GLY H H 17 7.600 7.075 0.525 1
1 166 . 4 1 1 A 17 17 GLY HA2 H 17 4.110 4.111 -0.001 1
1 167 . 4 1 1 A 17 17 GLY HA3 H 17 4.250 4.246 0.004 1
1 168 . 4 1 1 A 17 17 GLY C C 17 175.551 171.242 4.309 1
1 169 . 4 1 1 A 17 17 GLY CA C 17 46.258 45.561 0.697 1
1 170 . 4 1 1 A 17 17 GLY N N 17 109.407 108.656 0.751 1
1 171 . 4 1 1 A 18 18 LEU H H 18 8.820 8.521 0.299 1
1 172 . 4 1 1 A 18 18 LEU HA H 18 4.852 5.033 -0.181 1
1 182 . 4 1 1 A 18 18 LEU CA C 18 54.245 53.196 1.049 1
1 183 . 4 1 1 A 18 18 LEU CB C 18 44.906 46.431 -1.525 1
1 187 . 4 1 1 A 18 18 LEU N N 18 123.419 120.576 2.843 1
1 188 . 4 1 1 A 19 19 GLN H H 19 8.537 8.196 0.341 1
1 189 . 4 1 1 A 19 19 GLN HA H 19 4.520 4.639 -0.119 1
1 196 . 4 1 1 A 19 19 GLN C C 19 175.258 175.684 -0.426 1
1 197 . 4 1 1 A 19 19 GLN CA C 19 53.269 53.828 -0.559 1
1 198 . 4 1 1 A 19 19 GLN CB C 19 31.522 32.332 -0.810 1
1 200 . 4 1 1 A 19 19 GLN N N 19 120.187 121.254 -1.067 1
1 202 . 4 1 1 A 20 20 ALA H H 20 8.798 8.609 0.189 1
1 203 . 4 1 1 A 20 20 ALA HA H 20 4.010 4.077 -0.067 1
1 207 . 4 1 1 A 20 20 ALA C C 20 175.698 177.218 -1.520 1
1 208 . 4 1 1 A 20 20 ALA CA C 20 55.084 54.102 0.982 1
1 209 . 4 1 1 A 20 20 ALA CB C 20 18.277 18.693 -0.416 1
1 210 . 4 1 1 A 20 20 ALA N N 20 120.606 123.878 -3.272 1
1 211 . 4 1 1 A 21 21 TYR H H 21 6.618 7.510 -0.892 1
1 212 . 4 1 1 A 21 21 TYR HA H 21 4.540 4.838 -0.298 1
1 216 . 4 1 1 A 21 21 TYR C C 21 178.437 175.153 3.284 1
1 217 . 4 1 1 A 21 21 TYR CA C 21 55.120 57.017 -1.897 1
1 218 . 4 1 1 A 21 21 TYR CB C 21 37.891 40.276 -2.385 1
1 219 . 4 1 1 A 21 21 TYR N N 21 105.570 113.444 -7.874 1
1 220 . 4 1 1 A 22 22 GLY H H 22 7.203 7.079 0.124 1
1 221 . 4 1 1 A 22 22 GLY HA2 H 22 3.460 3.967 -0.507 1
1 222 . 4 1 1 A 22 22 GLY HA3 H 22 4.360 3.990 0.370 1
1 223 . 4 1 1 A 22 22 GLY C C 22 175.833 171.314 4.519 1
1 224 . 4 1 1 A 22 22 GLY CA C 22 46.356 45.477 0.879 1
1 225 . 4 1 1 A 22 22 GLY N N 22 109.854 108.696 1.158 1
1 226 . 4 1 1 A 23 23 ALA H H 23 8.549 8.513 0.036 1
1 227 . 4 1 1 A 23 23 ALA HA H 23 4.981 5.171 -0.190 1
1 231 . 4 1 1 A 23 23 ALA C C 23 168.810 175.744 -6.934 1
1 232 . 4 1 1 A 23 23 ALA CA C 23 49.178 50.566 -1.388 1
1 233 . 4 1 1 A 23 23 ALA CB C 23 22.797 21.797 1.000 1
1 234 . 4 1 1 A 23 23 ALA N N 23 118.749 122.226 -3.477 1
1 235 . 4 1 1 A 24 24 PHE H H 24 8.812 8.511 0.301 1
1 236 . 4 1 1 A 24 24 PHE HA H 24 5.125 4.880 0.245 1
1 240 . 4 1 1 A 24 24 PHE CA C 24 58.017 58.039 -0.022 1
1 241 . 4 1 1 A 24 24 PHE CB C 24 40.475 40.452 0.023 1
1 242 . 4 1 1 A 24 24 PHE N N 24 122.891 121.181 1.710 1
1 243 . 4 1 1 A 25 25 VAL H H 25 8.880 8.866 0.014 1
1 244 . 4 1 1 A 25 25 VAL HA H 25 4.660 4.611 0.049 1
1 252 . 4 1 1 A 25 25 VAL CA C 25 60.379 60.831 -0.452 1
1 253 . 4 1 1 A 25 25 VAL CB C 25 35.654 35.501 0.153 1
1 256 . 4 1 1 A 25 25 VAL N N 25 122.908 121.123 1.785 1
1 257 . 4 1 1 A 26 26 ALA H H 26 9.403 8.893 0.510 1
1 258 . 4 1 1 A 26 26 ALA HA H 26 4.750 4.453 0.297 1
1 262 . 4 1 1 A 26 26 ALA C C 26 174.445 176.884 -2.439 1
1 263 . 4 1 1 A 26 26 ALA CA C 26 51.711 52.258 -0.547 1
1 264 . 4 1 1 A 26 26 ALA CB C 26 19.319 18.677 0.642 1
1 265 . 4 1 1 A 26 26 ALA N N 26 129.425 129.285 0.140 1
1 266 . 4 1 1 A 27 27 LEU H H 27 8.601 9.082 -0.481 1
1 267 . 4 1 1 A 27 27 LEU HA H 27 4.158 4.113 0.045 1
1 277 . 4 1 1 A 27 27 LEU C C 27 177.814 175.922 1.892 1
1 278 . 4 1 1 A 27 27 LEU CA C 27 55.869 55.852 0.017 1
1 279 . 4 1 1 A 27 27 LEU CB C 27 42.251 42.457 -0.206 1
1 283 . 4 1 1 A 27 27 LEU N N 27 127.169 124.847 2.322 1
1 284 . 4 1 1 A 28 28 ASP H H 28 8.172 7.768 0.404 1
1 285 . 4 1 1 A 28 28 ASP HA H 28 4.420 4.792 -0.372 1
1 288 . 4 1 1 A 28 28 ASP C C 28 177.116 175.319 1.797 1
1 289 . 4 1 1 A 28 28 ASP CA C 28 53.755 53.133 0.622 1
1 290 . 4 1 1 A 28 28 ASP CB C 28 39.833 43.794 -3.961 1
1 291 . 4 1 1 A 28 28 ASP N N 28 115.657 115.072 0.585 1
1 292 . 4 1 1 A 29 29 GLU H H 29 8.857 8.663 0.194 1
1 293 . 4 1 1 A 29 29 GLU HA H 29 4.090 4.093 -0.003 1
1 298 . 4 1 1 A 29 29 GLU C C 29 175.965 176.824 -0.859 1
1 299 . 4 1 1 A 29 29 GLU CA C 29 59.470 59.250 0.220 1
1 300 . 4 1 1 A 29 29 GLU CB C 29 29.409 29.423 -0.014 1
1 302 . 4 1 1 A 29 29 GLU N N 29 114.738 122.724 -7.986 1
1 303 . 4 1 1 A 30 30 GLU H H 30 8.326 8.070 0.256 1
1 304 . 4 1 1 A 30 30 GLU HA H 30 4.640 4.527 0.113 1
1 309 . 4 1 1 A 30 30 GLU C C 30 176.817 174.967 1.850 1
1 310 . 4 1 1 A 30 30 GLU CA C 30 56.073 55.809 0.264 1
1 311 . 4 1 1 A 30 30 GLU CB C 30 32.453 30.809 1.644 1
1 313 . 4 1 1 A 30 30 GLU N N 30 115.753 117.286 -1.533 1
1 314 . 4 1 1 A 31 31 THR H H 31 7.819 7.335 0.484 1
1 315 . 4 1 1 A 31 31 THR HA H 31 4.484 5.071 -0.587 1
1 320 . 4 1 1 A 31 31 THR C C 31 176.330 172.883 3.447 1
1 321 . 4 1 1 A 31 31 THR CA C 31 63.398 61.068 2.330 1
1 322 . 4 1 1 A 31 31 THR CB C 31 69.367 72.550 -3.183 1
1 324 . 4 1 1 A 31 31 THR N N 31 118.750 115.293 3.457 1
1 325 . 4 1 1 A 32 32 GLN H H 32 8.913 8.779 0.134 1
1 326 . 4 1 1 A 32 32 GLN HA H 32 5.337 4.972 0.365 1
1 333 . 4 1 1 A 32 32 GLN C C 32 173.087 174.415 -1.328 1
1 334 . 4 1 1 A 32 32 GLN CA C 32 54.051 55.159 -1.108 1
1 335 . 4 1 1 A 32 32 GLN CB C 32 32.672 32.714 -0.042 1
1 337 . 4 1 1 A 32 32 GLN N N 32 127.294 125.575 1.719 1
1 339 . 4 1 1 A 33 33 GLY H H 33 8.900 8.519 0.381 1
1 340 . 4 1 1 A 33 33 GLY HA2 H 33 3.290 4.431 -1.141 1
1 341 . 4 1 1 A 33 33 GLY HA3 H 33 4.530 4.455 0.075 1
1 342 . 4 1 1 A 33 33 GLY C C 33 174.918 172.309 2.609 1
1 343 . 4 1 1 A 33 33 GLY CA C 33 44.534 45.431 -0.897 1
1 344 . 4 1 1 A 33 33 GLY N N 33 107.639 111.790 -4.151 1
1 345 . 4 1 1 A 34 34 LEU H H 34 8.127 8.729 -0.602 1
1 346 . 4 1 1 A 34 34 LEU HA H 34 4.950 5.029 -0.079 1
1 356 . 4 1 1 A 34 34 LEU CA C 34 53.755 53.991 -0.236 1
1 357 . 4 1 1 A 34 34 LEU CB C 34 45.493 45.040 0.453 1
1 361 . 4 1 1 A 34 34 LEU N N 34 120.897 120.766 0.131 1
1 362 . 4 1 1 A 35 35 VAL H H 35 9.386 8.866 0.520 1
1 363 . 4 1 1 A 35 35 VAL HA H 35 4.479 4.384 0.095 1
1 371 . 4 1 1 A 35 35 VAL C C 35 176.402 175.850 0.552 1
1 372 . 4 1 1 A 35 35 VAL CA C 35 59.594 63.071 -3.477 1
1 373 . 4 1 1 A 35 35 VAL CB C 35 32.590 31.479 1.111 1
1 376 . 4 1 1 A 35 35 VAL N N 35 128.897 127.901 0.996 1
1 377 . 4 1 1 A 36 36 HIS H H 36 9.194 8.920 0.274 1
1 378 . 4 1 1 A 36 36 HIS HA H 36 4.487 4.639 -0.152 1
1 381 . 4 1 1 A 36 36 HIS C C 36 174.864 176.394 -1.530 1
1 382 . 4 1 1 A 36 36 HIS CA C 36 59.426 56.722 2.704 1
1 383 . 4 1 1 A 36 36 HIS CB C 36 31.542 30.851 0.691 1
1 384 . 4 1 1 A 36 36 HIS N N 36 127.751 126.909 0.842 1
1 385 . 4 1 1 A 37 37 ILE H H 37 7.454 8.710 -1.256 1
1 386 . 4 1 1 A 37 37 ILE HA H 37 3.810 3.573 0.237 1
1 396 . 4 1 1 A 37 37 ILE C C 37 176.948 177.464 -0.516 1
1 397 . 4 1 1 A 37 37 ILE CA C 37 63.773 64.695 -0.922 1
1 398 . 4 1 1 A 37 37 ILE CB C 37 38.993 37.323 1.670 1
1 402 . 4 1 1 A 37 37 ILE N N 37 126.266 127.340 -1.074 1
1 403 . 4 1 1 A 38 38 SER H H 38 8.343 7.517 0.826 1
1 404 . 4 1 1 A 38 38 SER HA H 38 4.370 4.070 0.300 1
1 407 . 4 1 1 A 38 38 SER C C 38 174.792 174.782 0.010 1
1 408 . 4 1 1 A 38 38 SER CA C 38 60.567 61.182 -0.615 1
1 409 . 4 1 1 A 38 38 SER CB C 38 63.632 62.842 0.790 1
1 410 . 4 1 1 A 38 38 SER N N 38 118.079 118.251 -0.172 1
1 411 . 4 1 1 A 39 39 GLU H H 39 8.536 7.863 0.673 1
1 412 . 4 1 1 A 39 39 GLU HA H 39 4.503 4.482 0.021 1
1 417 . 4 1 1 A 39 39 GLU C C 39 175.131 176.835 -1.704 1
1 418 . 4 1 1 A 39 39 GLU CA C 39 54.928 56.187 -1.259 1
1 419 . 4 1 1 A 39 39 GLU CB C 39 29.621 30.312 -0.691 1
1 421 . 4 1 1 A 39 39 GLU N N 39 118.349 117.939 0.410 1
1 422 . 4 1 1 A 40 40 VAL H H 40 7.776 7.756 0.020 1
1 423 . 4 1 1 A 40 40 VAL HA H 40 3.616 3.891 -0.275 1
1 431 . 4 1 1 A 40 40 VAL C C 40 177.277 175.738 1.539 1
1 432 . 4 1 1 A 40 40 VAL CA C 40 66.245 64.164 2.081 1
1 433 . 4 1 1 A 40 40 VAL CB C 40 32.590 32.091 0.499 1
1 436 . 4 1 1 A 40 40 VAL N N 40 125.443 117.207 8.236 1
1 437 . 4 1 1 A 41 41 THR H H 41 7.888 7.454 0.434 1
1 438 . 4 1 1 A 41 41 THR HA H 41 4.345 4.538 -0.193 1
1 443 . 4 1 1 A 41 41 THR C C 41 173.492 173.374 0.118 1
1 444 . 4 1 1 A 41 41 THR CA C 41 59.047 60.532 -1.485 1
1 445 . 4 1 1 A 41 41 THR CB C 41 68.992 70.116 -1.124 1
1 447 . 4 1 1 A 41 41 THR N N 41 109.905 111.291 -1.386 1
1 448 . 4 1 1 A 42 42 HIS H H 42 8.063 9.362 -1.299 1
1 449 . 4 1 1 A 42 42 HIS HA H 42 4.510 4.412 0.098 1
1 452 . 4 1 1 A 42 42 HIS C C 42 172.139 176.158 -4.019 1
1 453 . 4 1 1 A 42 42 HIS CA C 42 57.735 58.257 -0.522 1
1 454 . 4 1 1 A 42 42 HIS CB C 42 31.144 29.623 1.521 1
1 455 . 4 1 1 A 42 42 HIS N N 42 121.760 121.750 0.010 1
1 456 . 4 1 1 A 43 43 GLY H H 43 8.286 7.698 0.588 1
1 457 . 4 1 1 A 43 43 GLY HA2 H 43 3.980 3.974 0.006 1
1 458 . 4 1 1 A 43 43 GLY HA3 H 43 3.980 4.030 -0.050 1
1 459 . 4 1 1 A 43 43 GLY C C 43 176.307 172.637 3.670 1
1 460 . 4 1 1 A 43 43 GLY CA C 43 44.336 44.856 -0.520 1
1 461 . 4 1 1 A 43 43 GLY N N 43 110.133 107.086 3.047 1
1 462 . 4 1 1 A 44 44 PHE H H 44 8.327 8.590 -0.263 1
1 463 . 4 1 1 A 44 44 PHE HA H 44 4.489 4.453 0.036 1
1 467 . 4 1 1 A 44 44 PHE C C 44 171.877 174.981 -3.104 1
1 468 . 4 1 1 A 44 44 PHE CA C 44 58.027 58.422 -0.395 1
1 469 . 4 1 1 A 44 44 PHE CB C 44 39.850 39.797 0.053 1
1 470 . 4 1 1 A 44 44 PHE N N 44 120.049 121.751 -1.702 1
1 471 . 4 1 1 A 45 45 VAL H H 45 7.939 8.117 -0.178 1
1 472 . 4 1 1 A 45 45 VAL HA H 45 3.865 3.767 0.098 1
1 480 . 4 1 1 A 45 45 VAL C C 45 175.523 175.620 -0.097 1
1 481 . 4 1 1 A 45 45 VAL CA C 45 61.536 61.249 0.287 1
1 482 . 4 1 1 A 45 45 VAL CB C 45 33.127 30.752 2.375 1
1 485 . 4 1 1 A 45 45 VAL N N 45 127.882 123.706 4.176 1
1 486 . 4 1 1 A 46 46 LYS H H 46 8.868 9.210 -0.342 1
1 487 . 4 1 1 A 46 46 LYS HA H 46 4.170 4.129 0.041 1
1 496 . 4 1 1 A 46 46 LYS C C 46 175.728 176.252 -0.524 1
1 497 . 4 1 1 A 46 46 LYS CA C 46 57.198 58.600 -1.402 1
1 498 . 4 1 1 A 46 46 LYS CB C 46 33.299 33.020 0.279 1
1 502 . 4 1 1 A 46 46 LYS N N 46 127.308 127.648 -0.340 1
1 503 . 4 1 1 A 47 47 ASP H H 47 7.652 7.920 -0.268 1
1 504 . 4 1 1 A 47 47 ASP HA H 47 4.710 4.844 -0.134 1
1 507 . 4 1 1 A 47 47 ASP C C 47 176.411 176.029 0.382 1
1 508 . 4 1 1 A 47 47 ASP CA C 47 53.390 53.973 -0.583 1
1 509 . 4 1 1 A 47 47 ASP CB C 47 42.635 44.310 -1.675 1
1 510 . 4 1 1 A 47 47 ASP N N 47 117.932 114.903 3.029 1
1 511 . 4 1 1 A 48 48 ILE H H 48 9.230 8.667 0.563 1
1 512 . 4 1 1 A 48 48 ILE HA H 48 3.579 3.896 -0.317 1
1 522 . 4 1 1 A 48 48 ILE C C 48 177.249 177.552 -0.303 1
1 523 . 4 1 1 A 48 48 ILE CA C 48 65.525 63.915 1.610 1
1 524 . 4 1 1 A 48 48 ILE CB C 48 38.797 38.039 0.758 1
1 528 . 4 1 1 A 48 48 ILE N N 48 129.049 125.310 3.739 1
1 529 . 4 1 1 A 49 49 ASN H H 49 8.468 9.081 -0.613 1
1 530 . 4 1 1 A 49 49 ASN HA H 49 4.690 4.590 0.100 1
1 535 . 4 1 1 A 49 49 ASN C C 49 175.779 176.222 -0.443 1
1 536 . 4 1 1 A 49 49 ASN CA C 49 55.587 54.801 0.786 1
1 537 . 4 1 1 A 49 49 ASN CB C 49 38.587 36.638 1.949 1
1 538 . 4 1 1 A 49 49 ASN N N 49 118.835 117.422 1.413 1
1 540 . 4 1 1 A 50 50 GLU H H 50 7.853 7.998 -0.145 1
1 541 . 4 1 1 A 50 50 GLU HA H 50 4.040 4.029 0.011 1
1 546 . 4 1 1 A 50 50 GLU C C 50 176.148 177.051 -0.903 1
1 547 . 4 1 1 A 50 50 GLU CA C 50 57.404 57.099 0.305 1
1 548 . 4 1 1 A 50 50 GLU CB C 50 29.491 29.374 0.117 1
1 550 . 4 1 1 A 50 50 GLU N N 50 116.358 117.937 -1.579 1
1 551 . 4 1 1 A 51 51 HIS H H 51 7.575 7.705 -0.130 1
1 552 . 4 1 1 A 51 51 HIS HA H 51 4.431 4.775 -0.344 1
1 555 . 4 1 1 A 51 51 HIS C C 51 176.383 174.397 1.986 1
1 556 . 4 1 1 A 51 51 HIS CA C 51 57.089 56.097 0.992 1
1 557 . 4 1 1 A 51 51 HIS CB C 51 33.168 31.938 1.230 1
1 558 . 4 1 1 A 51 51 HIS N N 51 115.828 114.949 0.879 1
1 559 . 4 1 1 A 52 52 LEU H H 52 7.640 7.385 0.255 1
1 560 . 4 1 1 A 52 52 LEU HA H 52 4.796 4.662 0.134 1
1 570 . 4 1 1 A 52 52 LEU C C 52 174.452 174.419 0.033 1
1 571 . 4 1 1 A 52 52 LEU CA C 52 53.398 53.829 -0.431 1
1 572 . 4 1 1 A 52 52 LEU CB C 52 48.805 45.336 3.469 1
1 576 . 4 1 1 A 52 52 LEU N N 52 117.932 119.368 -1.436 1
1 577 . 4 1 1 A 53 53 SER H H 53 8.151 8.842 -0.691 1
1 578 . 4 1 1 A 53 53 SER HA H 53 4.680 4.969 -0.289 1
1 581 . 4 1 1 A 53 53 SER C C 53 174.304 172.753 1.551 1
1 582 . 4 1 1 A 53 53 SER CA C 53 56.714 57.460 -0.746 1
1 583 . 4 1 1 A 53 53 SER CB C 53 65.431 66.187 -0.756 1
1 584 . 4 1 1 A 53 53 SER N N 53 113.496 117.411 -3.915 1
1 585 . 4 1 1 A 54 54 VAL H H 54 8.782 8.543 0.239 1
1 586 . 4 1 1 A 54 54 VAL HA H 54 3.230 3.775 -0.545 1
1 594 . 4 1 1 A 54 54 VAL C C 54 173.745 177.129 -3.384 1
1 595 . 4 1 1 A 54 54 VAL CA C 54 66.232 63.468 2.764 1
1 596 . 4 1 1 A 54 54 VAL CB C 54 31.067 31.921 -0.854 1
1 599 . 4 1 1 A 54 54 VAL N N 54 124.401 126.570 -2.169 1
1 600 . 4 1 1 A 55 55 GLY H H 55 9.079 8.961 0.118 1
1 601 . 4 1 1 A 55 55 GLY HA2 H 55 3.530 3.847 -0.317 1
1 602 . 4 1 1 A 55 55 GLY HA3 H 55 4.553 3.847 0.706 1
1 603 . 4 1 1 A 55 55 GLY C C 55 177.219 173.219 4.000 1
1 604 . 4 1 1 A 55 55 GLY CA C 55 44.647 46.242 -1.595 1
1 605 . 4 1 1 A 55 55 GLY N N 55 117.320 116.249 1.071 1
1 606 . 4 1 1 A 56 56 ASP H H 56 7.943 7.742 0.201 1
1 607 . 4 1 1 A 56 56 ASP HA H 56 4.460 5.163 -0.703 1
1 610 . 4 1 1 A 56 56 ASP C C 56 176.055 173.611 2.444 1
1 611 . 4 1 1 A 56 56 ASP CA C 56 55.456 52.447 3.009 1
1 612 . 4 1 1 A 56 56 ASP CB C 56 40.914 44.747 -3.833 1
1 613 . 4 1 1 A 56 56 ASP N N 56 121.782 119.616 2.166 1
1 614 . 4 1 1 A 57 57 GLU H H 57 8.649 8.891 -0.242 1
1 615 . 4 1 1 A 57 57 GLU HA H 57 5.100 5.203 -0.103 1
1 620 . 4 1 1 A 57 57 GLU C C 57 175.635 175.554 0.081 1
1 621 . 4 1 1 A 57 57 GLU CA C 57 55.805 55.240 0.565 1
1 622 . 4 1 1 A 57 57 GLU CB C 57 30.915 32.276 -1.361 1
1 624 . 4 1 1 A 57 57 GLU N N 57 122.513 123.795 -1.282 1
1 625 . 4 1 1 A 58 58 VAL H H 58 8.809 9.009 -0.200 1
1 626 . 4 1 1 A 58 58 VAL HA H 58 4.817 4.742 0.075 1
1 634 . 4 1 1 A 58 58 VAL C C 58 176.528 174.369 2.159 1
1 635 . 4 1 1 A 58 58 VAL CA C 58 58.719 59.432 -0.713 1
1 636 . 4 1 1 A 58 58 VAL CB C 58 35.523 35.818 -0.295 1
1 639 . 4 1 1 A 58 58 VAL N N 58 118.382 119.539 -1.157 1
1 640 . 4 1 1 A 59 59 GLN H H 59 8.255 8.493 -0.238 1
1 641 . 4 1 1 A 59 59 GLN HA H 59 5.030 4.779 0.251 1
1 646 . 4 1 1 A 59 59 GLN CA C 59 54.843 56.387 -1.544 1
1 647 . 4 1 1 A 59 59 GLN CB C 59 30.111 29.083 1.028 1
1 649 . 4 1 1 A 59 59 GLN N N 59 120.933 123.259 -2.326 1
1 650 . 4 1 1 A 60 60 VAL H H 60 8.970 9.069 -0.099 1
1 651 . 4 1 1 A 60 60 VAL HA H 60 4.990 4.966 0.024 1
1 659 . 4 1 1 A 60 60 VAL C C 60 175.203 174.029 1.174 1
1 660 . 4 1 1 A 60 60 VAL CA C 60 57.404 59.449 -2.045 1
1 661 . 4 1 1 A 60 60 VAL CB C 60 35.771 35.471 0.300 1
1 664 . 4 1 1 A 60 60 VAL N N 60 111.046 118.726 -7.680 1
1 665 . 4 1 1 A 61 61 LYS H H 61 8.937 8.457 0.480 1
1 666 . 4 1 1 A 61 61 LYS HA H 61 5.100 4.576 0.524 1
1 675 . 4 1 1 A 61 61 LYS C C 61 173.610 176.555 -2.945 1
1 676 . 4 1 1 A 61 61 LYS CA C 61 53.762 55.757 -1.995 1
1 677 . 4 1 1 A 61 61 LYS CB C 61 36.273 33.650 2.623 1
1 681 . 4 1 1 A 61 61 LYS N N 61 121.930 124.676 -2.746 1
1 682 . 4 1 1 A 62 62 VAL H H 62 8.429 9.233 -0.804 1
1 683 . 4 1 1 A 62 62 VAL HA H 62 4.074 4.078 -0.004 1
1 691 . 4 1 1 A 62 62 VAL C C 62 176.912 176.058 0.854 1
1 692 . 4 1 1 A 62 62 VAL CA C 62 63.188 63.468 -0.280 1
1 693 . 4 1 1 A 62 62 VAL CB C 62 30.813 31.058 -0.245 1
1 696 . 4 1 1 A 62 62 VAL N N 62 126.329 127.056 -0.727 1
1 697 . 4 1 1 A 63 63 LEU H H 63 9.109 9.323 -0.214 1
1 698 . 4 1 1 A 63 63 LEU HA H 63 4.423 4.494 -0.071 1
1 708 . 4 1 1 A 63 63 LEU C C 63 176.091 176.065 0.026 1
1 709 . 4 1 1 A 63 63 LEU CA C 63 55.876 56.148 -0.272 1
1 710 . 4 1 1 A 63 63 LEU CB C 63 42.800 43.822 -1.022 1
1 714 . 4 1 1 A 63 63 LEU N N 63 129.436 129.932 -0.496 1
1 715 . 4 1 1 A 64 64 ALA H H 64 7.594 7.226 0.368 1
1 716 . 4 1 1 A 64 64 ALA HA H 64 4.455 4.674 -0.219 1
1 720 . 4 1 1 A 64 64 ALA C C 64 177.314 174.966 2.348 1
1 721 . 4 1 1 A 64 64 ALA CA C 64 52.557 51.787 0.770 1
1 722 . 4 1 1 A 64 64 ALA CB C 64 21.458 22.580 -1.122 1
1 723 . 4 1 1 A 64 64 ALA N N 64 117.791 118.738 -0.947 1
1 724 . 4 1 1 A 65 65 VAL H H 65 8.583 8.506 0.077 1
1 725 . 4 1 1 A 65 65 VAL HA H 65 4.470 4.906 -0.436 1
1 733 . 4 1 1 A 65 65 VAL C C 65 174.697 174.910 -0.213 1
1 734 . 4 1 1 A 65 65 VAL CA C 65 61.936 60.611 1.325 1
1 735 . 4 1 1 A 65 65 VAL CB C 65 35.288 35.361 -0.073 1
1 738 . 4 1 1 A 65 65 VAL N N 65 120.009 119.610 0.399 1
1 739 . 4 1 1 A 66 66 ASP H H 66 8.567 8.927 -0.360 1
1 740 . 4 1 1 A 66 66 ASP HA H 66 4.880 4.976 -0.096 1
1 743 . 4 1 1 A 66 66 ASP C C 66 174.355 175.817 -1.462 1
1 744 . 4 1 1 A 66 66 ASP CA C 66 52.681 52.913 -0.232 1
1 745 . 4 1 1 A 66 66 ASP CB C 66 41.775 40.721 1.054 1
1 746 . 4 1 1 A 66 66 ASP N N 66 126.262 125.190 1.072 1
1 747 . 4 1 1 A 67 67 GLU H H 67 9.148 8.637 0.511 1
1 748 . 4 1 1 A 67 67 GLU HA H 67 4.110 4.104 0.006 1
1 753 . 4 1 1 A 67 67 GLU C C 67 177.052 178.401 -1.349 1
1 754 . 4 1 1 A 67 67 GLU CA C 67 59.044 58.601 0.443 1
1 755 . 4 1 1 A 67 67 GLU CB C 67 29.919 28.961 0.958 1
1 757 . 4 1 1 A 67 67 GLU N N 67 125.480 123.976 1.504 1
1 758 . 4 1 1 A 68 68 GLU H H 68 8.384 7.971 0.413 1
1 759 . 4 1 1 A 68 68 GLU HA H 68 4.140 4.129 0.011 1
1 764 . 4 1 1 A 68 68 GLU C C 68 178.383 177.534 0.849 1
1 765 . 4 1 1 A 68 68 GLU CA C 68 59.044 59.168 -0.124 1
1 766 . 4 1 1 A 68 68 GLU CB C 68 29.919 29.286 0.633 1
1 768 . 4 1 1 A 68 68 GLU N N 68 119.760 118.930 0.830 1
1 769 . 4 1 1 A 69 69 LYS H H 69 7.799 7.697 0.102 1
1 770 . 4 1 1 A 69 69 LYS HA H 69 4.375 4.517 -0.142 1
1 779 . 4 1 1 A 69 69 LYS C C 69 178.297 176.899 1.398 1
1 780 . 4 1 1 A 69 69 LYS CA C 69 55.704 55.661 0.043 1
1 781 . 4 1 1 A 69 69 LYS CB C 69 33.622 34.199 -0.577 1
1 785 . 4 1 1 A 69 69 LYS N N 69 115.476 117.166 -1.690 1
1 786 . 4 1 1 A 70 70 GLY H H 70 7.994 7.780 0.214 1
1 787 . 4 1 1 A 70 70 GLY HA2 H 70 3.940 3.934 0.006 1
1 788 . 4 1 1 A 70 70 GLY HA3 H 70 3.960 3.940 0.020 1
1 789 . 4 1 1 A 70 70 GLY C C 70 177.215 174.232 2.983 1
1 790 . 4 1 1 A 70 70 GLY CA C 70 46.773 46.653 0.120 1
1 791 . 4 1 1 A 70 70 GLY N N 70 110.245 109.781 0.464 1
1 792 . 4 1 1 A 71 71 LYS H H 71 7.560 7.795 -0.235 1
1 793 . 4 1 1 A 71 71 LYS HA H 71 4.690 4.930 -0.240 1
1 802 . 4 1 1 A 71 71 LYS C C 71 174.607 175.416 -0.809 1
1 803 . 4 1 1 A 71 71 LYS CA C 71 55.332 54.251 1.081 1
1 804 . 4 1 1 A 71 71 LYS CB C 71 34.903 35.975 -1.072 1
1 808 . 4 1 1 A 71 71 LYS N N 71 118.201 118.487 -0.286 1
1 809 . 4 1 1 A 72 72 ILE H H 72 8.867 8.669 0.198 1
1 810 . 4 1 1 A 72 72 ILE HA H 72 4.630 4.959 -0.329 1
1 820 . 4 1 1 A 72 72 ILE C C 72 175.708 174.604 1.104 1
1 821 . 4 1 1 A 72 72 ILE CA C 72 61.494 59.962 1.532 1
1 822 . 4 1 1 A 72 72 ILE CB C 72 40.652 42.620 -1.968 1
1 826 . 4 1 1 A 72 72 ILE N N 72 126.827 121.683 5.144 1
1 827 . 4 1 1 A 73 73 SER H H 73 8.815 8.949 -0.134 1
1 828 . 4 1 1 A 73 73 SER HA H 73 5.110 5.291 -0.181 1
1 831 . 4 1 1 A 73 73 SER C C 73 175.122 173.180 1.942 1
1 832 . 4 1 1 A 73 73 SER CA C 73 57.487 58.045 -0.558 1
1 833 . 4 1 1 A 73 73 SER CB C 73 64.386 64.772 -0.386 1
1 834 . 4 1 1 A 73 73 SER N N 73 123.640 124.125 -0.485 1
1 835 . 4 1 1 A 74 74 LEU H H 74 8.585 8.916 -0.331 1
1 836 . 4 1 1 A 74 74 LEU HA H 74 5.450 5.393 0.057 1
1 846 . 4 1 1 A 74 74 LEU C C 74 174.061 175.359 -1.298 1
1 847 . 4 1 1 A 74 74 LEU CA C 74 53.101 53.513 -0.412 1
1 848 . 4 1 1 A 74 74 LEU CB C 74 48.268 46.826 1.442 1
1 852 . 4 1 1 A 74 74 LEU N N 74 125.221 124.149 1.072 1
1 853 . 4 1 1 A 75 75 SER H H 75 8.840 8.711 0.129 1
1 854 . 4 1 1 A 75 75 SER HA H 75 5.040 5.211 -0.171 1
1 857 . 4 1 1 A 75 75 SER C C 75 176.552 173.026 3.526 1
1 858 . 4 1 1 A 75 75 SER CA C 75 57.487 56.465 1.022 1
1 859 . 4 1 1 A 75 75 SER CB C 75 64.993 65.574 -0.581 1
1 860 . 4 1 1 A 75 75 SER N N 75 111.252 114.147 -2.895 1
1 861 . 4 1 1 A 76 76 ILE H H 76 7.790 8.857 -1.067 1
1 862 . 4 1 1 A 76 76 ILE HA H 76 4.690 4.433 0.257 1
1 872 . 4 1 1 A 76 76 ILE C C 76 175.780 177.327 -1.547 1
1 873 . 4 1 1 A 76 76 ILE CA C 76 63.631 62.476 1.155 1
1 874 . 4 1 1 A 76 76 ILE CB C 76 39.484 39.201 0.283 1
1 878 . 4 1 1 A 76 76 ILE N N 76 129.205 126.439 2.766 1
1 879 . 4 1 1 A 77 77 ARG H H 77 8.115 8.570 -0.455 1
1 880 . 4 1 1 A 77 77 ARG HA H 77 3.760 4.362 -0.602 1
1 887 . 4 1 1 A 77 77 ARG C C 77 178.704 177.908 0.796 1
1 888 . 4 1 1 A 77 77 ARG CA C 77 58.933 58.646 0.287 1
1 889 . 4 1 1 A 77 77 ARG CB C 77 29.463 29.795 -0.332 1
1 892 . 4 1 1 A 77 77 ARG N N 77 123.257 121.921 1.336 1
1 893 . 4 1 1 A 78 78 ALA H H 78 8.304 7.494 0.810 1
1 894 . 4 1 1 A 78 78 ALA HA H 78 4.296 4.189 0.107 1
1 898 . 4 1 1 A 78 78 ALA C C 78 176.870 178.623 -1.753 1
1 899 . 4 1 1 A 78 78 ALA CA C 78 53.548 54.307 -0.759 1
1 900 . 4 1 1 A 78 78 ALA CB C 78 19.872 18.344 1.528 1
1 901 . 4 1 1 A 78 78 ALA N N 78 118.764 122.088 -3.324 1
1 902 . 4 1 1 A 79 79 THR H H 79 7.931 7.849 0.082 1
1 903 . 4 1 1 A 79 79 THR HA H 79 4.370 4.538 -0.168 1
1 908 . 4 1 1 A 79 79 THR C C 79 178.356 174.390 3.966 1
1 909 . 4 1 1 A 79 79 THR CA C 79 62.381 62.474 -0.093 1
1 910 . 4 1 1 A 79 79 THR CB C 79 69.693 70.107 -0.414 1
1 912 . 4 1 1 A 79 79 THR N N 79 107.360 105.172 2.188 1
1 913 . 4 1 1 A 80 80 GLN H H 80 7.651 7.880 -0.229 1
1 914 . 4 1 1 A 80 80 GLN HA H 80 4.527 4.677 -0.150 1
1 921 . 4 1 1 A 80 80 GLN C C 80 174.249 175.708 -1.459 1
1 922 . 4 1 1 A 80 80 GLN CA C 80 54.760 54.184 0.576 1
1 923 . 4 1 1 A 80 80 GLN CB C 80 30.565 30.965 -0.400 1
1 925 . 4 1 1 A 80 80 GLN N N 80 121.588 118.499 3.089 1
1 927 . 4 1 1 A 81 81 ALA H H 81 8.498 8.974 -0.476 1
1 928 . 4 1 1 A 81 81 ALA HA H 81 4.252 4.426 -0.174 1
1 932 . 4 1 1 A 81 81 ALA C C 81 175.693 177.642 -1.949 1
1 933 . 4 1 1 A 81 81 ALA CA C 81 52.345 55.006 -2.661 1
1 934 . 4 1 1 A 81 81 ALA CB C 81 19.062 18.840 0.222 1
1 935 . 4 1 1 A 81 81 ALA N N 81 126.423 125.137 1.286 1
1 936 . 4 1 1 A 82 82 ALA H H 82 8.324 7.374 0.950 1
1 937 . 4 1 1 A 82 82 ALA HA H 82 4.000 5.023 -1.023 1
1 941 . 4 1 1 A 82 82 ALA C C 82 177.065 176.748 0.317 1
1 942 . 4 1 1 A 82 82 ALA CA C 82 50.240 49.845 0.395 1
1 943 . 4 1 1 A 82 82 ALA CB C 82 17.650 21.505 -3.855 1
1 944 . 4 1 1 A 82 82 ALA N N 82 125.114 117.154 7.960 1
1 945 . 4 1 1 A 83 83 PRO HA H 83 4.350 4.487 -0.137 1
1 952 . 4 1 1 A 83 83 PRO CA C 83 63.148 63.938 -0.790 1
1 953 . 4 1 1 A 83 83 PRO CB C 83 32.054 31.550 0.504 1
1 956 . 4 1 1 A 84 84 GLU H H 84 8.517 8.545 -0.028 1
1 957 . 4 1 1 A 84 84 GLU HA H 84 4.197 4.567 -0.370 1
1 962 . 4 1 1 A 84 84 GLU C C 84 176.948 175.926 1.022 1
1 963 . 4 1 1 A 84 84 GLU CA C 84 56.674 55.895 0.779 1
1 964 . 4 1 1 A 84 84 GLU CB C 84 30.459 31.286 -0.827 1
1 966 . 4 1 1 A 84 84 GLU N N 84 121.479 116.425 5.054 1
1 967 . 4 1 1 A 85 85 LYS H H 85 8.381 7.537 0.844 1
1 968 . 4 1 1 A 85 85 LYS HA H 85 4.309 4.779 -0.470 1
1 977 . 4 1 1 A 85 85 LYS C C 85 176.457 175.949 0.508 1
1 978 . 4 1 1 A 85 85 LYS CA C 85 56.272 55.749 0.523 1
1 979 . 4 1 1 A 85 85 LYS CB C 85 32.961 35.515 -2.554 1
1 983 . 4 1 1 A 85 85 LYS N N 85 123.266 120.189 3.077 1
1 984 . 4 1 1 A 86 86 LYS H H 86 8.403 8.595 -0.192 1
1 985 . 4 1 1 A 86 86 LYS HA H 86 4.308 4.113 0.195 1
1 994 . 4 1 1 A 86 86 LYS C C 86 176.435 176.353 0.082 1
1 995 . 4 1 1 A 86 86 LYS CA C 86 56.272 58.538 -2.266 1
1 996 . 4 1 1 A 86 86 LYS CB C 86 32.961 32.851 0.110 1
1 1000 . 4 1 1 A 86 86 LYS N N 86 123.688 123.851 -0.163 1
1 1001 . 4 1 1 A 87 87 GLU H H 87 8.540 7.756 0.784 1
1 1002 . 4 1 1 A 87 87 GLU HA H 87 4.358 4.619 -0.261 1
1 1007 . 4 1 1 A 87 87 GLU C C 87 176.556 174.554 2.002 1
1 1008 . 4 1 1 A 87 87 GLU CA C 87 56.406 55.786 0.620 1
1 1009 . 4 1 1 A 87 87 GLU CB C 87 30.607 33.337 -2.730 1
1 1011 . 4 1 1 A 87 87 GLU N N 87 122.633 116.278 6.355 1
1 1012 . 4 1 1 A 88 88 SER H H 88 8.520 8.538 -0.018 1
1 1013 . 4 1 1 A 88 88 SER HA H 88 4.490 4.707 -0.217 1
1 1016 . 4 1 1 A 88 88 SER C C 88 175.780 174.586 1.194 1
1 1017 . 4 1 1 A 88 88 SER CA C 88 58.431 58.501 -0.070 1
1 1018 . 4 1 1 A 88 88 SER CB C 88 63.858 65.355 -1.497 1
1 1019 . 4 1 1 A 88 88 SER N N 88 118.333 117.836 0.497 1
1 1020 . 4 1 1 A 89 89 LYS H H 89 8.339 7.382 0.957 1
1 1021 . 4 1 1 A 89 89 LYS HA H 89 4.620 4.398 0.222 1
1 1030 . 4 1 1 A 89 89 LYS C C 89 174.160 174.617 -0.457 1
1 1031 . 4 1 1 A 89 89 LYS CA C 89 54.265 54.897 -0.632 1
1 1032 . 4 1 1 A 89 89 LYS CB C 89 32.672 31.842 0.830 1
1 1036 . 4 1 1 A 89 89 LYS N N 89 124.433 122.334 2.099 1
1 1037 . 4 1 1 A 90 90 PRO HA H 90 4.417 4.652 -0.235 1
1 1044 . 4 1 1 A 90 90 PRO CA C 90 63.064 62.398 0.666 1
1 1045 . 4 1 1 A 90 90 PRO CB C 90 32.266 32.968 -0.702 1
1 1048 . 4 1 1 A 91 91 ARG H H 91 8.502 8.855 -0.353 1
1 1049 . 4 1 1 A 91 91 ARG HA H 91 4.305 4.712 -0.407 1
1 1056 . 4 1 1 A 91 91 ARG C C 91 176.831 174.943 1.888 1
1 1057 . 4 1 1 A 91 91 ARG CA C 91 56.002 55.094 0.908 1
1 1058 . 4 1 1 A 91 91 ARG CB C 91 30.913 33.820 -2.907 1
1 1061 . 4 1 1 A 91 91 ARG N N 91 122.193 121.048 1.145 1
1 1062 . 4 1 1 A 92 92 LYS H H 92 8.415 8.305 0.110 1
1 1063 . 4 1 1 A 92 92 LYS HA H 92 4.610 4.446 0.164 1
1 1072 . 4 1 1 A 92 92 LYS C C 92 176.262 174.564 1.698 1
1 1073 . 4 1 1 A 92 92 LYS CA C 92 54.258 54.821 -0.563 1
1 1074 . 4 1 1 A 92 92 LYS CB C 92 32.672 31.425 1.247 1
1 1078 . 4 1 1 A 92 92 LYS N N 92 124.243 125.162 -0.919 1
1 1079 . 4 1 1 A 93 93 PRO HA H 93 4.415 4.507 -0.092 1
1 1086 . 4 1 1 A 93 93 PRO CA C 93 62.899 62.556 0.343 1
1 1087 . 4 1 1 A 93 93 PRO CB C 93 32.323 32.162 0.161 1
1 1090 . 4 1 1 A 94 94 LYS H H 94 8.420 8.033 0.387 1
1 1091 . 4 1 1 A 94 94 LYS HA H 94 4.290 4.309 -0.019 1
1 1100 . 4 1 1 A 94 94 LYS C C 94 176.714 176.590 0.124 1
1 1101 . 4 1 1 A 94 94 LYS CA C 94 56.585 56.355 0.230 1
1 1102 . 4 1 1 A 94 94 LYS CB C 94 33.161 31.940 1.221 1
1 1106 . 4 1 1 A 94 94 LYS N N 94 122.121 122.341 -0.220 1
1 1107 . 4 1 1 A 95 95 ALA H H 95 8.348 8.087 0.261 1
1 1108 . 4 1 1 A 95 95 ALA HA H 95 4.250 4.640 -0.390 1
1 1112 . 4 1 1 A 95 95 ALA C C 95 176.453 176.656 -0.203 1
1 1113 . 4 1 1 A 95 95 ALA CA C 95 52.471 51.151 1.320 1
1 1114 . 4 1 1 A 95 95 ALA CB C 95 19.347 20.253 -0.906 1
1 1115 . 4 1 1 A 95 95 ALA N N 95 125.624 129.191 -3.567 1
1 1116 . 4 1 1 A 96 96 ALA H H 96 8.348 7.430 0.918 1
1 1117 . 4 1 1 A 96 96 ALA HA H 96 4.254 4.602 -0.348 1
1 1121 . 4 1 1 A 96 96 ALA C C 96 176.462 177.455 -0.993 1
1 1122 . 4 1 1 A 96 96 ALA CA C 96 52.471 50.639 1.832 1
1 1123 . 4 1 1 A 96 96 ALA CB C 96 19.347 22.685 -3.338 1
1 1124 . 4 1 1 A 96 96 ALA N N 96 125.624 118.760 6.864 1
1 1125 . 4 1 1 A 97 97 GLN H H 97 8.333 8.905 -0.572 1
1 1126 . 4 1 1 A 97 97 GLN HA H 97 4.362 4.119 0.243 1
1 1133 . 4 1 1 A 97 97 GLN C C 97 177.684 177.803 -0.119 1
1 1134 . 4 1 1 A 97 97 GLN CA C 97 55.848 58.097 -2.249 1
1 1135 . 4 1 1 A 97 97 GLN CB C 97 29.643 28.029 1.614 1
1 1137 . 4 1 1 A 97 97 GLN N N 97 120.049 120.440 -0.391 1
1 1139 . 4 1 1 A 98 98 VAL H H 98 8.230 7.625 0.605 1
1 1140 . 4 1 1 A 98 98 VAL HA H 98 4.145 3.666 0.479 1
1 1148 . 4 1 1 A 98 98 VAL C C 98 176.033 176.526 -0.493 1
1 1149 . 4 1 1 A 98 98 VAL CA C 98 62.444 65.922 -3.478 1
1 1150 . 4 1 1 A 98 98 VAL CB C 98 32.942 31.929 1.013 1
1 1153 . 4 1 1 A 98 98 VAL N N 98 121.607 119.595 2.012 1
1 1154 . 4 1 1 A 99 99 SER H H 99 8.375 7.595 0.780 1
1 1155 . 4 1 1 A 99 99 SER HA H 99 4.473 4.462 0.011 1
1 1158 . 4 1 1 A 99 99 SER C C 99 176.204 174.055 2.149 1
1 1159 . 4 1 1 A 99 99 SER CA C 99 58.379 58.332 0.047 1
1 1160 . 4 1 1 A 99 99 SER CB C 99 63.914 64.579 -0.665 1
1 1161 . 4 1 1 A 99 99 SER N N 99 119.455 114.766 4.689 1
1 1162 . 4 1 1 A 100 100 GLU H H 100 8.547 8.871 -0.324 1
1 1163 . 4 1 1 A 100 100 GLU HA H 100 4.304 5.192 -0.888 1
1 1168 . 4 1 1 A 100 100 GLU C C 100 174.620 174.405 0.215 1
1 1169 . 4 1 1 A 100 100 GLU CA C 100 56.835 54.505 2.330 1
1 1170 . 4 1 1 A 100 100 GLU CB C 100 30.365 34.246 -3.881 1
1 1172 . 4 1 1 A 100 100 GLU N N 100 123.419 118.913 4.506 1
1 1173 . 4 1 1 A 101 101 GLU H H 101 8.432 8.677 -0.245 1
1 1174 . 4 1 1 A 101 101 GLU HA H 101 4.252 5.052 -0.800 1
1 1179 . 4 1 1 A 101 101 GLU C C 101 176.693 174.908 1.785 1
1 1180 . 4 1 1 A 101 101 GLU CA C 101 56.835 54.587 2.248 1
1 1181 . 4 1 1 A 101 101 GLU CB C 101 30.365 34.254 -3.889 1
1 1183 . 4 1 1 A 101 101 GLU N N 101 122.025 119.608 2.417 1
1 1184 . 4 1 1 A 102 102 ALA H H 102 8.324 8.142 0.182 1
1 1185 . 4 1 1 A 102 102 ALA HA H 102 4.361 4.647 -0.286 1
1 1189 . 4 1 1 A 102 102 ALA C C 102 177.065 177.232 -0.167 1
1 1190 . 4 1 1 A 102 102 ALA CA C 102 52.647 50.916 1.731 1
1 1191 . 4 1 1 A 102 102 ALA CB C 102 19.227 19.089 0.138 1
1 1192 . 4 1 1 A 102 102 ALA N N 102 125.114 122.297 2.817 1
1 1193 . 4 1 1 A 103 103 SER H H 103 8.259 8.205 0.054 1
1 1194 . 4 1 1 A 103 103 SER HA H 103 4.473 4.138 0.335 1
1 1197 . 4 1 1 A 103 103 SER C C 103 177.772 173.450 4.322 1
1 1198 . 4 1 1 A 103 103 SER CA C 103 58.301 59.635 -1.334 1
1 1199 . 4 1 1 A 103 103 SER CB C 103 63.961 61.130 2.831 1
1 1200 . 4 1 1 A 103 103 SER N N 103 115.109 109.491 5.618 1
1 1201 . 4 1 1 A 104 104 THR H H 104 8.127 7.598 0.529 1
1 1202 . 4 1 1 A 104 104 THR HA H 104 4.600 4.441 0.159 1
1 1207 . 4 1 1 A 104 104 THR C C 104 174.427 174.889 -0.462 1
1 1208 . 4 1 1 A 104 104 THR CA C 104 59.954 60.456 -0.502 1
1 1209 . 4 1 1 A 104 104 THR CB C 104 69.868 68.790 1.078 1
1 1211 . 4 1 1 A 104 104 THR N N 104 117.882 112.621 5.261 1
1 1212 . 4 1 1 A 105 105 PRO HA H 105 4.414 4.638 -0.224 1
1 1219 . 4 1 1 A 105 105 PRO CA C 105 63.300 63.879 -0.579 1
1 1220 . 4 1 1 A 105 105 PRO CB C 105 32.227 31.928 0.299 1
1 1223 . 4 1 1 A 106 106 GLN H H 106 8.524 7.762 0.762 1
1 1224 . 4 1 1 A 106 106 GLN HA H 106 4.276 3.982 0.294 1
1 1229 . 4 1 1 A 106 106 GLN C C 106 177.083 177.260 -0.177 1
1 1230 . 4 1 1 A 106 106 GLN CA C 106 56.209 58.030 -1.821 1
1 1231 . 4 1 1 A 106 106 GLN CB C 106 29.490 28.340 1.150 1
1 1233 . 4 1 1 A 106 106 GLN N N 106 120.754 119.282 1.472 1
1 1234 . 4 1 1 A 107 107 GLY H H 107 8.394 8.513 -0.119 1
1 1235 . 4 1 1 A 107 107 GLY HA2 H 107 3.895 4.001 -0.106 1
1 1236 . 4 1 1 A 107 107 GLY HA3 H 107 3.895 4.026 -0.131 1
1 1237 . 4 1 1 A 107 107 GLY C C 107 176.651 175.055 1.596 1
1 1238 . 4 1 1 A 107 107 GLY CA C 107 45.330 45.832 -0.502 1
1 1239 . 4 1 1 A 107 107 GLY N N 107 110.026 114.257 -4.231 1
1 1240 . 4 1 1 A 108 108 PHE H H 108 8.099 8.674 -0.575 1
1 1241 . 4 1 1 A 108 108 PHE HA H 108 4.582 4.457 0.125 1
1 1245 . 4 1 1 A 108 108 PHE C C 108 173.944 174.143 -0.199 1
1 1246 . 4 1 1 A 108 108 PHE CA C 108 58.054 59.657 -1.603 1
1 1247 . 4 1 1 A 108 108 PHE CB C 108 39.708 38.835 0.873 1
1 1248 . 4 1 1 A 108 108 PHE N N 108 120.180 118.910 1.270 1
1 1249 . 4 1 1 A 109 109 ASN H H 109 8.482 8.247 0.235 1
1 1250 . 4 1 1 A 109 109 ASN HA H 109 4.691 4.935 -0.244 1
1 1255 . 4 1 1 A 109 109 ASN C C 109 175.627 173.575 2.052 1
1 1256 . 4 1 1 A 109 109 ASN CA C 109 53.402 52.249 1.153 1
1 1257 . 4 1 1 A 109 109 ASN CB C 109 38.883 41.817 -2.934 1
1 1258 . 4 1 1 A 109 109 ASN N N 109 120.752 116.438 4.314 1
1 1260 . 4 1 1 A 110 110 THR H H 110 8.112 8.468 -0.356 1
1 1261 . 4 1 1 A 110 110 THR HA H 110 4.251 4.186 0.065 1
1 1266 . 4 1 1 A 110 110 THR C C 110 175.275 174.787 0.488 1
1 1267 . 4 1 1 A 110 110 THR CA C 110 62.460 64.353 -1.893 1
1 1268 . 4 1 1 A 110 110 THR CB C 110 69.726 68.827 0.899 1
1 1270 . 4 1 1 A 110 110 THR N N 110 114.601 117.890 -3.289 1
1 1271 . 4 1 1 A 111 111 LEU H H 111 8.168 8.339 -0.171 1
1 1272 . 4 1 1 A 111 111 LEU HA H 111 4.308 4.172 0.136 1
1 1282 . 4 1 1 A 111 111 LEU CA C 111 55.704 54.992 0.712 1
1 1283 . 4 1 1 A 111 111 LEU CB C 111 42.071 42.697 -0.626 1
1 1287 . 4 1 1 A 111 111 LEU N N 111 123.756 125.232 -1.476 1
1 1288 . 4 1 1 A 112 112 LYS H H 112 8.123 8.360 -0.237 1
1 1289 . 4 1 1 A 112 112 LYS HA H 112 4.242 4.553 -0.311 1
1 1298 . 4 1 1 A 112 112 LYS C C 112 177.547 175.364 2.183 1
1 1299 . 4 1 1 A 112 112 LYS CA C 112 56.928 55.857 1.071 1
1 1300 . 4 1 1 A 112 112 LYS CB C 112 33.055 35.163 -2.108 1
1 1304 . 4 1 1 A 112 112 LYS N N 112 121.442 122.969 -1.527 1
1 1305 . 4 1 1 A 113 113 ASP H H 113 8.230 9.075 -0.845 1
1 1306 . 4 1 1 A 113 113 ASP HA H 113 4.526 4.323 0.203 1
1 1309 . 4 1 1 A 113 113 ASP C C 113 176.532 174.441 2.091 1
1 1310 . 4 1 1 A 113 113 ASP CA C 113 54.896 55.552 -0.656 1
1 1311 . 4 1 1 A 113 113 ASP CB C 113 41.362 40.433 0.929 1
1 1312 . 4 1 1 A 113 113 ASP N N 113 120.598 125.962 -5.364 1
1 1313 . 4 1 1 A 114 114 LYS H H 114 8.127 7.852 0.275 1
1 1314 . 4 1 1 A 114 114 LYS HA H 114 4.300 4.808 -0.508 1
1 1323 . 4 1 1 A 114 114 LYS C C 114 176.303 175.141 1.162 1
1 1324 . 4 1 1 A 114 114 LYS CA C 114 56.633 54.280 2.353 1
1 1325 . 4 1 1 A 114 114 LYS CB C 114 32.818 37.131 -4.313 1
1 1329 . 4 1 1 A 114 114 LYS N N 114 120.897 118.829 2.068 1
1 1330 . 4 1 1 A 115 115 LEU H H 115 8.244 8.365 -0.121 1
1 1331 . 4 1 1 A 115 115 LEU HA H 115 4.254 4.297 -0.043 1
1 1341 . 4 1 1 A 115 115 LEU C C 115 176.909 176.186 0.723 1
1 1342 . 4 1 1 A 115 115 LEU CA C 115 56.282 55.422 0.860 1
1 1343 . 4 1 1 A 115 115 LEU CB C 115 42.188 43.535 -1.347 1
1 1347 . 4 1 1 A 115 115 LEU N N 115 123.251 124.035 -0.784 1
1 1348 . 4 1 1 A 116 116 GLU H H 116 8.421 8.551 -0.130 1
1 1349 . 4 1 1 A 116 116 GLU HA H 116 4.190 4.188 0.002 1
1 1352 . 4 1 1 A 116 116 GLU C C 116 177.828 175.792 2.036 1
1 1353 . 4 1 1 A 116 116 GLU CA C 116 57.466 56.808 0.658 1
1 1354 . 4 1 1 A 116 116 GLU CB C 116 30.124 30.021 0.103 1
1 1355 . 4 1 1 A 116 116 GLU N N 116 120.575 124.018 -3.443 1
1 1356 . 4 1 1 A 117 117 GLU H H 117 8.255 8.665 -0.410 1
1 1357 . 4 1 1 A 117 117 GLU HA H 117 4.192 4.769 -0.577 1
1 1362 . 4 1 1 A 117 117 GLU CA C 117 57.491 55.669 1.822 1
1 1363 . 4 1 1 A 117 117 GLU CB C 117 30.365 33.274 -2.909 1
1 1365 . 4 1 1 A 117 117 GLU N N 117 120.933 121.623 -0.690 1
1 1366 . 4 1 1 A 118 118 TRP H H 118 8.143 8.688 -0.545 1
1 1367 . 4 1 1 A 118 118 TRP HA H 118 4.581 4.410 0.171 1
1 1372 . 4 1 1 A 118 118 TRP C C 118 176.794 176.715 0.079 1
1 1373 . 4 1 1 A 118 118 TRP CA C 118 58.363 59.703 -1.340 1
1 1374 . 4 1 1 A 118 118 TRP CB C 118 29.333 28.805 0.528 1
1 1375 . 4 1 1 A 118 118 TRP N N 118 121.592 124.524 -2.932 1
1 1376 . 4 1 1 A 119 119 ILE H H 119 7.908 6.697 1.211 1
1 1377 . 4 1 1 A 119 119 ILE HA H 119 3.828 3.608 0.220 1
1 1387 . 4 1 1 A 119 119 ILE C C 119 176.984 175.621 1.363 1
1 1388 . 4 1 1 A 119 119 ILE CA C 119 62.335 60.418 1.917 1
1 1389 . 4 1 1 A 119 119 ILE CB C 119 38.649 38.363 0.286 1
1 1393 . 4 1 1 A 119 119 ILE N N 119 122.744 119.087 3.657 1
1 1394 . 4 1 1 A 120 120 GLU H H 120 8.143 8.102 0.041 1
1 1395 . 4 1 1 A 120 120 GLU HA H 120 4.093 4.468 -0.375 1
1 1400 . 4 1 1 A 120 120 GLU C C 120 176.565 176.389 0.176 1
1 1401 . 4 1 1 A 120 120 GLU CA C 120 57.613 57.457 0.156 1
1 1402 . 4 1 1 A 120 120 GLU CB C 120 29.834 30.631 -0.797 1
1 1404 . 4 1 1 A 120 120 GLU N N 120 123.139 124.102 -0.963 1
1 1405 . 4 1 1 A 121 121 MET H H 121 8.254 8.878 -0.624 1
1 1406 . 4 1 1 A 121 121 MET HA H 121 4.357 4.722 -0.365 1
1 1411 . 4 1 1 A 121 121 MET CA C 121 56.625 54.372 2.253 1
1 1412 . 4 1 1 A 121 121 MET CB C 121 32.664 34.236 -1.572 1
1 1414 . 4 1 1 A 121 121 MET N N 121 120.449 121.929 -1.480 1
1 1415 . 4 1 1 A 122 122 SER H H 122 8.199 8.129 0.070 1
1 1416 . 4 1 1 A 122 122 SER HA H 122 4.280 4.452 -0.172 1
1 1419 . 4 1 1 A 122 122 SER C C 122 177.224 172.398 4.826 1
1 1420 . 4 1 1 A 122 122 SER CA C 122 59.635 60.754 -1.119 1
1 1421 . 4 1 1 A 122 122 SER CB C 122 63.560 62.087 1.473 1
1 1422 . 4 1 1 A 122 122 SER N N 122 115.857 114.030 1.827 1
1 1423 . 4 1 1 A 123 123 ASN H H 123 8.211 8.442 -0.231 1
1 1424 . 4 1 1 A 123 123 ASN HA H 123 4.737 5.253 -0.516 1
1 1429 . 4 1 1 A 123 123 ASN C C 123 174.709 173.264 1.445 1
1 1430 . 4 1 1 A 123 123 ASN CA C 123 53.507 52.447 1.060 1
1 1431 . 4 1 1 A 123 123 ASN CB C 123 38.800 42.706 -3.906 1
1 1432 . 4 1 1 A 123 123 ASN N N 123 119.923 120.304 -0.381 1
1 1434 . 4 1 1 A 124 124 ARG H H 124 7.997 8.674 -0.677 1
1 1435 . 4 1 1 A 124 124 ARG HA H 124 4.305 4.890 -0.585 1
1 1442 . 4 1 1 A 124 124 ARG C C 124 175.477 175.972 -0.495 1
1 1443 . 4 1 1 A 124 124 ARG CA C 124 56.709 54.447 2.262 1
1 1444 . 4 1 1 A 124 124 ARG CB C 124 30.584 33.621 -3.037 1
1 1447 . 4 1 1 A 124 124 ARG N N 124 120.821 124.228 -3.407 1
1 1448 . 4 1 1 A 125 125 LYS H H 125 8.327 8.799 -0.472 1
1 1449 . 4 1 1 A 125 125 LYS HA H 125 4.254 4.030 0.224 1
1 1458 . 4 1 1 A 125 125 LYS C C 125 176.777 175.233 1.544 1
1 1459 . 4 1 1 A 125 125 LYS CA C 125 56.860 58.642 -1.782 1
1 1460 . 4 1 1 A 125 125 LYS CB C 125 32.879 32.669 0.210 1
1 1464 . 4 1 1 A 125 125 LYS N N 125 121.891 123.507 -1.616 1
1 1465 . 4 1 1 A 126 126 ASP H H 126 8.343 7.740 0.603 1
1 1466 . 4 1 1 A 126 126 ASP HA H 126 4.581 4.988 -0.407 1
1 1469 . 4 1 1 A 126 126 ASP C C 126 176.538 173.958 2.580 1
1 1470 . 4 1 1 A 126 126 ASP CA C 126 54.540 53.279 1.261 1
1 1471 . 4 1 1 A 126 126 ASP CB C 126 40.907 44.005 -3.098 1
1 1472 . 4 1 1 A 126 126 ASP N N 126 119.814 118.111 1.703 1
1 1473 . 4 1 1 A 127 127 LEU H H 127 7.946 8.760 -0.814 1
1 1474 . 4 1 1 A 127 127 LEU HA H 127 4.309 4.933 -0.624 1
1 1484 . 4 1 1 A 127 127 LEU C C 127 176.043 175.300 0.743 1
1 1485 . 4 1 1 A 127 127 LEU CA C 127 55.427 53.340 2.087 1
1 1486 . 4 1 1 A 127 127 LEU CB C 127 42.394 45.813 -3.419 1
1 1490 . 4 1 1 A 127 127 LEU N N 127 121.432 121.622 -0.190 1
1 1491 . 4 1 1 A 128 128 ILE H H 128 7.967 8.473 -0.506 1
1 1492 . 4 1 1 A 128 128 ILE HA H 128 4.141 4.137 0.004 1
1 1502 . 4 1 1 A 128 128 ILE C C 128 177.200 174.574 2.626 1
1 1503 . 4 1 1 A 128 128 ILE CA C 128 61.150 62.463 -1.313 1
1 1504 . 4 1 1 A 128 128 ILE CB C 128 38.489 38.599 -0.110 1
1 1508 . 4 1 1 A 128 128 ILE N N 128 121.579 126.258 -4.679 1
1 1509 . 4 1 1 A 129 129 LYS H H 129 8.331 8.919 -0.588 1
1 1510 . 4 1 1 A 129 129 LYS HA H 129 4.328 4.870 -0.542 1
1 1519 . 4 1 1 A 129 129 LYS C C 129 175.952 175.603 0.349 1
1 1520 . 4 1 1 A 129 129 LYS CA C 129 56.330 54.486 1.844 1
1 1521 . 4 1 1 A 129 129 LYS CB C 129 33.010 36.077 -3.067 1
1 1525 . 4 1 1 A 129 129 LYS N N 129 126.955 127.848 -0.893 1
1 1 . 5 1 1 A 2 2 ALA HA H 2 4.070 4.559 -0.489 1
1 5 . 5 1 1 A 2 2 ALA CA C 2 52.067 51.635 0.432 1
1 6 . 5 1 1 A 2 2 ALA CB C 2 19.577 23.298 -3.721 1
1 7 . 5 1 1 A 3 3 ALA H H 3 8.714 8.469 0.245 1
1 8 . 5 1 1 A 3 3 ALA HA H 3 4.253 4.845 -0.592 1
1 12 . 5 1 1 A 3 3 ALA C C 3 173.672 177.200 -3.528 1
1 13 . 5 1 1 A 3 3 ALA CA C 3 52.067 51.066 1.001 1
1 14 . 5 1 1 A 3 3 ALA CB C 3 19.577 23.044 -3.467 1
1 15 . 5 1 1 A 3 3 ALA N N 3 124.480 119.609 4.871 1
1 16 . 5 1 1 A 4 4 LYS H H 4 8.227 9.023 -0.796 1
1 17 . 5 1 1 A 4 4 LYS HA H 4 3.976 4.102 -0.126 1
1 26 . 5 1 1 A 4 4 LYS C C 4 176.672 176.122 0.550 1
1 27 . 5 1 1 A 4 4 LYS CA C 4 57.274 57.990 -0.716 1
1 28 . 5 1 1 A 4 4 LYS CB C 4 33.209 32.873 0.336 1
1 32 . 5 1 1 A 4 4 LYS N N 4 120.988 120.411 0.577 1
1 33 . 5 1 1 A 5 5 PHE H H 5 7.719 7.783 -0.064 1
1 34 . 5 1 1 A 5 5 PHE HA H 5 4.384 5.235 -0.851 1
1 38 . 5 1 1 A 5 5 PHE C C 5 175.364 174.196 1.168 1
1 39 . 5 1 1 A 5 5 PHE CA C 5 57.074 56.205 0.869 1
1 40 . 5 1 1 A 5 5 PHE CB C 5 39.669 43.484 -3.815 1
1 41 . 5 1 1 A 5 5 PHE N N 5 119.246 116.570 2.676 1
1 42 . 5 1 1 A 6 6 GLU H H 6 8.515 8.942 -0.427 1
1 43 . 5 1 1 A 6 6 GLU HA H 6 4.370 5.005 -0.635 1
1 48 . 5 1 1 A 6 6 GLU CA C 6 55.669 54.755 0.914 1
1 49 . 5 1 1 A 6 6 GLU CB C 6 32.094 33.864 -1.770 1
1 51 . 5 1 1 A 6 6 GLU N N 6 122.193 118.715 3.478 1
1 52 . 5 1 1 A 7 7 VAL H H 7 8.636 8.666 -0.030 1
1 53 . 5 1 1 A 7 7 VAL HA H 7 3.406 3.505 -0.099 1
1 61 . 5 1 1 A 7 7 VAL C C 7 176.611 177.234 -0.623 1
1 62 . 5 1 1 A 7 7 VAL CA C 7 65.358 65.411 -0.053 1
1 63 . 5 1 1 A 7 7 VAL CB C 7 31.391 31.514 -0.123 1
1 66 . 5 1 1 A 7 7 VAL N N 7 122.949 122.366 0.583 1
1 67 . 5 1 1 A 8 8 GLY H H 8 9.394 9.096 0.298 1
1 68 . 5 1 1 A 8 8 GLY HA2 H 8 3.600 4.040 -0.440 1
1 69 . 5 1 1 A 8 8 GLY HA3 H 8 4.546 4.041 0.505 1
1 70 . 5 1 1 A 8 8 GLY C C 8 178.074 174.375 3.699 1
1 71 . 5 1 1 A 8 8 GLY CA C 8 45.121 44.906 0.215 1
1 72 . 5 1 1 A 8 8 GLY N N 8 116.837 115.628 1.209 1
1 73 . 5 1 1 A 9 9 SER H H 9 8.021 8.069 -0.048 1
1 74 . 5 1 1 A 9 9 SER HA H 9 4.680 4.461 0.219 1
1 77 . 5 1 1 A 9 9 SER C C 9 174.234 173.050 1.184 1
1 78 . 5 1 1 A 9 9 SER CA C 9 59.387 59.466 -0.079 1
1 79 . 5 1 1 A 9 9 SER CB C 9 65.584 64.606 0.978 1
1 80 . 5 1 1 A 9 9 SER N N 9 118.208 118.285 -0.077 1
1 81 . 5 1 1 A 10 10 VAL H H 10 7.945 8.237 -0.292 1
1 82 . 5 1 1 A 10 10 VAL HA H 10 4.980 5.115 -0.135 1
1 90 . 5 1 1 A 10 10 VAL C C 10 171.388 174.316 -2.928 1
1 91 . 5 1 1 A 10 10 VAL CA C 10 61.021 61.007 0.014 1
1 92 . 5 1 1 A 10 10 VAL CB C 10 33.400 35.366 -1.966 1
1 95 . 5 1 1 A 10 10 VAL N N 10 121.118 122.444 -1.326 1
1 96 . 5 1 1 A 11 11 TYR H H 11 9.008 9.196 -0.188 1
1 97 . 5 1 1 A 11 11 TYR HA H 11 4.850 5.331 -0.481 1
1 101 . 5 1 1 A 11 11 TYR C C 11 174.926 174.885 0.041 1
1 102 . 5 1 1 A 11 11 TYR CA C 11 56.803 56.184 0.619 1
1 103 . 5 1 1 A 11 11 TYR CB C 11 43.676 43.591 0.085 1
1 104 . 5 1 1 A 11 11 TYR N N 11 125.043 125.569 -0.526 1
1 105 . 5 1 1 A 12 12 THR H H 12 8.809 8.640 0.169 1
1 106 . 5 1 1 A 12 12 THR HA H 12 5.020 5.328 -0.308 1
1 111 . 5 1 1 A 12 12 THR C C 12 174.195 174.633 -0.438 1
1 112 . 5 1 1 A 12 12 THR CA C 12 62.487 60.084 2.403 1
1 113 . 5 1 1 A 12 12 THR CB C 12 69.743 71.568 -1.825 1
1 115 . 5 1 1 A 12 12 THR N N 12 116.850 115.391 1.459 1
1 116 . 5 1 1 A 13 13 GLY H H 13 9.179 8.635 0.544 1
1 117 . 5 1 1 A 13 13 GLY HA2 H 13 3.250 4.376 -1.126 1
1 118 . 5 1 1 A 13 13 GLY HA3 H 13 4.801 4.388 0.413 1
1 119 . 5 1 1 A 13 13 GLY C C 13 174.654 172.144 2.510 1
1 120 . 5 1 1 A 13 13 GLY CA C 13 44.377 45.248 -0.871 1
1 121 . 5 1 1 A 13 13 GLY N N 13 113.654 111.337 2.317 1
1 122 . 5 1 1 A 14 14 LYS H H 14 7.770 8.701 -0.931 1
1 123 . 5 1 1 A 14 14 LYS HA H 14 5.426 5.222 0.204 1
1 132 . 5 1 1 A 14 14 LYS C C 14 171.343 175.888 -4.545 1
1 133 . 5 1 1 A 14 14 LYS CA C 14 53.879 54.780 -0.901 1
1 134 . 5 1 1 A 14 14 LYS CB C 14 36.032 35.471 0.561 1
1 138 . 5 1 1 A 14 14 LYS N N 14 118.322 120.918 -2.596 1
1 139 . 5 1 1 A 15 15 VAL H H 15 9.206 9.239 -0.033 1
1 140 . 5 1 1 A 15 15 VAL HA H 15 4.400 4.232 0.168 1
1 148 . 5 1 1 A 15 15 VAL C C 15 176.306 177.188 -0.882 1
1 149 . 5 1 1 A 15 15 VAL CA C 15 63.648 63.586 0.062 1
1 150 . 5 1 1 A 15 15 VAL CB C 15 31.769 31.497 0.272 1
1 153 . 5 1 1 A 15 15 VAL N N 15 125.308 127.276 -1.968 1
1 154 . 5 1 1 A 16 16 THR H H 16 9.403 9.225 0.178 1
1 155 . 5 1 1 A 16 16 THR HA H 16 4.562 4.581 -0.019 1
1 160 . 5 1 1 A 16 16 THR C C 16 178.098 174.824 3.274 1
1 161 . 5 1 1 A 16 16 THR CA C 16 62.018 62.161 -0.143 1
1 162 . 5 1 1 A 16 16 THR CB C 16 69.720 69.639 0.081 1
1 164 . 5 1 1 A 16 16 THR N N 16 121.753 118.641 3.112 1
1 165 . 5 1 1 A 17 17 GLY H H 17 7.600 7.073 0.527 1
1 166 . 5 1 1 A 17 17 GLY HA2 H 17 4.110 4.136 -0.026 1
1 167 . 5 1 1 A 17 17 GLY HA3 H 17 4.250 4.261 -0.011 1
1 168 . 5 1 1 A 17 17 GLY C C 17 175.551 171.399 4.152 1
1 169 . 5 1 1 A 17 17 GLY CA C 17 46.258 45.561 0.697 1
1 170 . 5 1 1 A 17 17 GLY N N 17 109.407 108.408 0.999 1
1 171 . 5 1 1 A 18 18 LEU H H 18 8.820 8.498 0.322 1
1 172 . 5 1 1 A 18 18 LEU HA H 18 4.852 5.016 -0.164 1
1 182 . 5 1 1 A 18 18 LEU CA C 18 54.245 53.154 1.091 1
1 183 . 5 1 1 A 18 18 LEU CB C 18 44.906 46.225 -1.319 1
1 187 . 5 1 1 A 18 18 LEU N N 18 123.419 120.947 2.472 1
1 188 . 5 1 1 A 19 19 GLN H H 19 8.537 8.247 0.290 1
1 189 . 5 1 1 A 19 19 GLN HA H 19 4.520 4.598 -0.078 1
1 196 . 5 1 1 A 19 19 GLN C C 19 175.258 175.605 -0.347 1
1 197 . 5 1 1 A 19 19 GLN CA C 19 53.269 53.677 -0.408 1
1 198 . 5 1 1 A 19 19 GLN CB C 19 31.522 32.141 -0.619 1
1 200 . 5 1 1 A 19 19 GLN N N 19 120.187 121.173 -0.986 1
1 202 . 5 1 1 A 20 20 ALA H H 20 8.798 8.679 0.119 1
1 203 . 5 1 1 A 20 20 ALA HA H 20 4.010 4.026 -0.016 1
1 207 . 5 1 1 A 20 20 ALA C C 20 175.698 177.342 -1.644 1
1 208 . 5 1 1 A 20 20 ALA CA C 20 55.084 54.184 0.900 1
1 209 . 5 1 1 A 20 20 ALA CB C 20 18.277 18.661 -0.384 1
1 210 . 5 1 1 A 20 20 ALA N N 20 120.606 123.922 -3.316 1
1 211 . 5 1 1 A 21 21 TYR H H 21 6.618 7.340 -0.722 1
1 212 . 5 1 1 A 21 21 TYR HA H 21 4.540 4.774 -0.234 1
1 216 . 5 1 1 A 21 21 TYR C C 21 178.437 175.173 3.264 1
1 217 . 5 1 1 A 21 21 TYR CA C 21 55.120 56.909 -1.789 1
1 218 . 5 1 1 A 21 21 TYR CB C 21 37.891 40.092 -2.201 1
1 219 . 5 1 1 A 21 21 TYR N N 21 105.570 113.732 -8.162 1
1 220 . 5 1 1 A 22 22 GLY H H 22 7.203 6.939 0.264 1
1 221 . 5 1 1 A 22 22 GLY HA2 H 22 3.460 3.849 -0.389 1
1 222 . 5 1 1 A 22 22 GLY HA3 H 22 4.360 3.941 0.419 1
1 223 . 5 1 1 A 22 22 GLY C C 22 175.833 171.148 4.685 1
1 224 . 5 1 1 A 22 22 GLY CA C 22 46.356 45.335 1.021 1
1 225 . 5 1 1 A 22 22 GLY N N 22 109.854 108.302 1.552 1
1 226 . 5 1 1 A 23 23 ALA H H 23 8.549 8.353 0.196 1
1 227 . 5 1 1 A 23 23 ALA HA H 23 4.981 5.096 -0.115 1
1 231 . 5 1 1 A 23 23 ALA C C 23 168.810 176.142 -7.332 1
1 232 . 5 1 1 A 23 23 ALA CA C 23 49.178 50.701 -1.523 1
1 233 . 5 1 1 A 23 23 ALA CB C 23 22.797 21.583 1.214 1
1 234 . 5 1 1 A 23 23 ALA N N 23 118.749 122.300 -3.551 1
1 235 . 5 1 1 A 24 24 PHE H H 24 8.812 8.477 0.335 1
1 236 . 5 1 1 A 24 24 PHE HA H 24 5.125 4.804 0.321 1
1 240 . 5 1 1 A 24 24 PHE CA C 24 58.017 58.360 -0.343 1
1 241 . 5 1 1 A 24 24 PHE CB C 24 40.475 40.589 -0.114 1
1 242 . 5 1 1 A 24 24 PHE N N 24 122.891 121.728 1.163 1
1 243 . 5 1 1 A 25 25 VAL H H 25 8.880 8.894 -0.014 1
1 244 . 5 1 1 A 25 25 VAL HA H 25 4.660 4.581 0.079 1
1 252 . 5 1 1 A 25 25 VAL CA C 25 60.379 61.113 -0.734 1
1 253 . 5 1 1 A 25 25 VAL CB C 25 35.654 35.134 0.520 1
1 256 . 5 1 1 A 25 25 VAL N N 25 122.908 121.344 1.564 1
1 257 . 5 1 1 A 26 26 ALA H H 26 9.403 8.867 0.536 1
1 258 . 5 1 1 A 26 26 ALA HA H 26 4.750 4.350 0.400 1
1 262 . 5 1 1 A 26 26 ALA C C 26 174.445 176.871 -2.426 1
1 263 . 5 1 1 A 26 26 ALA CA C 26 51.711 52.760 -1.049 1
1 264 . 5 1 1 A 26 26 ALA CB C 26 19.319 19.088 0.231 1
1 265 . 5 1 1 A 26 26 ALA N N 26 129.425 130.283 -0.858 1
1 266 . 5 1 1 A 27 27 LEU H H 27 8.601 9.203 -0.602 1
1 267 . 5 1 1 A 27 27 LEU HA H 27 4.158 4.561 -0.403 1
1 277 . 5 1 1 A 27 27 LEU C C 27 177.814 176.373 1.441 1
1 278 . 5 1 1 A 27 27 LEU CA C 27 55.869 55.657 0.212 1
1 279 . 5 1 1 A 27 27 LEU CB C 27 42.251 43.765 -1.514 1
1 283 . 5 1 1 A 27 27 LEU N N 27 127.169 122.122 5.047 1
1 284 . 5 1 1 A 28 28 ASP H H 28 8.172 7.911 0.261 1
1 285 . 5 1 1 A 28 28 ASP HA H 28 4.420 4.948 -0.528 1
1 288 . 5 1 1 A 28 28 ASP C C 28 177.116 175.417 1.699 1
1 289 . 5 1 1 A 28 28 ASP CA C 28 53.755 53.274 0.481 1
1 290 . 5 1 1 A 28 28 ASP CB C 28 39.833 43.912 -4.079 1
1 291 . 5 1 1 A 28 28 ASP N N 28 115.657 116.474 -0.817 1
1 292 . 5 1 1 A 29 29 GLU H H 29 8.857 8.649 0.208 1
1 293 . 5 1 1 A 29 29 GLU HA H 29 4.090 4.116 -0.026 1
1 298 . 5 1 1 A 29 29 GLU C C 29 175.965 176.737 -0.772 1
1 299 . 5 1 1 A 29 29 GLU CA C 29 59.470 59.010 0.460 1
1 300 . 5 1 1 A 29 29 GLU CB C 29 29.409 29.325 0.084 1
1 302 . 5 1 1 A 29 29 GLU N N 29 114.738 122.883 -8.145 1
1 303 . 5 1 1 A 30 30 GLU H H 30 8.326 8.108 0.218 1
1 304 . 5 1 1 A 30 30 GLU HA H 30 4.640 4.573 0.067 1
1 309 . 5 1 1 A 30 30 GLU C C 30 176.817 175.242 1.575 1
1 310 . 5 1 1 A 30 30 GLU CA C 30 56.073 55.977 0.096 1
1 311 . 5 1 1 A 30 30 GLU CB C 30 32.453 31.399 1.054 1
1 313 . 5 1 1 A 30 30 GLU N N 30 115.753 117.342 -1.589 1
1 314 . 5 1 1 A 31 31 THR H H 31 7.819 7.634 0.185 1
1 315 . 5 1 1 A 31 31 THR HA H 31 4.484 5.111 -0.627 1
1 320 . 5 1 1 A 31 31 THR C C 31 176.330 173.223 3.107 1
1 321 . 5 1 1 A 31 31 THR CA C 31 63.398 61.047 2.351 1
1 322 . 5 1 1 A 31 31 THR CB C 31 69.367 72.807 -3.440 1
1 324 . 5 1 1 A 31 31 THR N N 31 118.750 115.482 3.268 1
1 325 . 5 1 1 A 32 32 GLN H H 32 8.913 8.826 0.087 1
1 326 . 5 1 1 A 32 32 GLN HA H 32 5.337 4.952 0.385 1
1 333 . 5 1 1 A 32 32 GLN C C 32 173.087 173.774 -0.687 1
1 334 . 5 1 1 A 32 32 GLN CA C 32 54.051 54.111 -0.060 1
1 335 . 5 1 1 A 32 32 GLN CB C 32 32.672 32.794 -0.122 1
1 337 . 5 1 1 A 32 32 GLN N N 32 127.294 122.987 4.307 1
1 339 . 5 1 1 A 33 33 GLY H H 33 8.900 8.618 0.282 1
1 340 . 5 1 1 A 33 33 GLY HA2 H 33 3.290 4.321 -1.031 1
1 341 . 5 1 1 A 33 33 GLY HA3 H 33 4.530 4.375 0.155 1
1 342 . 5 1 1 A 33 33 GLY C C 33 174.918 172.359 2.559 1
1 343 . 5 1 1 A 33 33 GLY CA C 33 44.534 45.161 -0.627 1
1 344 . 5 1 1 A 33 33 GLY N N 33 107.639 106.709 0.930 1
1 345 . 5 1 1 A 34 34 LEU H H 34 8.127 8.750 -0.623 1
1 346 . 5 1 1 A 34 34 LEU HA H 34 4.950 4.995 -0.045 1
1 356 . 5 1 1 A 34 34 LEU CA C 34 53.755 54.330 -0.575 1
1 357 . 5 1 1 A 34 34 LEU CB C 34 45.493 44.636 0.857 1
1 361 . 5 1 1 A 34 34 LEU N N 34 120.897 121.309 -0.412 1
1 362 . 5 1 1 A 35 35 VAL H H 35 9.386 8.844 0.542 1
1 363 . 5 1 1 A 35 35 VAL HA H 35 4.479 4.344 0.135 1
1 371 . 5 1 1 A 35 35 VAL C C 35 176.402 176.146 0.256 1
1 372 . 5 1 1 A 35 35 VAL CA C 35 59.594 63.041 -3.447 1
1 373 . 5 1 1 A 35 35 VAL CB C 35 32.590 31.461 1.129 1
1 376 . 5 1 1 A 35 35 VAL N N 35 128.897 127.670 1.227 1
1 377 . 5 1 1 A 36 36 HIS H H 36 9.194 8.521 0.673 1
1 378 . 5 1 1 A 36 36 HIS HA H 36 4.487 4.569 -0.082 1
1 381 . 5 1 1 A 36 36 HIS C C 36 174.864 176.442 -1.578 1
1 382 . 5 1 1 A 36 36 HIS CA C 36 59.426 56.674 2.752 1
1 383 . 5 1 1 A 36 36 HIS CB C 36 31.542 30.007 1.535 1
1 384 . 5 1 1 A 36 36 HIS N N 36 127.751 126.571 1.180 1
1 385 . 5 1 1 A 37 37 ILE H H 37 7.454 8.867 -1.413 1
1 386 . 5 1 1 A 37 37 ILE HA H 37 3.810 3.695 0.115 1
1 396 . 5 1 1 A 37 37 ILE C C 37 176.948 177.682 -0.734 1
1 397 . 5 1 1 A 37 37 ILE CA C 37 63.773 64.941 -1.168 1
1 398 . 5 1 1 A 37 37 ILE CB C 37 38.993 37.515 1.478 1
1 402 . 5 1 1 A 37 37 ILE N N 37 126.266 126.673 -0.407 1
1 403 . 5 1 1 A 38 38 SER H H 38 8.343 8.283 0.060 1
1 404 . 5 1 1 A 38 38 SER HA H 38 4.370 4.267 0.103 1
1 407 . 5 1 1 A 38 38 SER C C 38 174.792 175.021 -0.229 1
1 408 . 5 1 1 A 38 38 SER CA C 38 60.567 61.449 -0.882 1
1 409 . 5 1 1 A 38 38 SER CB C 38 63.632 62.984 0.648 1
1 410 . 5 1 1 A 38 38 SER N N 38 118.079 118.496 -0.417 1
1 411 . 5 1 1 A 39 39 GLU H H 39 8.536 7.937 0.599 1
1 412 . 5 1 1 A 39 39 GLU HA H 39 4.503 4.650 -0.147 1
1 417 . 5 1 1 A 39 39 GLU C C 39 175.131 176.690 -1.559 1
1 418 . 5 1 1 A 39 39 GLU CA C 39 54.928 55.855 -0.927 1
1 419 . 5 1 1 A 39 39 GLU CB C 39 29.621 30.611 -0.990 1
1 421 . 5 1 1 A 39 39 GLU N N 39 118.349 117.412 0.937 1
1 422 . 5 1 1 A 40 40 VAL H H 40 7.776 7.895 -0.119 1
1 423 . 5 1 1 A 40 40 VAL HA H 40 3.616 3.850 -0.234 1
1 431 . 5 1 1 A 40 40 VAL C C 40 177.277 176.394 0.883 1
1 432 . 5 1 1 A 40 40 VAL CA C 40 66.245 64.810 1.435 1
1 433 . 5 1 1 A 40 40 VAL CB C 40 32.590 31.793 0.797 1
1 436 . 5 1 1 A 40 40 VAL N N 40 125.443 118.940 6.503 1
1 437 . 5 1 1 A 41 41 THR H H 41 7.888 7.690 0.198 1
1 438 . 5 1 1 A 41 41 THR HA H 41 4.345 4.821 -0.476 1
1 443 . 5 1 1 A 41 41 THR C C 41 173.492 174.526 -1.034 1
1 444 . 5 1 1 A 41 41 THR CA C 41 59.047 61.443 -2.396 1
1 445 . 5 1 1 A 41 41 THR CB C 41 68.992 72.874 -3.882 1
1 447 . 5 1 1 A 41 41 THR N N 41 109.905 112.784 -2.879 1
1 448 . 5 1 1 A 42 42 HIS H H 42 8.063 8.337 -0.274 1
1 449 . 5 1 1 A 42 42 HIS HA H 42 4.510 4.590 -0.080 1
1 452 . 5 1 1 A 42 42 HIS C C 42 172.139 174.668 -2.529 1
1 453 . 5 1 1 A 42 42 HIS CA C 42 57.735 55.246 2.489 1
1 454 . 5 1 1 A 42 42 HIS CB C 42 31.144 29.582 1.562 1
1 455 . 5 1 1 A 42 42 HIS N N 42 121.760 121.158 0.602 1
1 456 . 5 1 1 A 43 43 GLY H H 43 8.286 7.380 0.906 1
1 457 . 5 1 1 A 43 43 GLY HA2 H 43 3.980 3.795 0.185 1
1 458 . 5 1 1 A 43 43 GLY HA3 H 43 3.980 3.956 0.024 1
1 459 . 5 1 1 A 43 43 GLY C C 43 176.307 171.738 4.569 1
1 460 . 5 1 1 A 43 43 GLY CA C 43 44.336 45.560 -1.224 1
1 461 . 5 1 1 A 43 43 GLY N N 43 110.133 107.896 2.237 1
1 462 . 5 1 1 A 44 44 PHE H H 44 8.327 8.436 -0.109 1
1 463 . 5 1 1 A 44 44 PHE HA H 44 4.489 4.417 0.072 1
1 467 . 5 1 1 A 44 44 PHE C C 44 171.877 175.295 -3.418 1
1 468 . 5 1 1 A 44 44 PHE CA C 44 58.027 59.434 -1.407 1
1 469 . 5 1 1 A 44 44 PHE CB C 44 39.850 38.974 0.876 1
1 470 . 5 1 1 A 44 44 PHE N N 44 120.049 120.013 0.036 1
1 471 . 5 1 1 A 45 45 VAL H H 45 7.939 8.753 -0.814 1
1 472 . 5 1 1 A 45 45 VAL HA H 45 3.865 3.362 0.503 1
1 480 . 5 1 1 A 45 45 VAL C C 45 175.523 175.727 -0.204 1
1 481 . 5 1 1 A 45 45 VAL CA C 45 61.536 63.576 -2.040 1
1 482 . 5 1 1 A 45 45 VAL CB C 45 33.127 31.621 1.506 1
1 485 . 5 1 1 A 45 45 VAL N N 45 127.882 125.746 2.136 1
1 486 . 5 1 1 A 46 46 LYS H H 46 8.868 8.895 -0.027 1
1 487 . 5 1 1 A 46 46 LYS HA H 46 4.170 4.170 0.000 1
1 496 . 5 1 1 A 46 46 LYS C C 46 175.728 176.182 -0.454 1
1 497 . 5 1 1 A 46 46 LYS CA C 46 57.198 58.469 -1.271 1
1 498 . 5 1 1 A 46 46 LYS CB C 46 33.299 33.181 0.118 1
1 502 . 5 1 1 A 46 46 LYS N N 46 127.308 127.759 -0.451 1
1 503 . 5 1 1 A 47 47 ASP H H 47 7.652 7.954 -0.302 1
1 504 . 5 1 1 A 47 47 ASP HA H 47 4.710 4.923 -0.213 1
1 507 . 5 1 1 A 47 47 ASP C C 47 176.411 176.010 0.401 1
1 508 . 5 1 1 A 47 47 ASP CA C 47 53.390 53.922 -0.532 1
1 509 . 5 1 1 A 47 47 ASP CB C 47 42.635 44.268 -1.633 1
1 510 . 5 1 1 A 47 47 ASP N N 47 117.932 114.985 2.947 1
1 511 . 5 1 1 A 48 48 ILE H H 48 9.230 8.638 0.592 1
1 512 . 5 1 1 A 48 48 ILE HA H 48 3.579 3.867 -0.288 1
1 522 . 5 1 1 A 48 48 ILE C C 48 177.249 177.603 -0.354 1
1 523 . 5 1 1 A 48 48 ILE CA C 48 65.525 63.702 1.823 1
1 524 . 5 1 1 A 48 48 ILE CB C 48 38.797 37.733 1.064 1
1 528 . 5 1 1 A 48 48 ILE N N 48 129.049 125.265 3.784 1
1 529 . 5 1 1 A 49 49 ASN H H 49 8.468 9.097 -0.629 1
1 530 . 5 1 1 A 49 49 ASN HA H 49 4.690 4.696 -0.006 1
1 535 . 5 1 1 A 49 49 ASN C C 49 175.779 176.382 -0.603 1
1 536 . 5 1 1 A 49 49 ASN CA C 49 55.587 55.004 0.583 1
1 537 . 5 1 1 A 49 49 ASN CB C 49 38.587 36.791 1.796 1
1 538 . 5 1 1 A 49 49 ASN N N 49 118.835 117.636 1.199 1
1 540 . 5 1 1 A 50 50 GLU H H 50 7.853 8.162 -0.309 1
1 541 . 5 1 1 A 50 50 GLU HA H 50 4.040 4.251 -0.211 1
1 546 . 5 1 1 A 50 50 GLU C C 50 176.148 177.321 -1.173 1
1 547 . 5 1 1 A 50 50 GLU CA C 50 57.404 57.183 0.221 1
1 548 . 5 1 1 A 50 50 GLU CB C 50 29.491 29.797 -0.306 1
1 550 . 5 1 1 A 50 50 GLU N N 50 116.358 118.279 -1.921 1
1 551 . 5 1 1 A 51 51 HIS H H 51 7.575 7.991 -0.416 1
1 552 . 5 1 1 A 51 51 HIS HA H 51 4.431 4.741 -0.310 1
1 555 . 5 1 1 A 51 51 HIS C C 51 176.383 174.839 1.544 1
1 556 . 5 1 1 A 51 51 HIS CA C 51 57.089 56.678 0.411 1
1 557 . 5 1 1 A 51 51 HIS CB C 51 33.168 32.043 1.125 1
1 558 . 5 1 1 A 51 51 HIS N N 51 115.828 115.140 0.688 1
1 559 . 5 1 1 A 52 52 LEU H H 52 7.640 7.617 0.023 1
1 560 . 5 1 1 A 52 52 LEU HA H 52 4.796 4.879 -0.083 1
1 570 . 5 1 1 A 52 52 LEU C C 52 174.452 175.166 -0.714 1
1 571 . 5 1 1 A 52 52 LEU CA C 52 53.398 53.510 -0.112 1
1 572 . 5 1 1 A 52 52 LEU CB C 52 48.805 47.415 1.390 1
1 576 . 5 1 1 A 52 52 LEU N N 52 117.932 118.978 -1.046 1
1 577 . 5 1 1 A 53 53 SER H H 53 8.151 8.718 -0.567 1
1 578 . 5 1 1 A 53 53 SER HA H 53 4.680 4.952 -0.272 1
1 581 . 5 1 1 A 53 53 SER C C 53 174.304 172.985 1.319 1
1 582 . 5 1 1 A 53 53 SER CA C 53 56.714 57.602 -0.888 1
1 583 . 5 1 1 A 53 53 SER CB C 53 65.431 66.046 -0.615 1
1 584 . 5 1 1 A 53 53 SER N N 53 113.496 117.510 -4.014 1
1 585 . 5 1 1 A 54 54 VAL H H 54 8.782 8.560 0.222 1
1 586 . 5 1 1 A 54 54 VAL HA H 54 3.230 3.792 -0.562 1
1 594 . 5 1 1 A 54 54 VAL C C 54 173.745 177.191 -3.446 1
1 595 . 5 1 1 A 54 54 VAL CA C 54 66.232 63.662 2.570 1
1 596 . 5 1 1 A 54 54 VAL CB C 54 31.067 31.582 -0.515 1
1 599 . 5 1 1 A 54 54 VAL N N 54 124.401 126.361 -1.960 1
1 600 . 5 1 1 A 55 55 GLY H H 55 9.079 8.902 0.177 1
1 601 . 5 1 1 A 55 55 GLY HA2 H 55 3.530 3.856 -0.326 1
1 602 . 5 1 1 A 55 55 GLY HA3 H 55 4.553 3.859 0.694 1
1 603 . 5 1 1 A 55 55 GLY C C 55 177.219 173.213 4.006 1
1 604 . 5 1 1 A 55 55 GLY CA C 55 44.647 46.218 -1.571 1
1 605 . 5 1 1 A 55 55 GLY N N 55 117.320 116.138 1.182 1
1 606 . 5 1 1 A 56 56 ASP H H 56 7.943 7.750 0.193 1
1 607 . 5 1 1 A 56 56 ASP HA H 56 4.460 5.156 -0.696 1
1 610 . 5 1 1 A 56 56 ASP C C 56 176.055 173.730 2.325 1
1 611 . 5 1 1 A 56 56 ASP CA C 56 55.456 52.464 2.992 1
1 612 . 5 1 1 A 56 56 ASP CB C 56 40.914 44.604 -3.690 1
1 613 . 5 1 1 A 56 56 ASP N N 56 121.782 119.675 2.107 1
1 614 . 5 1 1 A 57 57 GLU H H 57 8.649 8.946 -0.297 1
1 615 . 5 1 1 A 57 57 GLU HA H 57 5.100 5.260 -0.160 1
1 620 . 5 1 1 A 57 57 GLU C C 57 175.635 175.578 0.057 1
1 621 . 5 1 1 A 57 57 GLU CA C 57 55.805 55.279 0.526 1
1 622 . 5 1 1 A 57 57 GLU CB C 57 30.915 32.361 -1.446 1
1 624 . 5 1 1 A 57 57 GLU N N 57 122.513 123.580 -1.067 1
1 625 . 5 1 1 A 58 58 VAL H H 58 8.809 9.000 -0.191 1
1 626 . 5 1 1 A 58 58 VAL HA H 58 4.817 4.770 0.047 1
1 634 . 5 1 1 A 58 58 VAL C C 58 176.528 174.546 1.982 1
1 635 . 5 1 1 A 58 58 VAL CA C 58 58.719 59.478 -0.759 1
1 636 . 5 1 1 A 58 58 VAL CB C 58 35.523 35.827 -0.304 1
1 639 . 5 1 1 A 58 58 VAL N N 58 118.382 119.965 -1.583 1
1 640 . 5 1 1 A 59 59 GLN H H 59 8.255 8.617 -0.362 1
1 641 . 5 1 1 A 59 59 GLN HA H 59 5.030 4.679 0.351 1
1 646 . 5 1 1 A 59 59 GLN CA C 59 54.843 56.521 -1.678 1
1 647 . 5 1 1 A 59 59 GLN CB C 59 30.111 29.063 1.048 1
1 649 . 5 1 1 A 59 59 GLN N N 59 120.933 123.275 -2.342 1
1 650 . 5 1 1 A 60 60 VAL H H 60 8.970 9.180 -0.210 1
1 651 . 5 1 1 A 60 60 VAL HA H 60 4.990 4.841 0.149 1
1 659 . 5 1 1 A 60 60 VAL C C 60 175.203 173.995 1.208 1
1 660 . 5 1 1 A 60 60 VAL CA C 60 57.404 59.469 -2.065 1
1 661 . 5 1 1 A 60 60 VAL CB C 60 35.771 35.615 0.156 1
1 664 . 5 1 1 A 60 60 VAL N N 60 111.046 118.851 -7.805 1
1 665 . 5 1 1 A 61 61 LYS H H 61 8.937 8.484 0.453 1
1 666 . 5 1 1 A 61 61 LYS HA H 61 5.100 4.758 0.342 1
1 675 . 5 1 1 A 61 61 LYS C C 61 173.610 176.478 -2.868 1
1 676 . 5 1 1 A 61 61 LYS CA C 61 53.762 55.259 -1.497 1
1 677 . 5 1 1 A 61 61 LYS CB C 61 36.273 34.095 2.178 1
1 681 . 5 1 1 A 61 61 LYS N N 61 121.930 124.615 -2.685 1
1 682 . 5 1 1 A 62 62 VAL H H 62 8.429 9.349 -0.920 1
1 683 . 5 1 1 A 62 62 VAL HA H 62 4.074 4.052 0.022 1
1 691 . 5 1 1 A 62 62 VAL C C 62 176.912 176.012 0.900 1
1 692 . 5 1 1 A 62 62 VAL CA C 62 63.188 63.630 -0.442 1
1 693 . 5 1 1 A 62 62 VAL CB C 62 30.813 31.295 -0.482 1
1 696 . 5 1 1 A 62 62 VAL N N 62 126.329 127.135 -0.806 1
1 697 . 5 1 1 A 63 63 LEU H H 63 9.109 9.102 0.007 1
1 698 . 5 1 1 A 63 63 LEU HA H 63 4.423 4.402 0.021 1
1 708 . 5 1 1 A 63 63 LEU C C 63 176.091 176.088 0.003 1
1 709 . 5 1 1 A 63 63 LEU CA C 63 55.876 56.552 -0.676 1
1 710 . 5 1 1 A 63 63 LEU CB C 63 42.800 43.469 -0.669 1
1 714 . 5 1 1 A 63 63 LEU N N 63 129.436 129.918 -0.482 1
1 715 . 5 1 1 A 64 64 ALA H H 64 7.594 7.262 0.332 1
1 716 . 5 1 1 A 64 64 ALA HA H 64 4.455 4.720 -0.265 1
1 720 . 5 1 1 A 64 64 ALA C C 64 177.314 175.200 2.114 1
1 721 . 5 1 1 A 64 64 ALA CA C 64 52.557 51.755 0.802 1
1 722 . 5 1 1 A 64 64 ALA CB C 64 21.458 22.588 -1.130 1
1 723 . 5 1 1 A 64 64 ALA N N 64 117.791 118.479 -0.688 1
1 724 . 5 1 1 A 65 65 VAL H H 65 8.583 8.576 0.007 1
1 725 . 5 1 1 A 65 65 VAL HA H 65 4.470 4.895 -0.425 1
1 733 . 5 1 1 A 65 65 VAL C C 65 174.697 172.871 1.826 1
1 734 . 5 1 1 A 65 65 VAL CA C 65 61.936 60.429 1.507 1
1 735 . 5 1 1 A 65 65 VAL CB C 65 35.288 35.533 -0.245 1
1 738 . 5 1 1 A 65 65 VAL N N 65 120.009 118.374 1.635 1
1 739 . 5 1 1 A 66 66 ASP H H 66 8.567 8.959 -0.392 1
1 740 . 5 1 1 A 66 66 ASP HA H 66 4.880 4.981 -0.101 1
1 743 . 5 1 1 A 66 66 ASP C C 66 174.355 176.096 -1.741 1
1 744 . 5 1 1 A 66 66 ASP CA C 66 52.681 53.442 -0.761 1
1 745 . 5 1 1 A 66 66 ASP CB C 66 41.775 42.277 -0.502 1
1 746 . 5 1 1 A 66 66 ASP N N 66 126.262 127.739 -1.477 1
1 747 . 5 1 1 A 67 67 GLU H H 67 9.148 8.814 0.334 1
1 748 . 5 1 1 A 67 67 GLU HA H 67 4.110 4.097 0.013 1
1 753 . 5 1 1 A 67 67 GLU C C 67 177.052 177.988 -0.936 1
1 754 . 5 1 1 A 67 67 GLU CA C 67 59.044 58.978 0.066 1
1 755 . 5 1 1 A 67 67 GLU CB C 67 29.919 29.607 0.312 1
1 757 . 5 1 1 A 67 67 GLU N N 67 125.480 125.852 -0.372 1
1 758 . 5 1 1 A 68 68 GLU H H 68 8.384 7.947 0.437 1
1 759 . 5 1 1 A 68 68 GLU HA H 68 4.140 4.174 -0.034 1
1 764 . 5 1 1 A 68 68 GLU C C 68 178.383 179.128 -0.745 1
1 765 . 5 1 1 A 68 68 GLU CA C 68 59.044 59.001 0.043 1
1 766 . 5 1 1 A 68 68 GLU CB C 68 29.919 29.974 -0.055 1
1 768 . 5 1 1 A 68 68 GLU N N 68 119.760 118.706 1.054 1
1 769 . 5 1 1 A 69 69 LYS H H 69 7.799 8.006 -0.207 1
1 770 . 5 1 1 A 69 69 LYS HA H 69 4.375 4.210 0.165 1
1 779 . 5 1 1 A 69 69 LYS C C 69 178.297 177.334 0.963 1
1 780 . 5 1 1 A 69 69 LYS CA C 69 55.704 56.269 -0.565 1
1 781 . 5 1 1 A 69 69 LYS CB C 69 33.622 32.823 0.799 1
1 785 . 5 1 1 A 69 69 LYS N N 69 115.476 116.956 -1.480 1
1 786 . 5 1 1 A 70 70 GLY H H 70 7.994 8.049 -0.055 1
1 787 . 5 1 1 A 70 70 GLY HA2 H 70 3.940 3.927 0.013 1
1 788 . 5 1 1 A 70 70 GLY HA3 H 70 3.960 3.933 0.027 1
1 789 . 5 1 1 A 70 70 GLY C C 70 177.215 174.179 3.036 1
1 790 . 5 1 1 A 70 70 GLY CA C 70 46.773 46.716 0.057 1
1 791 . 5 1 1 A 70 70 GLY N N 70 110.245 109.002 1.243 1
1 792 . 5 1 1 A 71 71 LYS H H 71 7.560 7.973 -0.413 1
1 793 . 5 1 1 A 71 71 LYS HA H 71 4.690 4.931 -0.241 1
1 802 . 5 1 1 A 71 71 LYS C C 71 174.607 175.152 -0.545 1
1 803 . 5 1 1 A 71 71 LYS CA C 71 55.332 54.303 1.029 1
1 804 . 5 1 1 A 71 71 LYS CB C 71 34.903 36.264 -1.361 1
1 808 . 5 1 1 A 71 71 LYS N N 71 118.201 118.422 -0.221 1
1 809 . 5 1 1 A 72 72 ILE H H 72 8.867 8.883 -0.016 1
1 810 . 5 1 1 A 72 72 ILE HA H 72 4.630 4.774 -0.144 1
1 820 . 5 1 1 A 72 72 ILE C C 72 175.708 175.127 0.581 1
1 821 . 5 1 1 A 72 72 ILE CA C 72 61.494 60.367 1.127 1
1 822 . 5 1 1 A 72 72 ILE CB C 72 40.652 41.091 -0.439 1
1 826 . 5 1 1 A 72 72 ILE N N 72 126.827 122.438 4.389 1
1 827 . 5 1 1 A 73 73 SER H H 73 8.815 8.838 -0.023 1
1 828 . 5 1 1 A 73 73 SER HA H 73 5.110 4.976 0.134 1
1 831 . 5 1 1 A 73 73 SER C C 73 175.122 173.981 1.141 1
1 832 . 5 1 1 A 73 73 SER CA C 73 57.487 58.755 -1.268 1
1 833 . 5 1 1 A 73 73 SER CB C 73 64.386 63.453 0.933 1
1 834 . 5 1 1 A 73 73 SER N N 73 123.640 124.430 -0.790 1
1 835 . 5 1 1 A 74 74 LEU H H 74 8.585 8.781 -0.196 1
1 836 . 5 1 1 A 74 74 LEU HA H 74 5.450 5.340 0.110 1
1 846 . 5 1 1 A 74 74 LEU C C 74 174.061 176.047 -1.986 1
1 847 . 5 1 1 A 74 74 LEU CA C 74 53.101 53.506 -0.405 1
1 848 . 5 1 1 A 74 74 LEU CB C 74 48.268 46.659 1.609 1
1 852 . 5 1 1 A 74 74 LEU N N 74 125.221 124.314 0.907 1
1 853 . 5 1 1 A 75 75 SER H H 75 8.840 8.759 0.081 1
1 854 . 5 1 1 A 75 75 SER HA H 75 5.040 5.209 -0.169 1
1 857 . 5 1 1 A 75 75 SER C C 75 176.552 173.619 2.933 1
1 858 . 5 1 1 A 75 75 SER CA C 75 57.487 57.151 0.336 1
1 859 . 5 1 1 A 75 75 SER CB C 75 64.993 66.600 -1.607 1
1 860 . 5 1 1 A 75 75 SER N N 75 111.252 116.335 -5.083 1
1 861 . 5 1 1 A 76 76 ILE H H 76 7.790 8.750 -0.960 1
1 862 . 5 1 1 A 76 76 ILE HA H 76 4.690 4.616 0.074 1
1 872 . 5 1 1 A 76 76 ILE C C 76 175.780 176.879 -1.099 1
1 873 . 5 1 1 A 76 76 ILE CA C 76 63.631 61.349 2.282 1
1 874 . 5 1 1 A 76 76 ILE CB C 76 39.484 39.621 -0.137 1
1 878 . 5 1 1 A 76 76 ILE N N 76 129.205 124.156 5.049 1
1 879 . 5 1 1 A 77 77 ARG H H 77 8.115 8.563 -0.448 1
1 880 . 5 1 1 A 77 77 ARG HA H 77 3.760 4.067 -0.307 1
1 887 . 5 1 1 A 77 77 ARG C C 77 178.704 177.883 0.821 1
1 888 . 5 1 1 A 77 77 ARG CA C 77 58.933 58.472 0.461 1
1 889 . 5 1 1 A 77 77 ARG CB C 77 29.463 29.766 -0.303 1
1 892 . 5 1 1 A 77 77 ARG N N 77 123.257 121.887 1.370 1
1 893 . 5 1 1 A 78 78 ALA H H 78 8.304 7.685 0.619 1
1 894 . 5 1 1 A 78 78 ALA HA H 78 4.296 4.182 0.114 1
1 898 . 5 1 1 A 78 78 ALA C C 78 176.870 177.954 -1.084 1
1 899 . 5 1 1 A 78 78 ALA CA C 78 53.548 53.979 -0.431 1
1 900 . 5 1 1 A 78 78 ALA CB C 78 19.872 18.473 1.399 1
1 901 . 5 1 1 A 78 78 ALA N N 78 118.764 121.283 -2.519 1
1 902 . 5 1 1 A 79 79 THR H H 79 7.931 7.775 0.156 1
1 903 . 5 1 1 A 79 79 THR HA H 79 4.370 4.647 -0.277 1
1 908 . 5 1 1 A 79 79 THR C C 79 178.356 173.667 4.689 1
1 909 . 5 1 1 A 79 79 THR CA C 79 62.381 61.481 0.900 1
1 910 . 5 1 1 A 79 79 THR CB C 79 69.693 70.932 -1.239 1
1 912 . 5 1 1 A 79 79 THR N N 79 107.360 103.501 3.859 1
1 913 . 5 1 1 A 80 80 GLN H H 80 7.651 7.671 -0.020 1
1 914 . 5 1 1 A 80 80 GLN HA H 80 4.527 4.680 -0.153 1
1 921 . 5 1 1 A 80 80 GLN C C 80 174.249 174.930 -0.681 1
1 922 . 5 1 1 A 80 80 GLN CA C 80 54.760 54.186 0.574 1
1 923 . 5 1 1 A 80 80 GLN CB C 80 30.565 31.696 -1.131 1
1 925 . 5 1 1 A 80 80 GLN N N 80 121.588 118.633 2.955 1
1 927 . 5 1 1 A 81 81 ALA H H 81 8.498 8.733 -0.235 1
1 928 . 5 1 1 A 81 81 ALA HA H 81 4.252 4.429 -0.177 1
1 932 . 5 1 1 A 81 81 ALA C C 81 175.693 176.712 -1.019 1
1 933 . 5 1 1 A 81 81 ALA CA C 81 52.345 52.938 -0.593 1
1 934 . 5 1 1 A 81 81 ALA CB C 81 19.062 20.505 -1.443 1
1 935 . 5 1 1 A 81 81 ALA N N 81 126.423 122.341 4.082 1
1 936 . 5 1 1 A 82 82 ALA H H 82 8.324 7.617 0.707 1
1 937 . 5 1 1 A 82 82 ALA HA H 82 4.000 4.537 -0.537 1
1 941 . 5 1 1 A 82 82 ALA C C 82 177.065 174.421 2.644 1
1 942 . 5 1 1 A 82 82 ALA CA C 82 50.240 50.459 -0.219 1
1 943 . 5 1 1 A 82 82 ALA CB C 82 17.650 20.807 -3.157 1
1 944 . 5 1 1 A 82 82 ALA N N 82 125.114 118.180 6.934 1
1 945 . 5 1 1 A 83 83 PRO HA H 83 4.350 4.545 -0.195 1
1 952 . 5 1 1 A 83 83 PRO CA C 83 63.148 62.334 0.814 1
1 953 . 5 1 1 A 83 83 PRO CB C 83 32.054 32.394 -0.340 1
1 956 . 5 1 1 A 84 84 GLU H H 84 8.517 8.403 0.114 1
1 957 . 5 1 1 A 84 84 GLU HA H 84 4.197 4.269 -0.072 1
1 962 . 5 1 1 A 84 84 GLU C C 84 176.948 176.224 0.724 1
1 963 . 5 1 1 A 84 84 GLU CA C 84 56.674 56.390 0.284 1
1 964 . 5 1 1 A 84 84 GLU CB C 84 30.459 29.778 0.681 1
1 966 . 5 1 1 A 84 84 GLU N N 84 121.479 119.568 1.911 1
1 967 . 5 1 1 A 85 85 LYS H H 85 8.381 8.468 -0.087 1
1 968 . 5 1 1 A 85 85 LYS HA H 85 4.309 4.407 -0.098 1
1 977 . 5 1 1 A 85 85 LYS C C 85 176.457 176.517 -0.060 1
1 978 . 5 1 1 A 85 85 LYS CA C 85 56.272 56.987 -0.715 1
1 979 . 5 1 1 A 85 85 LYS CB C 85 32.961 33.221 -0.260 1
1 983 . 5 1 1 A 85 85 LYS N N 85 123.266 122.321 0.945 1
1 984 . 5 1 1 A 86 86 LYS H H 86 8.403 8.924 -0.521 1
1 985 . 5 1 1 A 86 86 LYS HA H 86 4.308 4.990 -0.682 1
1 994 . 5 1 1 A 86 86 LYS C C 86 176.435 174.699 1.736 1
1 995 . 5 1 1 A 86 86 LYS CA C 86 56.272 54.215 2.057 1
1 996 . 5 1 1 A 86 86 LYS CB C 86 32.961 35.803 -2.842 1
1 1000 . 5 1 1 A 86 86 LYS N N 86 123.688 119.054 4.634 1
1 1001 . 5 1 1 A 87 87 GLU H H 87 8.540 8.765 -0.225 1
1 1002 . 5 1 1 A 87 87 GLU HA H 87 4.358 4.101 0.257 1
1 1007 . 5 1 1 A 87 87 GLU C C 87 176.556 177.909 -1.353 1
1 1008 . 5 1 1 A 87 87 GLU CA C 87 56.406 57.293 -0.887 1
1 1009 . 5 1 1 A 87 87 GLU CB C 87 30.607 31.081 -0.474 1
1 1011 . 5 1 1 A 87 87 GLU N N 87 122.633 122.551 0.082 1
1 1012 . 5 1 1 A 88 88 SER H H 88 8.520 8.525 -0.005 1
1 1013 . 5 1 1 A 88 88 SER HA H 88 4.490 4.494 -0.004 1
1 1016 . 5 1 1 A 88 88 SER C C 88 175.780 175.056 0.724 1
1 1017 . 5 1 1 A 88 88 SER CA C 88 58.431 60.513 -2.082 1
1 1018 . 5 1 1 A 88 88 SER CB C 88 63.858 63.992 -0.134 1
1 1019 . 5 1 1 A 88 88 SER N N 88 118.333 120.169 -1.836 1
1 1020 . 5 1 1 A 89 89 LYS H H 89 8.339 7.786 0.553 1
1 1021 . 5 1 1 A 89 89 LYS HA H 89 4.620 4.641 -0.021 1
1 1030 . 5 1 1 A 89 89 LYS C C 89 174.160 175.031 -0.871 1
1 1031 . 5 1 1 A 89 89 LYS CA C 89 54.265 53.568 0.697 1
1 1032 . 5 1 1 A 89 89 LYS CB C 89 32.672 32.504 0.168 1
1 1036 . 5 1 1 A 89 89 LYS N N 89 124.433 116.527 7.906 1
1 1037 . 5 1 1 A 90 90 PRO HA H 90 4.417 4.749 -0.332 1
1 1044 . 5 1 1 A 90 90 PRO CA C 90 63.064 63.062 0.002 1
1 1045 . 5 1 1 A 90 90 PRO CB C 90 32.266 33.222 -0.956 1
1 1048 . 5 1 1 A 91 91 ARG H H 91 8.502 8.841 -0.339 1
1 1049 . 5 1 1 A 91 91 ARG HA H 91 4.305 4.519 -0.214 1
1 1056 . 5 1 1 A 91 91 ARG C C 91 176.831 174.811 2.020 1
1 1057 . 5 1 1 A 91 91 ARG CA C 91 56.002 56.699 -0.697 1
1 1058 . 5 1 1 A 91 91 ARG CB C 91 30.913 33.839 -2.926 1
1 1061 . 5 1 1 A 91 91 ARG N N 91 122.193 121.943 0.250 1
1 1062 . 5 1 1 A 92 92 LYS H H 92 8.415 7.735 0.680 1
1 1063 . 5 1 1 A 92 92 LYS HA H 92 4.610 4.739 -0.129 1
1 1072 . 5 1 1 A 92 92 LYS C C 92 176.262 173.815 2.447 1
1 1073 . 5 1 1 A 92 92 LYS CA C 92 54.258 53.163 1.095 1
1 1074 . 5 1 1 A 92 92 LYS CB C 92 32.672 35.085 -2.413 1
1 1078 . 5 1 1 A 92 92 LYS N N 92 124.243 118.450 5.793 1
1 1079 . 5 1 1 A 93 93 PRO HA H 93 4.415 4.617 -0.202 1
1 1086 . 5 1 1 A 93 93 PRO CA C 93 62.899 62.969 -0.070 1
1 1087 . 5 1 1 A 93 93 PRO CB C 93 32.323 32.909 -0.586 1
1 1090 . 5 1 1 A 94 94 LYS H H 94 8.420 8.791 -0.371 1
1 1091 . 5 1 1 A 94 94 LYS HA H 94 4.290 4.492 -0.202 1
1 1100 . 5 1 1 A 94 94 LYS C C 94 176.714 176.447 0.267 1
1 1101 . 5 1 1 A 94 94 LYS CA C 94 56.585 56.024 0.561 1
1 1102 . 5 1 1 A 94 94 LYS CB C 94 33.161 32.815 0.346 1
1 1106 . 5 1 1 A 94 94 LYS N N 94 122.121 119.455 2.666 1
1 1107 . 5 1 1 A 95 95 ALA H H 95 8.348 7.465 0.883 1
1 1108 . 5 1 1 A 95 95 ALA HA H 95 4.250 4.292 -0.042 1
1 1112 . 5 1 1 A 95 95 ALA C C 95 176.453 177.358 -0.905 1
1 1113 . 5 1 1 A 95 95 ALA CA C 95 52.471 52.184 0.287 1
1 1114 . 5 1 1 A 95 95 ALA CB C 95 19.347 19.389 -0.042 1
1 1115 . 5 1 1 A 95 95 ALA N N 95 125.624 123.378 2.246 1
1 1116 . 5 1 1 A 96 96 ALA H H 96 8.348 8.287 0.061 1
1 1117 . 5 1 1 A 96 96 ALA HA H 96 4.254 4.413 -0.159 1
1 1121 . 5 1 1 A 96 96 ALA C C 96 176.462 177.804 -1.342 1
1 1122 . 5 1 1 A 96 96 ALA CA C 96 52.471 53.360 -0.889 1
1 1123 . 5 1 1 A 96 96 ALA CB C 96 19.347 19.129 0.218 1
1 1124 . 5 1 1 A 96 96 ALA N N 96 125.624 122.287 3.337 1
1 1125 . 5 1 1 A 97 97 GLN H H 97 8.333 8.652 -0.319 1
1 1126 . 5 1 1 A 97 97 GLN HA H 97 4.362 4.672 -0.310 1
1 1133 . 5 1 1 A 97 97 GLN C C 97 177.684 176.285 1.399 1
1 1134 . 5 1 1 A 97 97 GLN CA C 97 55.848 54.836 1.012 1
1 1135 . 5 1 1 A 97 97 GLN CB C 97 29.643 30.339 -0.696 1
1 1137 . 5 1 1 A 97 97 GLN N N 97 120.049 121.309 -1.260 1
1 1139 . 5 1 1 A 98 98 VAL H H 98 8.230 8.723 -0.493 1
1 1140 . 5 1 1 A 98 98 VAL HA H 98 4.145 3.908 0.237 1
1 1148 . 5 1 1 A 98 98 VAL C C 98 176.033 177.936 -1.903 1
1 1149 . 5 1 1 A 98 98 VAL CA C 98 62.444 65.263 -2.819 1
1 1150 . 5 1 1 A 98 98 VAL CB C 98 32.942 31.419 1.523 1
1 1153 . 5 1 1 A 98 98 VAL N N 98 121.607 120.546 1.061 1
1 1154 . 5 1 1 A 99 99 SER H H 99 8.375 8.355 0.020 1
1 1155 . 5 1 1 A 99 99 SER HA H 99 4.473 4.305 0.168 1
1 1158 . 5 1 1 A 99 99 SER C C 99 176.204 176.839 -0.635 1
1 1159 . 5 1 1 A 99 99 SER CA C 99 58.379 61.416 -3.037 1
1 1160 . 5 1 1 A 99 99 SER CB C 99 63.914 62.526 1.388 1
1 1161 . 5 1 1 A 99 99 SER N N 99 119.455 116.750 2.705 1
1 1162 . 5 1 1 A 100 100 GLU H H 100 8.547 8.458 0.089 1
1 1163 . 5 1 1 A 100 100 GLU HA H 100 4.304 4.137 0.167 1
1 1168 . 5 1 1 A 100 100 GLU C C 100 174.620 177.586 -2.966 1
1 1169 . 5 1 1 A 100 100 GLU CA C 100 56.835 58.729 -1.894 1
1 1170 . 5 1 1 A 100 100 GLU CB C 100 30.365 29.573 0.792 1
1 1172 . 5 1 1 A 100 100 GLU N N 100 123.419 122.558 0.861 1
1 1173 . 5 1 1 A 101 101 GLU H H 101 8.432 7.976 0.456 1
1 1174 . 5 1 1 A 101 101 GLU HA H 101 4.252 4.627 -0.375 1
1 1179 . 5 1 1 A 101 101 GLU C C 101 176.693 177.061 -0.368 1
1 1180 . 5 1 1 A 101 101 GLU CA C 101 56.835 56.186 0.649 1
1 1181 . 5 1 1 A 101 101 GLU CB C 101 30.365 30.836 -0.471 1
1 1183 . 5 1 1 A 101 101 GLU N N 101 122.025 116.886 5.139 1
1 1184 . 5 1 1 A 102 102 ALA H H 102 8.324 7.870 0.454 1
1 1185 . 5 1 1 A 102 102 ALA HA H 102 4.361 4.274 0.087 1
1 1189 . 5 1 1 A 102 102 ALA C C 102 177.065 178.262 -1.197 1
1 1190 . 5 1 1 A 102 102 ALA CA C 102 52.647 53.097 -0.450 1
1 1191 . 5 1 1 A 102 102 ALA CB C 102 19.227 18.392 0.835 1
1 1192 . 5 1 1 A 102 102 ALA N N 102 125.114 122.556 2.558 1
1 1193 . 5 1 1 A 103 103 SER H H 103 8.259 7.928 0.331 1
1 1194 . 5 1 1 A 103 103 SER HA H 103 4.473 4.563 -0.090 1
1 1197 . 5 1 1 A 103 103 SER C C 103 177.772 173.958 3.814 1
1 1198 . 5 1 1 A 103 103 SER CA C 103 58.301 58.430 -0.129 1
1 1199 . 5 1 1 A 103 103 SER CB C 103 63.961 61.981 1.980 1
1 1200 . 5 1 1 A 103 103 SER N N 103 115.109 113.019 2.090 1
1 1201 . 5 1 1 A 104 104 THR H H 104 8.127 7.368 0.759 1
1 1202 . 5 1 1 A 104 104 THR HA H 104 4.600 4.452 0.148 1
1 1207 . 5 1 1 A 104 104 THR C C 104 174.427 173.989 0.438 1
1 1208 . 5 1 1 A 104 104 THR CA C 104 59.954 60.740 -0.786 1
1 1209 . 5 1 1 A 104 104 THR CB C 104 69.868 68.828 1.040 1
1 1211 . 5 1 1 A 104 104 THR N N 104 117.882 114.080 3.802 1
1 1212 . 5 1 1 A 105 105 PRO HA H 105 4.414 4.471 -0.057 1
1 1219 . 5 1 1 A 105 105 PRO CA C 105 63.300 63.410 -0.110 1
1 1220 . 5 1 1 A 105 105 PRO CB C 105 32.227 32.162 0.065 1
1 1223 . 5 1 1 A 106 106 GLN H H 106 8.524 8.537 -0.013 1
1 1224 . 5 1 1 A 106 106 GLN HA H 106 4.276 4.947 -0.671 1
1 1229 . 5 1 1 A 106 106 GLN C C 106 177.083 173.989 3.094 1
1 1230 . 5 1 1 A 106 106 GLN CA C 106 56.209 54.647 1.562 1
1 1231 . 5 1 1 A 106 106 GLN CB C 106 29.490 32.306 -2.816 1
1 1233 . 5 1 1 A 106 106 GLN N N 106 120.754 117.817 2.937 1
1 1234 . 5 1 1 A 107 107 GLY H H 107 8.394 8.193 0.201 1
1 1235 . 5 1 1 A 107 107 GLY HA2 H 107 3.895 4.260 -0.365 1
1 1236 . 5 1 1 A 107 107 GLY HA3 H 107 3.895 4.354 -0.459 1
1 1237 . 5 1 1 A 107 107 GLY C C 107 176.651 171.615 5.036 1
1 1238 . 5 1 1 A 107 107 GLY CA C 107 45.330 45.461 -0.131 1
1 1239 . 5 1 1 A 107 107 GLY N N 107 110.026 106.496 3.530 1
1 1240 . 5 1 1 A 108 108 PHE H H 108 8.099 8.692 -0.593 1
1 1241 . 5 1 1 A 108 108 PHE HA H 108 4.582 5.414 -0.832 1
1 1245 . 5 1 1 A 108 108 PHE C C 108 173.944 174.088 -0.144 1
1 1246 . 5 1 1 A 108 108 PHE CA C 108 58.054 56.410 1.644 1
1 1247 . 5 1 1 A 108 108 PHE CB C 108 39.708 44.037 -4.329 1
1 1248 . 5 1 1 A 108 108 PHE N N 108 120.180 119.300 0.880 1
1 1249 . 5 1 1 A 109 109 ASN H H 109 8.482 8.903 -0.421 1
1 1250 . 5 1 1 A 109 109 ASN HA H 109 4.691 5.264 -0.573 1
1 1255 . 5 1 1 A 109 109 ASN C C 109 175.627 173.897 1.730 1
1 1256 . 5 1 1 A 109 109 ASN CA C 109 53.402 52.639 0.763 1
1 1257 . 5 1 1 A 109 109 ASN CB C 109 38.883 42.395 -3.512 1
1 1258 . 5 1 1 A 109 109 ASN N N 109 120.752 118.954 1.798 1
1 1260 . 5 1 1 A 110 110 THR H H 110 8.112 8.539 -0.427 1
1 1261 . 5 1 1 A 110 110 THR HA H 110 4.251 4.817 -0.566 1
1 1266 . 5 1 1 A 110 110 THR C C 110 175.275 175.358 -0.083 1
1 1267 . 5 1 1 A 110 110 THR CA C 110 62.460 60.692 1.768 1
1 1268 . 5 1 1 A 110 110 THR CB C 110 69.726 68.925 0.801 1
1 1270 . 5 1 1 A 110 110 THR N N 110 114.601 115.540 -0.939 1
1 1271 . 5 1 1 A 111 111 LEU H H 111 8.168 7.696 0.472 1
1 1272 . 5 1 1 A 111 111 LEU HA H 111 4.308 4.095 0.213 1
1 1282 . 5 1 1 A 111 111 LEU CA C 111 55.704 58.194 -2.490 1
1 1283 . 5 1 1 A 111 111 LEU CB C 111 42.071 41.964 0.107 1
1 1287 . 5 1 1 A 111 111 LEU N N 111 123.756 123.088 0.668 1
1 1288 . 5 1 1 A 112 112 LYS H H 112 8.123 7.580 0.543 1
1 1289 . 5 1 1 A 112 112 LYS HA H 112 4.242 4.324 -0.082 1
1 1298 . 5 1 1 A 112 112 LYS C C 112 177.547 175.915 1.632 1
1 1299 . 5 1 1 A 112 112 LYS CA C 112 56.928 56.395 0.533 1
1 1300 . 5 1 1 A 112 112 LYS CB C 112 33.055 33.207 -0.152 1
1 1304 . 5 1 1 A 112 112 LYS N N 112 121.442 119.908 1.534 1
1 1305 . 5 1 1 A 113 113 ASP H H 113 8.230 8.203 0.027 1
1 1306 . 5 1 1 A 113 113 ASP HA H 113 4.526 4.351 0.175 1
1 1309 . 5 1 1 A 113 113 ASP C C 113 176.532 177.507 -0.975 1
1 1310 . 5 1 1 A 113 113 ASP CA C 113 54.896 54.884 0.012 1
1 1311 . 5 1 1 A 113 113 ASP CB C 113 41.362 42.341 -0.979 1
1 1312 . 5 1 1 A 113 113 ASP N N 113 120.598 122.556 -1.958 1
1 1313 . 5 1 1 A 114 114 LYS H H 114 8.127 8.577 -0.450 1
1 1314 . 5 1 1 A 114 114 LYS HA H 114 4.300 3.872 0.428 1
1 1323 . 5 1 1 A 114 114 LYS C C 114 176.303 178.209 -1.906 1
1 1324 . 5 1 1 A 114 114 LYS CA C 114 56.633 58.619 -1.986 1
1 1325 . 5 1 1 A 114 114 LYS CB C 114 32.818 31.976 0.842 1
1 1329 . 5 1 1 A 114 114 LYS N N 114 120.897 126.357 -5.460 1
1 1330 . 5 1 1 A 115 115 LEU H H 115 8.244 7.751 0.493 1
1 1331 . 5 1 1 A 115 115 LEU HA H 115 4.254 3.203 1.051 1
1 1341 . 5 1 1 A 115 115 LEU C C 115 176.909 177.394 -0.485 1
1 1342 . 5 1 1 A 115 115 LEU CA C 115 56.282 56.577 -0.295 1
1 1343 . 5 1 1 A 115 115 LEU CB C 115 42.188 41.224 0.964 1
1 1347 . 5 1 1 A 115 115 LEU N N 115 123.251 121.532 1.719 1
1 1348 . 5 1 1 A 116 116 GLU H H 116 8.421 7.871 0.550 1
1 1349 . 5 1 1 A 116 116 GLU HA H 116 4.190 4.617 -0.427 1
1 1352 . 5 1 1 A 116 116 GLU C C 116 177.828 178.196 -0.368 1
1 1353 . 5 1 1 A 116 116 GLU CA C 116 57.466 57.301 0.165 1
1 1354 . 5 1 1 A 116 116 GLU CB C 116 30.124 32.691 -2.567 1
1 1355 . 5 1 1 A 116 116 GLU N N 116 120.575 117.946 2.629 1
1 1356 . 5 1 1 A 117 117 GLU H H 117 8.255 8.161 0.094 1
1 1357 . 5 1 1 A 117 117 GLU HA H 117 4.192 4.050 0.142 1
1 1362 . 5 1 1 A 117 117 GLU CA C 117 57.491 59.240 -1.749 1
1 1363 . 5 1 1 A 117 117 GLU CB C 117 30.365 29.366 0.999 1
1 1365 . 5 1 1 A 117 117 GLU N N 117 120.933 119.869 1.064 1
1 1366 . 5 1 1 A 118 118 TRP H H 118 8.143 7.518 0.625 1
1 1367 . 5 1 1 A 118 118 TRP HA H 118 4.581 4.246 0.335 1
1 1372 . 5 1 1 A 118 118 TRP C C 118 176.794 176.662 0.132 1
1 1373 . 5 1 1 A 118 118 TRP CA C 118 58.363 57.538 0.825 1
1 1374 . 5 1 1 A 118 118 TRP CB C 118 29.333 26.895 2.438 1
1 1375 . 5 1 1 A 118 118 TRP N N 118 121.592 119.185 2.407 1
1 1376 . 5 1 1 A 119 119 ILE H H 119 7.908 8.094 -0.186 1
1 1377 . 5 1 1 A 119 119 ILE HA H 119 3.828 4.233 -0.405 1
1 1387 . 5 1 1 A 119 119 ILE C C 119 176.984 176.250 0.734 1
1 1388 . 5 1 1 A 119 119 ILE CA C 119 62.335 61.209 1.126 1
1 1389 . 5 1 1 A 119 119 ILE CB C 119 38.649 37.356 1.293 1
1 1393 . 5 1 1 A 119 119 ILE N N 119 122.744 117.888 4.856 1
1 1394 . 5 1 1 A 120 120 GLU H H 120 8.143 7.883 0.260 1
1 1395 . 5 1 1 A 120 120 GLU HA H 120 4.093 4.381 -0.288 1
1 1400 . 5 1 1 A 120 120 GLU C C 120 176.565 176.758 -0.193 1
1 1401 . 5 1 1 A 120 120 GLU CA C 120 57.613 56.838 0.775 1
1 1402 . 5 1 1 A 120 120 GLU CB C 120 29.834 30.000 -0.166 1
1 1404 . 5 1 1 A 120 120 GLU N N 120 123.139 122.769 0.370 1
1 1405 . 5 1 1 A 121 121 MET H H 121 8.254 8.796 -0.542 1
1 1406 . 5 1 1 A 121 121 MET HA H 121 4.357 4.092 0.265 1
1 1411 . 5 1 1 A 121 121 MET CA C 121 56.625 56.831 -0.206 1
1 1412 . 5 1 1 A 121 121 MET CB C 121 32.664 32.489 0.175 1
1 1414 . 5 1 1 A 121 121 MET N N 121 120.449 124.178 -3.729 1
1 1415 . 5 1 1 A 122 122 SER H H 122 8.199 9.017 -0.818 1
1 1416 . 5 1 1 A 122 122 SER HA H 122 4.280 4.139 0.141 1
1 1419 . 5 1 1 A 122 122 SER C C 122 177.224 174.923 2.301 1
1 1420 . 5 1 1 A 122 122 SER CA C 122 59.635 59.787 -0.152 1
1 1421 . 5 1 1 A 122 122 SER CB C 122 63.560 61.472 2.088 1
1 1422 . 5 1 1 A 122 122 SER N N 122 115.857 118.959 -3.102 1
1 1423 . 5 1 1 A 123 123 ASN H H 123 8.211 8.335 -0.124 1
1 1424 . 5 1 1 A 123 123 ASN HA H 123 4.737 4.561 0.176 1
1 1429 . 5 1 1 A 123 123 ASN C C 123 174.709 175.030 -0.321 1
1 1430 . 5 1 1 A 123 123 ASN CA C 123 53.507 54.589 -1.082 1
1 1431 . 5 1 1 A 123 123 ASN CB C 123 38.800 37.944 0.856 1
1 1432 . 5 1 1 A 123 123 ASN N N 123 119.923 116.270 3.653 1
1 1434 . 5 1 1 A 124 124 ARG H H 124 7.997 7.443 0.554 1
1 1435 . 5 1 1 A 124 124 ARG HA H 124 4.305 4.625 -0.320 1
1 1442 . 5 1 1 A 124 124 ARG C C 124 175.477 176.008 -0.531 1
1 1443 . 5 1 1 A 124 124 ARG CA C 124 56.709 54.573 2.136 1
1 1444 . 5 1 1 A 124 124 ARG CB C 124 30.584 32.742 -2.158 1
1 1447 . 5 1 1 A 124 124 ARG N N 124 120.821 116.417 4.404 1
1 1448 . 5 1 1 A 125 125 LYS H H 125 8.327 8.960 -0.633 1
1 1449 . 5 1 1 A 125 125 LYS HA H 125 4.254 4.106 0.148 1
1 1458 . 5 1 1 A 125 125 LYS C C 125 176.777 176.849 -0.072 1
1 1459 . 5 1 1 A 125 125 LYS CA C 125 56.860 59.006 -2.146 1
1 1460 . 5 1 1 A 125 125 LYS CB C 125 32.879 32.036 0.843 1
1 1464 . 5 1 1 A 125 125 LYS N N 125 121.891 117.449 4.442 1
1 1465 . 5 1 1 A 126 126 ASP H H 126 8.343 7.650 0.693 1
1 1466 . 5 1 1 A 126 126 ASP HA H 126 4.581 4.727 -0.146 1
1 1469 . 5 1 1 A 126 126 ASP C C 126 176.538 176.097 0.441 1
1 1470 . 5 1 1 A 126 126 ASP CA C 126 54.540 53.331 1.209 1
1 1471 . 5 1 1 A 126 126 ASP CB C 126 40.907 40.500 0.407 1
1 1472 . 5 1 1 A 126 126 ASP N N 126 119.814 119.043 0.771 1
1 1473 . 5 1 1 A 127 127 LEU H H 127 7.946 7.477 0.469 1
1 1474 . 5 1 1 A 127 127 LEU HA H 127 4.309 4.255 0.054 1
1 1484 . 5 1 1 A 127 127 LEU C C 127 176.043 176.036 0.007 1
1 1485 . 5 1 1 A 127 127 LEU CA C 127 55.427 55.398 0.029 1
1 1486 . 5 1 1 A 127 127 LEU CB C 127 42.394 43.292 -0.898 1
1 1490 . 5 1 1 A 127 127 LEU N N 127 121.432 122.473 -1.041 1
1 1491 . 5 1 1 A 128 128 ILE H H 128 7.967 8.525 -0.558 1
1 1492 . 5 1 1 A 128 128 ILE HA H 128 4.141 3.992 0.149 1
1 1502 . 5 1 1 A 128 128 ILE C C 128 177.200 175.767 1.433 1
1 1503 . 5 1 1 A 128 128 ILE CA C 128 61.150 61.624 -0.474 1
1 1504 . 5 1 1 A 128 128 ILE CB C 128 38.489 38.827 -0.338 1
1 1508 . 5 1 1 A 128 128 ILE N N 128 121.579 120.078 1.501 1
1 1509 . 5 1 1 A 129 129 LYS H H 129 8.331 8.498 -0.167 1
1 1510 . 5 1 1 A 129 129 LYS HA H 129 4.328 5.216 -0.888 1
1 1519 . 5 1 1 A 129 129 LYS C C 129 175.952 175.122 0.830 1
1 1520 . 5 1 1 A 129 129 LYS CA C 129 56.330 54.548 1.782 1
1 1521 . 5 1 1 A 129 129 LYS CB C 129 33.010 34.267 -1.257 1
1 1525 . 5 1 1 A 129 129 LYS N N 129 126.955 122.742 4.213 1
1 1 . 6 1 1 A 2 2 ALA HA H 2 4.070 4.844 -0.774 1
1 5 . 6 1 1 A 2 2 ALA CA C 2 52.067 51.245 0.822 1
1 6 . 6 1 1 A 2 2 ALA CB C 2 19.577 23.426 -3.849 1
1 7 . 6 1 1 A 3 3 ALA H H 3 8.714 8.485 0.229 1
1 8 . 6 1 1 A 3 3 ALA HA H 3 4.253 4.462 -0.209 1
1 12 . 6 1 1 A 3 3 ALA C C 3 173.672 179.209 -5.537 1
1 13 . 6 1 1 A 3 3 ALA CA C 3 52.067 52.409 -0.342 1
1 14 . 6 1 1 A 3 3 ALA CB C 3 19.577 19.482 0.095 1
1 15 . 6 1 1 A 3 3 ALA N N 3 124.480 122.343 2.137 1
1 16 . 6 1 1 A 4 4 LYS H H 4 8.227 8.891 -0.664 1
1 17 . 6 1 1 A 4 4 LYS HA H 4 3.976 4.206 -0.230 1
1 26 . 6 1 1 A 4 4 LYS C C 4 176.672 175.501 1.171 1
1 27 . 6 1 1 A 4 4 LYS CA C 4 57.274 57.821 -0.547 1
1 28 . 6 1 1 A 4 4 LYS CB C 4 33.209 31.807 1.402 1
1 32 . 6 1 1 A 4 4 LYS N N 4 120.988 119.472 1.516 1
1 33 . 6 1 1 A 5 5 PHE H H 5 7.719 7.765 -0.046 1
1 34 . 6 1 1 A 5 5 PHE HA H 5 4.384 5.141 -0.757 1
1 38 . 6 1 1 A 5 5 PHE C C 5 175.364 174.232 1.132 1
1 39 . 6 1 1 A 5 5 PHE CA C 5 57.074 56.462 0.612 1
1 40 . 6 1 1 A 5 5 PHE CB C 5 39.669 43.095 -3.426 1
1 41 . 6 1 1 A 5 5 PHE N N 5 119.246 118.985 0.261 1
1 42 . 6 1 1 A 6 6 GLU H H 6 8.515 8.861 -0.346 1
1 43 . 6 1 1 A 6 6 GLU HA H 6 4.370 4.923 -0.553 1
1 48 . 6 1 1 A 6 6 GLU CA C 6 55.669 54.248 1.421 1
1 49 . 6 1 1 A 6 6 GLU CB C 6 32.094 33.859 -1.765 1
1 51 . 6 1 1 A 6 6 GLU N N 6 122.193 118.897 3.296 1
1 52 . 6 1 1 A 7 7 VAL H H 7 8.636 8.597 0.039 1
1 53 . 6 1 1 A 7 7 VAL HA H 7 3.406 3.510 -0.104 1
1 61 . 6 1 1 A 7 7 VAL C C 7 176.611 177.156 -0.545 1
1 62 . 6 1 1 A 7 7 VAL CA C 7 65.358 65.585 -0.227 1
1 63 . 6 1 1 A 7 7 VAL CB C 7 31.391 31.477 -0.086 1
1 66 . 6 1 1 A 7 7 VAL N N 7 122.949 122.356 0.593 1
1 67 . 6 1 1 A 8 8 GLY H H 8 9.394 8.879 0.515 1
1 68 . 6 1 1 A 8 8 GLY HA2 H 8 3.600 4.051 -0.451 1
1 69 . 6 1 1 A 8 8 GLY HA3 H 8 4.546 4.058 0.488 1
1 70 . 6 1 1 A 8 8 GLY C C 8 178.074 174.238 3.836 1
1 71 . 6 1 1 A 8 8 GLY CA C 8 45.121 44.929 0.192 1
1 72 . 6 1 1 A 8 8 GLY N N 8 116.837 115.930 0.907 1
1 73 . 6 1 1 A 9 9 SER H H 9 8.021 8.022 -0.001 1
1 74 . 6 1 1 A 9 9 SER HA H 9 4.680 4.497 0.183 1
1 77 . 6 1 1 A 9 9 SER C C 9 174.234 173.192 1.042 1
1 78 . 6 1 1 A 9 9 SER CA C 9 59.387 59.385 0.002 1
1 79 . 6 1 1 A 9 9 SER CB C 9 65.584 64.571 1.013 1
1 80 . 6 1 1 A 9 9 SER N N 9 118.208 118.154 0.054 1
1 81 . 6 1 1 A 10 10 VAL H H 10 7.945 8.426 -0.481 1
1 82 . 6 1 1 A 10 10 VAL HA H 10 4.980 5.210 -0.230 1
1 90 . 6 1 1 A 10 10 VAL C C 10 171.388 174.736 -3.348 1
1 91 . 6 1 1 A 10 10 VAL CA C 10 61.021 61.423 -0.402 1
1 92 . 6 1 1 A 10 10 VAL CB C 10 33.400 33.857 -0.457 1
1 95 . 6 1 1 A 10 10 VAL N N 10 121.118 123.124 -2.006 1
1 96 . 6 1 1 A 11 11 TYR H H 11 9.008 9.225 -0.217 1
1 97 . 6 1 1 A 11 11 TYR HA H 11 4.850 5.071 -0.221 1
1 101 . 6 1 1 A 11 11 TYR C C 11 174.926 173.787 1.139 1
1 102 . 6 1 1 A 11 11 TYR CA C 11 56.803 57.034 -0.231 1
1 103 . 6 1 1 A 11 11 TYR CB C 11 43.676 41.328 2.348 1
1 104 . 6 1 1 A 11 11 TYR N N 11 125.043 128.090 -3.047 1
1 105 . 6 1 1 A 12 12 THR H H 12 8.809 8.184 0.625 1
1 106 . 6 1 1 A 12 12 THR HA H 12 5.020 5.300 -0.280 1
1 111 . 6 1 1 A 12 12 THR C C 12 174.195 173.744 0.451 1
1 112 . 6 1 1 A 12 12 THR CA C 12 62.487 60.424 2.063 1
1 113 . 6 1 1 A 12 12 THR CB C 12 69.743 72.298 -2.555 1
1 115 . 6 1 1 A 12 12 THR N N 12 116.850 116.908 -0.058 1
1 116 . 6 1 1 A 13 13 GLY H H 13 9.179 8.353 0.826 1
1 117 . 6 1 1 A 13 13 GLY HA2 H 13 3.250 4.129 -0.879 1
1 118 . 6 1 1 A 13 13 GLY HA3 H 13 4.801 4.136 0.665 1
1 119 . 6 1 1 A 13 13 GLY C C 13 174.654 171.783 2.871 1
1 120 . 6 1 1 A 13 13 GLY CA C 13 44.377 45.601 -1.224 1
1 121 . 6 1 1 A 13 13 GLY N N 13 113.654 111.636 2.018 1
1 122 . 6 1 1 A 14 14 LYS H H 14 7.770 8.684 -0.914 1
1 123 . 6 1 1 A 14 14 LYS HA H 14 5.426 5.178 0.248 1
1 132 . 6 1 1 A 14 14 LYS C C 14 171.343 175.597 -4.254 1
1 133 . 6 1 1 A 14 14 LYS CA C 14 53.879 54.757 -0.878 1
1 134 . 6 1 1 A 14 14 LYS CB C 14 36.032 35.762 0.270 1
1 138 . 6 1 1 A 14 14 LYS N N 14 118.322 120.820 -2.498 1
1 139 . 6 1 1 A 15 15 VAL H H 15 9.206 9.239 -0.033 1
1 140 . 6 1 1 A 15 15 VAL HA H 15 4.400 4.205 0.195 1
1 148 . 6 1 1 A 15 15 VAL C C 15 176.306 177.108 -0.802 1
1 149 . 6 1 1 A 15 15 VAL CA C 15 63.648 63.456 0.192 1
1 150 . 6 1 1 A 15 15 VAL CB C 15 31.769 31.626 0.143 1
1 153 . 6 1 1 A 15 15 VAL N N 15 125.308 127.223 -1.915 1
1 154 . 6 1 1 A 16 16 THR H H 16 9.403 9.255 0.148 1
1 155 . 6 1 1 A 16 16 THR HA H 16 4.562 4.647 -0.085 1
1 160 . 6 1 1 A 16 16 THR C C 16 178.098 174.669 3.429 1
1 161 . 6 1 1 A 16 16 THR CA C 16 62.018 61.617 0.401 1
1 162 . 6 1 1 A 16 16 THR CB C 16 69.720 69.823 -0.103 1
1 164 . 6 1 1 A 16 16 THR N N 16 121.753 117.749 4.004 1
1 165 . 6 1 1 A 17 17 GLY H H 17 7.600 7.043 0.557 1
1 166 . 6 1 1 A 17 17 GLY HA2 H 17 4.110 4.091 0.019 1
1 167 . 6 1 1 A 17 17 GLY HA3 H 17 4.250 4.187 0.063 1
1 168 . 6 1 1 A 17 17 GLY C C 17 175.551 171.167 4.384 1
1 169 . 6 1 1 A 17 17 GLY CA C 17 46.258 45.490 0.768 1
1 170 . 6 1 1 A 17 17 GLY N N 17 109.407 108.664 0.743 1
1 171 . 6 1 1 A 18 18 LEU H H 18 8.820 8.485 0.335 1
1 172 . 6 1 1 A 18 18 LEU HA H 18 4.852 5.000 -0.148 1
1 182 . 6 1 1 A 18 18 LEU CA C 18 54.245 53.194 1.051 1
1 183 . 6 1 1 A 18 18 LEU CB C 18 44.906 46.267 -1.361 1
1 187 . 6 1 1 A 18 18 LEU N N 18 123.419 120.892 2.527 1
1 188 . 6 1 1 A 19 19 GLN H H 19 8.537 8.285 0.252 1
1 189 . 6 1 1 A 19 19 GLN HA H 19 4.520 4.732 -0.212 1
1 196 . 6 1 1 A 19 19 GLN C C 19 175.258 175.763 -0.505 1
1 197 . 6 1 1 A 19 19 GLN CA C 19 53.269 53.736 -0.467 1
1 198 . 6 1 1 A 19 19 GLN CB C 19 31.522 32.577 -1.055 1
1 200 . 6 1 1 A 19 19 GLN N N 19 120.187 121.442 -1.255 1
1 202 . 6 1 1 A 20 20 ALA H H 20 8.798 8.668 0.130 1
1 203 . 6 1 1 A 20 20 ALA HA H 20 4.010 4.100 -0.090 1
1 207 . 6 1 1 A 20 20 ALA C C 20 175.698 177.407 -1.709 1
1 208 . 6 1 1 A 20 20 ALA CA C 20 55.084 54.139 0.945 1
1 209 . 6 1 1 A 20 20 ALA CB C 20 18.277 18.637 -0.360 1
1 210 . 6 1 1 A 20 20 ALA N N 20 120.606 123.894 -3.288 1
1 211 . 6 1 1 A 21 21 TYR H H 21 6.618 7.684 -1.066 1
1 212 . 6 1 1 A 21 21 TYR HA H 21 4.540 4.879 -0.339 1
1 216 . 6 1 1 A 21 21 TYR C C 21 178.437 175.077 3.360 1
1 217 . 6 1 1 A 21 21 TYR CA C 21 55.120 56.868 -1.748 1
1 218 . 6 1 1 A 21 21 TYR CB C 21 37.891 40.262 -2.371 1
1 219 . 6 1 1 A 21 21 TYR N N 21 105.570 113.453 -7.883 1
1 220 . 6 1 1 A 22 22 GLY H H 22 7.203 7.044 0.159 1
1 221 . 6 1 1 A 22 22 GLY HA2 H 22 3.460 3.691 -0.231 1
1 222 . 6 1 1 A 22 22 GLY HA3 H 22 4.360 3.902 0.458 1
1 223 . 6 1 1 A 22 22 GLY C C 22 175.833 171.110 4.723 1
1 224 . 6 1 1 A 22 22 GLY CA C 22 46.356 45.480 0.876 1
1 225 . 6 1 1 A 22 22 GLY N N 22 109.854 108.386 1.468 1
1 226 . 6 1 1 A 23 23 ALA H H 23 8.549 8.497 0.052 1
1 227 . 6 1 1 A 23 23 ALA HA H 23 4.981 5.101 -0.120 1
1 231 . 6 1 1 A 23 23 ALA C C 23 168.810 175.950 -7.140 1
1 232 . 6 1 1 A 23 23 ALA CA C 23 49.178 50.749 -1.571 1
1 233 . 6 1 1 A 23 23 ALA CB C 23 22.797 21.796 1.001 1
1 234 . 6 1 1 A 23 23 ALA N N 23 118.749 122.222 -3.473 1
1 235 . 6 1 1 A 24 24 PHE H H 24 8.812 8.480 0.332 1
1 236 . 6 1 1 A 24 24 PHE HA H 24 5.125 4.818 0.307 1
1 240 . 6 1 1 A 24 24 PHE CA C 24 58.017 58.034 -0.017 1
1 241 . 6 1 1 A 24 24 PHE CB C 24 40.475 40.498 -0.023 1
1 242 . 6 1 1 A 24 24 PHE N N 24 122.891 121.898 0.993 1
1 243 . 6 1 1 A 25 25 VAL H H 25 8.880 8.835 0.045 1
1 244 . 6 1 1 A 25 25 VAL HA H 25 4.660 4.542 0.118 1
1 252 . 6 1 1 A 25 25 VAL CA C 25 60.379 61.071 -0.692 1
1 253 . 6 1 1 A 25 25 VAL CB C 25 35.654 35.077 0.577 1
1 256 . 6 1 1 A 25 25 VAL N N 25 122.908 121.060 1.848 1
1 257 . 6 1 1 A 26 26 ALA H H 26 9.403 8.708 0.695 1
1 258 . 6 1 1 A 26 26 ALA HA H 26 4.750 4.321 0.429 1
1 262 . 6 1 1 A 26 26 ALA C C 26 174.445 176.783 -2.338 1
1 263 . 6 1 1 A 26 26 ALA CA C 26 51.711 52.614 -0.903 1
1 264 . 6 1 1 A 26 26 ALA CB C 26 19.319 18.888 0.431 1
1 265 . 6 1 1 A 26 26 ALA N N 26 129.425 130.215 -0.790 1
1 266 . 6 1 1 A 27 27 LEU H H 27 8.601 9.094 -0.493 1
1 267 . 6 1 1 A 27 27 LEU HA H 27 4.158 4.245 -0.087 1
1 277 . 6 1 1 A 27 27 LEU C C 27 177.814 176.085 1.729 1
1 278 . 6 1 1 A 27 27 LEU CA C 27 55.869 55.460 0.409 1
1 279 . 6 1 1 A 27 27 LEU CB C 27 42.251 43.503 -1.252 1
1 283 . 6 1 1 A 27 27 LEU N N 27 127.169 122.687 4.482 1
1 284 . 6 1 1 A 28 28 ASP H H 28 8.172 7.869 0.303 1
1 285 . 6 1 1 A 28 28 ASP HA H 28 4.420 4.807 -0.387 1
1 288 . 6 1 1 A 28 28 ASP C C 28 177.116 175.770 1.346 1
1 289 . 6 1 1 A 28 28 ASP CA C 28 53.755 53.379 0.376 1
1 290 . 6 1 1 A 28 28 ASP CB C 28 39.833 43.692 -3.859 1
1 291 . 6 1 1 A 28 28 ASP N N 28 115.657 116.019 -0.362 1
1 292 . 6 1 1 A 29 29 GLU H H 29 8.857 9.061 -0.204 1
1 293 . 6 1 1 A 29 29 GLU HA H 29 4.090 4.131 -0.041 1
1 298 . 6 1 1 A 29 29 GLU C C 29 175.965 176.580 -0.615 1
1 299 . 6 1 1 A 29 29 GLU CA C 29 59.470 58.700 0.770 1
1 300 . 6 1 1 A 29 29 GLU CB C 29 29.409 28.930 0.479 1
1 302 . 6 1 1 A 29 29 GLU N N 29 114.738 122.211 -7.473 1
1 303 . 6 1 1 A 30 30 GLU H H 30 8.326 8.037 0.289 1
1 304 . 6 1 1 A 30 30 GLU HA H 30 4.640 4.523 0.117 1
1 309 . 6 1 1 A 30 30 GLU C C 30 176.817 175.002 1.815 1
1 310 . 6 1 1 A 30 30 GLU CA C 30 56.073 55.796 0.277 1
1 311 . 6 1 1 A 30 30 GLU CB C 30 32.453 30.815 1.638 1
1 313 . 6 1 1 A 30 30 GLU N N 30 115.753 118.212 -2.459 1
1 314 . 6 1 1 A 31 31 THR H H 31 7.819 7.564 0.255 1
1 315 . 6 1 1 A 31 31 THR HA H 31 4.484 5.083 -0.599 1
1 320 . 6 1 1 A 31 31 THR C C 31 176.330 173.109 3.221 1
1 321 . 6 1 1 A 31 31 THR CA C 31 63.398 61.044 2.354 1
1 322 . 6 1 1 A 31 31 THR CB C 31 69.367 72.240 -2.873 1
1 324 . 6 1 1 A 31 31 THR N N 31 118.750 115.061 3.689 1
1 325 . 6 1 1 A 32 32 GLN H H 32 8.913 8.754 0.159 1
1 326 . 6 1 1 A 32 32 GLN HA H 32 5.337 4.919 0.418 1
1 333 . 6 1 1 A 32 32 GLN C C 32 173.087 174.457 -1.370 1
1 334 . 6 1 1 A 32 32 GLN CA C 32 54.051 55.267 -1.216 1
1 335 . 6 1 1 A 32 32 GLN CB C 32 32.672 32.791 -0.119 1
1 337 . 6 1 1 A 32 32 GLN N N 32 127.294 125.125 2.169 1
1 339 . 6 1 1 A 33 33 GLY H H 33 8.900 8.544 0.356 1
1 340 . 6 1 1 A 33 33 GLY HA2 H 33 3.290 4.438 -1.148 1
1 341 . 6 1 1 A 33 33 GLY HA3 H 33 4.530 4.465 0.065 1
1 342 . 6 1 1 A 33 33 GLY C C 33 174.918 172.092 2.826 1
1 343 . 6 1 1 A 33 33 GLY CA C 33 44.534 45.650 -1.116 1
1 344 . 6 1 1 A 33 33 GLY N N 33 107.639 110.850 -3.211 1
1 345 . 6 1 1 A 34 34 LEU H H 34 8.127 8.731 -0.604 1
1 346 . 6 1 1 A 34 34 LEU HA H 34 4.950 4.876 0.074 1
1 356 . 6 1 1 A 34 34 LEU CA C 34 53.755 53.973 -0.218 1
1 357 . 6 1 1 A 34 34 LEU CB C 34 45.493 44.911 0.582 1
1 361 . 6 1 1 A 34 34 LEU N N 34 120.897 120.796 0.101 1
1 362 . 6 1 1 A 35 35 VAL H H 35 9.386 8.827 0.559 1
1 363 . 6 1 1 A 35 35 VAL HA H 35 4.479 4.362 0.117 1
1 371 . 6 1 1 A 35 35 VAL C C 35 176.402 176.051 0.351 1
1 372 . 6 1 1 A 35 35 VAL CA C 35 59.594 62.889 -3.295 1
1 373 . 6 1 1 A 35 35 VAL CB C 35 32.590 31.490 1.100 1
1 376 . 6 1 1 A 35 35 VAL N N 35 128.897 127.778 1.119 1
1 377 . 6 1 1 A 36 36 HIS H H 36 9.194 8.912 0.282 1
1 378 . 6 1 1 A 36 36 HIS HA H 36 4.487 4.607 -0.120 1
1 381 . 6 1 1 A 36 36 HIS C C 36 174.864 176.537 -1.673 1
1 382 . 6 1 1 A 36 36 HIS CA C 36 59.426 56.441 2.985 1
1 383 . 6 1 1 A 36 36 HIS CB C 36 31.542 30.509 1.033 1
1 384 . 6 1 1 A 36 36 HIS N N 36 127.751 126.008 1.743 1
1 385 . 6 1 1 A 37 37 ILE H H 37 7.454 8.899 -1.445 1
1 386 . 6 1 1 A 37 37 ILE HA H 37 3.810 3.716 0.094 1
1 396 . 6 1 1 A 37 37 ILE C C 37 176.948 178.075 -1.127 1
1 397 . 6 1 1 A 37 37 ILE CA C 37 63.773 64.936 -1.163 1
1 398 . 6 1 1 A 37 37 ILE CB C 37 38.993 37.500 1.493 1
1 402 . 6 1 1 A 37 37 ILE N N 37 126.266 125.845 0.421 1
1 403 . 6 1 1 A 38 38 SER H H 38 8.343 8.259 0.084 1
1 404 . 6 1 1 A 38 38 SER HA H 38 4.370 4.281 0.089 1
1 407 . 6 1 1 A 38 38 SER C C 38 174.792 174.944 -0.152 1
1 408 . 6 1 1 A 38 38 SER CA C 38 60.567 60.801 -0.234 1
1 409 . 6 1 1 A 38 38 SER CB C 38 63.632 62.928 0.704 1
1 410 . 6 1 1 A 38 38 SER N N 38 118.079 118.530 -0.451 1
1 411 . 6 1 1 A 39 39 GLU H H 39 8.536 8.111 0.425 1
1 412 . 6 1 1 A 39 39 GLU HA H 39 4.503 4.606 -0.103 1
1 417 . 6 1 1 A 39 39 GLU C C 39 175.131 176.998 -1.867 1
1 418 . 6 1 1 A 39 39 GLU CA C 39 54.928 56.378 -1.450 1
1 419 . 6 1 1 A 39 39 GLU CB C 39 29.621 30.807 -1.186 1
1 421 . 6 1 1 A 39 39 GLU N N 39 118.349 118.678 -0.329 1
1 422 . 6 1 1 A 40 40 VAL H H 40 7.776 7.725 0.051 1
1 423 . 6 1 1 A 40 40 VAL HA H 40 3.616 3.927 -0.311 1
1 431 . 6 1 1 A 40 40 VAL C C 40 177.277 175.706 1.571 1
1 432 . 6 1 1 A 40 40 VAL CA C 40 66.245 64.076 2.169 1
1 433 . 6 1 1 A 40 40 VAL CB C 40 32.590 32.335 0.255 1
1 436 . 6 1 1 A 40 40 VAL N N 40 125.443 117.446 7.997 1
1 437 . 6 1 1 A 41 41 THR H H 41 7.888 7.480 0.408 1
1 438 . 6 1 1 A 41 41 THR HA H 41 4.345 4.475 -0.130 1
1 443 . 6 1 1 A 41 41 THR C C 41 173.492 173.908 -0.416 1
1 444 . 6 1 1 A 41 41 THR CA C 41 59.047 60.018 -0.971 1
1 445 . 6 1 1 A 41 41 THR CB C 41 68.992 70.180 -1.188 1
1 447 . 6 1 1 A 41 41 THR N N 41 109.905 111.639 -1.734 1
1 448 . 6 1 1 A 42 42 HIS H H 42 8.063 8.177 -0.114 1
1 449 . 6 1 1 A 42 42 HIS HA H 42 4.510 4.380 0.130 1
1 452 . 6 1 1 A 42 42 HIS C C 42 172.139 175.664 -3.525 1
1 453 . 6 1 1 A 42 42 HIS CA C 42 57.735 56.841 0.894 1
1 454 . 6 1 1 A 42 42 HIS CB C 42 31.144 29.445 1.699 1
1 455 . 6 1 1 A 42 42 HIS N N 42 121.760 122.476 -0.716 1
1 456 . 6 1 1 A 43 43 GLY H H 43 8.286 7.285 1.001 1
1 457 . 6 1 1 A 43 43 GLY HA2 H 43 3.980 3.816 0.164 1
1 458 . 6 1 1 A 43 43 GLY HA3 H 43 3.980 3.825 0.155 1
1 459 . 6 1 1 A 43 43 GLY C C 43 176.307 172.855 3.452 1
1 460 . 6 1 1 A 43 43 GLY CA C 43 44.336 44.267 0.069 1
1 461 . 6 1 1 A 43 43 GLY N N 43 110.133 108.633 1.500 1
1 462 . 6 1 1 A 44 44 PHE H H 44 8.327 8.301 0.026 1
1 463 . 6 1 1 A 44 44 PHE HA H 44 4.489 4.507 -0.018 1
1 467 . 6 1 1 A 44 44 PHE C C 44 171.877 175.347 -3.470 1
1 468 . 6 1 1 A 44 44 PHE CA C 44 58.027 58.664 -0.637 1
1 469 . 6 1 1 A 44 44 PHE CB C 44 39.850 38.722 1.128 1
1 470 . 6 1 1 A 44 44 PHE N N 44 120.049 118.552 1.497 1
1 471 . 6 1 1 A 45 45 VAL H H 45 7.939 8.617 -0.678 1
1 472 . 6 1 1 A 45 45 VAL HA H 45 3.865 3.734 0.131 1
1 480 . 6 1 1 A 45 45 VAL C C 45 175.523 175.583 -0.060 1
1 481 . 6 1 1 A 45 45 VAL CA C 45 61.536 62.453 -0.917 1
1 482 . 6 1 1 A 45 45 VAL CB C 45 33.127 32.047 1.080 1
1 485 . 6 1 1 A 45 45 VAL N N 45 127.882 125.814 2.068 1
1 486 . 6 1 1 A 46 46 LYS H H 46 8.868 9.310 -0.442 1
1 487 . 6 1 1 A 46 46 LYS HA H 46 4.170 4.226 -0.056 1
1 496 . 6 1 1 A 46 46 LYS C C 46 175.728 176.173 -0.445 1
1 497 . 6 1 1 A 46 46 LYS CA C 46 57.198 58.551 -1.353 1
1 498 . 6 1 1 A 46 46 LYS CB C 46 33.299 33.148 0.151 1
1 502 . 6 1 1 A 46 46 LYS N N 46 127.308 131.115 -3.807 1
1 503 . 6 1 1 A 47 47 ASP H H 47 7.652 8.038 -0.386 1
1 504 . 6 1 1 A 47 47 ASP HA H 47 4.710 4.988 -0.278 1
1 507 . 6 1 1 A 47 47 ASP C C 47 176.411 176.106 0.305 1
1 508 . 6 1 1 A 47 47 ASP CA C 47 53.390 53.892 -0.502 1
1 509 . 6 1 1 A 47 47 ASP CB C 47 42.635 44.112 -1.477 1
1 510 . 6 1 1 A 47 47 ASP N N 47 117.932 116.060 1.872 1
1 511 . 6 1 1 A 48 48 ILE H H 48 9.230 8.717 0.513 1
1 512 . 6 1 1 A 48 48 ILE HA H 48 3.579 3.975 -0.396 1
1 522 . 6 1 1 A 48 48 ILE C C 48 177.249 177.596 -0.347 1
1 523 . 6 1 1 A 48 48 ILE CA C 48 65.525 63.887 1.638 1
1 524 . 6 1 1 A 48 48 ILE CB C 48 38.797 37.822 0.975 1
1 528 . 6 1 1 A 48 48 ILE N N 48 129.049 125.536 3.513 1
1 529 . 6 1 1 A 49 49 ASN H H 49 8.468 9.073 -0.605 1
1 530 . 6 1 1 A 49 49 ASN HA H 49 4.690 4.573 0.117 1
1 535 . 6 1 1 A 49 49 ASN C C 49 175.779 176.561 -0.782 1
1 536 . 6 1 1 A 49 49 ASN CA C 49 55.587 55.155 0.432 1
1 537 . 6 1 1 A 49 49 ASN CB C 49 38.587 37.040 1.547 1
1 538 . 6 1 1 A 49 49 ASN N N 49 118.835 117.711 1.124 1
1 540 . 6 1 1 A 50 50 GLU H H 50 7.853 7.931 -0.078 1
1 541 . 6 1 1 A 50 50 GLU HA H 50 4.040 4.075 -0.035 1
1 546 . 6 1 1 A 50 50 GLU C C 50 176.148 177.166 -1.018 1
1 547 . 6 1 1 A 50 50 GLU CA C 50 57.404 57.708 -0.304 1
1 548 . 6 1 1 A 50 50 GLU CB C 50 29.491 29.507 -0.016 1
1 550 . 6 1 1 A 50 50 GLU N N 50 116.358 118.192 -1.834 1
1 551 . 6 1 1 A 51 51 HIS H H 51 7.575 7.753 -0.178 1
1 552 . 6 1 1 A 51 51 HIS HA H 51 4.431 4.736 -0.305 1
1 555 . 6 1 1 A 51 51 HIS C C 51 176.383 174.528 1.855 1
1 556 . 6 1 1 A 51 51 HIS CA C 51 57.089 56.251 0.838 1
1 557 . 6 1 1 A 51 51 HIS CB C 51 33.168 31.859 1.309 1
1 558 . 6 1 1 A 51 51 HIS N N 51 115.828 114.726 1.102 1
1 559 . 6 1 1 A 52 52 LEU H H 52 7.640 7.478 0.162 1
1 560 . 6 1 1 A 52 52 LEU HA H 52 4.796 4.656 0.140 1
1 570 . 6 1 1 A 52 52 LEU C C 52 174.452 174.281 0.171 1
1 571 . 6 1 1 A 52 52 LEU CA C 52 53.398 53.506 -0.108 1
1 572 . 6 1 1 A 52 52 LEU CB C 52 48.805 44.445 4.360 1
1 576 . 6 1 1 A 52 52 LEU N N 52 117.932 119.626 -1.694 1
1 577 . 6 1 1 A 53 53 SER H H 53 8.151 8.740 -0.589 1
1 578 . 6 1 1 A 53 53 SER HA H 53 4.680 4.909 -0.229 1
1 581 . 6 1 1 A 53 53 SER C C 53 174.304 172.932 1.372 1
1 582 . 6 1 1 A 53 53 SER CA C 53 56.714 57.494 -0.780 1
1 583 . 6 1 1 A 53 53 SER CB C 53 65.431 66.543 -1.112 1
1 584 . 6 1 1 A 53 53 SER N N 53 113.496 117.399 -3.903 1
1 585 . 6 1 1 A 54 54 VAL H H 54 8.782 8.518 0.264 1
1 586 . 6 1 1 A 54 54 VAL HA H 54 3.230 3.763 -0.533 1
1 594 . 6 1 1 A 54 54 VAL C C 54 173.745 177.128 -3.383 1
1 595 . 6 1 1 A 54 54 VAL CA C 54 66.232 63.466 2.766 1
1 596 . 6 1 1 A 54 54 VAL CB C 54 31.067 31.843 -0.776 1
1 599 . 6 1 1 A 54 54 VAL N N 54 124.401 125.921 -1.520 1
1 600 . 6 1 1 A 55 55 GLY H H 55 9.079 8.772 0.307 1
1 601 . 6 1 1 A 55 55 GLY HA2 H 55 3.530 3.844 -0.314 1
1 602 . 6 1 1 A 55 55 GLY HA3 H 55 4.553 3.846 0.707 1
1 603 . 6 1 1 A 55 55 GLY C C 55 177.219 173.202 4.017 1
1 604 . 6 1 1 A 55 55 GLY CA C 55 44.647 46.201 -1.554 1
1 605 . 6 1 1 A 55 55 GLY N N 55 117.320 116.292 1.028 1
1 606 . 6 1 1 A 56 56 ASP H H 56 7.943 7.708 0.235 1
1 607 . 6 1 1 A 56 56 ASP HA H 56 4.460 5.141 -0.681 1
1 610 . 6 1 1 A 56 56 ASP C C 56 176.055 173.835 2.220 1
1 611 . 6 1 1 A 56 56 ASP CA C 56 55.456 52.206 3.250 1
1 612 . 6 1 1 A 56 56 ASP CB C 56 40.914 44.493 -3.579 1
1 613 . 6 1 1 A 56 56 ASP N N 56 121.782 119.591 2.191 1
1 614 . 6 1 1 A 57 57 GLU H H 57 8.649 8.617 0.032 1
1 615 . 6 1 1 A 57 57 GLU HA H 57 5.100 5.086 0.014 1
1 620 . 6 1 1 A 57 57 GLU C C 57 175.635 176.088 -0.453 1
1 621 . 6 1 1 A 57 57 GLU CA C 57 55.805 55.650 0.155 1
1 622 . 6 1 1 A 57 57 GLU CB C 57 30.915 31.184 -0.269 1
1 624 . 6 1 1 A 57 57 GLU N N 57 122.513 122.991 -0.478 1
1 625 . 6 1 1 A 58 58 VAL H H 58 8.809 9.189 -0.380 1
1 626 . 6 1 1 A 58 58 VAL HA H 58 4.817 4.806 0.011 1
1 634 . 6 1 1 A 58 58 VAL C C 58 176.528 173.397 3.131 1
1 635 . 6 1 1 A 58 58 VAL CA C 58 58.719 59.023 -0.304 1
1 636 . 6 1 1 A 58 58 VAL CB C 58 35.523 35.953 -0.430 1
1 639 . 6 1 1 A 58 58 VAL N N 58 118.382 119.316 -0.934 1
1 640 . 6 1 1 A 59 59 GLN H H 59 8.255 8.944 -0.689 1
1 641 . 6 1 1 A 59 59 GLN HA H 59 5.030 5.153 -0.123 1
1 646 . 6 1 1 A 59 59 GLN CA C 59 54.843 54.347 0.496 1
1 647 . 6 1 1 A 59 59 GLN CB C 59 30.111 31.988 -1.877 1
1 649 . 6 1 1 A 59 59 GLN N N 59 120.933 122.470 -1.537 1
1 650 . 6 1 1 A 60 60 VAL H H 60 8.970 9.403 -0.433 1
1 651 . 6 1 1 A 60 60 VAL HA H 60 4.990 4.994 -0.004 1
1 659 . 6 1 1 A 60 60 VAL C C 60 175.203 173.815 1.388 1
1 660 . 6 1 1 A 60 60 VAL CA C 60 57.404 58.934 -1.530 1
1 661 . 6 1 1 A 60 60 VAL CB C 60 35.771 35.343 0.428 1
1 664 . 6 1 1 A 60 60 VAL N N 60 111.046 120.614 -9.568 1
1 665 . 6 1 1 A 61 61 LYS H H 61 8.937 8.751 0.186 1
1 666 . 6 1 1 A 61 61 LYS HA H 61 5.100 5.009 0.091 1
1 675 . 6 1 1 A 61 61 LYS C C 61 173.610 176.383 -2.773 1
1 676 . 6 1 1 A 61 61 LYS CA C 61 53.762 54.978 -1.216 1
1 677 . 6 1 1 A 61 61 LYS CB C 61 36.273 34.773 1.500 1
1 681 . 6 1 1 A 61 61 LYS N N 61 121.930 123.078 -1.148 1
1 682 . 6 1 1 A 62 62 VAL H H 62 8.429 9.312 -0.883 1
1 683 . 6 1 1 A 62 62 VAL HA H 62 4.074 4.146 -0.072 1
1 691 . 6 1 1 A 62 62 VAL C C 62 176.912 175.922 0.990 1
1 692 . 6 1 1 A 62 62 VAL CA C 62 63.188 63.659 -0.471 1
1 693 . 6 1 1 A 62 62 VAL CB C 62 30.813 32.328 -1.515 1
1 696 . 6 1 1 A 62 62 VAL N N 62 126.329 127.072 -0.743 1
1 697 . 6 1 1 A 63 63 LEU H H 63 9.109 9.331 -0.222 1
1 698 . 6 1 1 A 63 63 LEU HA H 63 4.423 4.529 -0.106 1
1 708 . 6 1 1 A 63 63 LEU C C 63 176.091 175.829 0.262 1
1 709 . 6 1 1 A 63 63 LEU CA C 63 55.876 55.832 0.044 1
1 710 . 6 1 1 A 63 63 LEU CB C 63 42.800 45.252 -2.452 1
1 714 . 6 1 1 A 63 63 LEU N N 63 129.436 128.650 0.786 1
1 715 . 6 1 1 A 64 64 ALA H H 64 7.594 7.409 0.185 1
1 716 . 6 1 1 A 64 64 ALA HA H 64 4.455 4.789 -0.334 1
1 720 . 6 1 1 A 64 64 ALA C C 64 177.314 175.223 2.091 1
1 721 . 6 1 1 A 64 64 ALA CA C 64 52.557 51.651 0.906 1
1 722 . 6 1 1 A 64 64 ALA CB C 64 21.458 22.795 -1.337 1
1 723 . 6 1 1 A 64 64 ALA N N 64 117.791 118.949 -1.158 1
1 724 . 6 1 1 A 65 65 VAL H H 65 8.583 8.529 0.054 1
1 725 . 6 1 1 A 65 65 VAL HA H 65 4.470 4.858 -0.388 1
1 733 . 6 1 1 A 65 65 VAL C C 65 174.697 174.678 0.019 1
1 734 . 6 1 1 A 65 65 VAL CA C 65 61.936 61.256 0.680 1
1 735 . 6 1 1 A 65 65 VAL CB C 65 35.288 35.116 0.172 1
1 738 . 6 1 1 A 65 65 VAL N N 65 120.009 120.022 -0.013 1
1 739 . 6 1 1 A 66 66 ASP H H 66 8.567 8.857 -0.290 1
1 740 . 6 1 1 A 66 66 ASP HA H 66 4.880 4.968 -0.088 1
1 743 . 6 1 1 A 66 66 ASP C C 66 174.355 176.080 -1.725 1
1 744 . 6 1 1 A 66 66 ASP CA C 66 52.681 53.360 -0.679 1
1 745 . 6 1 1 A 66 66 ASP CB C 66 41.775 41.495 0.280 1
1 746 . 6 1 1 A 66 66 ASP N N 66 126.262 125.267 0.995 1
1 747 . 6 1 1 A 67 67 GLU H H 67 9.148 8.786 0.362 1
1 748 . 6 1 1 A 67 67 GLU HA H 67 4.110 3.993 0.117 1
1 753 . 6 1 1 A 67 67 GLU C C 67 177.052 177.916 -0.864 1
1 754 . 6 1 1 A 67 67 GLU CA C 67 59.044 59.197 -0.153 1
1 755 . 6 1 1 A 67 67 GLU CB C 67 29.919 29.591 0.328 1
1 757 . 6 1 1 A 67 67 GLU N N 67 125.480 125.736 -0.256 1
1 758 . 6 1 1 A 68 68 GLU H H 68 8.384 7.849 0.535 1
1 759 . 6 1 1 A 68 68 GLU HA H 68 4.140 4.140 0.000 1
1 764 . 6 1 1 A 68 68 GLU C C 68 178.383 179.970 -1.587 1
1 765 . 6 1 1 A 68 68 GLU CA C 68 59.044 58.956 0.088 1
1 766 . 6 1 1 A 68 68 GLU CB C 68 29.919 29.821 0.098 1
1 768 . 6 1 1 A 68 68 GLU N N 68 119.760 118.845 0.915 1
1 769 . 6 1 1 A 69 69 LYS H H 69 7.799 8.146 -0.347 1
1 770 . 6 1 1 A 69 69 LYS HA H 69 4.375 4.291 0.084 1
1 779 . 6 1 1 A 69 69 LYS C C 69 178.297 176.732 1.565 1
1 780 . 6 1 1 A 69 69 LYS CA C 69 55.704 57.843 -2.139 1
1 781 . 6 1 1 A 69 69 LYS CB C 69 33.622 33.364 0.258 1
1 785 . 6 1 1 A 69 69 LYS N N 69 115.476 119.920 -4.444 1
1 786 . 6 1 1 A 70 70 GLY H H 70 7.994 8.589 -0.595 1
1 787 . 6 1 1 A 70 70 GLY HA2 H 70 3.940 3.962 -0.022 1
1 788 . 6 1 1 A 70 70 GLY HA3 H 70 3.960 3.967 -0.007 1
1 789 . 6 1 1 A 70 70 GLY C C 70 177.215 173.790 3.425 1
1 790 . 6 1 1 A 70 70 GLY CA C 70 46.773 46.410 0.363 1
1 791 . 6 1 1 A 70 70 GLY N N 70 110.245 108.014 2.231 1
1 792 . 6 1 1 A 71 71 LYS H H 71 7.560 8.032 -0.472 1
1 793 . 6 1 1 A 71 71 LYS HA H 71 4.690 4.995 -0.305 1
1 802 . 6 1 1 A 71 71 LYS C C 71 174.607 174.620 -0.013 1
1 803 . 6 1 1 A 71 71 LYS CA C 71 55.332 54.728 0.604 1
1 804 . 6 1 1 A 71 71 LYS CB C 71 34.903 36.026 -1.123 1
1 808 . 6 1 1 A 71 71 LYS N N 71 118.201 118.864 -0.663 1
1 809 . 6 1 1 A 72 72 ILE H H 72 8.867 8.782 0.085 1
1 810 . 6 1 1 A 72 72 ILE HA H 72 4.630 4.995 -0.365 1
1 820 . 6 1 1 A 72 72 ILE C C 72 175.708 174.981 0.727 1
1 821 . 6 1 1 A 72 72 ILE CA C 72 61.494 60.326 1.168 1
1 822 . 6 1 1 A 72 72 ILE CB C 72 40.652 41.464 -0.812 1
1 826 . 6 1 1 A 72 72 ILE N N 72 126.827 122.020 4.807 1
1 827 . 6 1 1 A 73 73 SER H H 73 8.815 9.068 -0.253 1
1 828 . 6 1 1 A 73 73 SER HA H 73 5.110 5.130 -0.020 1
1 831 . 6 1 1 A 73 73 SER C C 73 175.122 173.625 1.497 1
1 832 . 6 1 1 A 73 73 SER CA C 73 57.487 58.942 -1.455 1
1 833 . 6 1 1 A 73 73 SER CB C 73 64.386 64.009 0.377 1
1 834 . 6 1 1 A 73 73 SER N N 73 123.640 123.912 -0.272 1
1 835 . 6 1 1 A 74 74 LEU H H 74 8.585 8.850 -0.265 1
1 836 . 6 1 1 A 74 74 LEU HA H 74 5.450 5.309 0.141 1
1 846 . 6 1 1 A 74 74 LEU C C 74 174.061 175.452 -1.391 1
1 847 . 6 1 1 A 74 74 LEU CA C 74 53.101 53.532 -0.431 1
1 848 . 6 1 1 A 74 74 LEU CB C 74 48.268 46.894 1.374 1
1 852 . 6 1 1 A 74 74 LEU N N 74 125.221 124.307 0.914 1
1 853 . 6 1 1 A 75 75 SER H H 75 8.840 8.674 0.166 1
1 854 . 6 1 1 A 75 75 SER HA H 75 5.040 5.356 -0.316 1
1 857 . 6 1 1 A 75 75 SER C C 75 176.552 173.728 2.824 1
1 858 . 6 1 1 A 75 75 SER CA C 75 57.487 56.461 1.026 1
1 859 . 6 1 1 A 75 75 SER CB C 75 64.993 66.577 -1.584 1
1 860 . 6 1 1 A 75 75 SER N N 75 111.252 113.036 -1.784 1
1 861 . 6 1 1 A 76 76 ILE H H 76 7.790 8.872 -1.082 1
1 862 . 6 1 1 A 76 76 ILE HA H 76 4.690 4.555 0.135 1
1 872 . 6 1 1 A 76 76 ILE C C 76 175.780 177.228 -1.448 1
1 873 . 6 1 1 A 76 76 ILE CA C 76 63.631 62.122 1.509 1
1 874 . 6 1 1 A 76 76 ILE CB C 76 39.484 39.904 -0.420 1
1 878 . 6 1 1 A 76 76 ILE N N 76 129.205 119.864 9.341 1
1 879 . 6 1 1 A 77 77 ARG H H 77 8.115 8.631 -0.516 1
1 880 . 6 1 1 A 77 77 ARG HA H 77 3.760 4.131 -0.371 1
1 887 . 6 1 1 A 77 77 ARG C C 77 178.704 177.803 0.901 1
1 888 . 6 1 1 A 77 77 ARG CA C 77 58.933 58.523 0.410 1
1 889 . 6 1 1 A 77 77 ARG CB C 77 29.463 29.811 -0.348 1
1 892 . 6 1 1 A 77 77 ARG N N 77 123.257 121.737 1.520 1
1 893 . 6 1 1 A 78 78 ALA H H 78 8.304 7.770 0.534 1
1 894 . 6 1 1 A 78 78 ALA HA H 78 4.296 4.152 0.144 1
1 898 . 6 1 1 A 78 78 ALA C C 78 176.870 178.302 -1.432 1
1 899 . 6 1 1 A 78 78 ALA CA C 78 53.548 54.163 -0.615 1
1 900 . 6 1 1 A 78 78 ALA CB C 78 19.872 18.461 1.411 1
1 901 . 6 1 1 A 78 78 ALA N N 78 118.764 122.184 -3.420 1
1 902 . 6 1 1 A 79 79 THR H H 79 7.931 7.648 0.283 1
1 903 . 6 1 1 A 79 79 THR HA H 79 4.370 4.588 -0.218 1
1 908 . 6 1 1 A 79 79 THR C C 79 178.356 175.006 3.350 1
1 909 . 6 1 1 A 79 79 THR CA C 79 62.381 62.098 0.283 1
1 910 . 6 1 1 A 79 79 THR CB C 79 69.693 70.674 -0.981 1
1 912 . 6 1 1 A 79 79 THR N N 79 107.360 105.125 2.235 1
1 913 . 6 1 1 A 80 80 GLN H H 80 7.651 8.131 -0.480 1
1 914 . 6 1 1 A 80 80 GLN HA H 80 4.527 4.431 0.096 1
1 921 . 6 1 1 A 80 80 GLN C C 80 174.249 175.261 -1.012 1
1 922 . 6 1 1 A 80 80 GLN CA C 80 54.760 56.617 -1.857 1
1 923 . 6 1 1 A 80 80 GLN CB C 80 30.565 29.477 1.088 1
1 925 . 6 1 1 A 80 80 GLN N N 80 121.588 123.046 -1.458 1
1 927 . 6 1 1 A 81 81 ALA H H 81 8.498 8.546 -0.048 1
1 928 . 6 1 1 A 81 81 ALA HA H 81 4.252 4.889 -0.637 1
1 932 . 6 1 1 A 81 81 ALA C C 81 175.693 175.945 -0.252 1
1 933 . 6 1 1 A 81 81 ALA CA C 81 52.345 51.072 1.273 1
1 934 . 6 1 1 A 81 81 ALA CB C 81 19.062 23.392 -4.330 1
1 935 . 6 1 1 A 81 81 ALA N N 81 126.423 121.887 4.536 1
1 936 . 6 1 1 A 82 82 ALA H H 82 8.324 8.536 -0.212 1
1 937 . 6 1 1 A 82 82 ALA HA H 82 4.000 4.453 -0.453 1
1 941 . 6 1 1 A 82 82 ALA C C 82 177.065 175.780 1.285 1
1 942 . 6 1 1 A 82 82 ALA CA C 82 50.240 51.004 -0.764 1
1 943 . 6 1 1 A 82 82 ALA CB C 82 17.650 17.827 -0.177 1
1 944 . 6 1 1 A 82 82 ALA N N 82 125.114 122.847 2.267 1
1 945 . 6 1 1 A 83 83 PRO HA H 83 4.350 4.546 -0.196 1
1 952 . 6 1 1 A 83 83 PRO CA C 83 63.148 62.348 0.800 1
1 953 . 6 1 1 A 83 83 PRO CB C 83 32.054 32.333 -0.279 1
1 956 . 6 1 1 A 84 84 GLU H H 84 8.517 8.604 -0.087 1
1 957 . 6 1 1 A 84 84 GLU HA H 84 4.197 4.331 -0.134 1
1 962 . 6 1 1 A 84 84 GLU C C 84 176.948 176.610 0.338 1
1 963 . 6 1 1 A 84 84 GLU CA C 84 56.674 56.363 0.311 1
1 964 . 6 1 1 A 84 84 GLU CB C 84 30.459 30.534 -0.075 1
1 966 . 6 1 1 A 84 84 GLU N N 84 121.479 121.933 -0.454 1
1 967 . 6 1 1 A 85 85 LYS H H 85 8.381 8.767 -0.386 1
1 968 . 6 1 1 A 85 85 LYS HA H 85 4.309 4.442 -0.133 1
1 977 . 6 1 1 A 85 85 LYS C C 85 176.457 176.467 -0.010 1
1 978 . 6 1 1 A 85 85 LYS CA C 85 56.272 55.451 0.821 1
1 979 . 6 1 1 A 85 85 LYS CB C 85 32.961 30.491 2.470 1
1 983 . 6 1 1 A 85 85 LYS N N 85 123.266 125.393 -2.127 1
1 984 . 6 1 1 A 86 86 LYS H H 86 8.403 8.253 0.150 1
1 985 . 6 1 1 A 86 86 LYS HA H 86 4.308 4.021 0.287 1
1 994 . 6 1 1 A 86 86 LYS C C 86 176.435 178.679 -2.244 1
1 995 . 6 1 1 A 86 86 LYS CA C 86 56.272 59.683 -3.411 1
1 996 . 6 1 1 A 86 86 LYS CB C 86 32.961 32.186 0.775 1
1 1000 . 6 1 1 A 86 86 LYS N N 86 123.688 121.094 2.594 1
1 1001 . 6 1 1 A 87 87 GLU H H 87 8.540 8.083 0.457 1
1 1002 . 6 1 1 A 87 87 GLU HA H 87 4.358 4.168 0.190 1
1 1007 . 6 1 1 A 87 87 GLU C C 87 176.556 177.497 -0.941 1
1 1008 . 6 1 1 A 87 87 GLU CA C 87 56.406 58.373 -1.967 1
1 1009 . 6 1 1 A 87 87 GLU CB C 87 30.607 29.566 1.041 1
1 1011 . 6 1 1 A 87 87 GLU N N 87 122.633 119.333 3.300 1
1 1012 . 6 1 1 A 88 88 SER H H 88 8.520 7.844 0.676 1
1 1013 . 6 1 1 A 88 88 SER HA H 88 4.490 4.683 -0.193 1
1 1016 . 6 1 1 A 88 88 SER C C 88 175.780 175.147 0.633 1
1 1017 . 6 1 1 A 88 88 SER CA C 88 58.431 58.959 -0.528 1
1 1018 . 6 1 1 A 88 88 SER CB C 88 63.858 65.819 -1.961 1
1 1019 . 6 1 1 A 88 88 SER N N 88 118.333 112.182 6.151 1
1 1020 . 6 1 1 A 89 89 LYS H H 89 8.339 8.172 0.167 1
1 1021 . 6 1 1 A 89 89 LYS HA H 89 4.620 4.102 0.518 1
1 1030 . 6 1 1 A 89 89 LYS C C 89 174.160 176.443 -2.283 1
1 1031 . 6 1 1 A 89 89 LYS CA C 89 54.265 61.477 -7.212 1
1 1032 . 6 1 1 A 89 89 LYS CB C 89 32.672 30.480 2.192 1
1 1036 . 6 1 1 A 89 89 LYS N N 89 124.433 120.693 3.740 1
1 1037 . 6 1 1 A 90 90 PRO HA H 90 4.417 4.461 -0.044 1
1 1044 . 6 1 1 A 90 90 PRO CA C 90 63.064 62.867 0.197 1
1 1045 . 6 1 1 A 90 90 PRO CB C 90 32.266 32.394 -0.128 1
1 1048 . 6 1 1 A 91 91 ARG H H 91 8.502 9.070 -0.568 1
1 1049 . 6 1 1 A 91 91 ARG HA H 91 4.305 4.274 0.031 1
1 1056 . 6 1 1 A 91 91 ARG C C 91 176.831 176.159 0.672 1
1 1057 . 6 1 1 A 91 91 ARG CA C 91 56.002 57.477 -1.475 1
1 1058 . 6 1 1 A 91 91 ARG CB C 91 30.913 31.472 -0.559 1
1 1061 . 6 1 1 A 91 91 ARG N N 91 122.193 119.198 2.995 1
1 1062 . 6 1 1 A 92 92 LYS H H 92 8.415 7.409 1.006 1
1 1063 . 6 1 1 A 92 92 LYS HA H 92 4.610 4.834 -0.224 1
1 1072 . 6 1 1 A 92 92 LYS C C 92 176.262 174.110 2.152 1
1 1073 . 6 1 1 A 92 92 LYS CA C 92 54.258 53.386 0.872 1
1 1074 . 6 1 1 A 92 92 LYS CB C 92 32.672 35.829 -3.157 1
1 1078 . 6 1 1 A 92 92 LYS N N 92 124.243 119.313 4.930 1
1 1079 . 6 1 1 A 93 93 PRO HA H 93 4.415 4.500 -0.085 1
1 1086 . 6 1 1 A 93 93 PRO CA C 93 62.899 63.004 -0.105 1
1 1087 . 6 1 1 A 93 93 PRO CB C 93 32.323 32.941 -0.618 1
1 1090 . 6 1 1 A 94 94 LYS H H 94 8.420 8.888 -0.468 1
1 1091 . 6 1 1 A 94 94 LYS HA H 94 4.290 4.706 -0.416 1
1 1100 . 6 1 1 A 94 94 LYS C C 94 176.714 174.365 2.349 1
1 1101 . 6 1 1 A 94 94 LYS CA C 94 56.585 55.364 1.221 1
1 1102 . 6 1 1 A 94 94 LYS CB C 94 33.161 36.027 -2.866 1
1 1106 . 6 1 1 A 94 94 LYS N N 94 122.121 122.606 -0.485 1
1 1107 . 6 1 1 A 95 95 ALA H H 95 8.348 8.540 -0.192 1
1 1108 . 6 1 1 A 95 95 ALA HA H 95 4.250 4.261 -0.011 1
1 1112 . 6 1 1 A 95 95 ALA C C 95 176.453 177.413 -0.960 1
1 1113 . 6 1 1 A 95 95 ALA CA C 95 52.471 52.245 0.226 1
1 1114 . 6 1 1 A 95 95 ALA CB C 95 19.347 19.081 0.266 1
1 1115 . 6 1 1 A 95 95 ALA N N 95 125.624 127.460 -1.836 1
1 1116 . 6 1 1 A 96 96 ALA H H 96 8.348 8.251 0.097 1
1 1117 . 6 1 1 A 96 96 ALA HA H 96 4.254 4.336 -0.082 1
1 1121 . 6 1 1 A 96 96 ALA C C 96 176.462 177.755 -1.293 1
1 1122 . 6 1 1 A 96 96 ALA CA C 96 52.471 52.994 -0.523 1
1 1123 . 6 1 1 A 96 96 ALA CB C 96 19.347 19.202 0.145 1
1 1124 . 6 1 1 A 96 96 ALA N N 96 125.624 123.151 2.473 1
1 1125 . 6 1 1 A 97 97 GLN H H 97 8.333 8.575 -0.242 1
1 1126 . 6 1 1 A 97 97 GLN HA H 97 4.362 4.893 -0.531 1
1 1133 . 6 1 1 A 97 97 GLN C C 97 177.684 175.432 2.252 1
1 1134 . 6 1 1 A 97 97 GLN CA C 97 55.848 53.733 2.115 1
1 1135 . 6 1 1 A 97 97 GLN CB C 97 29.643 33.181 -3.538 1
1 1137 . 6 1 1 A 97 97 GLN N N 97 120.049 121.487 -1.438 1
1 1139 . 6 1 1 A 98 98 VAL H H 98 8.230 8.472 -0.242 1
1 1140 . 6 1 1 A 98 98 VAL HA H 98 4.145 4.079 0.066 1
1 1148 . 6 1 1 A 98 98 VAL C C 98 176.033 175.361 0.672 1
1 1149 . 6 1 1 A 98 98 VAL CA C 98 62.444 61.975 0.469 1
1 1150 . 6 1 1 A 98 98 VAL CB C 98 32.942 33.142 -0.200 1
1 1153 . 6 1 1 A 98 98 VAL N N 98 121.607 121.497 0.110 1
1 1154 . 6 1 1 A 99 99 SER H H 99 8.375 8.417 -0.042 1
1 1155 . 6 1 1 A 99 99 SER HA H 99 4.473 4.379 0.094 1
1 1158 . 6 1 1 A 99 99 SER C C 99 176.204 174.737 1.467 1
1 1159 . 6 1 1 A 99 99 SER CA C 99 58.379 59.705 -1.326 1
1 1160 . 6 1 1 A 99 99 SER CB C 99 63.914 63.901 0.013 1
1 1161 . 6 1 1 A 99 99 SER N N 99 119.455 119.301 0.154 1
1 1162 . 6 1 1 A 100 100 GLU H H 100 8.547 8.757 -0.210 1
1 1163 . 6 1 1 A 100 100 GLU HA H 100 4.304 4.782 -0.478 1
1 1168 . 6 1 1 A 100 100 GLU C C 100 174.620 174.380 0.240 1
1 1169 . 6 1 1 A 100 100 GLU CA C 100 56.835 55.420 1.415 1
1 1170 . 6 1 1 A 100 100 GLU CB C 100 30.365 33.699 -3.334 1
1 1172 . 6 1 1 A 100 100 GLU N N 100 123.419 124.527 -1.108 1
1 1173 . 6 1 1 A 101 101 GLU H H 101 8.432 8.679 -0.247 1
1 1174 . 6 1 1 A 101 101 GLU HA H 101 4.252 4.691 -0.439 1
1 1179 . 6 1 1 A 101 101 GLU C C 101 176.693 175.918 0.775 1
1 1180 . 6 1 1 A 101 101 GLU CA C 101 56.835 55.760 1.075 1
1 1181 . 6 1 1 A 101 101 GLU CB C 101 30.365 31.132 -0.767 1
1 1183 . 6 1 1 A 101 101 GLU N N 101 122.025 122.998 -0.973 1
1 1184 . 6 1 1 A 102 102 ALA H H 102 8.324 7.609 0.715 1
1 1185 . 6 1 1 A 102 102 ALA HA H 102 4.361 4.346 0.015 1
1 1189 . 6 1 1 A 102 102 ALA C C 102 177.065 176.121 0.944 1
1 1190 . 6 1 1 A 102 102 ALA CA C 102 52.647 50.272 2.375 1
1 1191 . 6 1 1 A 102 102 ALA CB C 102 19.227 22.468 -3.241 1
1 1192 . 6 1 1 A 102 102 ALA N N 102 125.114 123.023 2.091 1
1 1193 . 6 1 1 A 103 103 SER H H 103 8.259 8.177 0.082 1
1 1194 . 6 1 1 A 103 103 SER HA H 103 4.473 4.167 0.306 1
1 1197 . 6 1 1 A 103 103 SER C C 103 177.772 173.393 4.379 1
1 1198 . 6 1 1 A 103 103 SER CA C 103 58.301 58.874 -0.573 1
1 1199 . 6 1 1 A 103 103 SER CB C 103 63.961 61.975 1.986 1
1 1200 . 6 1 1 A 103 103 SER N N 103 115.109 111.314 3.795 1
1 1201 . 6 1 1 A 104 104 THR H H 104 8.127 7.568 0.559 1
1 1202 . 6 1 1 A 104 104 THR HA H 104 4.600 4.594 0.006 1
1 1207 . 6 1 1 A 104 104 THR C C 104 174.427 174.861 -0.434 1
1 1208 . 6 1 1 A 104 104 THR CA C 104 59.954 60.388 -0.434 1
1 1209 . 6 1 1 A 104 104 THR CB C 104 69.868 69.011 0.857 1
1 1211 . 6 1 1 A 104 104 THR N N 104 117.882 111.867 6.015 1
1 1212 . 6 1 1 A 105 105 PRO HA H 105 4.414 4.541 -0.127 1
1 1219 . 6 1 1 A 105 105 PRO CA C 105 63.300 64.593 -1.293 1
1 1220 . 6 1 1 A 105 105 PRO CB C 105 32.227 31.914 0.313 1
1 1223 . 6 1 1 A 106 106 GLN H H 106 8.524 8.231 0.293 1
1 1224 . 6 1 1 A 106 106 GLN HA H 106 4.276 4.342 -0.066 1
1 1229 . 6 1 1 A 106 106 GLN C C 106 177.083 176.080 1.003 1
1 1230 . 6 1 1 A 106 106 GLN CA C 106 56.209 55.925 0.284 1
1 1231 . 6 1 1 A 106 106 GLN CB C 106 29.490 28.808 0.682 1
1 1233 . 6 1 1 A 106 106 GLN N N 106 120.754 116.643 4.111 1
1 1234 . 6 1 1 A 107 107 GLY H H 107 8.394 7.514 0.880 1
1 1235 . 6 1 1 A 107 107 GLY HA2 H 107 3.895 4.124 -0.229 1
1 1236 . 6 1 1 A 107 107 GLY HA3 H 107 3.895 4.133 -0.238 1
1 1237 . 6 1 1 A 107 107 GLY C C 107 176.651 172.869 3.782 1
1 1238 . 6 1 1 A 107 107 GLY CA C 107 45.330 43.914 1.416 1
1 1239 . 6 1 1 A 107 107 GLY N N 107 110.026 107.853 2.173 1
1 1240 . 6 1 1 A 108 108 PHE H H 108 8.099 8.429 -0.330 1
1 1241 . 6 1 1 A 108 108 PHE HA H 108 4.582 4.600 -0.018 1
1 1245 . 6 1 1 A 108 108 PHE C C 108 173.944 174.846 -0.902 1
1 1246 . 6 1 1 A 108 108 PHE CA C 108 58.054 58.866 -0.812 1
1 1247 . 6 1 1 A 108 108 PHE CB C 108 39.708 39.885 -0.177 1
1 1248 . 6 1 1 A 108 108 PHE N N 108 120.180 120.586 -0.406 1
1 1249 . 6 1 1 A 109 109 ASN H H 109 8.482 7.635 0.847 1
1 1250 . 6 1 1 A 109 109 ASN HA H 109 4.691 4.951 -0.260 1
1 1255 . 6 1 1 A 109 109 ASN C C 109 175.627 174.104 1.523 1
1 1256 . 6 1 1 A 109 109 ASN CA C 109 53.402 52.259 1.143 1
1 1257 . 6 1 1 A 109 109 ASN CB C 109 38.883 41.842 -2.959 1
1 1258 . 6 1 1 A 109 109 ASN N N 109 120.752 124.950 -4.198 1
1 1260 . 6 1 1 A 110 110 THR H H 110 8.112 8.547 -0.435 1
1 1261 . 6 1 1 A 110 110 THR HA H 110 4.251 4.542 -0.291 1
1 1266 . 6 1 1 A 110 110 THR C C 110 175.275 173.615 1.660 1
1 1267 . 6 1 1 A 110 110 THR CA C 110 62.460 61.583 0.877 1
1 1268 . 6 1 1 A 110 110 THR CB C 110 69.726 71.097 -1.371 1
1 1270 . 6 1 1 A 110 110 THR N N 110 114.601 116.146 -1.545 1
1 1271 . 6 1 1 A 111 111 LEU H H 111 8.168 8.602 -0.434 1
1 1272 . 6 1 1 A 111 111 LEU HA H 111 4.308 5.016 -0.708 1
1 1282 . 6 1 1 A 111 111 LEU CA C 111 55.704 54.014 1.690 1
1 1283 . 6 1 1 A 111 111 LEU CB C 111 42.071 46.379 -4.308 1
1 1287 . 6 1 1 A 111 111 LEU N N 111 123.756 122.290 1.466 1
1 1288 . 6 1 1 A 112 112 LYS H H 112 8.123 8.362 -0.239 1
1 1289 . 6 1 1 A 112 112 LYS HA H 112 4.242 4.777 -0.535 1
1 1298 . 6 1 1 A 112 112 LYS C C 112 177.547 176.342 1.205 1
1 1299 . 6 1 1 A 112 112 LYS CA C 112 56.928 54.272 2.656 1
1 1300 . 6 1 1 A 112 112 LYS CB C 112 33.055 35.986 -2.931 1
1 1304 . 6 1 1 A 112 112 LYS N N 112 121.442 124.764 -3.322 1
1 1305 . 6 1 1 A 113 113 ASP H H 113 8.230 8.928 -0.698 1
1 1306 . 6 1 1 A 113 113 ASP HA H 113 4.526 4.336 0.190 1
1 1309 . 6 1 1 A 113 113 ASP C C 113 176.532 176.839 -0.307 1
1 1310 . 6 1 1 A 113 113 ASP CA C 113 54.896 57.153 -2.257 1
1 1311 . 6 1 1 A 113 113 ASP CB C 113 41.362 40.524 0.838 1
1 1312 . 6 1 1 A 113 113 ASP N N 113 120.598 122.723 -2.125 1
1 1313 . 6 1 1 A 114 114 LYS H H 114 8.127 7.830 0.297 1
1 1314 . 6 1 1 A 114 114 LYS HA H 114 4.300 4.844 -0.544 1
1 1323 . 6 1 1 A 114 114 LYS C C 114 176.303 176.095 0.208 1
1 1324 . 6 1 1 A 114 114 LYS CA C 114 56.633 55.086 1.547 1
1 1325 . 6 1 1 A 114 114 LYS CB C 114 32.818 33.135 -0.317 1
1 1329 . 6 1 1 A 114 114 LYS N N 114 120.897 116.127 4.770 1
1 1330 . 6 1 1 A 115 115 LEU H H 115 8.244 7.413 0.831 1
1 1331 . 6 1 1 A 115 115 LEU HA H 115 4.254 4.362 -0.108 1
1 1341 . 6 1 1 A 115 115 LEU C C 115 176.909 175.501 1.408 1
1 1342 . 6 1 1 A 115 115 LEU CA C 115 56.282 55.472 0.810 1
1 1343 . 6 1 1 A 115 115 LEU CB C 115 42.188 41.883 0.305 1
1 1347 . 6 1 1 A 115 115 LEU N N 115 123.251 123.595 -0.344 1
1 1348 . 6 1 1 A 116 116 GLU H H 116 8.421 8.203 0.218 1
1 1349 . 6 1 1 A 116 116 GLU HA H 116 4.190 4.382 -0.192 1
1 1352 . 6 1 1 A 116 116 GLU C C 116 177.828 175.889 1.939 1
1 1353 . 6 1 1 A 116 116 GLU CA C 116 57.466 54.647 2.819 1
1 1354 . 6 1 1 A 116 116 GLU CB C 116 30.124 32.478 -2.354 1
1 1355 . 6 1 1 A 116 116 GLU N N 116 120.575 125.510 -4.935 1
1 1356 . 6 1 1 A 117 117 GLU H H 117 8.255 8.448 -0.193 1
1 1357 . 6 1 1 A 117 117 GLU HA H 117 4.192 3.875 0.317 1
1 1362 . 6 1 1 A 117 117 GLU CA C 117 57.491 58.926 -1.435 1
1 1363 . 6 1 1 A 117 117 GLU CB C 117 30.365 29.366 0.999 1
1 1365 . 6 1 1 A 117 117 GLU N N 117 120.933 122.300 -1.367 1
1 1366 . 6 1 1 A 118 118 TRP H H 118 8.143 7.265 0.878 1
1 1367 . 6 1 1 A 118 118 TRP HA H 118 4.581 4.498 0.083 1
1 1372 . 6 1 1 A 118 118 TRP C C 118 176.794 176.822 -0.028 1
1 1373 . 6 1 1 A 118 118 TRP CA C 118 58.363 59.188 -0.825 1
1 1374 . 6 1 1 A 118 118 TRP CB C 118 29.333 28.195 1.138 1
1 1375 . 6 1 1 A 118 118 TRP N N 118 121.592 119.513 2.079 1
1 1376 . 6 1 1 A 119 119 ILE H H 119 7.908 7.538 0.370 1
1 1377 . 6 1 1 A 119 119 ILE HA H 119 3.828 4.430 -0.602 1
1 1387 . 6 1 1 A 119 119 ILE C C 119 176.984 175.286 1.698 1
1 1388 . 6 1 1 A 119 119 ILE CA C 119 62.335 60.584 1.751 1
1 1389 . 6 1 1 A 119 119 ILE CB C 119 38.649 39.306 -0.657 1
1 1393 . 6 1 1 A 119 119 ILE N N 119 122.744 119.337 3.407 1
1 1394 . 6 1 1 A 120 120 GLU H H 120 8.143 8.586 -0.443 1
1 1395 . 6 1 1 A 120 120 GLU HA H 120 4.093 5.243 -1.150 1
1 1400 . 6 1 1 A 120 120 GLU C C 120 176.565 174.945 1.620 1
1 1401 . 6 1 1 A 120 120 GLU CA C 120 57.613 54.760 2.853 1
1 1402 . 6 1 1 A 120 120 GLU CB C 120 29.834 33.327 -3.493 1
1 1404 . 6 1 1 A 120 120 GLU N N 120 123.139 121.475 1.664 1
1 1405 . 6 1 1 A 121 121 MET H H 121 8.254 8.858 -0.604 1
1 1406 . 6 1 1 A 121 121 MET HA H 121 4.357 4.913 -0.556 1
1 1411 . 6 1 1 A 121 121 MET CA C 121 56.625 54.587 2.038 1
1 1412 . 6 1 1 A 121 121 MET CB C 121 32.664 36.969 -4.305 1
1 1414 . 6 1 1 A 121 121 MET N N 121 120.449 123.087 -2.638 1
1 1415 . 6 1 1 A 122 122 SER H H 122 8.199 9.103 -0.904 1
1 1416 . 6 1 1 A 122 122 SER HA H 122 4.280 4.154 0.126 1
1 1419 . 6 1 1 A 122 122 SER C C 122 177.224 176.212 1.012 1
1 1420 . 6 1 1 A 122 122 SER CA C 122 59.635 61.435 -1.800 1
1 1421 . 6 1 1 A 122 122 SER CB C 122 63.560 62.897 0.663 1
1 1422 . 6 1 1 A 122 122 SER N N 122 115.857 118.044 -2.187 1
1 1423 . 6 1 1 A 123 123 ASN H H 123 8.211 8.285 -0.074 1
1 1424 . 6 1 1 A 123 123 ASN HA H 123 4.737 4.491 0.246 1
1 1429 . 6 1 1 A 123 123 ASN C C 123 174.709 177.947 -3.238 1
1 1430 . 6 1 1 A 123 123 ASN CA C 123 53.507 56.336 -2.829 1
1 1431 . 6 1 1 A 123 123 ASN CB C 123 38.800 38.654 0.146 1
1 1432 . 6 1 1 A 123 123 ASN N N 123 119.923 120.235 -0.312 1
1 1434 . 6 1 1 A 124 124 ARG H H 124 7.997 7.962 0.035 1
1 1435 . 6 1 1 A 124 124 ARG HA H 124 4.305 4.048 0.257 1
1 1442 . 6 1 1 A 124 124 ARG C C 124 175.477 176.957 -1.480 1
1 1443 . 6 1 1 A 124 124 ARG CA C 124 56.709 58.787 -2.078 1
1 1444 . 6 1 1 A 124 124 ARG CB C 124 30.584 29.589 0.995 1
1 1447 . 6 1 1 A 124 124 ARG N N 124 120.821 119.042 1.779 1
1 1448 . 6 1 1 A 125 125 LYS H H 125 8.327 7.387 0.940 1
1 1449 . 6 1 1 A 125 125 LYS HA H 125 4.254 4.289 -0.035 1
1 1458 . 6 1 1 A 125 125 LYS C C 125 176.777 177.231 -0.454 1
1 1459 . 6 1 1 A 125 125 LYS CA C 125 56.860 56.653 0.207 1
1 1460 . 6 1 1 A 125 125 LYS CB C 125 32.879 32.892 -0.013 1
1 1464 . 6 1 1 A 125 125 LYS N N 125 121.891 119.193 2.698 1
1 1465 . 6 1 1 A 126 126 ASP H H 126 8.343 9.137 -0.794 1
1 1466 . 6 1 1 A 126 126 ASP HA H 126 4.581 4.333 0.248 1
1 1469 . 6 1 1 A 126 126 ASP C C 126 176.538 177.247 -0.709 1
1 1470 . 6 1 1 A 126 126 ASP CA C 126 54.540 57.831 -3.291 1
1 1471 . 6 1 1 A 126 126 ASP CB C 126 40.907 40.728 0.179 1
1 1472 . 6 1 1 A 126 126 ASP N N 126 119.814 124.005 -4.191 1
1 1473 . 6 1 1 A 127 127 LEU H H 127 7.946 7.488 0.458 1
1 1474 . 6 1 1 A 127 127 LEU HA H 127 4.309 4.359 -0.050 1
1 1484 . 6 1 1 A 127 127 LEU C C 127 176.043 175.584 0.459 1
1 1485 . 6 1 1 A 127 127 LEU CA C 127 55.427 53.981 1.446 1
1 1486 . 6 1 1 A 127 127 LEU CB C 127 42.394 40.580 1.814 1
1 1490 . 6 1 1 A 127 127 LEU N N 127 121.432 118.770 2.662 1
1 1491 . 6 1 1 A 128 128 ILE H H 128 7.967 8.545 -0.578 1
1 1492 . 6 1 1 A 128 128 ILE HA H 128 4.141 4.197 -0.056 1
1 1502 . 6 1 1 A 128 128 ILE C C 128 177.200 174.763 2.437 1
1 1503 . 6 1 1 A 128 128 ILE CA C 128 61.150 62.248 -1.098 1
1 1504 . 6 1 1 A 128 128 ILE CB C 128 38.489 38.472 0.017 1
1 1508 . 6 1 1 A 128 128 ILE N N 128 121.579 127.779 -6.200 1
1 1509 . 6 1 1 A 129 129 LYS H H 129 8.331 8.504 -0.173 1
1 1510 . 6 1 1 A 129 129 LYS HA H 129 4.328 5.037 -0.709 1
1 1519 . 6 1 1 A 129 129 LYS C C 129 175.952 174.576 1.376 1
1 1520 . 6 1 1 A 129 129 LYS CA C 129 56.330 55.387 0.943 1
1 1521 . 6 1 1 A 129 129 LYS CB C 129 33.010 36.261 -3.251 1
1 1525 . 6 1 1 A 129 129 LYS N N 129 126.955 128.619 -1.664 1
1 1 . 7 1 1 A 2 2 ALA HA H 2 4.070 3.801 0.269 1
1 5 . 7 1 1 A 2 2 ALA CA C 2 52.067 53.169 -1.102 1
1 6 . 7 1 1 A 2 2 ALA CB C 2 19.577 17.159 2.418 1
1 7 . 7 1 1 A 3 3 ALA H H 3 8.714 7.559 1.155 1
1 8 . 7 1 1 A 3 3 ALA HA H 3 4.253 4.291 -0.038 1
1 12 . 7 1 1 A 3 3 ALA C C 3 173.672 177.666 -3.994 1
1 13 . 7 1 1 A 3 3 ALA CA C 3 52.067 52.320 -0.253 1
1 14 . 7 1 1 A 3 3 ALA CB C 3 19.577 19.829 -0.252 1
1 15 . 7 1 1 A 3 3 ALA N N 3 124.480 118.333 6.147 1
1 16 . 7 1 1 A 4 4 LYS H H 4 8.227 8.724 -0.497 1
1 17 . 7 1 1 A 4 4 LYS HA H 4 3.976 4.056 -0.080 1
1 26 . 7 1 1 A 4 4 LYS C C 4 176.672 175.980 0.692 1
1 27 . 7 1 1 A 4 4 LYS CA C 4 57.274 57.947 -0.673 1
1 28 . 7 1 1 A 4 4 LYS CB C 4 33.209 32.533 0.676 1
1 32 . 7 1 1 A 4 4 LYS N N 4 120.988 121.256 -0.268 1
1 33 . 7 1 1 A 5 5 PHE H H 5 7.719 7.712 0.007 1
1 34 . 7 1 1 A 5 5 PHE HA H 5 4.384 5.294 -0.910 1
1 38 . 7 1 1 A 5 5 PHE C C 5 175.364 174.260 1.104 1
1 39 . 7 1 1 A 5 5 PHE CA C 5 57.074 56.174 0.900 1
1 40 . 7 1 1 A 5 5 PHE CB C 5 39.669 43.585 -3.916 1
1 41 . 7 1 1 A 5 5 PHE N N 5 119.246 116.824 2.422 1
1 42 . 7 1 1 A 6 6 GLU H H 6 8.515 8.888 -0.373 1
1 43 . 7 1 1 A 6 6 GLU HA H 6 4.370 4.955 -0.585 1
1 48 . 7 1 1 A 6 6 GLU CA C 6 55.669 54.620 1.049 1
1 49 . 7 1 1 A 6 6 GLU CB C 6 32.094 33.782 -1.688 1
1 51 . 7 1 1 A 6 6 GLU N N 6 122.193 120.316 1.877 1
1 52 . 7 1 1 A 7 7 VAL H H 7 8.636 8.506 0.130 1
1 53 . 7 1 1 A 7 7 VAL HA H 7 3.406 3.955 -0.549 1
1 61 . 7 1 1 A 7 7 VAL C C 7 176.611 176.363 0.248 1
1 62 . 7 1 1 A 7 7 VAL CA C 7 65.358 63.394 1.964 1
1 63 . 7 1 1 A 7 7 VAL CB C 7 31.391 31.434 -0.043 1
1 66 . 7 1 1 A 7 7 VAL N N 7 122.949 122.214 0.735 1
1 67 . 7 1 1 A 8 8 GLY H H 8 9.394 9.148 0.246 1
1 68 . 7 1 1 A 8 8 GLY HA2 H 8 3.600 4.039 -0.439 1
1 69 . 7 1 1 A 8 8 GLY HA3 H 8 4.546 4.041 0.505 1
1 70 . 7 1 1 A 8 8 GLY C C 8 178.074 174.266 3.808 1
1 71 . 7 1 1 A 8 8 GLY CA C 8 45.121 44.909 0.212 1
1 72 . 7 1 1 A 8 8 GLY N N 8 116.837 115.225 1.612 1
1 73 . 7 1 1 A 9 9 SER H H 9 8.021 8.033 -0.012 1
1 74 . 7 1 1 A 9 9 SER HA H 9 4.680 4.487 0.193 1
1 77 . 7 1 1 A 9 9 SER C C 9 174.234 173.054 1.180 1
1 78 . 7 1 1 A 9 9 SER CA C 9 59.387 59.372 0.015 1
1 79 . 7 1 1 A 9 9 SER CB C 9 65.584 64.648 0.936 1
1 80 . 7 1 1 A 9 9 SER N N 9 118.208 118.235 -0.027 1
1 81 . 7 1 1 A 10 10 VAL H H 10 7.945 8.228 -0.283 1
1 82 . 7 1 1 A 10 10 VAL HA H 10 4.980 5.110 -0.130 1
1 90 . 7 1 1 A 10 10 VAL C C 10 171.388 174.301 -2.913 1
1 91 . 7 1 1 A 10 10 VAL CA C 10 61.021 61.047 -0.026 1
1 92 . 7 1 1 A 10 10 VAL CB C 10 33.400 35.480 -2.080 1
1 95 . 7 1 1 A 10 10 VAL N N 10 121.118 122.478 -1.360 1
1 96 . 7 1 1 A 11 11 TYR H H 11 9.008 9.323 -0.315 1
1 97 . 7 1 1 A 11 11 TYR HA H 11 4.850 5.347 -0.497 1
1 101 . 7 1 1 A 11 11 TYR C C 11 174.926 174.849 0.077 1
1 102 . 7 1 1 A 11 11 TYR CA C 11 56.803 56.275 0.528 1
1 103 . 7 1 1 A 11 11 TYR CB C 11 43.676 43.765 -0.089 1
1 104 . 7 1 1 A 11 11 TYR N N 11 125.043 125.542 -0.499 1
1 105 . 7 1 1 A 12 12 THR H H 12 8.809 8.660 0.149 1
1 106 . 7 1 1 A 12 12 THR HA H 12 5.020 5.434 -0.414 1
1 111 . 7 1 1 A 12 12 THR C C 12 174.195 174.765 -0.570 1
1 112 . 7 1 1 A 12 12 THR CA C 12 62.487 59.978 2.509 1
1 113 . 7 1 1 A 12 12 THR CB C 12 69.743 72.078 -2.335 1
1 115 . 7 1 1 A 12 12 THR N N 12 116.850 115.236 1.614 1
1 116 . 7 1 1 A 13 13 GLY H H 13 9.179 8.515 0.664 1
1 117 . 7 1 1 A 13 13 GLY HA2 H 13 3.250 4.346 -1.096 1
1 118 . 7 1 1 A 13 13 GLY HA3 H 13 4.801 4.358 0.443 1
1 119 . 7 1 1 A 13 13 GLY C C 13 174.654 172.000 2.654 1
1 120 . 7 1 1 A 13 13 GLY CA C 13 44.377 45.476 -1.099 1
1 121 . 7 1 1 A 13 13 GLY N N 13 113.654 111.896 1.758 1
1 122 . 7 1 1 A 14 14 LYS H H 14 7.770 8.588 -0.818 1
1 123 . 7 1 1 A 14 14 LYS HA H 14 5.426 5.206 0.220 1
1 132 . 7 1 1 A 14 14 LYS C C 14 171.343 175.659 -4.316 1
1 133 . 7 1 1 A 14 14 LYS CA C 14 53.879 54.877 -0.998 1
1 134 . 7 1 1 A 14 14 LYS CB C 14 36.032 35.755 0.277 1
1 138 . 7 1 1 A 14 14 LYS N N 14 118.322 120.736 -2.414 1
1 139 . 7 1 1 A 15 15 VAL H H 15 9.206 9.249 -0.043 1
1 140 . 7 1 1 A 15 15 VAL HA H 15 4.400 4.300 0.100 1
1 148 . 7 1 1 A 15 15 VAL C C 15 176.306 177.045 -0.739 1
1 149 . 7 1 1 A 15 15 VAL CA C 15 63.648 63.545 0.103 1
1 150 . 7 1 1 A 15 15 VAL CB C 15 31.769 31.462 0.307 1
1 153 . 7 1 1 A 15 15 VAL N N 15 125.308 127.258 -1.950 1
1 154 . 7 1 1 A 16 16 THR H H 16 9.403 9.246 0.157 1
1 155 . 7 1 1 A 16 16 THR HA H 16 4.562 4.651 -0.089 1
1 160 . 7 1 1 A 16 16 THR C C 16 178.098 174.745 3.353 1
1 161 . 7 1 1 A 16 16 THR CA C 16 62.018 61.918 0.100 1
1 162 . 7 1 1 A 16 16 THR CB C 16 69.720 69.757 -0.037 1
1 164 . 7 1 1 A 16 16 THR N N 16 121.753 118.075 3.678 1
1 165 . 7 1 1 A 17 17 GLY H H 17 7.600 7.028 0.572 1
1 166 . 7 1 1 A 17 17 GLY HA2 H 17 4.110 4.092 0.018 1
1 167 . 7 1 1 A 17 17 GLY HA3 H 17 4.250 4.184 0.066 1
1 168 . 7 1 1 A 17 17 GLY C C 17 175.551 171.495 4.056 1
1 169 . 7 1 1 A 17 17 GLY CA C 17 46.258 45.564 0.694 1
1 170 . 7 1 1 A 17 17 GLY N N 17 109.407 108.740 0.667 1
1 171 . 7 1 1 A 18 18 LEU H H 18 8.820 8.559 0.261 1
1 172 . 7 1 1 A 18 18 LEU HA H 18 4.852 5.101 -0.249 1
1 182 . 7 1 1 A 18 18 LEU CA C 18 54.245 53.159 1.086 1
1 183 . 7 1 1 A 18 18 LEU CB C 18 44.906 45.300 -0.394 1
1 187 . 7 1 1 A 18 18 LEU N N 18 123.419 121.677 1.742 1
1 188 . 7 1 1 A 19 19 GLN H H 19 8.537 8.685 -0.148 1
1 189 . 7 1 1 A 19 19 GLN HA H 19 4.520 4.547 -0.027 1
1 196 . 7 1 1 A 19 19 GLN C C 19 175.258 175.836 -0.578 1
1 197 . 7 1 1 A 19 19 GLN CA C 19 53.269 53.681 -0.412 1
1 198 . 7 1 1 A 19 19 GLN CB C 19 31.522 31.598 -0.076 1
1 200 . 7 1 1 A 19 19 GLN N N 19 120.187 121.477 -1.290 1
1 202 . 7 1 1 A 20 20 ALA H H 20 8.798 8.368 0.430 1
1 203 . 7 1 1 A 20 20 ALA HA H 20 4.010 4.005 0.005 1
1 207 . 7 1 1 A 20 20 ALA C C 20 175.698 177.018 -1.320 1
1 208 . 7 1 1 A 20 20 ALA CA C 20 55.084 53.897 1.187 1
1 209 . 7 1 1 A 20 20 ALA CB C 20 18.277 18.428 -0.151 1
1 210 . 7 1 1 A 20 20 ALA N N 20 120.606 123.662 -3.056 1
1 211 . 7 1 1 A 21 21 TYR H H 21 6.618 7.264 -0.646 1
1 212 . 7 1 1 A 21 21 TYR HA H 21 4.540 4.887 -0.347 1
1 216 . 7 1 1 A 21 21 TYR C C 21 178.437 175.147 3.290 1
1 217 . 7 1 1 A 21 21 TYR CA C 21 55.120 56.906 -1.786 1
1 218 . 7 1 1 A 21 21 TYR CB C 21 37.891 40.723 -2.832 1
1 219 . 7 1 1 A 21 21 TYR N N 21 105.570 113.336 -7.766 1
1 220 . 7 1 1 A 22 22 GLY H H 22 7.203 7.208 -0.005 1
1 221 . 7 1 1 A 22 22 GLY HA2 H 22 3.460 4.021 -0.561 1
1 222 . 7 1 1 A 22 22 GLY HA3 H 22 4.360 4.054 0.306 1
1 223 . 7 1 1 A 22 22 GLY C C 22 175.833 170.956 4.877 1
1 224 . 7 1 1 A 22 22 GLY CA C 22 46.356 45.476 0.880 1
1 225 . 7 1 1 A 22 22 GLY N N 22 109.854 108.533 1.321 1
1 226 . 7 1 1 A 23 23 ALA H H 23 8.549 8.414 0.135 1
1 227 . 7 1 1 A 23 23 ALA HA H 23 4.981 5.167 -0.186 1
1 231 . 7 1 1 A 23 23 ALA C C 23 168.810 175.706 -6.896 1
1 232 . 7 1 1 A 23 23 ALA CA C 23 49.178 50.806 -1.628 1
1 233 . 7 1 1 A 23 23 ALA CB C 23 22.797 22.532 0.265 1
1 234 . 7 1 1 A 23 23 ALA N N 23 118.749 121.564 -2.815 1
1 235 . 7 1 1 A 24 24 PHE H H 24 8.812 8.727 0.085 1
1 236 . 7 1 1 A 24 24 PHE HA H 24 5.125 4.902 0.223 1
1 240 . 7 1 1 A 24 24 PHE CA C 24 58.017 57.863 0.154 1
1 241 . 7 1 1 A 24 24 PHE CB C 24 40.475 40.530 -0.055 1
1 242 . 7 1 1 A 24 24 PHE N N 24 122.891 121.114 1.777 1
1 243 . 7 1 1 A 25 25 VAL H H 25 8.880 9.018 -0.138 1
1 244 . 7 1 1 A 25 25 VAL HA H 25 4.660 4.715 -0.055 1
1 252 . 7 1 1 A 25 25 VAL CA C 25 60.379 61.092 -0.713 1
1 253 . 7 1 1 A 25 25 VAL CB C 25 35.654 35.142 0.512 1
1 256 . 7 1 1 A 25 25 VAL N N 25 122.908 121.033 1.875 1
1 257 . 7 1 1 A 26 26 ALA H H 26 9.403 8.816 0.587 1
1 258 . 7 1 1 A 26 26 ALA HA H 26 4.750 4.350 0.400 1
1 262 . 7 1 1 A 26 26 ALA C C 26 174.445 176.777 -2.332 1
1 263 . 7 1 1 A 26 26 ALA CA C 26 51.711 52.710 -0.999 1
1 264 . 7 1 1 A 26 26 ALA CB C 26 19.319 19.021 0.298 1
1 265 . 7 1 1 A 26 26 ALA N N 26 129.425 130.255 -0.830 1
1 266 . 7 1 1 A 27 27 LEU H H 27 8.601 9.316 -0.715 1
1 267 . 7 1 1 A 27 27 LEU HA H 27 4.158 4.541 -0.383 1
1 277 . 7 1 1 A 27 27 LEU C C 27 177.814 176.407 1.407 1
1 278 . 7 1 1 A 27 27 LEU CA C 27 55.869 55.750 0.119 1
1 279 . 7 1 1 A 27 27 LEU CB C 27 42.251 43.612 -1.361 1
1 283 . 7 1 1 A 27 27 LEU N N 27 127.169 123.276 3.893 1
1 284 . 7 1 1 A 28 28 ASP H H 28 8.172 7.856 0.316 1
1 285 . 7 1 1 A 28 28 ASP HA H 28 4.420 4.845 -0.425 1
1 288 . 7 1 1 A 28 28 ASP C C 28 177.116 175.764 1.352 1
1 289 . 7 1 1 A 28 28 ASP CA C 28 53.755 53.132 0.623 1
1 290 . 7 1 1 A 28 28 ASP CB C 28 39.833 43.853 -4.020 1
1 291 . 7 1 1 A 28 28 ASP N N 28 115.657 116.116 -0.459 1
1 292 . 7 1 1 A 29 29 GLU H H 29 8.857 9.141 -0.284 1
1 293 . 7 1 1 A 29 29 GLU HA H 29 4.090 4.130 -0.040 1
1 298 . 7 1 1 A 29 29 GLU C C 29 175.965 176.637 -0.672 1
1 299 . 7 1 1 A 29 29 GLU CA C 29 59.470 58.542 0.928 1
1 300 . 7 1 1 A 29 29 GLU CB C 29 29.409 29.017 0.392 1
1 302 . 7 1 1 A 29 29 GLU N N 29 114.738 122.146 -7.408 1
1 303 . 7 1 1 A 30 30 GLU H H 30 8.326 8.032 0.294 1
1 304 . 7 1 1 A 30 30 GLU HA H 30 4.640 4.529 0.111 1
1 309 . 7 1 1 A 30 30 GLU C C 30 176.817 175.076 1.741 1
1 310 . 7 1 1 A 30 30 GLU CA C 30 56.073 55.756 0.317 1
1 311 . 7 1 1 A 30 30 GLU CB C 30 32.453 31.173 1.280 1
1 313 . 7 1 1 A 30 30 GLU N N 30 115.753 117.851 -2.098 1
1 314 . 7 1 1 A 31 31 THR H H 31 7.819 7.542 0.277 1
1 315 . 7 1 1 A 31 31 THR HA H 31 4.484 5.060 -0.576 1
1 320 . 7 1 1 A 31 31 THR C C 31 176.330 172.798 3.532 1
1 321 . 7 1 1 A 31 31 THR CA C 31 63.398 60.867 2.531 1
1 322 . 7 1 1 A 31 31 THR CB C 31 69.367 72.598 -3.231 1
1 324 . 7 1 1 A 31 31 THR N N 31 118.750 115.564 3.186 1
1 325 . 7 1 1 A 32 32 GLN H H 32 8.913 8.640 0.273 1
1 326 . 7 1 1 A 32 32 GLN HA H 32 5.337 4.795 0.542 1
1 333 . 7 1 1 A 32 32 GLN C C 32 173.087 174.323 -1.236 1
1 334 . 7 1 1 A 32 32 GLN CA C 32 54.051 54.951 -0.900 1
1 335 . 7 1 1 A 32 32 GLN CB C 32 32.672 32.652 0.020 1
1 337 . 7 1 1 A 32 32 GLN N N 32 127.294 125.481 1.813 1
1 339 . 7 1 1 A 33 33 GLY H H 33 8.900 8.660 0.240 1
1 340 . 7 1 1 A 33 33 GLY HA2 H 33 3.290 4.306 -1.016 1
1 341 . 7 1 1 A 33 33 GLY HA3 H 33 4.530 4.361 0.169 1
1 342 . 7 1 1 A 33 33 GLY C C 33 174.918 172.288 2.630 1
1 343 . 7 1 1 A 33 33 GLY CA C 33 44.534 44.669 -0.135 1
1 344 . 7 1 1 A 33 33 GLY N N 33 107.639 111.638 -3.999 1
1 345 . 7 1 1 A 34 34 LEU H H 34 8.127 8.286 -0.159 1
1 346 . 7 1 1 A 34 34 LEU HA H 34 4.950 5.018 -0.068 1
1 356 . 7 1 1 A 34 34 LEU CA C 34 53.755 53.927 -0.172 1
1 357 . 7 1 1 A 34 34 LEU CB C 34 45.493 45.246 0.247 1
1 361 . 7 1 1 A 34 34 LEU N N 34 120.897 121.167 -0.270 1
1 362 . 7 1 1 A 35 35 VAL H H 35 9.386 8.688 0.698 1
1 363 . 7 1 1 A 35 35 VAL HA H 35 4.479 4.726 -0.247 1
1 371 . 7 1 1 A 35 35 VAL C C 35 176.402 175.568 0.834 1
1 372 . 7 1 1 A 35 35 VAL CA C 35 59.594 61.914 -2.320 1
1 373 . 7 1 1 A 35 35 VAL CB C 35 32.590 32.423 0.167 1
1 376 . 7 1 1 A 35 35 VAL N N 35 128.897 126.713 2.184 1
1 377 . 7 1 1 A 36 36 HIS H H 36 9.194 8.852 0.342 1
1 378 . 7 1 1 A 36 36 HIS HA H 36 4.487 4.785 -0.298 1
1 381 . 7 1 1 A 36 36 HIS C C 36 174.864 176.631 -1.767 1
1 382 . 7 1 1 A 36 36 HIS CA C 36 59.426 56.612 2.814 1
1 383 . 7 1 1 A 36 36 HIS CB C 36 31.542 30.347 1.195 1
1 384 . 7 1 1 A 36 36 HIS N N 36 127.751 126.817 0.934 1
1 385 . 7 1 1 A 37 37 ILE H H 37 7.454 9.001 -1.547 1
1 386 . 7 1 1 A 37 37 ILE HA H 37 3.810 3.732 0.078 1
1 396 . 7 1 1 A 37 37 ILE C C 37 176.948 177.799 -0.851 1
1 397 . 7 1 1 A 37 37 ILE CA C 37 63.773 64.975 -1.202 1
1 398 . 7 1 1 A 37 37 ILE CB C 37 38.993 37.568 1.425 1
1 402 . 7 1 1 A 37 37 ILE N N 37 126.266 126.111 0.155 1
1 403 . 7 1 1 A 38 38 SER H H 38 8.343 8.290 0.053 1
1 404 . 7 1 1 A 38 38 SER HA H 38 4.370 4.259 0.111 1
1 407 . 7 1 1 A 38 38 SER C C 38 174.792 174.950 -0.158 1
1 408 . 7 1 1 A 38 38 SER CA C 38 60.567 61.540 -0.973 1
1 409 . 7 1 1 A 38 38 SER CB C 38 63.632 62.912 0.720 1
1 410 . 7 1 1 A 38 38 SER N N 38 118.079 118.484 -0.405 1
1 411 . 7 1 1 A 39 39 GLU H H 39 8.536 8.032 0.504 1
1 412 . 7 1 1 A 39 39 GLU HA H 39 4.503 4.547 -0.044 1
1 417 . 7 1 1 A 39 39 GLU C C 39 175.131 176.709 -1.578 1
1 418 . 7 1 1 A 39 39 GLU CA C 39 54.928 55.813 -0.885 1
1 419 . 7 1 1 A 39 39 GLU CB C 39 29.621 30.582 -0.961 1
1 421 . 7 1 1 A 39 39 GLU N N 39 118.349 117.338 1.011 1
1 422 . 7 1 1 A 40 40 VAL H H 40 7.776 7.768 0.008 1
1 423 . 7 1 1 A 40 40 VAL HA H 40 3.616 3.952 -0.336 1
1 431 . 7 1 1 A 40 40 VAL C C 40 177.277 175.550 1.727 1
1 432 . 7 1 1 A 40 40 VAL CA C 40 66.245 64.113 2.132 1
1 433 . 7 1 1 A 40 40 VAL CB C 40 32.590 32.231 0.359 1
1 436 . 7 1 1 A 40 40 VAL N N 40 125.443 117.146 8.297 1
1 437 . 7 1 1 A 41 41 THR H H 41 7.888 7.410 0.478 1
1 438 . 7 1 1 A 41 41 THR HA H 41 4.345 4.317 0.028 1
1 443 . 7 1 1 A 41 41 THR C C 41 173.492 173.199 0.293 1
1 444 . 7 1 1 A 41 41 THR CA C 41 59.047 60.412 -1.365 1
1 445 . 7 1 1 A 41 41 THR CB C 41 68.992 69.522 -0.530 1
1 447 . 7 1 1 A 41 41 THR N N 41 109.905 111.340 -1.435 1
1 448 . 7 1 1 A 42 42 HIS H H 42 8.063 8.984 -0.921 1
1 449 . 7 1 1 A 42 42 HIS HA H 42 4.510 4.460 0.050 1
1 452 . 7 1 1 A 42 42 HIS C C 42 172.139 176.051 -3.912 1
1 453 . 7 1 1 A 42 42 HIS CA C 42 57.735 58.183 -0.448 1
1 454 . 7 1 1 A 42 42 HIS CB C 42 31.144 29.530 1.614 1
1 455 . 7 1 1 A 42 42 HIS N N 42 121.760 121.656 0.104 1
1 456 . 7 1 1 A 43 43 GLY H H 43 8.286 7.550 0.736 1
1 457 . 7 1 1 A 43 43 GLY HA2 H 43 3.980 3.820 0.160 1
1 458 . 7 1 1 A 43 43 GLY HA3 H 43 3.980 3.980 0.000 1
1 459 . 7 1 1 A 43 43 GLY C C 43 176.307 173.368 2.939 1
1 460 . 7 1 1 A 43 43 GLY CA C 43 44.336 44.452 -0.116 1
1 461 . 7 1 1 A 43 43 GLY N N 43 110.133 107.019 3.114 1
1 462 . 7 1 1 A 44 44 PHE H H 44 8.327 8.598 -0.271 1
1 463 . 7 1 1 A 44 44 PHE HA H 44 4.489 4.496 -0.007 1
1 467 . 7 1 1 A 44 44 PHE C C 44 171.877 175.038 -3.161 1
1 468 . 7 1 1 A 44 44 PHE CA C 44 58.027 57.331 0.696 1
1 469 . 7 1 1 A 44 44 PHE CB C 44 39.850 39.803 0.047 1
1 470 . 7 1 1 A 44 44 PHE N N 44 120.049 116.788 3.261 1
1 471 . 7 1 1 A 45 45 VAL H H 45 7.939 8.689 -0.750 1
1 472 . 7 1 1 A 45 45 VAL HA H 45 3.865 4.472 -0.607 1
1 480 . 7 1 1 A 45 45 VAL C C 45 175.523 175.573 -0.050 1
1 481 . 7 1 1 A 45 45 VAL CA C 45 61.536 61.296 0.240 1
1 482 . 7 1 1 A 45 45 VAL CB C 45 33.127 31.947 1.180 1
1 485 . 7 1 1 A 45 45 VAL N N 45 127.882 120.716 7.166 1
1 486 . 7 1 1 A 46 46 LYS H H 46 8.868 8.319 0.549 1
1 487 . 7 1 1 A 46 46 LYS HA H 46 4.170 4.154 0.016 1
1 496 . 7 1 1 A 46 46 LYS C C 46 175.728 175.866 -0.138 1
1 497 . 7 1 1 A 46 46 LYS CA C 46 57.198 58.622 -1.424 1
1 498 . 7 1 1 A 46 46 LYS CB C 46 33.299 32.335 0.964 1
1 502 . 7 1 1 A 46 46 LYS N N 46 127.308 125.725 1.583 1
1 503 . 7 1 1 A 47 47 ASP H H 47 7.652 7.810 -0.158 1
1 504 . 7 1 1 A 47 47 ASP HA H 47 4.710 5.028 -0.318 1
1 507 . 7 1 1 A 47 47 ASP C C 47 176.411 176.401 0.010 1
1 508 . 7 1 1 A 47 47 ASP CA C 47 53.390 53.241 0.149 1
1 509 . 7 1 1 A 47 47 ASP CB C 47 42.635 43.145 -0.510 1
1 510 . 7 1 1 A 47 47 ASP N N 47 117.932 118.840 -0.908 1
1 511 . 7 1 1 A 48 48 ILE H H 48 9.230 8.708 0.522 1
1 512 . 7 1 1 A 48 48 ILE HA H 48 3.579 3.864 -0.285 1
1 522 . 7 1 1 A 48 48 ILE C C 48 177.249 177.529 -0.280 1
1 523 . 7 1 1 A 48 48 ILE CA C 48 65.525 63.893 1.632 1
1 524 . 7 1 1 A 48 48 ILE CB C 48 38.797 38.030 0.767 1
1 528 . 7 1 1 A 48 48 ILE N N 48 129.049 125.527 3.522 1
1 529 . 7 1 1 A 49 49 ASN H H 49 8.468 9.066 -0.598 1
1 530 . 7 1 1 A 49 49 ASN HA H 49 4.690 4.467 0.223 1
1 535 . 7 1 1 A 49 49 ASN C C 49 175.779 176.547 -0.768 1
1 536 . 7 1 1 A 49 49 ASN CA C 49 55.587 55.147 0.440 1
1 537 . 7 1 1 A 49 49 ASN CB C 49 38.587 36.903 1.684 1
1 538 . 7 1 1 A 49 49 ASN N N 49 118.835 117.696 1.139 1
1 540 . 7 1 1 A 50 50 GLU H H 50 7.853 8.228 -0.375 1
1 541 . 7 1 1 A 50 50 GLU HA H 50 4.040 4.336 -0.296 1
1 546 . 7 1 1 A 50 50 GLU C C 50 176.148 176.195 -0.047 1
1 547 . 7 1 1 A 50 50 GLU CA C 50 57.404 57.896 -0.492 1
1 548 . 7 1 1 A 50 50 GLU CB C 50 29.491 29.564 -0.073 1
1 550 . 7 1 1 A 50 50 GLU N N 50 116.358 117.527 -1.169 1
1 551 . 7 1 1 A 51 51 HIS H H 51 7.575 7.549 0.026 1
1 552 . 7 1 1 A 51 51 HIS HA H 51 4.431 4.754 -0.323 1
1 555 . 7 1 1 A 51 51 HIS C C 51 176.383 174.134 2.249 1
1 556 . 7 1 1 A 51 51 HIS CA C 51 57.089 54.892 2.197 1
1 557 . 7 1 1 A 51 51 HIS CB C 51 33.168 32.424 0.744 1
1 558 . 7 1 1 A 51 51 HIS N N 51 115.828 118.683 -2.855 1
1 559 . 7 1 1 A 52 52 LEU H H 52 7.640 7.752 -0.112 1
1 560 . 7 1 1 A 52 52 LEU HA H 52 4.796 3.961 0.835 1
1 570 . 7 1 1 A 52 52 LEU C C 52 174.452 174.740 -0.288 1
1 571 . 7 1 1 A 52 52 LEU CA C 52 53.398 55.904 -2.506 1
1 572 . 7 1 1 A 52 52 LEU CB C 52 48.805 41.746 7.059 1
1 576 . 7 1 1 A 52 52 LEU N N 52 117.932 123.066 -5.134 1
1 577 . 7 1 1 A 53 53 SER H H 53 8.151 8.705 -0.554 1
1 578 . 7 1 1 A 53 53 SER HA H 53 4.680 5.013 -0.333 1
1 581 . 7 1 1 A 53 53 SER C C 53 174.304 172.463 1.841 1
1 582 . 7 1 1 A 53 53 SER CA C 53 56.714 57.569 -0.855 1
1 583 . 7 1 1 A 53 53 SER CB C 53 65.431 66.709 -1.278 1
1 584 . 7 1 1 A 53 53 SER N N 53 113.496 116.527 -3.031 1
1 585 . 7 1 1 A 54 54 VAL H H 54 8.782 8.745 0.037 1
1 586 . 7 1 1 A 54 54 VAL HA H 54 3.230 4.657 -1.427 1
1 594 . 7 1 1 A 54 54 VAL C C 54 173.745 175.608 -1.863 1
1 595 . 7 1 1 A 54 54 VAL CA C 54 66.232 59.718 6.514 1
1 596 . 7 1 1 A 54 54 VAL CB C 54 31.067 34.966 -3.899 1
1 599 . 7 1 1 A 54 54 VAL N N 54 124.401 120.765 3.636 1
1 600 . 7 1 1 A 55 55 GLY H H 55 9.079 8.693 0.386 1
1 601 . 7 1 1 A 55 55 GLY HA2 H 55 3.530 3.842 -0.312 1
1 602 . 7 1 1 A 55 55 GLY HA3 H 55 4.553 3.845 0.708 1
1 603 . 7 1 1 A 55 55 GLY C C 55 177.219 173.300 3.919 1
1 604 . 7 1 1 A 55 55 GLY CA C 55 44.647 46.558 -1.911 1
1 605 . 7 1 1 A 55 55 GLY N N 55 117.320 115.418 1.902 1
1 606 . 7 1 1 A 56 56 ASP H H 56 7.943 7.782 0.161 1
1 607 . 7 1 1 A 56 56 ASP HA H 56 4.460 5.219 -0.759 1
1 610 . 7 1 1 A 56 56 ASP C C 56 176.055 173.615 2.440 1
1 611 . 7 1 1 A 56 56 ASP CA C 56 55.456 52.835 2.621 1
1 612 . 7 1 1 A 56 56 ASP CB C 56 40.914 44.670 -3.756 1
1 613 . 7 1 1 A 56 56 ASP N N 56 121.782 119.224 2.558 1
1 614 . 7 1 1 A 57 57 GLU H H 57 8.649 8.644 0.005 1
1 615 . 7 1 1 A 57 57 GLU HA H 57 5.100 5.173 -0.073 1
1 620 . 7 1 1 A 57 57 GLU C C 57 175.635 176.047 -0.412 1
1 621 . 7 1 1 A 57 57 GLU CA C 57 55.805 55.678 0.127 1
1 622 . 7 1 1 A 57 57 GLU CB C 57 30.915 31.205 -0.290 1
1 624 . 7 1 1 A 57 57 GLU N N 57 122.513 122.985 -0.472 1
1 625 . 7 1 1 A 58 58 VAL H H 58 8.809 9.109 -0.300 1
1 626 . 7 1 1 A 58 58 VAL HA H 58 4.817 4.771 0.046 1
1 634 . 7 1 1 A 58 58 VAL C C 58 176.528 174.024 2.504 1
1 635 . 7 1 1 A 58 58 VAL CA C 58 58.719 59.187 -0.468 1
1 636 . 7 1 1 A 58 58 VAL CB C 58 35.523 35.987 -0.464 1
1 639 . 7 1 1 A 58 58 VAL N N 58 118.382 119.402 -1.020 1
1 640 . 7 1 1 A 59 59 GLN H H 59 8.255 8.380 -0.125 1
1 641 . 7 1 1 A 59 59 GLN HA H 59 5.030 5.008 0.022 1
1 646 . 7 1 1 A 59 59 GLN CA C 59 54.843 55.785 -0.942 1
1 647 . 7 1 1 A 59 59 GLN CB C 59 30.111 29.983 0.128 1
1 649 . 7 1 1 A 59 59 GLN N N 59 120.933 122.125 -1.192 1
1 650 . 7 1 1 A 60 60 VAL H H 60 8.970 9.299 -0.329 1
1 651 . 7 1 1 A 60 60 VAL HA H 60 4.990 4.860 0.130 1
1 659 . 7 1 1 A 60 60 VAL C C 60 175.203 174.054 1.149 1
1 660 . 7 1 1 A 60 60 VAL CA C 60 57.404 59.642 -2.238 1
1 661 . 7 1 1 A 60 60 VAL CB C 60 35.771 35.369 0.402 1
1 664 . 7 1 1 A 60 60 VAL N N 60 111.046 118.510 -7.464 1
1 665 . 7 1 1 A 61 61 LYS H H 61 8.937 8.473 0.464 1
1 666 . 7 1 1 A 61 61 LYS HA H 61 5.100 4.591 0.509 1
1 675 . 7 1 1 A 61 61 LYS C C 61 173.610 176.557 -2.947 1
1 676 . 7 1 1 A 61 61 LYS CA C 61 53.762 55.745 -1.983 1
1 677 . 7 1 1 A 61 61 LYS CB C 61 36.273 33.651 2.622 1
1 681 . 7 1 1 A 61 61 LYS N N 61 121.930 124.686 -2.756 1
1 682 . 7 1 1 A 62 62 VAL H H 62 8.429 9.311 -0.882 1
1 683 . 7 1 1 A 62 62 VAL HA H 62 4.074 4.033 0.041 1
1 691 . 7 1 1 A 62 62 VAL C C 62 176.912 176.022 0.890 1
1 692 . 7 1 1 A 62 62 VAL CA C 62 63.188 63.407 -0.219 1
1 693 . 7 1 1 A 62 62 VAL CB C 62 30.813 31.118 -0.305 1
1 696 . 7 1 1 A 62 62 VAL N N 62 126.329 127.061 -0.732 1
1 697 . 7 1 1 A 63 63 LEU H H 63 9.109 9.040 0.069 1
1 698 . 7 1 1 A 63 63 LEU HA H 63 4.423 4.420 0.003 1
1 708 . 7 1 1 A 63 63 LEU C C 63 176.091 176.275 -0.184 1
1 709 . 7 1 1 A 63 63 LEU CA C 63 55.876 56.566 -0.690 1
1 710 . 7 1 1 A 63 63 LEU CB C 63 42.800 43.098 -0.298 1
1 714 . 7 1 1 A 63 63 LEU N N 63 129.436 130.140 -0.704 1
1 715 . 7 1 1 A 64 64 ALA H H 64 7.594 7.366 0.228 1
1 716 . 7 1 1 A 64 64 ALA HA H 64 4.455 4.743 -0.288 1
1 720 . 7 1 1 A 64 64 ALA C C 64 177.314 174.841 2.473 1
1 721 . 7 1 1 A 64 64 ALA CA C 64 52.557 51.808 0.749 1
1 722 . 7 1 1 A 64 64 ALA CB C 64 21.458 22.782 -1.324 1
1 723 . 7 1 1 A 64 64 ALA N N 64 117.791 118.498 -0.707 1
1 724 . 7 1 1 A 65 65 VAL H H 65 8.583 8.741 -0.158 1
1 725 . 7 1 1 A 65 65 VAL HA H 65 4.470 5.009 -0.539 1
1 733 . 7 1 1 A 65 65 VAL C C 65 174.697 173.075 1.622 1
1 734 . 7 1 1 A 65 65 VAL CA C 65 61.936 59.834 2.102 1
1 735 . 7 1 1 A 65 65 VAL CB C 65 35.288 36.014 -0.726 1
1 738 . 7 1 1 A 65 65 VAL N N 65 120.009 118.154 1.855 1
1 739 . 7 1 1 A 66 66 ASP H H 66 8.567 8.973 -0.406 1
1 740 . 7 1 1 A 66 66 ASP HA H 66 4.880 4.962 -0.082 1
1 743 . 7 1 1 A 66 66 ASP C C 66 174.355 176.121 -1.766 1
1 744 . 7 1 1 A 66 66 ASP CA C 66 52.681 52.722 -0.041 1
1 745 . 7 1 1 A 66 66 ASP CB C 66 41.775 40.870 0.905 1
1 746 . 7 1 1 A 66 66 ASP N N 66 126.262 127.533 -1.271 1
1 747 . 7 1 1 A 67 67 GLU H H 67 9.148 8.496 0.652 1
1 748 . 7 1 1 A 67 67 GLU HA H 67 4.110 3.881 0.229 1
1 753 . 7 1 1 A 67 67 GLU C C 67 177.052 178.369 -1.317 1
1 754 . 7 1 1 A 67 67 GLU CA C 67 59.044 59.554 -0.510 1
1 755 . 7 1 1 A 67 67 GLU CB C 67 29.919 29.611 0.308 1
1 757 . 7 1 1 A 67 67 GLU N N 67 125.480 126.060 -0.580 1
1 758 . 7 1 1 A 68 68 GLU H H 68 8.384 8.076 0.308 1
1 759 . 7 1 1 A 68 68 GLU HA H 68 4.140 4.144 -0.004 1
1 764 . 7 1 1 A 68 68 GLU C C 68 178.383 177.020 1.363 1
1 765 . 7 1 1 A 68 68 GLU CA C 68 59.044 58.779 0.265 1
1 766 . 7 1 1 A 68 68 GLU CB C 68 29.919 29.288 0.631 1
1 768 . 7 1 1 A 68 68 GLU N N 68 119.760 118.647 1.113 1
1 769 . 7 1 1 A 69 69 LYS H H 69 7.799 7.861 -0.062 1
1 770 . 7 1 1 A 69 69 LYS HA H 69 4.375 4.524 -0.149 1
1 779 . 7 1 1 A 69 69 LYS C C 69 178.297 176.882 1.415 1
1 780 . 7 1 1 A 69 69 LYS CA C 69 55.704 55.813 -0.109 1
1 781 . 7 1 1 A 69 69 LYS CB C 69 33.622 34.261 -0.639 1
1 785 . 7 1 1 A 69 69 LYS N N 69 115.476 118.855 -3.379 1
1 786 . 7 1 1 A 70 70 GLY H H 70 7.994 7.919 0.075 1
1 787 . 7 1 1 A 70 70 GLY HA2 H 70 3.940 3.943 -0.003 1
1 788 . 7 1 1 A 70 70 GLY HA3 H 70 3.960 3.950 0.010 1
1 789 . 7 1 1 A 70 70 GLY C C 70 177.215 174.181 3.034 1
1 790 . 7 1 1 A 70 70 GLY CA C 70 46.773 46.544 0.229 1
1 791 . 7 1 1 A 70 70 GLY N N 70 110.245 108.903 1.342 1
1 792 . 7 1 1 A 71 71 LYS H H 71 7.560 7.700 -0.140 1
1 793 . 7 1 1 A 71 71 LYS HA H 71 4.690 4.881 -0.191 1
1 802 . 7 1 1 A 71 71 LYS C C 71 174.607 175.304 -0.697 1
1 803 . 7 1 1 A 71 71 LYS CA C 71 55.332 54.226 1.106 1
1 804 . 7 1 1 A 71 71 LYS CB C 71 34.903 35.828 -0.925 1
1 808 . 7 1 1 A 71 71 LYS N N 71 118.201 118.696 -0.495 1
1 809 . 7 1 1 A 72 72 ILE H H 72 8.867 8.611 0.256 1
1 810 . 7 1 1 A 72 72 ILE HA H 72 4.630 4.930 -0.300 1
1 820 . 7 1 1 A 72 72 ILE C C 72 175.708 174.724 0.984 1
1 821 . 7 1 1 A 72 72 ILE CA C 72 61.494 59.842 1.652 1
1 822 . 7 1 1 A 72 72 ILE CB C 72 40.652 42.320 -1.668 1
1 826 . 7 1 1 A 72 72 ILE N N 72 126.827 121.692 5.135 1
1 827 . 7 1 1 A 73 73 SER H H 73 8.815 8.871 -0.056 1
1 828 . 7 1 1 A 73 73 SER HA H 73 5.110 5.320 -0.210 1
1 831 . 7 1 1 A 73 73 SER C C 73 175.122 173.049 2.073 1
1 832 . 7 1 1 A 73 73 SER CA C 73 57.487 57.462 0.025 1
1 833 . 7 1 1 A 73 73 SER CB C 73 64.386 65.493 -1.107 1
1 834 . 7 1 1 A 73 73 SER N N 73 123.640 124.911 -1.271 1
1 835 . 7 1 1 A 74 74 LEU H H 74 8.585 8.833 -0.248 1
1 836 . 7 1 1 A 74 74 LEU HA H 74 5.450 5.366 0.084 1
1 846 . 7 1 1 A 74 74 LEU C C 74 174.061 175.421 -1.360 1
1 847 . 7 1 1 A 74 74 LEU CA C 74 53.101 53.475 -0.374 1
1 848 . 7 1 1 A 74 74 LEU CB C 74 48.268 46.628 1.640 1
1 852 . 7 1 1 A 74 74 LEU N N 74 125.221 124.242 0.979 1
1 853 . 7 1 1 A 75 75 SER H H 75 8.840 8.558 0.282 1
1 854 . 7 1 1 A 75 75 SER HA H 75 5.040 5.329 -0.289 1
1 857 . 7 1 1 A 75 75 SER C C 75 176.552 173.804 2.748 1
1 858 . 7 1 1 A 75 75 SER CA C 75 57.487 56.370 1.117 1
1 859 . 7 1 1 A 75 75 SER CB C 75 64.993 66.564 -1.571 1
1 860 . 7 1 1 A 75 75 SER N N 75 111.252 112.572 -1.320 1
1 861 . 7 1 1 A 76 76 ILE H H 76 7.790 8.869 -1.079 1
1 862 . 7 1 1 A 76 76 ILE HA H 76 4.690 4.536 0.154 1
1 872 . 7 1 1 A 76 76 ILE C C 76 175.780 177.337 -1.557 1
1 873 . 7 1 1 A 76 76 ILE CA C 76 63.631 62.193 1.438 1
1 874 . 7 1 1 A 76 76 ILE CB C 76 39.484 39.573 -0.089 1
1 878 . 7 1 1 A 76 76 ILE N N 76 129.205 120.261 8.944 1
1 879 . 7 1 1 A 77 77 ARG H H 77 8.115 8.410 -0.295 1
1 880 . 7 1 1 A 77 77 ARG HA H 77 3.760 4.044 -0.284 1
1 887 . 7 1 1 A 77 77 ARG C C 77 178.704 177.714 0.990 1
1 888 . 7 1 1 A 77 77 ARG CA C 77 58.933 58.364 0.569 1
1 889 . 7 1 1 A 77 77 ARG CB C 77 29.463 29.580 -0.117 1
1 892 . 7 1 1 A 77 77 ARG N N 77 123.257 121.621 1.636 1
1 893 . 7 1 1 A 78 78 ALA H H 78 8.304 7.625 0.679 1
1 894 . 7 1 1 A 78 78 ALA HA H 78 4.296 4.171 0.125 1
1 898 . 7 1 1 A 78 78 ALA C C 78 176.870 178.283 -1.413 1
1 899 . 7 1 1 A 78 78 ALA CA C 78 53.548 54.093 -0.545 1
1 900 . 7 1 1 A 78 78 ALA CB C 78 19.872 18.291 1.581 1
1 901 . 7 1 1 A 78 78 ALA N N 78 118.764 122.030 -3.266 1
1 902 . 7 1 1 A 79 79 THR H H 79 7.931 7.654 0.277 1
1 903 . 7 1 1 A 79 79 THR HA H 79 4.370 4.581 -0.211 1
1 908 . 7 1 1 A 79 79 THR C C 79 178.356 175.004 3.352 1
1 909 . 7 1 1 A 79 79 THR CA C 79 62.381 61.819 0.562 1
1 910 . 7 1 1 A 79 79 THR CB C 79 69.693 70.735 -1.042 1
1 912 . 7 1 1 A 79 79 THR N N 79 107.360 104.955 2.405 1
1 913 . 7 1 1 A 80 80 GLN H H 80 7.651 8.020 -0.369 1
1 914 . 7 1 1 A 80 80 GLN HA H 80 4.527 4.442 0.085 1
1 921 . 7 1 1 A 80 80 GLN C C 80 174.249 176.453 -2.204 1
1 922 . 7 1 1 A 80 80 GLN CA C 80 54.760 56.374 -1.614 1
1 923 . 7 1 1 A 80 80 GLN CB C 80 30.565 29.247 1.318 1
1 925 . 7 1 1 A 80 80 GLN N N 80 121.588 123.122 -1.534 1
1 927 . 7 1 1 A 81 81 ALA H H 81 8.498 8.667 -0.169 1
1 928 . 7 1 1 A 81 81 ALA HA H 81 4.252 4.720 -0.468 1
1 932 . 7 1 1 A 81 81 ALA C C 81 175.693 176.399 -0.706 1
1 933 . 7 1 1 A 81 81 ALA CA C 81 52.345 51.206 1.139 1
1 934 . 7 1 1 A 81 81 ALA CB C 81 19.062 20.158 -1.096 1
1 935 . 7 1 1 A 81 81 ALA N N 81 126.423 122.574 3.849 1
1 936 . 7 1 1 A 82 82 ALA H H 82 8.324 7.363 0.961 1
1 937 . 7 1 1 A 82 82 ALA HA H 82 4.000 4.853 -0.853 1
1 941 . 7 1 1 A 82 82 ALA C C 82 177.065 176.514 0.551 1
1 942 . 7 1 1 A 82 82 ALA CA C 82 50.240 49.916 0.324 1
1 943 . 7 1 1 A 82 82 ALA CB C 82 17.650 21.574 -3.924 1
1 944 . 7 1 1 A 82 82 ALA N N 82 125.114 117.507 7.607 1
1 945 . 7 1 1 A 83 83 PRO HA H 83 4.350 4.404 -0.054 1
1 952 . 7 1 1 A 83 83 PRO CA C 83 63.148 64.612 -1.464 1
1 953 . 7 1 1 A 83 83 PRO CB C 83 32.054 32.008 0.046 1
1 956 . 7 1 1 A 84 84 GLU H H 84 8.517 7.872 0.645 1
1 957 . 7 1 1 A 84 84 GLU HA H 84 4.197 5.203 -1.006 1
1 962 . 7 1 1 A 84 84 GLU C C 84 176.948 175.633 1.315 1
1 963 . 7 1 1 A 84 84 GLU CA C 84 56.674 54.916 1.758 1
1 964 . 7 1 1 A 84 84 GLU CB C 84 30.459 34.815 -4.356 1
1 966 . 7 1 1 A 84 84 GLU N N 84 121.479 118.210 3.269 1
1 967 . 7 1 1 A 85 85 LYS H H 85 8.381 8.722 -0.341 1
1 968 . 7 1 1 A 85 85 LYS HA H 85 4.309 4.312 -0.003 1
1 977 . 7 1 1 A 85 85 LYS C C 85 176.457 175.109 1.348 1
1 978 . 7 1 1 A 85 85 LYS CA C 85 56.272 55.425 0.847 1
1 979 . 7 1 1 A 85 85 LYS CB C 85 32.961 30.768 2.193 1
1 983 . 7 1 1 A 85 85 LYS N N 85 123.266 122.780 0.486 1
1 984 . 7 1 1 A 86 86 LYS H H 86 8.403 8.058 0.345 1
1 985 . 7 1 1 A 86 86 LYS HA H 86 4.308 4.193 0.115 1
1 994 . 7 1 1 A 86 86 LYS C C 86 176.435 176.836 -0.401 1
1 995 . 7 1 1 A 86 86 LYS CA C 86 56.272 57.061 -0.789 1
1 996 . 7 1 1 A 86 86 LYS CB C 86 32.961 33.071 -0.110 1
1 1000 . 7 1 1 A 86 86 LYS N N 86 123.688 126.452 -2.764 1
1 1001 . 7 1 1 A 87 87 GLU H H 87 8.540 8.564 -0.024 1
1 1002 . 7 1 1 A 87 87 GLU HA H 87 4.358 4.270 0.088 1
1 1007 . 7 1 1 A 87 87 GLU C C 87 176.556 177.028 -0.472 1
1 1008 . 7 1 1 A 87 87 GLU CA C 87 56.406 57.006 -0.600 1
1 1009 . 7 1 1 A 87 87 GLU CB C 87 30.607 30.238 0.369 1
1 1011 . 7 1 1 A 87 87 GLU N N 87 122.633 122.656 -0.023 1
1 1012 . 7 1 1 A 88 88 SER H H 88 8.520 8.556 -0.036 1
1 1013 . 7 1 1 A 88 88 SER HA H 88 4.490 4.316 0.174 1
1 1016 . 7 1 1 A 88 88 SER C C 88 175.780 175.126 0.654 1
1 1017 . 7 1 1 A 88 88 SER CA C 88 58.431 59.057 -0.626 1
1 1018 . 7 1 1 A 88 88 SER CB C 88 63.858 63.708 0.150 1
1 1019 . 7 1 1 A 88 88 SER N N 88 118.333 117.598 0.735 1
1 1020 . 7 1 1 A 89 89 LYS H H 89 8.339 8.501 -0.162 1
1 1021 . 7 1 1 A 89 89 LYS HA H 89 4.620 4.441 0.179 1
1 1030 . 7 1 1 A 89 89 LYS C C 89 174.160 174.655 -0.495 1
1 1031 . 7 1 1 A 89 89 LYS CA C 89 54.265 55.040 -0.775 1
1 1032 . 7 1 1 A 89 89 LYS CB C 89 32.672 31.519 1.153 1
1 1036 . 7 1 1 A 89 89 LYS N N 89 124.433 123.192 1.241 1
1 1037 . 7 1 1 A 90 90 PRO HA H 90 4.417 4.728 -0.311 1
1 1044 . 7 1 1 A 90 90 PRO CA C 90 63.064 62.981 0.083 1
1 1045 . 7 1 1 A 90 90 PRO CB C 90 32.266 33.059 -0.793 1
1 1048 . 7 1 1 A 91 91 ARG H H 91 8.502 8.710 -0.208 1
1 1049 . 7 1 1 A 91 91 ARG HA H 91 4.305 4.481 -0.176 1
1 1056 . 7 1 1 A 91 91 ARG C C 91 176.831 176.381 0.450 1
1 1057 . 7 1 1 A 91 91 ARG CA C 91 56.002 55.510 0.492 1
1 1058 . 7 1 1 A 91 91 ARG CB C 91 30.913 32.031 -1.118 1
1 1061 . 7 1 1 A 91 91 ARG N N 91 122.193 121.117 1.076 1
1 1062 . 7 1 1 A 92 92 LYS H H 92 8.415 7.254 1.161 1
1 1063 . 7 1 1 A 92 92 LYS HA H 92 4.610 4.424 0.186 1
1 1072 . 7 1 1 A 92 92 LYS C C 92 176.262 174.582 1.680 1
1 1073 . 7 1 1 A 92 92 LYS CA C 92 54.258 54.898 -0.640 1
1 1074 . 7 1 1 A 92 92 LYS CB C 92 32.672 31.955 0.717 1
1 1078 . 7 1 1 A 92 92 LYS N N 92 124.243 119.899 4.344 1
1 1079 . 7 1 1 A 93 93 PRO HA H 93 4.415 4.606 -0.191 1
1 1086 . 7 1 1 A 93 93 PRO CA C 93 62.899 62.861 0.038 1
1 1087 . 7 1 1 A 93 93 PRO CB C 93 32.323 32.250 0.073 1
1 1090 . 7 1 1 A 94 94 LYS H H 94 8.420 8.829 -0.409 1
1 1091 . 7 1 1 A 94 94 LYS HA H 94 4.290 4.138 0.152 1
1 1100 . 7 1 1 A 94 94 LYS C C 94 176.714 177.695 -0.981 1
1 1101 . 7 1 1 A 94 94 LYS CA C 94 56.585 59.555 -2.970 1
1 1102 . 7 1 1 A 94 94 LYS CB C 94 33.161 32.615 0.546 1
1 1106 . 7 1 1 A 94 94 LYS N N 94 122.121 122.304 -0.183 1
1 1107 . 7 1 1 A 95 95 ALA H H 95 8.348 7.626 0.722 1
1 1108 . 7 1 1 A 95 95 ALA HA H 95 4.250 4.381 -0.131 1
1 1112 . 7 1 1 A 95 95 ALA C C 95 176.453 177.324 -0.871 1
1 1113 . 7 1 1 A 95 95 ALA CA C 95 52.471 52.186 0.285 1
1 1114 . 7 1 1 A 95 95 ALA CB C 95 19.347 19.559 -0.212 1
1 1115 . 7 1 1 A 95 95 ALA N N 95 125.624 120.810 4.814 1
1 1116 . 7 1 1 A 96 96 ALA H H 96 8.348 8.942 -0.594 1
1 1117 . 7 1 1 A 96 96 ALA HA H 96 4.254 4.315 -0.061 1
1 1121 . 7 1 1 A 96 96 ALA C C 96 176.462 177.616 -1.154 1
1 1122 . 7 1 1 A 96 96 ALA CA C 96 52.471 51.278 1.193 1
1 1123 . 7 1 1 A 96 96 ALA CB C 96 19.347 17.251 2.096 1
1 1124 . 7 1 1 A 96 96 ALA N N 96 125.624 122.271 3.353 1
1 1125 . 7 1 1 A 97 97 GLN H H 97 8.333 8.278 0.055 1
1 1126 . 7 1 1 A 97 97 GLN HA H 97 4.362 4.279 0.083 1
1 1133 . 7 1 1 A 97 97 GLN C C 97 177.684 175.889 1.795 1
1 1134 . 7 1 1 A 97 97 GLN CA C 97 55.848 57.539 -1.691 1
1 1135 . 7 1 1 A 97 97 GLN CB C 97 29.643 29.444 0.199 1
1 1137 . 7 1 1 A 97 97 GLN N N 97 120.049 122.253 -2.204 1
1 1139 . 7 1 1 A 98 98 VAL H H 98 8.230 8.017 0.213 1
1 1140 . 7 1 1 A 98 98 VAL HA H 98 4.145 3.776 0.369 1
1 1148 . 7 1 1 A 98 98 VAL C C 98 176.033 175.970 0.063 1
1 1149 . 7 1 1 A 98 98 VAL CA C 98 62.444 63.218 -0.774 1
1 1150 . 7 1 1 A 98 98 VAL CB C 98 32.942 29.498 3.444 1
1 1153 . 7 1 1 A 98 98 VAL N N 98 121.607 119.806 1.801 1
1 1154 . 7 1 1 A 99 99 SER H H 99 8.375 8.067 0.308 1
1 1155 . 7 1 1 A 99 99 SER HA H 99 4.473 4.596 -0.123 1
1 1158 . 7 1 1 A 99 99 SER C C 99 176.204 173.075 3.129 1
1 1159 . 7 1 1 A 99 99 SER CA C 99 58.379 58.604 -0.225 1
1 1160 . 7 1 1 A 99 99 SER CB C 99 63.914 63.041 0.873 1
1 1161 . 7 1 1 A 99 99 SER N N 99 119.455 116.338 3.117 1
1 1162 . 7 1 1 A 100 100 GLU H H 100 8.547 7.538 1.009 1
1 1163 . 7 1 1 A 100 100 GLU HA H 100 4.304 4.809 -0.505 1
1 1168 . 7 1 1 A 100 100 GLU C C 100 174.620 176.429 -1.809 1
1 1169 . 7 1 1 A 100 100 GLU CA C 100 56.835 54.415 2.420 1
1 1170 . 7 1 1 A 100 100 GLU CB C 100 30.365 32.925 -2.560 1
1 1172 . 7 1 1 A 100 100 GLU N N 100 123.419 118.603 4.816 1
1 1173 . 7 1 1 A 101 101 GLU H H 101 8.432 8.748 -0.316 1
1 1174 . 7 1 1 A 101 101 GLU HA H 101 4.252 4.220 0.032 1
1 1179 . 7 1 1 A 101 101 GLU C C 101 176.693 176.315 0.378 1
1 1180 . 7 1 1 A 101 101 GLU CA C 101 56.835 57.961 -1.126 1
1 1181 . 7 1 1 A 101 101 GLU CB C 101 30.365 29.829 0.536 1
1 1183 . 7 1 1 A 101 101 GLU N N 101 122.025 121.160 0.865 1
1 1184 . 7 1 1 A 102 102 ALA H H 102 8.324 7.453 0.871 1
1 1185 . 7 1 1 A 102 102 ALA HA H 102 4.361 4.576 -0.215 1
1 1189 . 7 1 1 A 102 102 ALA C C 102 177.065 176.585 0.480 1
1 1190 . 7 1 1 A 102 102 ALA CA C 102 52.647 51.007 1.640 1
1 1191 . 7 1 1 A 102 102 ALA CB C 102 19.227 22.780 -3.553 1
1 1192 . 7 1 1 A 102 102 ALA N N 102 125.114 119.834 5.280 1
1 1193 . 7 1 1 A 103 103 SER H H 103 8.259 8.967 -0.708 1
1 1194 . 7 1 1 A 103 103 SER HA H 103 4.473 4.697 -0.224 1
1 1197 . 7 1 1 A 103 103 SER C C 103 177.772 174.618 3.154 1
1 1198 . 7 1 1 A 103 103 SER CA C 103 58.301 57.945 0.356 1
1 1199 . 7 1 1 A 103 103 SER CB C 103 63.961 62.868 1.093 1
1 1200 . 7 1 1 A 103 103 SER N N 103 115.109 113.940 1.169 1
1 1201 . 7 1 1 A 104 104 THR H H 104 8.127 8.148 -0.021 1
1 1202 . 7 1 1 A 104 104 THR HA H 104 4.600 4.158 0.442 1
1 1207 . 7 1 1 A 104 104 THR C C 104 174.427 175.117 -0.690 1
1 1208 . 7 1 1 A 104 104 THR CA C 104 59.954 66.628 -6.674 1
1 1209 . 7 1 1 A 104 104 THR CB C 104 69.868 67.822 2.046 1
1 1211 . 7 1 1 A 104 104 THR N N 104 117.882 114.651 3.231 1
1 1212 . 7 1 1 A 105 105 PRO HA H 105 4.414 4.763 -0.349 1
1 1219 . 7 1 1 A 105 105 PRO CA C 105 63.300 62.777 0.523 1
1 1220 . 7 1 1 A 105 105 PRO CB C 105 32.227 32.431 -0.204 1
1 1223 . 7 1 1 A 106 106 GLN H H 106 8.524 8.438 0.086 1
1 1224 . 7 1 1 A 106 106 GLN HA H 106 4.276 5.035 -0.759 1
1 1229 . 7 1 1 A 106 106 GLN C C 106 177.083 174.774 2.309 1
1 1230 . 7 1 1 A 106 106 GLN CA C 106 56.209 54.411 1.798 1
1 1231 . 7 1 1 A 106 106 GLN CB C 106 29.490 33.313 -3.823 1
1 1233 . 7 1 1 A 106 106 GLN N N 106 120.754 121.093 -0.339 1
1 1234 . 7 1 1 A 107 107 GLY H H 107 8.394 8.347 0.047 1
1 1235 . 7 1 1 A 107 107 GLY HA2 H 107 3.895 4.026 -0.131 1
1 1236 . 7 1 1 A 107 107 GLY HA3 H 107 3.895 4.146 -0.251 1
1 1237 . 7 1 1 A 107 107 GLY C C 107 176.651 171.747 4.904 1
1 1238 . 7 1 1 A 107 107 GLY CA C 107 45.330 45.628 -0.298 1
1 1239 . 7 1 1 A 107 107 GLY N N 107 110.026 108.690 1.336 1
1 1240 . 7 1 1 A 108 108 PHE H H 108 8.099 8.425 -0.326 1
1 1241 . 7 1 1 A 108 108 PHE HA H 108 4.582 4.581 0.001 1
1 1245 . 7 1 1 A 108 108 PHE C C 108 173.944 175.692 -1.748 1
1 1246 . 7 1 1 A 108 108 PHE CA C 108 58.054 58.118 -0.064 1
1 1247 . 7 1 1 A 108 108 PHE CB C 108 39.708 39.837 -0.129 1
1 1248 . 7 1 1 A 108 108 PHE N N 108 120.180 121.339 -1.159 1
1 1249 . 7 1 1 A 109 109 ASN H H 109 8.482 8.883 -0.401 1
1 1250 . 7 1 1 A 109 109 ASN HA H 109 4.691 5.235 -0.544 1
1 1255 . 7 1 1 A 109 109 ASN C C 109 175.627 175.669 -0.042 1
1 1256 . 7 1 1 A 109 109 ASN CA C 109 53.402 52.536 0.866 1
1 1257 . 7 1 1 A 109 109 ASN CB C 109 38.883 41.865 -2.982 1
1 1258 . 7 1 1 A 109 109 ASN N N 109 120.752 119.262 1.490 1
1 1260 . 7 1 1 A 110 110 THR H H 110 8.112 8.709 -0.597 1
1 1261 . 7 1 1 A 110 110 THR HA H 110 4.251 3.962 0.289 1
1 1266 . 7 1 1 A 110 110 THR C C 110 175.275 176.663 -1.388 1
1 1267 . 7 1 1 A 110 110 THR CA C 110 62.460 66.361 -3.901 1
1 1268 . 7 1 1 A 110 110 THR CB C 110 69.726 68.397 1.329 1
1 1270 . 7 1 1 A 110 110 THR N N 110 114.601 118.435 -3.834 1
1 1271 . 7 1 1 A 111 111 LEU H H 111 8.168 8.422 -0.254 1
1 1272 . 7 1 1 A 111 111 LEU HA H 111 4.308 4.088 0.220 1
1 1282 . 7 1 1 A 111 111 LEU CA C 111 55.704 58.255 -2.551 1
1 1283 . 7 1 1 A 111 111 LEU CB C 111 42.071 41.721 0.350 1
1 1287 . 7 1 1 A 111 111 LEU N N 111 123.756 123.883 -0.127 1
1 1288 . 7 1 1 A 112 112 LYS H H 112 8.123 8.189 -0.066 1
1 1289 . 7 1 1 A 112 112 LYS HA H 112 4.242 4.046 0.196 1
1 1298 . 7 1 1 A 112 112 LYS C C 112 177.547 179.142 -1.595 1
1 1299 . 7 1 1 A 112 112 LYS CA C 112 56.928 59.726 -2.798 1
1 1300 . 7 1 1 A 112 112 LYS CB C 112 33.055 32.147 0.908 1
1 1304 . 7 1 1 A 112 112 LYS N N 112 121.442 118.754 2.688 1
1 1305 . 7 1 1 A 113 113 ASP H H 113 8.230 7.721 0.509 1
1 1306 . 7 1 1 A 113 113 ASP HA H 113 4.526 4.468 0.058 1
1 1309 . 7 1 1 A 113 113 ASP C C 113 176.532 176.919 -0.387 1
1 1310 . 7 1 1 A 113 113 ASP CA C 113 54.896 56.222 -1.326 1
1 1311 . 7 1 1 A 113 113 ASP CB C 113 41.362 40.531 0.831 1
1 1312 . 7 1 1 A 113 113 ASP N N 113 120.598 119.359 1.239 1
1 1313 . 7 1 1 A 114 114 LYS H H 114 8.127 7.861 0.266 1
1 1314 . 7 1 1 A 114 114 LYS HA H 114 4.300 4.614 -0.314 1
1 1323 . 7 1 1 A 114 114 LYS C C 114 176.303 176.629 -0.326 1
1 1324 . 7 1 1 A 114 114 LYS CA C 114 56.633 56.363 0.270 1
1 1325 . 7 1 1 A 114 114 LYS CB C 114 32.818 34.331 -1.513 1
1 1329 . 7 1 1 A 114 114 LYS N N 114 120.897 113.134 7.763 1
1 1330 . 7 1 1 A 115 115 LEU H H 115 8.244 7.673 0.571 1
1 1331 . 7 1 1 A 115 115 LEU HA H 115 4.254 4.348 -0.094 1
1 1341 . 7 1 1 A 115 115 LEU C C 115 176.909 176.719 0.190 1
1 1342 . 7 1 1 A 115 115 LEU CA C 115 56.282 53.969 2.313 1
1 1343 . 7 1 1 A 115 115 LEU CB C 115 42.188 43.874 -1.686 1
1 1347 . 7 1 1 A 115 115 LEU N N 115 123.251 119.122 4.129 1
1 1348 . 7 1 1 A 116 116 GLU H H 116 8.421 8.918 -0.497 1
1 1349 . 7 1 1 A 116 116 GLU HA H 116 4.190 4.166 0.024 1
1 1352 . 7 1 1 A 116 116 GLU C C 116 177.828 176.620 1.208 1
1 1353 . 7 1 1 A 116 116 GLU CA C 116 57.466 56.065 1.401 1
1 1354 . 7 1 1 A 116 116 GLU CB C 116 30.124 30.321 -0.197 1
1 1355 . 7 1 1 A 116 116 GLU N N 116 120.575 117.876 2.699 1
1 1356 . 7 1 1 A 117 117 GLU H H 117 8.255 8.039 0.216 1
1 1357 . 7 1 1 A 117 117 GLU HA H 117 4.192 4.004 0.188 1
1 1362 . 7 1 1 A 117 117 GLU CA C 117 57.491 58.848 -1.357 1
1 1363 . 7 1 1 A 117 117 GLU CB C 117 30.365 29.467 0.898 1
1 1365 . 7 1 1 A 117 117 GLU N N 117 120.933 119.775 1.158 1
1 1366 . 7 1 1 A 118 118 TRP H H 118 8.143 7.867 0.276 1
1 1367 . 7 1 1 A 118 118 TRP HA H 118 4.581 4.570 0.011 1
1 1372 . 7 1 1 A 118 118 TRP C C 118 176.794 177.884 -1.090 1
1 1373 . 7 1 1 A 118 118 TRP CA C 118 58.363 59.431 -1.068 1
1 1374 . 7 1 1 A 118 118 TRP CB C 118 29.333 27.928 1.405 1
1 1375 . 7 1 1 A 118 118 TRP N N 118 121.592 120.044 1.548 1
1 1376 . 7 1 1 A 119 119 ILE H H 119 7.908 7.220 0.688 1
1 1377 . 7 1 1 A 119 119 ILE HA H 119 3.828 3.951 -0.123 1
1 1387 . 7 1 1 A 119 119 ILE C C 119 176.984 176.139 0.845 1
1 1388 . 7 1 1 A 119 119 ILE CA C 119 62.335 63.315 -0.980 1
1 1389 . 7 1 1 A 119 119 ILE CB C 119 38.649 37.275 1.374 1
1 1393 . 7 1 1 A 119 119 ILE N N 119 122.744 117.705 5.039 1
1 1394 . 7 1 1 A 120 120 GLU H H 120 8.143 7.496 0.647 1
1 1395 . 7 1 1 A 120 120 GLU HA H 120 4.093 4.035 0.058 1
1 1400 . 7 1 1 A 120 120 GLU C C 120 176.565 177.759 -1.194 1
1 1401 . 7 1 1 A 120 120 GLU CA C 120 57.613 57.365 0.248 1
1 1402 . 7 1 1 A 120 120 GLU CB C 120 29.834 31.114 -1.280 1
1 1404 . 7 1 1 A 120 120 GLU N N 120 123.139 123.677 -0.538 1
1 1405 . 7 1 1 A 121 121 MET H H 121 8.254 8.738 -0.484 1
1 1406 . 7 1 1 A 121 121 MET HA H 121 4.357 4.144 0.213 1
1 1411 . 7 1 1 A 121 121 MET CA C 121 56.625 58.187 -1.562 1
1 1412 . 7 1 1 A 121 121 MET CB C 121 32.664 32.182 0.482 1
1 1414 . 7 1 1 A 121 121 MET N N 121 120.449 125.650 -5.201 1
1 1415 . 7 1 1 A 122 122 SER H H 122 8.199 8.208 -0.009 1
1 1416 . 7 1 1 A 122 122 SER HA H 122 4.280 4.329 -0.049 1
1 1419 . 7 1 1 A 122 122 SER C C 122 177.224 175.321 1.903 1
1 1420 . 7 1 1 A 122 122 SER CA C 122 59.635 61.608 -1.973 1
1 1421 . 7 1 1 A 122 122 SER CB C 122 63.560 63.016 0.544 1
1 1422 . 7 1 1 A 122 122 SER N N 122 115.857 117.141 -1.284 1
1 1423 . 7 1 1 A 123 123 ASN H H 123 8.211 8.229 -0.018 1
1 1424 . 7 1 1 A 123 123 ASN HA H 123 4.737 5.093 -0.356 1
1 1429 . 7 1 1 A 123 123 ASN C C 123 174.709 177.102 -2.393 1
1 1430 . 7 1 1 A 123 123 ASN CA C 123 53.507 54.179 -0.672 1
1 1431 . 7 1 1 A 123 123 ASN CB C 123 38.800 40.640 -1.840 1
1 1432 . 7 1 1 A 123 123 ASN N N 123 119.923 119.047 0.876 1
1 1434 . 7 1 1 A 124 124 ARG H H 124 7.997 8.466 -0.469 1
1 1435 . 7 1 1 A 124 124 ARG HA H 124 4.305 4.043 0.262 1
1 1442 . 7 1 1 A 124 124 ARG C C 124 175.477 178.777 -3.300 1
1 1443 . 7 1 1 A 124 124 ARG CA C 124 56.709 59.062 -2.353 1
1 1444 . 7 1 1 A 124 124 ARG CB C 124 30.584 29.973 0.611 1
1 1447 . 7 1 1 A 124 124 ARG N N 124 120.821 119.705 1.116 1
1 1448 . 7 1 1 A 125 125 LYS H H 125 8.327 8.106 0.221 1
1 1449 . 7 1 1 A 125 125 LYS HA H 125 4.254 4.136 0.118 1
1 1458 . 7 1 1 A 125 125 LYS C C 125 176.777 178.319 -1.542 1
1 1459 . 7 1 1 A 125 125 LYS CA C 125 56.860 58.861 -2.001 1
1 1460 . 7 1 1 A 125 125 LYS CB C 125 32.879 31.749 1.130 1
1 1464 . 7 1 1 A 125 125 LYS N N 125 121.891 117.102 4.789 1
1 1465 . 7 1 1 A 126 126 ASP H H 126 8.343 8.146 0.197 1
1 1466 . 7 1 1 A 126 126 ASP HA H 126 4.581 4.452 0.129 1
1 1469 . 7 1 1 A 126 126 ASP C C 126 176.538 175.991 0.547 1
1 1470 . 7 1 1 A 126 126 ASP CA C 126 54.540 56.279 -1.739 1
1 1471 . 7 1 1 A 126 126 ASP CB C 126 40.907 41.334 -0.427 1
1 1472 . 7 1 1 A 126 126 ASP N N 126 119.814 120.663 -0.849 1
1 1473 . 7 1 1 A 127 127 LEU H H 127 7.946 7.624 0.322 1
1 1474 . 7 1 1 A 127 127 LEU HA H 127 4.309 4.278 0.031 1
1 1484 . 7 1 1 A 127 127 LEU C C 127 176.043 175.981 0.062 1
1 1485 . 7 1 1 A 127 127 LEU CA C 127 55.427 54.739 0.688 1
1 1486 . 7 1 1 A 127 127 LEU CB C 127 42.394 43.051 -0.657 1
1 1490 . 7 1 1 A 127 127 LEU N N 127 121.432 117.122 4.310 1
1 1491 . 7 1 1 A 128 128 ILE H H 128 7.967 8.501 -0.534 1
1 1492 . 7 1 1 A 128 128 ILE HA H 128 4.141 4.901 -0.760 1
1 1502 . 7 1 1 A 128 128 ILE C C 128 177.200 173.580 3.620 1
1 1503 . 7 1 1 A 128 128 ILE CA C 128 61.150 58.993 2.157 1
1 1504 . 7 1 1 A 128 128 ILE CB C 128 38.489 41.761 -3.272 1
1 1508 . 7 1 1 A 128 128 ILE N N 128 121.579 120.048 1.531 1
1 1509 . 7 1 1 A 129 129 LYS H H 129 8.331 8.859 -0.528 1
1 1510 . 7 1 1 A 129 129 LYS HA H 129 4.328 5.034 -0.706 1
1 1519 . 7 1 1 A 129 129 LYS C C 129 175.952 175.118 0.834 1
1 1520 . 7 1 1 A 129 129 LYS CA C 129 56.330 54.337 1.993 1
1 1521 . 7 1 1 A 129 129 LYS CB C 129 33.010 35.952 -2.942 1
1 1525 . 7 1 1 A 129 129 LYS N N 129 126.955 125.090 1.865 1
1 1 . 8 1 1 A 2 2 ALA HA H 2 4.070 4.693 -0.623 1
1 5 . 8 1 1 A 2 2 ALA CA C 2 52.067 51.200 0.867 1
1 6 . 8 1 1 A 2 2 ALA CB C 2 19.577 20.234 -0.657 1
1 7 . 8 1 1 A 3 3 ALA H H 3 8.714 7.352 1.362 1
1 8 . 8 1 1 A 3 3 ALA HA H 3 4.253 4.457 -0.204 1
1 12 . 8 1 1 A 3 3 ALA C C 3 173.672 177.171 -3.499 1
1 13 . 8 1 1 A 3 3 ALA CA C 3 52.067 50.934 1.133 1
1 14 . 8 1 1 A 3 3 ALA CB C 3 19.577 22.149 -2.572 1
1 15 . 8 1 1 A 3 3 ALA N N 3 124.480 118.392 6.088 1
1 16 . 8 1 1 A 4 4 LYS H H 4 8.227 8.465 -0.238 1
1 17 . 8 1 1 A 4 4 LYS HA H 4 3.976 3.968 0.008 1
1 26 . 8 1 1 A 4 4 LYS C C 4 176.672 175.696 0.976 1
1 27 . 8 1 1 A 4 4 LYS CA C 4 57.274 57.945 -0.671 1
1 28 . 8 1 1 A 4 4 LYS CB C 4 33.209 32.249 0.960 1
1 32 . 8 1 1 A 4 4 LYS N N 4 120.988 119.243 1.745 1
1 33 . 8 1 1 A 5 5 PHE H H 5 7.719 7.667 0.052 1
1 34 . 8 1 1 A 5 5 PHE HA H 5 4.384 5.247 -0.863 1
1 38 . 8 1 1 A 5 5 PHE C C 5 175.364 174.046 1.318 1
1 39 . 8 1 1 A 5 5 PHE CA C 5 57.074 56.160 0.914 1
1 40 . 8 1 1 A 5 5 PHE CB C 5 39.669 43.773 -4.104 1
1 41 . 8 1 1 A 5 5 PHE N N 5 119.246 116.859 2.387 1
1 42 . 8 1 1 A 6 6 GLU H H 6 8.515 8.967 -0.452 1
1 43 . 8 1 1 A 6 6 GLU HA H 6 4.370 4.856 -0.486 1
1 48 . 8 1 1 A 6 6 GLU CA C 6 55.669 55.323 0.346 1
1 49 . 8 1 1 A 6 6 GLU CB C 6 32.094 34.011 -1.917 1
1 51 . 8 1 1 A 6 6 GLU N N 6 122.193 121.002 1.191 1
1 52 . 8 1 1 A 7 7 VAL H H 7 8.636 8.443 0.193 1
1 53 . 8 1 1 A 7 7 VAL HA H 7 3.406 3.899 -0.493 1
1 61 . 8 1 1 A 7 7 VAL C C 7 176.611 176.330 0.281 1
1 62 . 8 1 1 A 7 7 VAL CA C 7 65.358 63.338 2.020 1
1 63 . 8 1 1 A 7 7 VAL CB C 7 31.391 31.357 0.034 1
1 66 . 8 1 1 A 7 7 VAL N N 7 122.949 123.317 -0.368 1
1 67 . 8 1 1 A 8 8 GLY H H 8 9.394 9.160 0.234 1
1 68 . 8 1 1 A 8 8 GLY HA2 H 8 3.600 4.041 -0.441 1
1 69 . 8 1 1 A 8 8 GLY HA3 H 8 4.546 4.042 0.504 1
1 70 . 8 1 1 A 8 8 GLY C C 8 178.074 174.410 3.664 1
1 71 . 8 1 1 A 8 8 GLY CA C 8 45.121 44.858 0.263 1
1 72 . 8 1 1 A 8 8 GLY N N 8 116.837 115.269 1.568 1
1 73 . 8 1 1 A 9 9 SER H H 9 8.021 8.035 -0.014 1
1 74 . 8 1 1 A 9 9 SER HA H 9 4.680 4.476 0.204 1
1 77 . 8 1 1 A 9 9 SER C C 9 174.234 173.051 1.183 1
1 78 . 8 1 1 A 9 9 SER CA C 9 59.387 59.480 -0.093 1
1 79 . 8 1 1 A 9 9 SER CB C 9 65.584 64.649 0.935 1
1 80 . 8 1 1 A 9 9 SER N N 9 118.208 117.884 0.324 1
1 81 . 8 1 1 A 10 10 VAL H H 10 7.945 8.258 -0.313 1
1 82 . 8 1 1 A 10 10 VAL HA H 10 4.980 5.144 -0.164 1
1 90 . 8 1 1 A 10 10 VAL C C 10 171.388 174.345 -2.957 1
1 91 . 8 1 1 A 10 10 VAL CA C 10 61.021 61.120 -0.099 1
1 92 . 8 1 1 A 10 10 VAL CB C 10 33.400 34.941 -1.541 1
1 95 . 8 1 1 A 10 10 VAL N N 10 121.118 122.486 -1.368 1
1 96 . 8 1 1 A 11 11 TYR H H 11 9.008 9.145 -0.137 1
1 97 . 8 1 1 A 11 11 TYR HA H 11 4.850 5.304 -0.454 1
1 101 . 8 1 1 A 11 11 TYR C C 11 174.926 174.658 0.268 1
1 102 . 8 1 1 A 11 11 TYR CA C 11 56.803 56.171 0.632 1
1 103 . 8 1 1 A 11 11 TYR CB C 11 43.676 43.527 0.149 1
1 104 . 8 1 1 A 11 11 TYR N N 11 125.043 125.414 -0.371 1
1 105 . 8 1 1 A 12 12 THR H H 12 8.809 8.641 0.168 1
1 106 . 8 1 1 A 12 12 THR HA H 12 5.020 5.424 -0.404 1
1 111 . 8 1 1 A 12 12 THR C C 12 174.195 174.680 -0.485 1
1 112 . 8 1 1 A 12 12 THR CA C 12 62.487 60.157 2.330 1
1 113 . 8 1 1 A 12 12 THR CB C 12 69.743 71.690 -1.947 1
1 115 . 8 1 1 A 12 12 THR N N 12 116.850 115.246 1.604 1
1 116 . 8 1 1 A 13 13 GLY H H 13 9.179 8.760 0.419 1
1 117 . 8 1 1 A 13 13 GLY HA2 H 13 3.250 4.375 -1.125 1
1 118 . 8 1 1 A 13 13 GLY HA3 H 13 4.801 4.388 0.413 1
1 119 . 8 1 1 A 13 13 GLY C C 13 174.654 171.950 2.704 1
1 120 . 8 1 1 A 13 13 GLY CA C 13 44.377 45.467 -1.090 1
1 121 . 8 1 1 A 13 13 GLY N N 13 113.654 111.933 1.721 1
1 122 . 8 1 1 A 14 14 LYS H H 14 7.770 8.682 -0.912 1
1 123 . 8 1 1 A 14 14 LYS HA H 14 5.426 5.098 0.328 1
1 132 . 8 1 1 A 14 14 LYS C C 14 171.343 175.765 -4.422 1
1 133 . 8 1 1 A 14 14 LYS CA C 14 53.879 54.607 -0.728 1
1 134 . 8 1 1 A 14 14 LYS CB C 14 36.032 35.567 0.465 1
1 138 . 8 1 1 A 14 14 LYS N N 14 118.322 120.501 -2.179 1
1 139 . 8 1 1 A 15 15 VAL H H 15 9.206 9.270 -0.064 1
1 140 . 8 1 1 A 15 15 VAL HA H 15 4.400 4.248 0.152 1
1 148 . 8 1 1 A 15 15 VAL C C 15 176.306 177.052 -0.746 1
1 149 . 8 1 1 A 15 15 VAL CA C 15 63.648 63.342 0.306 1
1 150 . 8 1 1 A 15 15 VAL CB C 15 31.769 31.418 0.351 1
1 153 . 8 1 1 A 15 15 VAL N N 15 125.308 123.665 1.643 1
1 154 . 8 1 1 A 16 16 THR H H 16 9.403 9.296 0.107 1
1 155 . 8 1 1 A 16 16 THR HA H 16 4.562 4.722 -0.160 1
1 160 . 8 1 1 A 16 16 THR C C 16 178.098 174.493 3.605 1
1 161 . 8 1 1 A 16 16 THR CA C 16 62.018 61.402 0.616 1
1 162 . 8 1 1 A 16 16 THR CB C 16 69.720 69.914 -0.194 1
1 164 . 8 1 1 A 16 16 THR N N 16 121.753 117.561 4.192 1
1 165 . 8 1 1 A 17 17 GLY H H 17 7.600 7.133 0.467 1
1 166 . 8 1 1 A 17 17 GLY HA2 H 17 4.110 4.106 0.004 1
1 167 . 8 1 1 A 17 17 GLY HA3 H 17 4.250 4.195 0.055 1
1 168 . 8 1 1 A 17 17 GLY C C 17 175.551 171.330 4.221 1
1 169 . 8 1 1 A 17 17 GLY CA C 17 46.258 45.542 0.716 1
1 170 . 8 1 1 A 17 17 GLY N N 17 109.407 108.805 0.602 1
1 171 . 8 1 1 A 18 18 LEU H H 18 8.820 8.469 0.351 1
1 172 . 8 1 1 A 18 18 LEU HA H 18 4.852 5.068 -0.216 1
1 182 . 8 1 1 A 18 18 LEU CA C 18 54.245 53.279 0.966 1
1 183 . 8 1 1 A 18 18 LEU CB C 18 44.906 46.388 -1.482 1
1 187 . 8 1 1 A 18 18 LEU N N 18 123.419 121.052 2.367 1
1 188 . 8 1 1 A 19 19 GLN H H 19 8.537 8.379 0.158 1
1 189 . 8 1 1 A 19 19 GLN HA H 19 4.520 4.665 -0.145 1
1 196 . 8 1 1 A 19 19 GLN C C 19 175.258 175.566 -0.308 1
1 197 . 8 1 1 A 19 19 GLN CA C 19 53.269 53.831 -0.562 1
1 198 . 8 1 1 A 19 19 GLN CB C 19 31.522 32.380 -0.858 1
1 200 . 8 1 1 A 19 19 GLN N N 19 120.187 121.548 -1.361 1
1 202 . 8 1 1 A 20 20 ALA H H 20 8.798 8.675 0.123 1
1 203 . 8 1 1 A 20 20 ALA HA H 20 4.010 4.085 -0.075 1
1 207 . 8 1 1 A 20 20 ALA C C 20 175.698 177.230 -1.532 1
1 208 . 8 1 1 A 20 20 ALA CA C 20 55.084 53.820 1.264 1
1 209 . 8 1 1 A 20 20 ALA CB C 20 18.277 18.403 -0.126 1
1 210 . 8 1 1 A 20 20 ALA N N 20 120.606 124.154 -3.548 1
1 211 . 8 1 1 A 21 21 TYR H H 21 6.618 7.475 -0.857 1
1 212 . 8 1 1 A 21 21 TYR HA H 21 4.540 4.805 -0.265 1
1 216 . 8 1 1 A 21 21 TYR C C 21 178.437 175.073 3.364 1
1 217 . 8 1 1 A 21 21 TYR CA C 21 55.120 56.838 -1.718 1
1 218 . 8 1 1 A 21 21 TYR CB C 21 37.891 40.190 -2.299 1
1 219 . 8 1 1 A 21 21 TYR N N 21 105.570 113.871 -8.301 1
1 220 . 8 1 1 A 22 22 GLY H H 22 7.203 7.067 0.136 1
1 221 . 8 1 1 A 22 22 GLY HA2 H 22 3.460 3.793 -0.333 1
1 222 . 8 1 1 A 22 22 GLY HA3 H 22 4.360 3.937 0.423 1
1 223 . 8 1 1 A 22 22 GLY C C 22 175.833 171.311 4.522 1
1 224 . 8 1 1 A 22 22 GLY CA C 22 46.356 45.347 1.009 1
1 225 . 8 1 1 A 22 22 GLY N N 22 109.854 108.342 1.512 1
1 226 . 8 1 1 A 23 23 ALA H H 23 8.549 8.471 0.078 1
1 227 . 8 1 1 A 23 23 ALA HA H 23 4.981 5.213 -0.232 1
1 231 . 8 1 1 A 23 23 ALA C C 23 168.810 176.163 -7.353 1
1 232 . 8 1 1 A 23 23 ALA CA C 23 49.178 50.887 -1.709 1
1 233 . 8 1 1 A 23 23 ALA CB C 23 22.797 21.206 1.591 1
1 234 . 8 1 1 A 23 23 ALA N N 23 118.749 122.349 -3.600 1
1 235 . 8 1 1 A 24 24 PHE H H 24 8.812 8.730 0.082 1
1 236 . 8 1 1 A 24 24 PHE HA H 24 5.125 4.822 0.303 1
1 240 . 8 1 1 A 24 24 PHE CA C 24 58.017 58.286 -0.269 1
1 241 . 8 1 1 A 24 24 PHE CB C 24 40.475 40.586 -0.111 1
1 242 . 8 1 1 A 24 24 PHE N N 24 122.891 121.935 0.956 1
1 243 . 8 1 1 A 25 25 VAL H H 25 8.880 8.987 -0.107 1
1 244 . 8 1 1 A 25 25 VAL HA H 25 4.660 4.717 -0.057 1
1 252 . 8 1 1 A 25 25 VAL CA C 25 60.379 61.156 -0.777 1
1 253 . 8 1 1 A 25 25 VAL CB C 25 35.654 34.876 0.778 1
1 256 . 8 1 1 A 25 25 VAL N N 25 122.908 121.321 1.587 1
1 257 . 8 1 1 A 26 26 ALA H H 26 9.403 8.777 0.626 1
1 258 . 8 1 1 A 26 26 ALA HA H 26 4.750 4.396 0.354 1
1 262 . 8 1 1 A 26 26 ALA C C 26 174.445 176.776 -2.331 1
1 263 . 8 1 1 A 26 26 ALA CA C 26 51.711 52.712 -1.001 1
1 264 . 8 1 1 A 26 26 ALA CB C 26 19.319 19.014 0.305 1
1 265 . 8 1 1 A 26 26 ALA N N 26 129.425 130.546 -1.121 1
1 266 . 8 1 1 A 27 27 LEU H H 27 8.601 9.347 -0.746 1
1 267 . 8 1 1 A 27 27 LEU HA H 27 4.158 4.497 -0.339 1
1 277 . 8 1 1 A 27 27 LEU C C 27 177.814 176.306 1.508 1
1 278 . 8 1 1 A 27 27 LEU CA C 27 55.869 55.591 0.278 1
1 279 . 8 1 1 A 27 27 LEU CB C 27 42.251 43.218 -0.967 1
1 283 . 8 1 1 A 27 27 LEU N N 27 127.169 124.853 2.316 1
1 284 . 8 1 1 A 28 28 ASP H H 28 8.172 7.785 0.387 1
1 285 . 8 1 1 A 28 28 ASP HA H 28 4.420 5.014 -0.594 1
1 288 . 8 1 1 A 28 28 ASP C C 28 177.116 176.033 1.083 1
1 289 . 8 1 1 A 28 28 ASP CA C 28 53.755 52.975 0.780 1
1 290 . 8 1 1 A 28 28 ASP CB C 28 39.833 41.853 -2.020 1
1 291 . 8 1 1 A 28 28 ASP N N 28 115.657 119.836 -4.179 1
1 292 . 8 1 1 A 29 29 GLU H H 29 8.857 8.363 0.494 1
1 293 . 8 1 1 A 29 29 GLU HA H 29 4.090 3.942 0.148 1
1 298 . 8 1 1 A 29 29 GLU C C 29 175.965 176.443 -0.478 1
1 299 . 8 1 1 A 29 29 GLU CA C 29 59.470 58.004 1.466 1
1 300 . 8 1 1 A 29 29 GLU CB C 29 29.409 27.985 1.424 1
1 302 . 8 1 1 A 29 29 GLU N N 29 114.738 116.083 -1.345 1
1 303 . 8 1 1 A 30 30 GLU H H 30 8.326 8.402 -0.076 1
1 304 . 8 1 1 A 30 30 GLU HA H 30 4.640 4.538 0.102 1
1 309 . 8 1 1 A 30 30 GLU C C 30 176.817 175.205 1.612 1
1 310 . 8 1 1 A 30 30 GLU CA C 30 56.073 55.965 0.108 1
1 311 . 8 1 1 A 30 30 GLU CB C 30 32.453 31.253 1.200 1
1 313 . 8 1 1 A 30 30 GLU N N 30 115.753 117.446 -1.693 1
1 314 . 8 1 1 A 31 31 THR H H 31 7.819 7.647 0.172 1
1 315 . 8 1 1 A 31 31 THR HA H 31 4.484 5.074 -0.590 1
1 320 . 8 1 1 A 31 31 THR C C 31 176.330 173.073 3.257 1
1 321 . 8 1 1 A 31 31 THR CA C 31 63.398 61.115 2.283 1
1 322 . 8 1 1 A 31 31 THR CB C 31 69.367 73.150 -3.783 1
1 324 . 8 1 1 A 31 31 THR N N 31 118.750 115.229 3.521 1
1 325 . 8 1 1 A 32 32 GLN H H 32 8.913 8.774 0.139 1
1 326 . 8 1 1 A 32 32 GLN HA H 32 5.337 4.804 0.533 1
1 333 . 8 1 1 A 32 32 GLN C C 32 173.087 174.458 -1.371 1
1 334 . 8 1 1 A 32 32 GLN CA C 32 54.051 54.907 -0.856 1
1 335 . 8 1 1 A 32 32 GLN CB C 32 32.672 33.046 -0.374 1
1 337 . 8 1 1 A 32 32 GLN N N 32 127.294 124.704 2.590 1
1 339 . 8 1 1 A 33 33 GLY H H 33 8.900 8.546 0.354 1
1 340 . 8 1 1 A 33 33 GLY HA2 H 33 3.290 4.339 -1.049 1
1 341 . 8 1 1 A 33 33 GLY HA3 H 33 4.530 4.415 0.115 1
1 342 . 8 1 1 A 33 33 GLY C C 33 174.918 172.354 2.564 1
1 343 . 8 1 1 A 33 33 GLY CA C 33 44.534 44.998 -0.464 1
1 344 . 8 1 1 A 33 33 GLY N N 33 107.639 110.807 -3.168 1
1 345 . 8 1 1 A 34 34 LEU H H 34 8.127 8.517 -0.390 1
1 346 . 8 1 1 A 34 34 LEU HA H 34 4.950 4.683 0.267 1
1 356 . 8 1 1 A 34 34 LEU CA C 34 53.755 54.069 -0.314 1
1 357 . 8 1 1 A 34 34 LEU CB C 34 45.493 44.701 0.792 1
1 361 . 8 1 1 A 34 34 LEU N N 34 120.897 121.190 -0.293 1
1 362 . 8 1 1 A 35 35 VAL H H 35 9.386 8.713 0.673 1
1 363 . 8 1 1 A 35 35 VAL HA H 35 4.479 4.299 0.180 1
1 371 . 8 1 1 A 35 35 VAL C C 35 176.402 176.102 0.300 1
1 372 . 8 1 1 A 35 35 VAL CA C 35 59.594 63.121 -3.527 1
1 373 . 8 1 1 A 35 35 VAL CB C 35 32.590 31.401 1.189 1
1 376 . 8 1 1 A 35 35 VAL N N 35 128.897 127.831 1.066 1
1 377 . 8 1 1 A 36 36 HIS H H 36 9.194 8.960 0.234 1
1 378 . 8 1 1 A 36 36 HIS HA H 36 4.487 4.577 -0.090 1
1 381 . 8 1 1 A 36 36 HIS C C 36 174.864 176.591 -1.727 1
1 382 . 8 1 1 A 36 36 HIS CA C 36 59.426 56.739 2.687 1
1 383 . 8 1 1 A 36 36 HIS CB C 36 31.542 30.252 1.290 1
1 384 . 8 1 1 A 36 36 HIS N N 36 127.751 126.635 1.116 1
1 385 . 8 1 1 A 37 37 ILE H H 37 7.454 8.850 -1.396 1
1 386 . 8 1 1 A 37 37 ILE HA H 37 3.810 3.694 0.116 1
1 396 . 8 1 1 A 37 37 ILE C C 37 176.948 177.772 -0.824 1
1 397 . 8 1 1 A 37 37 ILE CA C 37 63.773 64.841 -1.068 1
1 398 . 8 1 1 A 37 37 ILE CB C 37 38.993 37.407 1.586 1
1 402 . 8 1 1 A 37 37 ILE N N 37 126.266 126.174 0.092 1
1 403 . 8 1 1 A 38 38 SER H H 38 8.343 8.112 0.231 1
1 404 . 8 1 1 A 38 38 SER HA H 38 4.370 4.192 0.178 1
1 407 . 8 1 1 A 38 38 SER C C 38 174.792 175.296 -0.504 1
1 408 . 8 1 1 A 38 38 SER CA C 38 60.567 62.020 -1.453 1
1 409 . 8 1 1 A 38 38 SER CB C 38 63.632 62.953 0.679 1
1 410 . 8 1 1 A 38 38 SER N N 38 118.079 119.247 -1.168 1
1 411 . 8 1 1 A 39 39 GLU H H 39 8.536 7.972 0.564 1
1 412 . 8 1 1 A 39 39 GLU HA H 39 4.503 4.339 0.164 1
1 417 . 8 1 1 A 39 39 GLU C C 39 175.131 178.199 -3.068 1
1 418 . 8 1 1 A 39 39 GLU CA C 39 54.928 57.067 -2.139 1
1 419 . 8 1 1 A 39 39 GLU CB C 39 29.621 29.900 -0.279 1
1 421 . 8 1 1 A 39 39 GLU N N 39 118.349 119.127 -0.778 1
1 422 . 8 1 1 A 40 40 VAL H H 40 7.776 7.618 0.158 1
1 423 . 8 1 1 A 40 40 VAL HA H 40 3.616 3.938 -0.322 1
1 431 . 8 1 1 A 40 40 VAL C C 40 177.277 176.226 1.051 1
1 432 . 8 1 1 A 40 40 VAL CA C 40 66.245 64.511 1.734 1
1 433 . 8 1 1 A 40 40 VAL CB C 40 32.590 32.209 0.381 1
1 436 . 8 1 1 A 40 40 VAL N N 40 125.443 117.491 7.952 1
1 437 . 8 1 1 A 41 41 THR H H 41 7.888 7.613 0.275 1
1 438 . 8 1 1 A 41 41 THR HA H 41 4.345 4.760 -0.415 1
1 443 . 8 1 1 A 41 41 THR C C 41 173.492 174.459 -0.967 1
1 444 . 8 1 1 A 41 41 THR CA C 41 59.047 61.417 -2.370 1
1 445 . 8 1 1 A 41 41 THR CB C 41 68.992 72.824 -3.832 1
1 447 . 8 1 1 A 41 41 THR N N 41 109.905 113.484 -3.579 1
1 448 . 8 1 1 A 42 42 HIS H H 42 8.063 8.222 -0.159 1
1 449 . 8 1 1 A 42 42 HIS HA H 42 4.510 4.578 -0.068 1
1 452 . 8 1 1 A 42 42 HIS C C 42 172.139 174.637 -2.498 1
1 453 . 8 1 1 A 42 42 HIS CA C 42 57.735 55.554 2.181 1
1 454 . 8 1 1 A 42 42 HIS CB C 42 31.144 29.686 1.458 1
1 455 . 8 1 1 A 42 42 HIS N N 42 121.760 121.022 0.738 1
1 456 . 8 1 1 A 43 43 GLY H H 43 8.286 7.306 0.980 1
1 457 . 8 1 1 A 43 43 GLY HA2 H 43 3.980 3.849 0.131 1
1 458 . 8 1 1 A 43 43 GLY HA3 H 43 3.980 3.945 0.035 1
1 459 . 8 1 1 A 43 43 GLY C C 43 176.307 171.721 4.586 1
1 460 . 8 1 1 A 43 43 GLY CA C 43 44.336 45.978 -1.642 1
1 461 . 8 1 1 A 43 43 GLY N N 43 110.133 107.799 2.334 1
1 462 . 8 1 1 A 44 44 PHE H H 44 8.327 8.550 -0.223 1
1 463 . 8 1 1 A 44 44 PHE HA H 44 4.489 4.374 0.115 1
1 467 . 8 1 1 A 44 44 PHE C C 44 171.877 175.102 -3.225 1
1 468 . 8 1 1 A 44 44 PHE CA C 44 58.027 58.688 -0.661 1
1 469 . 8 1 1 A 44 44 PHE CB C 44 39.850 39.781 0.069 1
1 470 . 8 1 1 A 44 44 PHE N N 44 120.049 121.543 -1.494 1
1 471 . 8 1 1 A 45 45 VAL H H 45 7.939 8.555 -0.616 1
1 472 . 8 1 1 A 45 45 VAL HA H 45 3.865 3.418 0.447 1
1 480 . 8 1 1 A 45 45 VAL C C 45 175.523 175.394 0.129 1
1 481 . 8 1 1 A 45 45 VAL CA C 45 61.536 60.839 0.697 1
1 482 . 8 1 1 A 45 45 VAL CB C 45 33.127 32.021 1.106 1
1 485 . 8 1 1 A 45 45 VAL N N 45 127.882 121.505 6.377 1
1 486 . 8 1 1 A 46 46 LYS H H 46 8.868 8.030 0.838 1
1 487 . 8 1 1 A 46 46 LYS HA H 46 4.170 4.119 0.051 1
1 496 . 8 1 1 A 46 46 LYS C C 46 175.728 175.993 -0.265 1
1 497 . 8 1 1 A 46 46 LYS CA C 46 57.198 58.950 -1.752 1
1 498 . 8 1 1 A 46 46 LYS CB C 46 33.299 32.210 1.089 1
1 502 . 8 1 1 A 46 46 LYS N N 46 127.308 125.693 1.615 1
1 503 . 8 1 1 A 47 47 ASP H H 47 7.652 8.063 -0.411 1
1 504 . 8 1 1 A 47 47 ASP HA H 47 4.710 4.985 -0.275 1
1 507 . 8 1 1 A 47 47 ASP C C 47 176.411 176.247 0.164 1
1 508 . 8 1 1 A 47 47 ASP CA C 47 53.390 53.865 -0.475 1
1 509 . 8 1 1 A 47 47 ASP CB C 47 42.635 43.353 -0.718 1
1 510 . 8 1 1 A 47 47 ASP N N 47 117.932 118.229 -0.297 1
1 511 . 8 1 1 A 48 48 ILE H H 48 9.230 8.706 0.524 1
1 512 . 8 1 1 A 48 48 ILE HA H 48 3.579 4.038 -0.459 1
1 522 . 8 1 1 A 48 48 ILE C C 48 177.249 177.532 -0.283 1
1 523 . 8 1 1 A 48 48 ILE CA C 48 65.525 63.482 2.043 1
1 524 . 8 1 1 A 48 48 ILE CB C 48 38.797 37.927 0.870 1
1 528 . 8 1 1 A 48 48 ILE N N 48 129.049 126.183 2.866 1
1 529 . 8 1 1 A 49 49 ASN H H 49 8.468 9.094 -0.626 1
1 530 . 8 1 1 A 49 49 ASN HA H 49 4.690 4.661 0.029 1
1 535 . 8 1 1 A 49 49 ASN C C 49 175.779 176.245 -0.466 1
1 536 . 8 1 1 A 49 49 ASN CA C 49 55.587 54.870 0.717 1
1 537 . 8 1 1 A 49 49 ASN CB C 49 38.587 36.674 1.913 1
1 538 . 8 1 1 A 49 49 ASN N N 49 118.835 117.683 1.152 1
1 540 . 8 1 1 A 50 50 GLU H H 50 7.853 7.910 -0.057 1
1 541 . 8 1 1 A 50 50 GLU HA H 50 4.040 4.142 -0.102 1
1 546 . 8 1 1 A 50 50 GLU C C 50 176.148 176.958 -0.810 1
1 547 . 8 1 1 A 50 50 GLU CA C 50 57.404 57.072 0.332 1
1 548 . 8 1 1 A 50 50 GLU CB C 50 29.491 29.506 -0.015 1
1 550 . 8 1 1 A 50 50 GLU N N 50 116.358 118.266 -1.908 1
1 551 . 8 1 1 A 51 51 HIS H H 51 7.575 7.878 -0.303 1
1 552 . 8 1 1 A 51 51 HIS HA H 51 4.431 4.725 -0.294 1
1 555 . 8 1 1 A 51 51 HIS C C 51 176.383 174.798 1.585 1
1 556 . 8 1 1 A 51 51 HIS CA C 51 57.089 56.482 0.607 1
1 557 . 8 1 1 A 51 51 HIS CB C 51 33.168 32.166 1.002 1
1 558 . 8 1 1 A 51 51 HIS N N 51 115.828 115.603 0.225 1
1 559 . 8 1 1 A 52 52 LEU H H 52 7.640 7.656 -0.016 1
1 560 . 8 1 1 A 52 52 LEU HA H 52 4.796 4.652 0.144 1
1 570 . 8 1 1 A 52 52 LEU C C 52 174.452 174.315 0.137 1
1 571 . 8 1 1 A 52 52 LEU CA C 52 53.398 53.513 -0.115 1
1 572 . 8 1 1 A 52 52 LEU CB C 52 48.805 44.184 4.621 1
1 576 . 8 1 1 A 52 52 LEU N N 52 117.932 119.440 -1.508 1
1 577 . 8 1 1 A 53 53 SER H H 53 8.151 8.723 -0.572 1
1 578 . 8 1 1 A 53 53 SER HA H 53 4.680 4.898 -0.218 1
1 581 . 8 1 1 A 53 53 SER C C 53 174.304 172.877 1.427 1
1 582 . 8 1 1 A 53 53 SER CA C 53 56.714 57.520 -0.806 1
1 583 . 8 1 1 A 53 53 SER CB C 53 65.431 66.483 -1.052 1
1 584 . 8 1 1 A 53 53 SER N N 53 113.496 116.661 -3.165 1
1 585 . 8 1 1 A 54 54 VAL H H 54 8.782 8.487 0.295 1
1 586 . 8 1 1 A 54 54 VAL HA H 54 3.230 3.707 -0.477 1
1 594 . 8 1 1 A 54 54 VAL C C 54 173.745 176.927 -3.182 1
1 595 . 8 1 1 A 54 54 VAL CA C 54 66.232 63.387 2.845 1
1 596 . 8 1 1 A 54 54 VAL CB C 54 31.067 31.817 -0.750 1
1 599 . 8 1 1 A 54 54 VAL N N 54 124.401 126.176 -1.775 1
1 600 . 8 1 1 A 55 55 GLY H H 55 9.079 8.908 0.171 1
1 601 . 8 1 1 A 55 55 GLY HA2 H 55 3.530 3.113 0.417 1
1 602 . 8 1 1 A 55 55 GLY HA3 H 55 4.553 3.680 0.873 1
1 603 . 8 1 1 A 55 55 GLY C C 55 177.219 172.825 4.394 1
1 604 . 8 1 1 A 55 55 GLY CA C 55 44.647 45.953 -1.306 1
1 605 . 8 1 1 A 55 55 GLY N N 55 117.320 115.728 1.592 1
1 606 . 8 1 1 A 56 56 ASP H H 56 7.943 7.614 0.329 1
1 607 . 8 1 1 A 56 56 ASP HA H 56 4.460 5.005 -0.545 1
1 610 . 8 1 1 A 56 56 ASP C C 56 176.055 173.797 2.258 1
1 611 . 8 1 1 A 56 56 ASP CA C 56 55.456 52.169 3.287 1
1 612 . 8 1 1 A 56 56 ASP CB C 56 40.914 44.387 -3.473 1
1 613 . 8 1 1 A 56 56 ASP N N 56 121.782 119.448 2.334 1
1 614 . 8 1 1 A 57 57 GLU H H 57 8.649 8.674 -0.025 1
1 615 . 8 1 1 A 57 57 GLU HA H 57 5.100 5.167 -0.067 1
1 620 . 8 1 1 A 57 57 GLU C C 57 175.635 175.926 -0.291 1
1 621 . 8 1 1 A 57 57 GLU CA C 57 55.805 55.391 0.414 1
1 622 . 8 1 1 A 57 57 GLU CB C 57 30.915 31.330 -0.415 1
1 624 . 8 1 1 A 57 57 GLU N N 57 122.513 123.597 -1.084 1
1 625 . 8 1 1 A 58 58 VAL H H 58 8.809 9.149 -0.340 1
1 626 . 8 1 1 A 58 58 VAL HA H 58 4.817 4.806 0.011 1
1 634 . 8 1 1 A 58 58 VAL C C 58 176.528 174.232 2.296 1
1 635 . 8 1 1 A 58 58 VAL CA C 58 58.719 59.122 -0.403 1
1 636 . 8 1 1 A 58 58 VAL CB C 58 35.523 35.973 -0.450 1
1 639 . 8 1 1 A 58 58 VAL N N 58 118.382 119.598 -1.216 1
1 640 . 8 1 1 A 59 59 GLN H H 59 8.255 8.609 -0.354 1
1 641 . 8 1 1 A 59 59 GLN HA H 59 5.030 5.120 -0.090 1
1 646 . 8 1 1 A 59 59 GLN CA C 59 54.843 54.932 -0.089 1
1 647 . 8 1 1 A 59 59 GLN CB C 59 30.111 30.078 0.033 1
1 649 . 8 1 1 A 59 59 GLN N N 59 120.933 121.813 -0.880 1
1 650 . 8 1 1 A 60 60 VAL H H 60 8.970 9.353 -0.383 1
1 651 . 8 1 1 A 60 60 VAL HA H 60 4.990 4.973 0.017 1
1 659 . 8 1 1 A 60 60 VAL C C 60 175.203 173.808 1.395 1
1 660 . 8 1 1 A 60 60 VAL CA C 60 57.404 58.943 -1.539 1
1 661 . 8 1 1 A 60 60 VAL CB C 60 35.771 35.558 0.213 1
1 664 . 8 1 1 A 60 60 VAL N N 60 111.046 118.413 -7.367 1
1 665 . 8 1 1 A 61 61 LYS H H 61 8.937 8.696 0.241 1
1 666 . 8 1 1 A 61 61 LYS HA H 61 5.100 5.048 0.052 1
1 675 . 8 1 1 A 61 61 LYS C C 61 173.610 176.238 -2.628 1
1 676 . 8 1 1 A 61 61 LYS CA C 61 53.762 54.813 -1.051 1
1 677 . 8 1 1 A 61 61 LYS CB C 61 36.273 34.724 1.549 1
1 681 . 8 1 1 A 61 61 LYS N N 61 121.930 123.279 -1.349 1
1 682 . 8 1 1 A 62 62 VAL H H 62 8.429 9.326 -0.897 1
1 683 . 8 1 1 A 62 62 VAL HA H 62 4.074 4.068 0.006 1
1 691 . 8 1 1 A 62 62 VAL C C 62 176.912 175.830 1.082 1
1 692 . 8 1 1 A 62 62 VAL CA C 62 63.188 63.711 -0.523 1
1 693 . 8 1 1 A 62 62 VAL CB C 62 30.813 31.905 -1.092 1
1 696 . 8 1 1 A 62 62 VAL N N 62 126.329 127.229 -0.900 1
1 697 . 8 1 1 A 63 63 LEU H H 63 9.109 9.366 -0.257 1
1 698 . 8 1 1 A 63 63 LEU HA H 63 4.423 4.510 -0.087 1
1 708 . 8 1 1 A 63 63 LEU C C 63 176.091 176.038 0.053 1
1 709 . 8 1 1 A 63 63 LEU CA C 63 55.876 56.071 -0.195 1
1 710 . 8 1 1 A 63 63 LEU CB C 63 42.800 44.548 -1.748 1
1 714 . 8 1 1 A 63 63 LEU N N 63 129.436 129.434 0.002 1
1 715 . 8 1 1 A 64 64 ALA H H 64 7.594 7.325 0.269 1
1 716 . 8 1 1 A 64 64 ALA HA H 64 4.455 4.735 -0.280 1
1 720 . 8 1 1 A 64 64 ALA C C 64 177.314 175.192 2.122 1
1 721 . 8 1 1 A 64 64 ALA CA C 64 52.557 51.530 1.027 1
1 722 . 8 1 1 A 64 64 ALA CB C 64 21.458 22.740 -1.282 1
1 723 . 8 1 1 A 64 64 ALA N N 64 117.791 118.837 -1.046 1
1 724 . 8 1 1 A 65 65 VAL H H 65 8.583 8.609 -0.026 1
1 725 . 8 1 1 A 65 65 VAL HA H 65 4.470 4.782 -0.312 1
1 733 . 8 1 1 A 65 65 VAL C C 65 174.697 174.676 0.021 1
1 734 . 8 1 1 A 65 65 VAL CA C 65 61.936 61.172 0.764 1
1 735 . 8 1 1 A 65 65 VAL CB C 65 35.288 35.168 0.120 1
1 738 . 8 1 1 A 65 65 VAL N N 65 120.009 120.070 -0.061 1
1 739 . 8 1 1 A 66 66 ASP H H 66 8.567 8.870 -0.303 1
1 740 . 8 1 1 A 66 66 ASP HA H 66 4.880 4.972 -0.092 1
1 743 . 8 1 1 A 66 66 ASP C C 66 174.355 176.045 -1.690 1
1 744 . 8 1 1 A 66 66 ASP CA C 66 52.681 53.297 -0.616 1
1 745 . 8 1 1 A 66 66 ASP CB C 66 41.775 40.994 0.781 1
1 746 . 8 1 1 A 66 66 ASP N N 66 126.262 125.436 0.826 1
1 747 . 8 1 1 A 67 67 GLU H H 67 9.148 8.624 0.524 1
1 748 . 8 1 1 A 67 67 GLU HA H 67 4.110 4.050 0.060 1
1 753 . 8 1 1 A 67 67 GLU C C 67 177.052 178.022 -0.970 1
1 754 . 8 1 1 A 67 67 GLU CA C 67 59.044 58.856 0.188 1
1 755 . 8 1 1 A 67 67 GLU CB C 67 29.919 29.763 0.156 1
1 757 . 8 1 1 A 67 67 GLU N N 67 125.480 125.822 -0.342 1
1 758 . 8 1 1 A 68 68 GLU H H 68 8.384 7.705 0.679 1
1 759 . 8 1 1 A 68 68 GLU HA H 68 4.140 4.125 0.015 1
1 764 . 8 1 1 A 68 68 GLU C C 68 178.383 179.139 -0.756 1
1 765 . 8 1 1 A 68 68 GLU CA C 68 59.044 58.994 0.050 1
1 766 . 8 1 1 A 68 68 GLU CB C 68 29.919 29.794 0.125 1
1 768 . 8 1 1 A 68 68 GLU N N 68 119.760 118.785 0.975 1
1 769 . 8 1 1 A 69 69 LYS H H 69 7.799 7.987 -0.188 1
1 770 . 8 1 1 A 69 69 LYS HA H 69 4.375 4.179 0.196 1
1 779 . 8 1 1 A 69 69 LYS C C 69 178.297 177.162 1.135 1
1 780 . 8 1 1 A 69 69 LYS CA C 69 55.704 56.394 -0.690 1
1 781 . 8 1 1 A 69 69 LYS CB C 69 33.622 32.822 0.800 1
1 785 . 8 1 1 A 69 69 LYS N N 69 115.476 116.955 -1.479 1
1 786 . 8 1 1 A 70 70 GLY H H 70 7.994 8.802 -0.808 1
1 787 . 8 1 1 A 70 70 GLY HA2 H 70 3.940 3.947 -0.007 1
1 788 . 8 1 1 A 70 70 GLY HA3 H 70 3.960 3.950 0.010 1
1 789 . 8 1 1 A 70 70 GLY C C 70 177.215 173.683 3.532 1
1 790 . 8 1 1 A 70 70 GLY CA C 70 46.773 46.417 0.356 1
1 791 . 8 1 1 A 70 70 GLY N N 70 110.245 108.640 1.605 1
1 792 . 8 1 1 A 71 71 LYS H H 71 7.560 7.748 -0.188 1
1 793 . 8 1 1 A 71 71 LYS HA H 71 4.690 4.983 -0.293 1
1 802 . 8 1 1 A 71 71 LYS C C 71 174.607 174.619 -0.012 1
1 803 . 8 1 1 A 71 71 LYS CA C 71 55.332 54.503 0.829 1
1 804 . 8 1 1 A 71 71 LYS CB C 71 34.903 36.691 -1.788 1
1 808 . 8 1 1 A 71 71 LYS N N 71 118.201 114.774 3.427 1
1 809 . 8 1 1 A 72 72 ILE H H 72 8.867 8.593 0.274 1
1 810 . 8 1 1 A 72 72 ILE HA H 72 4.630 4.974 -0.344 1
1 820 . 8 1 1 A 72 72 ILE C C 72 175.708 174.681 1.027 1
1 821 . 8 1 1 A 72 72 ILE CA C 72 61.494 60.170 1.324 1
1 822 . 8 1 1 A 72 72 ILE CB C 72 40.652 42.151 -1.499 1
1 826 . 8 1 1 A 72 72 ILE N N 72 126.827 121.000 5.827 1
1 827 . 8 1 1 A 73 73 SER H H 73 8.815 9.103 -0.288 1
1 828 . 8 1 1 A 73 73 SER HA H 73 5.110 5.300 -0.190 1
1 831 . 8 1 1 A 73 73 SER C C 73 175.122 173.335 1.787 1
1 832 . 8 1 1 A 73 73 SER CA C 73 57.487 58.156 -0.669 1
1 833 . 8 1 1 A 73 73 SER CB C 73 64.386 64.579 -0.193 1
1 834 . 8 1 1 A 73 73 SER N N 73 123.640 124.392 -0.752 1
1 835 . 8 1 1 A 74 74 LEU H H 74 8.585 8.752 -0.167 1
1 836 . 8 1 1 A 74 74 LEU HA H 74 5.450 5.265 0.185 1
1 846 . 8 1 1 A 74 74 LEU C C 74 174.061 175.232 -1.171 1
1 847 . 8 1 1 A 74 74 LEU CA C 74 53.101 53.402 -0.301 1
1 848 . 8 1 1 A 74 74 LEU CB C 74 48.268 46.858 1.410 1
1 852 . 8 1 1 A 74 74 LEU N N 74 125.221 123.988 1.233 1
1 853 . 8 1 1 A 75 75 SER H H 75 8.840 8.495 0.345 1
1 854 . 8 1 1 A 75 75 SER HA H 75 5.040 5.252 -0.212 1
1 857 . 8 1 1 A 75 75 SER C C 75 176.552 173.615 2.937 1
1 858 . 8 1 1 A 75 75 SER CA C 75 57.487 56.466 1.021 1
1 859 . 8 1 1 A 75 75 SER CB C 75 64.993 66.407 -1.414 1
1 860 . 8 1 1 A 75 75 SER N N 75 111.252 112.460 -1.208 1
1 861 . 8 1 1 A 76 76 ILE H H 76 7.790 8.956 -1.166 1
1 862 . 8 1 1 A 76 76 ILE HA H 76 4.690 4.594 0.096 1
1 872 . 8 1 1 A 76 76 ILE C C 76 175.780 177.052 -1.272 1
1 873 . 8 1 1 A 76 76 ILE CA C 76 63.631 62.006 1.625 1
1 874 . 8 1 1 A 76 76 ILE CB C 76 39.484 39.549 -0.065 1
1 878 . 8 1 1 A 76 76 ILE N N 76 129.205 120.323 8.882 1
1 879 . 8 1 1 A 77 77 ARG H H 77 8.115 8.543 -0.428 1
1 880 . 8 1 1 A 77 77 ARG HA H 77 3.760 4.146 -0.386 1
1 887 . 8 1 1 A 77 77 ARG C C 77 178.704 177.760 0.944 1
1 888 . 8 1 1 A 77 77 ARG CA C 77 58.933 58.463 0.470 1
1 889 . 8 1 1 A 77 77 ARG CB C 77 29.463 29.886 -0.423 1
1 892 . 8 1 1 A 77 77 ARG N N 77 123.257 121.790 1.467 1
1 893 . 8 1 1 A 78 78 ALA H H 78 8.304 7.679 0.625 1
1 894 . 8 1 1 A 78 78 ALA HA H 78 4.296 4.145 0.151 1
1 898 . 8 1 1 A 78 78 ALA C C 78 176.870 178.243 -1.373 1
1 899 . 8 1 1 A 78 78 ALA CA C 78 53.548 54.042 -0.494 1
1 900 . 8 1 1 A 78 78 ALA CB C 78 19.872 18.344 1.528 1
1 901 . 8 1 1 A 78 78 ALA N N 78 118.764 121.611 -2.847 1
1 902 . 8 1 1 A 79 79 THR H H 79 7.931 7.796 0.135 1
1 903 . 8 1 1 A 79 79 THR HA H 79 4.370 4.610 -0.240 1
1 908 . 8 1 1 A 79 79 THR C C 79 178.356 174.557 3.799 1
1 909 . 8 1 1 A 79 79 THR CA C 79 62.381 61.765 0.616 1
1 910 . 8 1 1 A 79 79 THR CB C 79 69.693 70.840 -1.147 1
1 912 . 8 1 1 A 79 79 THR N N 79 107.360 103.736 3.624 1
1 913 . 8 1 1 A 80 80 GLN H H 80 7.651 7.714 -0.063 1
1 914 . 8 1 1 A 80 80 GLN HA H 80 4.527 4.777 -0.250 1
1 921 . 8 1 1 A 80 80 GLN C C 80 174.249 174.205 0.044 1
1 922 . 8 1 1 A 80 80 GLN CA C 80 54.760 54.137 0.623 1
1 923 . 8 1 1 A 80 80 GLN CB C 80 30.565 33.303 -2.738 1
1 925 . 8 1 1 A 80 80 GLN N N 80 121.588 119.529 2.059 1
1 927 . 8 1 1 A 81 81 ALA H H 81 8.498 8.762 -0.264 1
1 928 . 8 1 1 A 81 81 ALA HA H 81 4.252 5.344 -1.092 1
1 932 . 8 1 1 A 81 81 ALA C C 81 175.693 175.172 0.521 1
1 933 . 8 1 1 A 81 81 ALA CA C 81 52.345 51.151 1.194 1
1 934 . 8 1 1 A 81 81 ALA CB C 81 19.062 24.334 -5.272 1
1 935 . 8 1 1 A 81 81 ALA N N 81 126.423 121.255 5.168 1
1 936 . 8 1 1 A 82 82 ALA H H 82 8.324 8.478 -0.154 1
1 937 . 8 1 1 A 82 82 ALA HA H 82 4.000 4.917 -0.917 1
1 941 . 8 1 1 A 82 82 ALA C C 82 177.065 174.410 2.655 1
1 942 . 8 1 1 A 82 82 ALA CA C 82 50.240 49.858 0.382 1
1 943 . 8 1 1 A 82 82 ALA CB C 82 17.650 22.190 -4.540 1
1 944 . 8 1 1 A 82 82 ALA N N 82 125.114 120.438 4.676 1
1 945 . 8 1 1 A 83 83 PRO HA H 83 4.350 4.643 -0.293 1
1 952 . 8 1 1 A 83 83 PRO CA C 83 63.148 62.408 0.740 1
1 953 . 8 1 1 A 83 83 PRO CB C 83 32.054 32.529 -0.475 1
1 956 . 8 1 1 A 84 84 GLU H H 84 8.517 8.561 -0.044 1
1 957 . 8 1 1 A 84 84 GLU HA H 84 4.197 4.433 -0.236 1
1 962 . 8 1 1 A 84 84 GLU C C 84 176.948 175.724 1.224 1
1 963 . 8 1 1 A 84 84 GLU CA C 84 56.674 56.593 0.081 1
1 964 . 8 1 1 A 84 84 GLU CB C 84 30.459 30.527 -0.068 1
1 966 . 8 1 1 A 84 84 GLU N N 84 121.479 122.005 -0.526 1
1 967 . 8 1 1 A 85 85 LYS H H 85 8.381 8.709 -0.328 1
1 968 . 8 1 1 A 85 85 LYS HA H 85 4.309 4.888 -0.579 1
1 977 . 8 1 1 A 85 85 LYS C C 85 176.457 176.098 0.359 1
1 978 . 8 1 1 A 85 85 LYS CA C 85 56.272 54.689 1.583 1
1 979 . 8 1 1 A 85 85 LYS CB C 85 32.961 35.229 -2.268 1
1 983 . 8 1 1 A 85 85 LYS N N 85 123.266 125.034 -1.768 1
1 984 . 8 1 1 A 86 86 LYS H H 86 8.403 8.623 -0.220 1
1 985 . 8 1 1 A 86 86 LYS HA H 86 4.308 4.408 -0.100 1
1 994 . 8 1 1 A 86 86 LYS C C 86 176.435 176.220 0.215 1
1 995 . 8 1 1 A 86 86 LYS CA C 86 56.272 56.291 -0.019 1
1 996 . 8 1 1 A 86 86 LYS CB C 86 32.961 32.851 0.110 1
1 1000 . 8 1 1 A 86 86 LYS N N 86 123.688 123.622 0.066 1
1 1001 . 8 1 1 A 87 87 GLU H H 87 8.540 7.758 0.782 1
1 1002 . 8 1 1 A 87 87 GLU HA H 87 4.358 4.161 0.197 1
1 1007 . 8 1 1 A 87 87 GLU C C 87 176.556 176.527 0.029 1
1 1008 . 8 1 1 A 87 87 GLU CA C 87 56.406 56.374 0.032 1
1 1009 . 8 1 1 A 87 87 GLU CB C 87 30.607 30.764 -0.157 1
1 1011 . 8 1 1 A 87 87 GLU N N 87 122.633 122.347 0.286 1
1 1012 . 8 1 1 A 88 88 SER H H 88 8.520 8.447 0.073 1
1 1013 . 8 1 1 A 88 88 SER HA H 88 4.490 4.379 0.111 1
1 1016 . 8 1 1 A 88 88 SER C C 88 175.780 174.083 1.697 1
1 1017 . 8 1 1 A 88 88 SER CA C 88 58.431 59.074 -0.643 1
1 1018 . 8 1 1 A 88 88 SER CB C 88 63.858 63.910 -0.052 1
1 1019 . 8 1 1 A 88 88 SER N N 88 118.333 120.060 -1.727 1
1 1020 . 8 1 1 A 89 89 LYS H H 89 8.339 8.567 -0.228 1
1 1021 . 8 1 1 A 89 89 LYS HA H 89 4.620 4.689 -0.069 1
1 1030 . 8 1 1 A 89 89 LYS C C 89 174.160 173.757 0.403 1
1 1031 . 8 1 1 A 89 89 LYS CA C 89 54.265 52.882 1.383 1
1 1032 . 8 1 1 A 89 89 LYS CB C 89 32.672 34.498 -1.826 1
1 1036 . 8 1 1 A 89 89 LYS N N 89 124.433 121.248 3.185 1
1 1037 . 8 1 1 A 90 90 PRO HA H 90 4.417 4.577 -0.160 1
1 1044 . 8 1 1 A 90 90 PRO CA C 90 63.064 62.372 0.692 1
1 1045 . 8 1 1 A 90 90 PRO CB C 90 32.266 33.002 -0.736 1
1 1048 . 8 1 1 A 91 91 ARG H H 91 8.502 8.501 0.001 1
1 1049 . 8 1 1 A 91 91 ARG HA H 91 4.305 4.071 0.234 1
1 1056 . 8 1 1 A 91 91 ARG C C 91 176.831 176.033 0.798 1
1 1057 . 8 1 1 A 91 91 ARG CA C 91 56.002 58.557 -2.555 1
1 1058 . 8 1 1 A 91 91 ARG CB C 91 30.913 29.713 1.200 1
1 1061 . 8 1 1 A 91 91 ARG N N 91 122.193 119.901 2.292 1
1 1062 . 8 1 1 A 92 92 LYS H H 92 8.415 7.704 0.711 1
1 1063 . 8 1 1 A 92 92 LYS HA H 92 4.610 4.727 -0.117 1
1 1072 . 8 1 1 A 92 92 LYS C C 92 176.262 175.408 0.854 1
1 1073 . 8 1 1 A 92 92 LYS CA C 92 54.258 53.356 0.902 1
1 1074 . 8 1 1 A 92 92 LYS CB C 92 32.672 36.135 -3.463 1
1 1078 . 8 1 1 A 92 92 LYS N N 92 124.243 118.592 5.651 1
1 1079 . 8 1 1 A 93 93 PRO HA H 93 4.415 4.320 0.095 1
1 1086 . 8 1 1 A 93 93 PRO CA C 93 62.899 65.576 -2.677 1
1 1087 . 8 1 1 A 93 93 PRO CB C 93 32.323 31.728 0.595 1
1 1090 . 8 1 1 A 94 94 LYS H H 94 8.420 8.435 -0.015 1
1 1091 . 8 1 1 A 94 94 LYS HA H 94 4.290 4.131 0.159 1
1 1100 . 8 1 1 A 94 94 LYS C C 94 176.714 178.996 -2.282 1
1 1101 . 8 1 1 A 94 94 LYS CA C 94 56.585 59.183 -2.598 1
1 1102 . 8 1 1 A 94 94 LYS CB C 94 33.161 31.834 1.327 1
1 1106 . 8 1 1 A 94 94 LYS N N 94 122.121 117.367 4.754 1
1 1107 . 8 1 1 A 95 95 ALA H H 95 8.348 8.467 -0.119 1
1 1108 . 8 1 1 A 95 95 ALA HA H 95 4.250 4.145 0.105 1
1 1112 . 8 1 1 A 95 95 ALA C C 95 176.453 178.903 -2.450 1
1 1113 . 8 1 1 A 95 95 ALA CA C 95 52.471 54.436 -1.965 1
1 1114 . 8 1 1 A 95 95 ALA CB C 95 19.347 18.324 1.023 1
1 1115 . 8 1 1 A 95 95 ALA N N 95 125.624 120.786 4.838 1
1 1116 . 8 1 1 A 96 96 ALA H H 96 8.348 7.889 0.459 1
1 1117 . 8 1 1 A 96 96 ALA HA H 96 4.254 4.278 -0.024 1
1 1121 . 8 1 1 A 96 96 ALA C C 96 176.462 176.222 0.240 1
1 1122 . 8 1 1 A 96 96 ALA CA C 96 52.471 52.388 0.083 1
1 1123 . 8 1 1 A 96 96 ALA CB C 96 19.347 17.940 1.407 1
1 1124 . 8 1 1 A 96 96 ALA N N 96 125.624 119.027 6.597 1
1 1125 . 8 1 1 A 97 97 GLN H H 97 8.333 7.773 0.560 1
1 1126 . 8 1 1 A 97 97 GLN HA H 97 4.362 4.990 -0.628 1
1 1133 . 8 1 1 A 97 97 GLN C C 97 177.684 174.766 2.918 1
1 1134 . 8 1 1 A 97 97 GLN CA C 97 55.848 53.949 1.899 1
1 1135 . 8 1 1 A 97 97 GLN CB C 97 29.643 33.276 -3.633 1
1 1137 . 8 1 1 A 97 97 GLN N N 97 120.049 115.638 4.411 1
1 1139 . 8 1 1 A 98 98 VAL H H 98 8.230 8.042 0.188 1
1 1140 . 8 1 1 A 98 98 VAL HA H 98 4.145 4.611 -0.466 1
1 1148 . 8 1 1 A 98 98 VAL C C 98 176.033 176.078 -0.045 1
1 1149 . 8 1 1 A 98 98 VAL CA C 98 62.444 59.683 2.761 1
1 1150 . 8 1 1 A 98 98 VAL CB C 98 32.942 34.525 -1.583 1
1 1153 . 8 1 1 A 98 98 VAL N N 98 121.607 116.926 4.681 1
1 1154 . 8 1 1 A 99 99 SER H H 99 8.375 8.547 -0.172 1
1 1155 . 8 1 1 A 99 99 SER HA H 99 4.473 4.491 -0.018 1
1 1158 . 8 1 1 A 99 99 SER C C 99 176.204 174.210 1.994 1
1 1159 . 8 1 1 A 99 99 SER CA C 99 58.379 59.706 -1.327 1
1 1160 . 8 1 1 A 99 99 SER CB C 99 63.914 63.242 0.672 1
1 1161 . 8 1 1 A 99 99 SER N N 99 119.455 115.477 3.978 1
1 1162 . 8 1 1 A 100 100 GLU H H 100 8.547 7.618 0.929 1
1 1163 . 8 1 1 A 100 100 GLU HA H 100 4.304 4.673 -0.369 1
1 1168 . 8 1 1 A 100 100 GLU C C 100 174.620 174.495 0.125 1
1 1169 . 8 1 1 A 100 100 GLU CA C 100 56.835 55.085 1.750 1
1 1170 . 8 1 1 A 100 100 GLU CB C 100 30.365 33.290 -2.925 1
1 1172 . 8 1 1 A 100 100 GLU N N 100 123.419 120.957 2.462 1
1 1173 . 8 1 1 A 101 101 GLU H H 101 8.432 8.695 -0.263 1
1 1174 . 8 1 1 A 101 101 GLU HA H 101 4.252 4.391 -0.139 1
1 1179 . 8 1 1 A 101 101 GLU C C 101 176.693 178.449 -1.756 1
1 1180 . 8 1 1 A 101 101 GLU CA C 101 56.835 57.307 -0.472 1
1 1181 . 8 1 1 A 101 101 GLU CB C 101 30.365 30.467 -0.102 1
1 1183 . 8 1 1 A 101 101 GLU N N 101 122.025 123.714 -1.689 1
1 1184 . 8 1 1 A 102 102 ALA H H 102 8.324 8.662 -0.338 1
1 1185 . 8 1 1 A 102 102 ALA HA H 102 4.361 4.359 0.002 1
1 1189 . 8 1 1 A 102 102 ALA C C 102 177.065 176.646 0.419 1
1 1190 . 8 1 1 A 102 102 ALA CA C 102 52.647 51.917 0.730 1
1 1191 . 8 1 1 A 102 102 ALA CB C 102 19.227 18.851 0.376 1
1 1192 . 8 1 1 A 102 102 ALA N N 102 125.114 130.364 -5.250 1
1 1193 . 8 1 1 A 103 103 SER H H 103 8.259 8.204 0.055 1
1 1194 . 8 1 1 A 103 103 SER HA H 103 4.473 4.262 0.211 1
1 1197 . 8 1 1 A 103 103 SER C C 103 177.772 174.016 3.756 1
1 1198 . 8 1 1 A 103 103 SER CA C 103 58.301 59.093 -0.792 1
1 1199 . 8 1 1 A 103 103 SER CB C 103 63.961 61.595 2.366 1
1 1200 . 8 1 1 A 103 103 SER N N 103 115.109 110.982 4.127 1
1 1201 . 8 1 1 A 104 104 THR H H 104 8.127 7.767 0.360 1
1 1202 . 8 1 1 A 104 104 THR HA H 104 4.600 3.928 0.672 1
1 1207 . 8 1 1 A 104 104 THR C C 104 174.427 175.299 -0.872 1
1 1208 . 8 1 1 A 104 104 THR CA C 104 59.954 67.482 -7.528 1
1 1209 . 8 1 1 A 104 104 THR CB C 104 69.868 66.960 2.908 1
1 1211 . 8 1 1 A 104 104 THR N N 104 117.882 112.962 4.920 1
1 1212 . 8 1 1 A 105 105 PRO HA H 105 4.414 4.704 -0.290 1
1 1219 . 8 1 1 A 105 105 PRO CA C 105 63.300 62.952 0.348 1
1 1220 . 8 1 1 A 105 105 PRO CB C 105 32.227 32.948 -0.721 1
1 1223 . 8 1 1 A 106 106 GLN H H 106 8.524 8.575 -0.051 1
1 1224 . 8 1 1 A 106 106 GLN HA H 106 4.276 4.957 -0.681 1
1 1229 . 8 1 1 A 106 106 GLN C C 106 177.083 174.988 2.095 1
1 1230 . 8 1 1 A 106 106 GLN CA C 106 56.209 54.412 1.797 1
1 1231 . 8 1 1 A 106 106 GLN CB C 106 29.490 31.970 -2.480 1
1 1233 . 8 1 1 A 106 106 GLN N N 106 120.754 116.883 3.871 1
1 1234 . 8 1 1 A 107 107 GLY H H 107 8.394 8.568 -0.174 1
1 1235 . 8 1 1 A 107 107 GLY HA2 H 107 3.895 4.120 -0.225 1
1 1236 . 8 1 1 A 107 107 GLY HA3 H 107 3.895 4.139 -0.244 1
1 1237 . 8 1 1 A 107 107 GLY C C 107 176.651 172.516 4.135 1
1 1238 . 8 1 1 A 107 107 GLY CA C 107 45.330 44.204 1.126 1
1 1239 . 8 1 1 A 107 107 GLY N N 107 110.026 107.052 2.974 1
1 1240 . 8 1 1 A 108 108 PHE H H 108 8.099 8.744 -0.645 1
1 1241 . 8 1 1 A 108 108 PHE HA H 108 4.582 5.137 -0.555 1
1 1245 . 8 1 1 A 108 108 PHE C C 108 173.944 175.444 -1.500 1
1 1246 . 8 1 1 A 108 108 PHE CA C 108 58.054 57.075 0.979 1
1 1247 . 8 1 1 A 108 108 PHE CB C 108 39.708 42.339 -2.631 1
1 1248 . 8 1 1 A 108 108 PHE N N 108 120.180 120.263 -0.083 1
1 1249 . 8 1 1 A 109 109 ASN H H 109 8.482 7.565 0.917 1
1 1250 . 8 1 1 A 109 109 ASN HA H 109 4.691 3.873 0.818 1
1 1255 . 8 1 1 A 109 109 ASN C C 109 175.627 174.731 0.896 1
1 1256 . 8 1 1 A 109 109 ASN CA C 109 53.402 55.912 -2.510 1
1 1257 . 8 1 1 A 109 109 ASN CB C 109 38.883 37.278 1.605 1
1 1258 . 8 1 1 A 109 109 ASN N N 109 120.752 122.996 -2.244 1
1 1260 . 8 1 1 A 110 110 THR H H 110 8.112 6.784 1.328 1
1 1261 . 8 1 1 A 110 110 THR HA H 110 4.251 3.949 0.302 1
1 1266 . 8 1 1 A 110 110 THR C C 110 175.275 174.175 1.100 1
1 1267 . 8 1 1 A 110 110 THR CA C 110 62.460 65.139 -2.679 1
1 1268 . 8 1 1 A 110 110 THR CB C 110 69.726 67.285 2.441 1
1 1270 . 8 1 1 A 110 110 THR N N 110 114.601 111.942 2.659 1
1 1271 . 8 1 1 A 111 111 LEU H H 111 8.168 8.058 0.110 1
1 1272 . 8 1 1 A 111 111 LEU HA H 111 4.308 4.511 -0.203 1
1 1282 . 8 1 1 A 111 111 LEU CA C 111 55.704 54.465 1.239 1
1 1283 . 8 1 1 A 111 111 LEU CB C 111 42.071 43.381 -1.310 1
1 1287 . 8 1 1 A 111 111 LEU N N 111 123.756 120.258 3.498 1
1 1288 . 8 1 1 A 112 112 LYS H H 112 8.123 7.774 0.349 1
1 1289 . 8 1 1 A 112 112 LYS HA H 112 4.242 3.978 0.264 1
1 1298 . 8 1 1 A 112 112 LYS C C 112 177.547 176.115 1.432 1
1 1299 . 8 1 1 A 112 112 LYS CA C 112 56.928 59.300 -2.372 1
1 1300 . 8 1 1 A 112 112 LYS CB C 112 33.055 32.690 0.365 1
1 1304 . 8 1 1 A 112 112 LYS N N 112 121.442 118.465 2.977 1
1 1305 . 8 1 1 A 113 113 ASP H H 113 8.230 7.598 0.632 1
1 1306 . 8 1 1 A 113 113 ASP HA H 113 4.526 5.084 -0.558 1
1 1309 . 8 1 1 A 113 113 ASP C C 113 176.532 174.108 2.424 1
1 1310 . 8 1 1 A 113 113 ASP CA C 113 54.896 52.985 1.911 1
1 1311 . 8 1 1 A 113 113 ASP CB C 113 41.362 44.765 -3.403 1
1 1312 . 8 1 1 A 113 113 ASP N N 113 120.598 116.819 3.779 1
1 1313 . 8 1 1 A 114 114 LYS H H 114 8.127 9.012 -0.885 1
1 1314 . 8 1 1 A 114 114 LYS HA H 114 4.300 5.440 -1.140 1
1 1323 . 8 1 1 A 114 114 LYS C C 114 176.303 174.942 1.361 1
1 1324 . 8 1 1 A 114 114 LYS CA C 114 56.633 54.536 2.097 1
1 1325 . 8 1 1 A 114 114 LYS CB C 114 32.818 36.908 -4.090 1
1 1329 . 8 1 1 A 114 114 LYS N N 114 120.897 118.719 2.178 1
1 1330 . 8 1 1 A 115 115 LEU H H 115 8.244 8.809 -0.565 1
1 1331 . 8 1 1 A 115 115 LEU HA H 115 4.254 4.853 -0.599 1
1 1341 . 8 1 1 A 115 115 LEU C C 115 176.909 176.990 -0.081 1
1 1342 . 8 1 1 A 115 115 LEU CA C 115 56.282 53.443 2.839 1
1 1343 . 8 1 1 A 115 115 LEU CB C 115 42.188 46.019 -3.831 1
1 1347 . 8 1 1 A 115 115 LEU N N 115 123.251 121.965 1.286 1
1 1348 . 8 1 1 A 116 116 GLU H H 116 8.421 8.883 -0.462 1
1 1349 . 8 1 1 A 116 116 GLU HA H 116 4.190 4.134 0.056 1
1 1352 . 8 1 1 A 116 116 GLU C C 116 177.828 175.924 1.904 1
1 1353 . 8 1 1 A 116 116 GLU CA C 116 57.466 59.131 -1.665 1
1 1354 . 8 1 1 A 116 116 GLU CB C 116 30.124 29.904 0.220 1
1 1355 . 8 1 1 A 116 116 GLU N N 116 120.575 122.382 -1.807 1
1 1356 . 8 1 1 A 117 117 GLU H H 117 8.255 7.988 0.267 1
1 1357 . 8 1 1 A 117 117 GLU HA H 117 4.192 4.795 -0.603 1
1 1362 . 8 1 1 A 117 117 GLU CA C 117 57.491 55.778 1.713 1
1 1363 . 8 1 1 A 117 117 GLU CB C 117 30.365 32.907 -2.542 1
1 1365 . 8 1 1 A 117 117 GLU N N 117 120.933 118.081 2.852 1
1 1366 . 8 1 1 A 118 118 TRP H H 118 8.143 9.225 -1.082 1
1 1367 . 8 1 1 A 118 118 TRP HA H 118 4.581 4.280 0.301 1
1 1372 . 8 1 1 A 118 118 TRP C C 118 176.794 177.644 -0.850 1
1 1373 . 8 1 1 A 118 118 TRP CA C 118 58.363 60.899 -2.536 1
1 1374 . 8 1 1 A 118 118 TRP CB C 118 29.333 29.996 -0.663 1
1 1375 . 8 1 1 A 118 118 TRP N N 118 121.592 127.939 -6.347 1
1 1376 . 8 1 1 A 119 119 ILE H H 119 7.908 7.839 0.069 1
1 1377 . 8 1 1 A 119 119 ILE HA H 119 3.828 3.714 0.114 1
1 1387 . 8 1 1 A 119 119 ILE C C 119 176.984 177.609 -0.625 1
1 1388 . 8 1 1 A 119 119 ILE CA C 119 62.335 64.418 -2.083 1
1 1389 . 8 1 1 A 119 119 ILE CB C 119 38.649 37.584 1.065 1
1 1393 . 8 1 1 A 119 119 ILE N N 119 122.744 118.163 4.581 1
1 1394 . 8 1 1 A 120 120 GLU H H 120 8.143 8.419 -0.276 1
1 1395 . 8 1 1 A 120 120 GLU HA H 120 4.093 4.258 -0.165 1
1 1400 . 8 1 1 A 120 120 GLU C C 120 176.565 178.856 -2.291 1
1 1401 . 8 1 1 A 120 120 GLU CA C 120 57.613 58.320 -0.707 1
1 1402 . 8 1 1 A 120 120 GLU CB C 120 29.834 29.199 0.635 1
1 1404 . 8 1 1 A 120 120 GLU N N 120 123.139 121.015 2.124 1
1 1405 . 8 1 1 A 121 121 MET H H 121 8.254 7.615 0.639 1
1 1406 . 8 1 1 A 121 121 MET HA H 121 4.357 4.063 0.294 1
1 1411 . 8 1 1 A 121 121 MET CA C 121 56.625 57.438 -0.813 1
1 1412 . 8 1 1 A 121 121 MET CB C 121 32.664 31.685 0.979 1
1 1414 . 8 1 1 A 121 121 MET N N 121 120.449 119.414 1.035 1
1 1415 . 8 1 1 A 122 122 SER H H 122 8.199 8.026 0.173 1
1 1416 . 8 1 1 A 122 122 SER HA H 122 4.280 4.586 -0.306 1
1 1419 . 8 1 1 A 122 122 SER C C 122 177.224 174.349 2.875 1
1 1420 . 8 1 1 A 122 122 SER CA C 122 59.635 59.092 0.543 1
1 1421 . 8 1 1 A 122 122 SER CB C 122 63.560 65.982 -2.422 1
1 1422 . 8 1 1 A 122 122 SER N N 122 115.857 114.197 1.660 1
1 1423 . 8 1 1 A 123 123 ASN H H 123 8.211 8.097 0.114 1
1 1424 . 8 1 1 A 123 123 ASN HA H 123 4.737 4.519 0.218 1
1 1429 . 8 1 1 A 123 123 ASN C C 123 174.709 174.938 -0.229 1
1 1430 . 8 1 1 A 123 123 ASN CA C 123 53.507 53.864 -0.357 1
1 1431 . 8 1 1 A 123 123 ASN CB C 123 38.800 38.797 0.003 1
1 1432 . 8 1 1 A 123 123 ASN N N 123 119.923 120.624 -0.701 1
1 1434 . 8 1 1 A 124 124 ARG H H 124 7.997 8.858 -0.861 1
1 1435 . 8 1 1 A 124 124 ARG HA H 124 4.305 4.871 -0.566 1
1 1442 . 8 1 1 A 124 124 ARG C C 124 175.477 175.832 -0.355 1
1 1443 . 8 1 1 A 124 124 ARG CA C 124 56.709 54.083 2.626 1
1 1444 . 8 1 1 A 124 124 ARG CB C 124 30.584 34.087 -3.503 1
1 1447 . 8 1 1 A 124 124 ARG N N 124 120.821 124.061 -3.240 1
1 1448 . 8 1 1 A 125 125 LYS H H 125 8.327 8.379 -0.052 1
1 1449 . 8 1 1 A 125 125 LYS HA H 125 4.254 4.379 -0.125 1
1 1458 . 8 1 1 A 125 125 LYS C C 125 176.777 176.218 0.559 1
1 1459 . 8 1 1 A 125 125 LYS CA C 125 56.860 57.250 -0.390 1
1 1460 . 8 1 1 A 125 125 LYS CB C 125 32.879 33.160 -0.281 1
1 1464 . 8 1 1 A 125 125 LYS N N 125 121.891 121.040 0.851 1
1 1465 . 8 1 1 A 126 126 ASP H H 126 8.343 8.521 -0.178 1
1 1466 . 8 1 1 A 126 126 ASP HA H 126 4.581 5.165 -0.584 1
1 1469 . 8 1 1 A 126 126 ASP C C 126 176.538 174.251 2.287 1
1 1470 . 8 1 1 A 126 126 ASP CA C 126 54.540 53.669 0.871 1
1 1471 . 8 1 1 A 126 126 ASP CB C 126 40.907 45.235 -4.328 1
1 1472 . 8 1 1 A 126 126 ASP N N 126 119.814 122.488 -2.674 1
1 1473 . 8 1 1 A 127 127 LEU H H 127 7.946 8.591 -0.645 1
1 1474 . 8 1 1 A 127 127 LEU HA H 127 4.309 5.016 -0.707 1
1 1484 . 8 1 1 A 127 127 LEU C C 127 176.043 174.988 1.055 1
1 1485 . 8 1 1 A 127 127 LEU CA C 127 55.427 53.602 1.825 1
1 1486 . 8 1 1 A 127 127 LEU CB C 127 42.394 46.038 -3.644 1
1 1490 . 8 1 1 A 127 127 LEU N N 127 121.432 122.670 -1.238 1
1 1491 . 8 1 1 A 128 128 ILE H H 128 7.967 8.422 -0.455 1
1 1492 . 8 1 1 A 128 128 ILE HA H 128 4.141 4.071 0.070 1
1 1502 . 8 1 1 A 128 128 ILE C C 128 177.200 175.295 1.905 1
1 1503 . 8 1 1 A 128 128 ILE CA C 128 61.150 61.377 -0.227 1
1 1504 . 8 1 1 A 128 128 ILE CB C 128 38.489 38.990 -0.501 1
1 1508 . 8 1 1 A 128 128 ILE N N 128 121.579 120.932 0.647 1
1 1509 . 8 1 1 A 129 129 LYS H H 129 8.331 8.459 -0.128 1
1 1510 . 8 1 1 A 129 129 LYS HA H 129 4.328 4.906 -0.578 1
1 1519 . 8 1 1 A 129 129 LYS C C 129 175.952 174.443 1.509 1
1 1520 . 8 1 1 A 129 129 LYS CA C 129 56.330 55.391 0.939 1
1 1521 . 8 1 1 A 129 129 LYS CB C 129 33.010 36.573 -3.563 1
1 1525 . 8 1 1 A 129 129 LYS N N 129 126.955 123.085 3.870 1
1 1 . 9 1 1 A 2 2 ALA HA H 2 4.070 5.071 -1.001 1
1 5 . 9 1 1 A 2 2 ALA CA C 2 52.067 51.198 0.869 1
1 6 . 9 1 1 A 2 2 ALA CB C 2 19.577 24.466 -4.889 1
1 7 . 9 1 1 A 3 3 ALA H H 3 8.714 8.492 0.222 1
1 8 . 9 1 1 A 3 3 ALA HA H 3 4.253 4.605 -0.352 1
1 12 . 9 1 1 A 3 3 ALA C C 3 173.672 177.214 -3.542 1
1 13 . 9 1 1 A 3 3 ALA CA C 3 52.067 51.162 0.905 1
1 14 . 9 1 1 A 3 3 ALA CB C 3 19.577 22.825 -3.248 1
1 15 . 9 1 1 A 3 3 ALA N N 3 124.480 119.420 5.060 1
1 16 . 9 1 1 A 4 4 LYS H H 4 8.227 8.550 -0.323 1
1 17 . 9 1 1 A 4 4 LYS HA H 4 3.976 4.075 -0.099 1
1 26 . 9 1 1 A 4 4 LYS C C 4 176.672 175.943 0.729 1
1 27 . 9 1 1 A 4 4 LYS CA C 4 57.274 58.250 -0.976 1
1 28 . 9 1 1 A 4 4 LYS CB C 4 33.209 32.626 0.583 1
1 32 . 9 1 1 A 4 4 LYS N N 4 120.988 119.239 1.749 1
1 33 . 9 1 1 A 5 5 PHE H H 5 7.719 7.774 -0.055 1
1 34 . 9 1 1 A 5 5 PHE HA H 5 4.384 5.221 -0.837 1
1 38 . 9 1 1 A 5 5 PHE C C 5 175.364 174.173 1.191 1
1 39 . 9 1 1 A 5 5 PHE CA C 5 57.074 56.243 0.831 1
1 40 . 9 1 1 A 5 5 PHE CB C 5 39.669 43.577 -3.908 1
1 41 . 9 1 1 A 5 5 PHE N N 5 119.246 116.711 2.535 1
1 42 . 9 1 1 A 6 6 GLU H H 6 8.515 8.977 -0.462 1
1 43 . 9 1 1 A 6 6 GLU HA H 6 4.370 4.864 -0.494 1
1 48 . 9 1 1 A 6 6 GLU CA C 6 55.669 55.303 0.366 1
1 49 . 9 1 1 A 6 6 GLU CB C 6 32.094 34.074 -1.980 1
1 51 . 9 1 1 A 6 6 GLU N N 6 122.193 120.695 1.498 1
1 52 . 9 1 1 A 7 7 VAL H H 7 8.636 8.481 0.155 1
1 53 . 9 1 1 A 7 7 VAL HA H 7 3.406 3.923 -0.517 1
1 61 . 9 1 1 A 7 7 VAL C C 7 176.611 176.310 0.301 1
1 62 . 9 1 1 A 7 7 VAL CA C 7 65.358 63.320 2.038 1
1 63 . 9 1 1 A 7 7 VAL CB C 7 31.391 31.398 -0.007 1
1 66 . 9 1 1 A 7 7 VAL N N 7 122.949 123.318 -0.369 1
1 67 . 9 1 1 A 8 8 GLY H H 8 9.394 9.069 0.325 1
1 68 . 9 1 1 A 8 8 GLY HA2 H 8 3.600 4.021 -0.421 1
1 69 . 9 1 1 A 8 8 GLY HA3 H 8 4.546 4.022 0.524 1
1 70 . 9 1 1 A 8 8 GLY C C 8 178.074 174.250 3.824 1
1 71 . 9 1 1 A 8 8 GLY CA C 8 45.121 45.039 0.082 1
1 72 . 9 1 1 A 8 8 GLY N N 8 116.837 115.195 1.642 1
1 73 . 9 1 1 A 9 9 SER H H 9 8.021 7.969 0.052 1
1 74 . 9 1 1 A 9 9 SER HA H 9 4.680 4.489 0.191 1
1 77 . 9 1 1 A 9 9 SER C C 9 174.234 172.973 1.261 1
1 78 . 9 1 1 A 9 9 SER CA C 9 59.387 59.186 0.201 1
1 79 . 9 1 1 A 9 9 SER CB C 9 65.584 64.709 0.875 1
1 80 . 9 1 1 A 9 9 SER N N 9 118.208 118.136 0.072 1
1 81 . 9 1 1 A 10 10 VAL H H 10 7.945 8.226 -0.281 1
1 82 . 9 1 1 A 10 10 VAL HA H 10 4.980 5.129 -0.149 1
1 90 . 9 1 1 A 10 10 VAL C C 10 171.388 174.275 -2.887 1
1 91 . 9 1 1 A 10 10 VAL CA C 10 61.021 61.078 -0.057 1
1 92 . 9 1 1 A 10 10 VAL CB C 10 33.400 35.093 -1.693 1
1 95 . 9 1 1 A 10 10 VAL N N 10 121.118 122.403 -1.285 1
1 96 . 9 1 1 A 11 11 TYR H H 11 9.008 9.185 -0.177 1
1 97 . 9 1 1 A 11 11 TYR HA H 11 4.850 5.295 -0.445 1
1 101 . 9 1 1 A 11 11 TYR C C 11 174.926 174.716 0.210 1
1 102 . 9 1 1 A 11 11 TYR CA C 11 56.803 56.130 0.673 1
1 103 . 9 1 1 A 11 11 TYR CB C 11 43.676 43.669 0.007 1
1 104 . 9 1 1 A 11 11 TYR N N 11 125.043 125.415 -0.372 1
1 105 . 9 1 1 A 12 12 THR H H 12 8.809 8.724 0.085 1
1 106 . 9 1 1 A 12 12 THR HA H 12 5.020 5.367 -0.347 1
1 111 . 9 1 1 A 12 12 THR C C 12 174.195 174.672 -0.477 1
1 112 . 9 1 1 A 12 12 THR CA C 12 62.487 59.963 2.524 1
1 113 . 9 1 1 A 12 12 THR CB C 12 69.743 71.523 -1.780 1
1 115 . 9 1 1 A 12 12 THR N N 12 116.850 115.624 1.226 1
1 116 . 9 1 1 A 13 13 GLY H H 13 9.179 8.626 0.553 1
1 117 . 9 1 1 A 13 13 GLY HA2 H 13 3.250 4.348 -1.098 1
1 118 . 9 1 1 A 13 13 GLY HA3 H 13 4.801 4.359 0.442 1
1 119 . 9 1 1 A 13 13 GLY C C 13 174.654 171.878 2.776 1
1 120 . 9 1 1 A 13 13 GLY CA C 13 44.377 45.619 -1.242 1
1 121 . 9 1 1 A 13 13 GLY N N 13 113.654 111.888 1.766 1
1 122 . 9 1 1 A 14 14 LYS H H 14 7.770 8.470 -0.700 1
1 123 . 9 1 1 A 14 14 LYS HA H 14 5.426 5.170 0.256 1
1 132 . 9 1 1 A 14 14 LYS C C 14 171.343 175.764 -4.421 1
1 133 . 9 1 1 A 14 14 LYS CA C 14 53.879 54.586 -0.707 1
1 134 . 9 1 1 A 14 14 LYS CB C 14 36.032 35.932 0.100 1
1 138 . 9 1 1 A 14 14 LYS N N 14 118.322 120.497 -2.175 1
1 139 . 9 1 1 A 15 15 VAL H H 15 9.206 9.321 -0.115 1
1 140 . 9 1 1 A 15 15 VAL HA H 15 4.400 4.305 0.095 1
1 148 . 9 1 1 A 15 15 VAL C C 15 176.306 176.876 -0.570 1
1 149 . 9 1 1 A 15 15 VAL CA C 15 63.648 63.307 0.341 1
1 150 . 9 1 1 A 15 15 VAL CB C 15 31.769 31.413 0.356 1
1 153 . 9 1 1 A 15 15 VAL N N 15 125.308 123.560 1.748 1
1 154 . 9 1 1 A 16 16 THR H H 16 9.403 9.151 0.252 1
1 155 . 9 1 1 A 16 16 THR HA H 16 4.562 4.662 -0.100 1
1 160 . 9 1 1 A 16 16 THR C C 16 178.098 174.673 3.425 1
1 161 . 9 1 1 A 16 16 THR CA C 16 62.018 61.761 0.257 1
1 162 . 9 1 1 A 16 16 THR CB C 16 69.720 69.787 -0.067 1
1 164 . 9 1 1 A 16 16 THR N N 16 121.753 117.893 3.860 1
1 165 . 9 1 1 A 17 17 GLY H H 17 7.600 7.073 0.527 1
1 166 . 9 1 1 A 17 17 GLY HA2 H 17 4.110 4.091 0.019 1
1 167 . 9 1 1 A 17 17 GLY HA3 H 17 4.250 4.182 0.068 1
1 168 . 9 1 1 A 17 17 GLY C C 17 175.551 171.473 4.078 1
1 169 . 9 1 1 A 17 17 GLY CA C 17 46.258 45.581 0.677 1
1 170 . 9 1 1 A 17 17 GLY N N 17 109.407 108.755 0.652 1
1 171 . 9 1 1 A 18 18 LEU H H 18 8.820 8.498 0.322 1
1 172 . 9 1 1 A 18 18 LEU HA H 18 4.852 5.167 -0.315 1
1 182 . 9 1 1 A 18 18 LEU CA C 18 54.245 53.279 0.966 1
1 183 . 9 1 1 A 18 18 LEU CB C 18 44.906 46.182 -1.276 1
1 187 . 9 1 1 A 18 18 LEU N N 18 123.419 121.673 1.746 1
1 188 . 9 1 1 A 19 19 GLN H H 19 8.537 8.045 0.492 1
1 189 . 9 1 1 A 19 19 GLN HA H 19 4.520 4.724 -0.204 1
1 196 . 9 1 1 A 19 19 GLN C C 19 175.258 175.628 -0.370 1
1 197 . 9 1 1 A 19 19 GLN CA C 19 53.269 53.672 -0.403 1
1 198 . 9 1 1 A 19 19 GLN CB C 19 31.522 32.461 -0.939 1
1 200 . 9 1 1 A 19 19 GLN N N 19 120.187 120.823 -0.636 1
1 202 . 9 1 1 A 20 20 ALA H H 20 8.798 8.621 0.177 1
1 203 . 9 1 1 A 20 20 ALA HA H 20 4.010 4.091 -0.081 1
1 207 . 9 1 1 A 20 20 ALA C C 20 175.698 177.212 -1.514 1
1 208 . 9 1 1 A 20 20 ALA CA C 20 55.084 54.367 0.717 1
1 209 . 9 1 1 A 20 20 ALA CB C 20 18.277 18.697 -0.420 1
1 210 . 9 1 1 A 20 20 ALA N N 20 120.606 123.689 -3.083 1
1 211 . 9 1 1 A 21 21 TYR H H 21 6.618 7.638 -1.020 1
1 212 . 9 1 1 A 21 21 TYR HA H 21 4.540 4.666 -0.126 1
1 216 . 9 1 1 A 21 21 TYR C C 21 178.437 174.826 3.611 1
1 217 . 9 1 1 A 21 21 TYR CA C 21 55.120 56.645 -1.525 1
1 218 . 9 1 1 A 21 21 TYR CB C 21 37.891 40.501 -2.610 1
1 219 . 9 1 1 A 21 21 TYR N N 21 105.570 113.354 -7.784 1
1 220 . 9 1 1 A 22 22 GLY H H 22 7.203 6.814 0.389 1
1 221 . 9 1 1 A 22 22 GLY HA2 H 22 3.460 3.692 -0.232 1
1 222 . 9 1 1 A 22 22 GLY HA3 H 22 4.360 3.837 0.523 1
1 223 . 9 1 1 A 22 22 GLY C C 22 175.833 171.203 4.630 1
1 224 . 9 1 1 A 22 22 GLY CA C 22 46.356 45.501 0.855 1
1 225 . 9 1 1 A 22 22 GLY N N 22 109.854 108.609 1.245 1
1 226 . 9 1 1 A 23 23 ALA H H 23 8.549 8.428 0.121 1
1 227 . 9 1 1 A 23 23 ALA HA H 23 4.981 5.124 -0.143 1
1 231 . 9 1 1 A 23 23 ALA C C 23 168.810 175.870 -7.060 1
1 232 . 9 1 1 A 23 23 ALA CA C 23 49.178 50.848 -1.670 1
1 233 . 9 1 1 A 23 23 ALA CB C 23 22.797 21.817 0.980 1
1 234 . 9 1 1 A 23 23 ALA N N 23 118.749 122.188 -3.439 1
1 235 . 9 1 1 A 24 24 PHE H H 24 8.812 8.563 0.249 1
1 236 . 9 1 1 A 24 24 PHE HA H 24 5.125 4.872 0.253 1
1 240 . 9 1 1 A 24 24 PHE CA C 24 58.017 58.087 -0.070 1
1 241 . 9 1 1 A 24 24 PHE CB C 24 40.475 40.490 -0.015 1
1 242 . 9 1 1 A 24 24 PHE N N 24 122.891 122.082 0.809 1
1 243 . 9 1 1 A 25 25 VAL H H 25 8.880 9.006 -0.126 1
1 244 . 9 1 1 A 25 25 VAL HA H 25 4.660 4.684 -0.024 1
1 252 . 9 1 1 A 25 25 VAL CA C 25 60.379 61.103 -0.724 1
1 253 . 9 1 1 A 25 25 VAL CB C 25 35.654 35.001 0.653 1
1 256 . 9 1 1 A 25 25 VAL N N 25 122.908 121.116 1.792 1
1 257 . 9 1 1 A 26 26 ALA H H 26 9.403 8.734 0.669 1
1 258 . 9 1 1 A 26 26 ALA HA H 26 4.750 4.349 0.401 1
1 262 . 9 1 1 A 26 26 ALA C C 26 174.445 176.871 -2.426 1
1 263 . 9 1 1 A 26 26 ALA CA C 26 51.711 52.644 -0.933 1
1 264 . 9 1 1 A 26 26 ALA CB C 26 19.319 19.045 0.274 1
1 265 . 9 1 1 A 26 26 ALA N N 26 129.425 130.633 -1.208 1
1 266 . 9 1 1 A 27 27 LEU H H 27 8.601 9.240 -0.639 1
1 267 . 9 1 1 A 27 27 LEU HA H 27 4.158 4.596 -0.438 1
1 277 . 9 1 1 A 27 27 LEU C C 27 177.814 176.372 1.442 1
1 278 . 9 1 1 A 27 27 LEU CA C 27 55.869 55.746 0.123 1
1 279 . 9 1 1 A 27 27 LEU CB C 27 42.251 43.638 -1.387 1
1 283 . 9 1 1 A 27 27 LEU N N 27 127.169 123.204 3.965 1
1 284 . 9 1 1 A 28 28 ASP H H 28 8.172 7.854 0.318 1
1 285 . 9 1 1 A 28 28 ASP HA H 28 4.420 4.858 -0.438 1
1 288 . 9 1 1 A 28 28 ASP C C 28 177.116 175.448 1.668 1
1 289 . 9 1 1 A 28 28 ASP CA C 28 53.755 53.610 0.145 1
1 290 . 9 1 1 A 28 28 ASP CB C 28 39.833 43.665 -3.832 1
1 291 . 9 1 1 A 28 28 ASP N N 28 115.657 117.218 -1.561 1
1 292 . 9 1 1 A 29 29 GLU H H 29 8.857 8.636 0.221 1
1 293 . 9 1 1 A 29 29 GLU HA H 29 4.090 4.117 -0.027 1
1 298 . 9 1 1 A 29 29 GLU C C 29 175.965 176.702 -0.737 1
1 299 . 9 1 1 A 29 29 GLU CA C 29 59.470 58.950 0.520 1
1 300 . 9 1 1 A 29 29 GLU CB C 29 29.409 29.300 0.109 1
1 302 . 9 1 1 A 29 29 GLU N N 29 114.738 122.029 -7.291 1
1 303 . 9 1 1 A 30 30 GLU H H 30 8.326 8.278 0.048 1
1 304 . 9 1 1 A 30 30 GLU HA H 30 4.640 4.562 0.078 1
1 309 . 9 1 1 A 30 30 GLU C C 30 176.817 175.149 1.668 1
1 310 . 9 1 1 A 30 30 GLU CA C 30 56.073 55.972 0.101 1
1 311 . 9 1 1 A 30 30 GLU CB C 30 32.453 31.445 1.008 1
1 313 . 9 1 1 A 30 30 GLU N N 30 115.753 117.480 -1.727 1
1 314 . 9 1 1 A 31 31 THR H H 31 7.819 7.618 0.201 1
1 315 . 9 1 1 A 31 31 THR HA H 31 4.484 5.114 -0.630 1
1 320 . 9 1 1 A 31 31 THR C C 31 176.330 172.997 3.333 1
1 321 . 9 1 1 A 31 31 THR CA C 31 63.398 61.123 2.275 1
1 322 . 9 1 1 A 31 31 THR CB C 31 69.367 72.903 -3.536 1
1 324 . 9 1 1 A 31 31 THR N N 31 118.750 115.442 3.308 1
1 325 . 9 1 1 A 32 32 GLN H H 32 8.913 8.678 0.235 1
1 326 . 9 1 1 A 32 32 GLN HA H 32 5.337 4.939 0.398 1
1 333 . 9 1 1 A 32 32 GLN C C 32 173.087 174.488 -1.401 1
1 334 . 9 1 1 A 32 32 GLN CA C 32 54.051 54.695 -0.644 1
1 335 . 9 1 1 A 32 32 GLN CB C 32 32.672 32.837 -0.165 1
1 337 . 9 1 1 A 32 32 GLN N N 32 127.294 124.934 2.360 1
1 339 . 9 1 1 A 33 33 GLY H H 33 8.900 8.556 0.344 1
1 340 . 9 1 1 A 33 33 GLY HA2 H 33 3.290 4.349 -1.059 1
1 341 . 9 1 1 A 33 33 GLY HA3 H 33 4.530 4.417 0.113 1
1 342 . 9 1 1 A 33 33 GLY C C 33 174.918 172.260 2.658 1
1 343 . 9 1 1 A 33 33 GLY CA C 33 44.534 44.782 -0.248 1
1 344 . 9 1 1 A 33 33 GLY N N 33 107.639 110.865 -3.226 1
1 345 . 9 1 1 A 34 34 LEU H H 34 8.127 8.498 -0.371 1
1 346 . 9 1 1 A 34 34 LEU HA H 34 4.950 4.831 0.119 1
1 356 . 9 1 1 A 34 34 LEU CA C 34 53.755 53.806 -0.051 1
1 357 . 9 1 1 A 34 34 LEU CB C 34 45.493 45.145 0.348 1
1 361 . 9 1 1 A 34 34 LEU N N 34 120.897 120.942 -0.045 1
1 362 . 9 1 1 A 35 35 VAL H H 35 9.386 8.837 0.549 1
1 363 . 9 1 1 A 35 35 VAL HA H 35 4.479 4.356 0.123 1
1 371 . 9 1 1 A 35 35 VAL C C 35 176.402 175.753 0.649 1
1 372 . 9 1 1 A 35 35 VAL CA C 35 59.594 63.064 -3.470 1
1 373 . 9 1 1 A 35 35 VAL CB C 35 32.590 31.462 1.128 1
1 376 . 9 1 1 A 35 35 VAL N N 35 128.897 127.683 1.214 1
1 377 . 9 1 1 A 36 36 HIS H H 36 9.194 8.888 0.306 1
1 378 . 9 1 1 A 36 36 HIS HA H 36 4.487 4.549 -0.062 1
1 381 . 9 1 1 A 36 36 HIS C C 36 174.864 176.103 -1.239 1
1 382 . 9 1 1 A 36 36 HIS CA C 36 59.426 56.708 2.718 1
1 383 . 9 1 1 A 36 36 HIS CB C 36 31.542 30.865 0.677 1
1 384 . 9 1 1 A 36 36 HIS N N 36 127.751 126.882 0.869 1
1 385 . 9 1 1 A 37 37 ILE H H 37 7.454 8.447 -0.993 1
1 386 . 9 1 1 A 37 37 ILE HA H 37 3.810 3.603 0.207 1
1 396 . 9 1 1 A 37 37 ILE C C 37 176.948 177.765 -0.817 1
1 397 . 9 1 1 A 37 37 ILE CA C 37 63.773 64.788 -1.015 1
1 398 . 9 1 1 A 37 37 ILE CB C 37 38.993 37.360 1.633 1
1 402 . 9 1 1 A 37 37 ILE N N 37 126.266 127.038 -0.772 1
1 403 . 9 1 1 A 38 38 SER H H 38 8.343 8.257 0.086 1
1 404 . 9 1 1 A 38 38 SER HA H 38 4.370 4.345 0.025 1
1 407 . 9 1 1 A 38 38 SER C C 38 174.792 174.968 -0.176 1
1 408 . 9 1 1 A 38 38 SER CA C 38 60.567 61.502 -0.935 1
1 409 . 9 1 1 A 38 38 SER CB C 38 63.632 63.012 0.620 1
1 410 . 9 1 1 A 38 38 SER N N 38 118.079 118.445 -0.366 1
1 411 . 9 1 1 A 39 39 GLU H H 39 8.536 7.995 0.541 1
1 412 . 9 1 1 A 39 39 GLU HA H 39 4.503 4.579 -0.076 1
1 417 . 9 1 1 A 39 39 GLU C C 39 175.131 176.759 -1.628 1
1 418 . 9 1 1 A 39 39 GLU CA C 39 54.928 56.133 -1.205 1
1 419 . 9 1 1 A 39 39 GLU CB C 39 29.621 30.623 -1.002 1
1 421 . 9 1 1 A 39 39 GLU N N 39 118.349 117.435 0.914 1
1 422 . 9 1 1 A 40 40 VAL H H 40 7.776 7.829 -0.053 1
1 423 . 9 1 1 A 40 40 VAL HA H 40 3.616 3.945 -0.329 1
1 431 . 9 1 1 A 40 40 VAL C C 40 177.277 176.260 1.017 1
1 432 . 9 1 1 A 40 40 VAL CA C 40 66.245 64.287 1.958 1
1 433 . 9 1 1 A 40 40 VAL CB C 40 32.590 32.179 0.411 1
1 436 . 9 1 1 A 40 40 VAL N N 40 125.443 116.989 8.454 1
1 437 . 9 1 1 A 41 41 THR H H 41 7.888 7.724 0.164 1
1 438 . 9 1 1 A 41 41 THR HA H 41 4.345 4.885 -0.540 1
1 443 . 9 1 1 A 41 41 THR C C 41 173.492 174.399 -0.907 1
1 444 . 9 1 1 A 41 41 THR CA C 41 59.047 61.339 -2.292 1
1 445 . 9 1 1 A 41 41 THR CB C 41 68.992 72.820 -3.828 1
1 447 . 9 1 1 A 41 41 THR N N 41 109.905 112.995 -3.090 1
1 448 . 9 1 1 A 42 42 HIS H H 42 8.063 8.734 -0.671 1
1 449 . 9 1 1 A 42 42 HIS HA H 42 4.510 4.318 0.192 1
1 452 . 9 1 1 A 42 42 HIS C C 42 172.139 175.770 -3.631 1
1 453 . 9 1 1 A 42 42 HIS CA C 42 57.735 59.270 -1.535 1
1 454 . 9 1 1 A 42 42 HIS CB C 42 31.144 30.147 0.997 1
1 455 . 9 1 1 A 42 42 HIS N N 42 121.760 124.459 -2.699 1
1 456 . 9 1 1 A 43 43 GLY H H 43 8.286 7.715 0.571 1
1 457 . 9 1 1 A 43 43 GLY HA2 H 43 3.980 4.063 -0.083 1
1 458 . 9 1 1 A 43 43 GLY HA3 H 43 3.980 4.087 -0.107 1
1 459 . 9 1 1 A 43 43 GLY C C 43 176.307 172.811 3.496 1
1 460 . 9 1 1 A 43 43 GLY CA C 43 44.336 44.634 -0.298 1
1 461 . 9 1 1 A 43 43 GLY N N 43 110.133 107.086 3.047 1
1 462 . 9 1 1 A 44 44 PHE H H 44 8.327 8.680 -0.353 1
1 463 . 9 1 1 A 44 44 PHE HA H 44 4.489 4.552 -0.063 1
1 467 . 9 1 1 A 44 44 PHE C C 44 171.877 174.388 -2.511 1
1 468 . 9 1 1 A 44 44 PHE CA C 44 58.027 57.527 0.500 1
1 469 . 9 1 1 A 44 44 PHE CB C 44 39.850 39.363 0.487 1
1 470 . 9 1 1 A 44 44 PHE N N 44 120.049 121.351 -1.302 1
1 471 . 9 1 1 A 45 45 VAL H H 45 7.939 8.462 -0.523 1
1 472 . 9 1 1 A 45 45 VAL HA H 45 3.865 3.182 0.683 1
1 480 . 9 1 1 A 45 45 VAL C C 45 175.523 175.625 -0.102 1
1 481 . 9 1 1 A 45 45 VAL CA C 45 61.536 61.116 0.420 1
1 482 . 9 1 1 A 45 45 VAL CB C 45 33.127 30.277 2.850 1
1 485 . 9 1 1 A 45 45 VAL N N 45 127.882 127.695 0.187 1
1 486 . 9 1 1 A 46 46 LYS H H 46 8.868 7.584 1.284 1
1 487 . 9 1 1 A 46 46 LYS HA H 46 4.170 3.079 1.091 1
1 496 . 9 1 1 A 46 46 LYS C C 46 175.728 175.798 -0.070 1
1 497 . 9 1 1 A 46 46 LYS CA C 46 57.198 58.117 -0.919 1
1 498 . 9 1 1 A 46 46 LYS CB C 46 33.299 32.099 1.200 1
1 502 . 9 1 1 A 46 46 LYS N N 46 127.308 125.638 1.670 1
1 503 . 9 1 1 A 47 47 ASP H H 47 7.652 7.697 -0.045 1
1 504 . 9 1 1 A 47 47 ASP HA H 47 4.710 4.783 -0.073 1
1 507 . 9 1 1 A 47 47 ASP C C 47 176.411 176.063 0.348 1
1 508 . 9 1 1 A 47 47 ASP CA C 47 53.390 53.679 -0.289 1
1 509 . 9 1 1 A 47 47 ASP CB C 47 42.635 42.681 -0.046 1
1 510 . 9 1 1 A 47 47 ASP N N 47 117.932 118.629 -0.697 1
1 511 . 9 1 1 A 48 48 ILE H H 48 9.230 8.631 0.599 1
1 512 . 9 1 1 A 48 48 ILE HA H 48 3.579 3.887 -0.308 1
1 522 . 9 1 1 A 48 48 ILE C C 48 177.249 177.653 -0.404 1
1 523 . 9 1 1 A 48 48 ILE CA C 48 65.525 63.630 1.895 1
1 524 . 9 1 1 A 48 48 ILE CB C 48 38.797 37.992 0.805 1
1 528 . 9 1 1 A 48 48 ILE N N 48 129.049 126.881 2.168 1
1 529 . 9 1 1 A 49 49 ASN H H 49 8.468 8.197 0.271 1
1 530 . 9 1 1 A 49 49 ASN HA H 49 4.690 4.614 0.076 1
1 535 . 9 1 1 A 49 49 ASN C C 49 175.779 176.303 -0.524 1
1 536 . 9 1 1 A 49 49 ASN CA C 49 55.587 55.242 0.345 1
1 537 . 9 1 1 A 49 49 ASN CB C 49 38.587 38.150 0.437 1
1 538 . 9 1 1 A 49 49 ASN N N 49 118.835 119.087 -0.252 1
1 540 . 9 1 1 A 50 50 GLU H H 50 7.853 7.911 -0.058 1
1 541 . 9 1 1 A 50 50 GLU HA H 50 4.040 4.487 -0.447 1
1 546 . 9 1 1 A 50 50 GLU C C 50 176.148 177.025 -0.877 1
1 547 . 9 1 1 A 50 50 GLU CA C 50 57.404 56.297 1.107 1
1 548 . 9 1 1 A 50 50 GLU CB C 50 29.491 30.970 -1.479 1
1 550 . 9 1 1 A 50 50 GLU N N 50 116.358 116.813 -0.455 1
1 551 . 9 1 1 A 51 51 HIS H H 51 7.575 7.785 -0.210 1
1 552 . 9 1 1 A 51 51 HIS HA H 51 4.431 4.741 -0.310 1
1 555 . 9 1 1 A 51 51 HIS C C 51 176.383 174.578 1.805 1
1 556 . 9 1 1 A 51 51 HIS CA C 51 57.089 56.293 0.796 1
1 557 . 9 1 1 A 51 51 HIS CB C 51 33.168 31.780 1.388 1
1 558 . 9 1 1 A 51 51 HIS N N 51 115.828 115.513 0.315 1
1 559 . 9 1 1 A 52 52 LEU H H 52 7.640 7.576 0.064 1
1 560 . 9 1 1 A 52 52 LEU HA H 52 4.796 4.661 0.135 1
1 570 . 9 1 1 A 52 52 LEU C C 52 174.452 174.652 -0.200 1
1 571 . 9 1 1 A 52 52 LEU CA C 52 53.398 53.857 -0.459 1
1 572 . 9 1 1 A 52 52 LEU CB C 52 48.805 45.135 3.670 1
1 576 . 9 1 1 A 52 52 LEU N N 52 117.932 119.363 -1.431 1
1 577 . 9 1 1 A 53 53 SER H H 53 8.151 8.459 -0.308 1
1 578 . 9 1 1 A 53 53 SER HA H 53 4.680 4.910 -0.230 1
1 581 . 9 1 1 A 53 53 SER C C 53 174.304 172.980 1.324 1
1 582 . 9 1 1 A 53 53 SER CA C 53 56.714 57.691 -0.977 1
1 583 . 9 1 1 A 53 53 SER CB C 53 65.431 66.323 -0.892 1
1 584 . 9 1 1 A 53 53 SER N N 53 113.496 116.548 -3.052 1
1 585 . 9 1 1 A 54 54 VAL H H 54 8.782 8.524 0.258 1
1 586 . 9 1 1 A 54 54 VAL HA H 54 3.230 3.786 -0.556 1
1 594 . 9 1 1 A 54 54 VAL C C 54 173.745 177.220 -3.475 1
1 595 . 9 1 1 A 54 54 VAL CA C 54 66.232 63.553 2.679 1
1 596 . 9 1 1 A 54 54 VAL CB C 54 31.067 31.652 -0.585 1
1 599 . 9 1 1 A 54 54 VAL N N 54 124.401 126.371 -1.970 1
1 600 . 9 1 1 A 55 55 GLY H H 55 9.079 9.000 0.079 1
1 601 . 9 1 1 A 55 55 GLY HA2 H 55 3.530 3.862 -0.332 1
1 602 . 9 1 1 A 55 55 GLY HA3 H 55 4.553 3.864 0.689 1
1 603 . 9 1 1 A 55 55 GLY C C 55 177.219 173.190 4.029 1
1 604 . 9 1 1 A 55 55 GLY CA C 55 44.647 46.274 -1.627 1
1 605 . 9 1 1 A 55 55 GLY N N 55 117.320 115.955 1.365 1
1 606 . 9 1 1 A 56 56 ASP H H 56 7.943 7.725 0.218 1
1 607 . 9 1 1 A 56 56 ASP HA H 56 4.460 5.175 -0.715 1
1 610 . 9 1 1 A 56 56 ASP C C 56 176.055 173.683 2.372 1
1 611 . 9 1 1 A 56 56 ASP CA C 56 55.456 52.460 2.996 1
1 612 . 9 1 1 A 56 56 ASP CB C 56 40.914 44.998 -4.084 1
1 613 . 9 1 1 A 56 56 ASP N N 56 121.782 119.584 2.198 1
1 614 . 9 1 1 A 57 57 GLU H H 57 8.649 8.681 -0.032 1
1 615 . 9 1 1 A 57 57 GLU HA H 57 5.100 5.146 -0.046 1
1 620 . 9 1 1 A 57 57 GLU C C 57 175.635 176.051 -0.416 1
1 621 . 9 1 1 A 57 57 GLU CA C 57 55.805 55.629 0.176 1
1 622 . 9 1 1 A 57 57 GLU CB C 57 30.915 31.340 -0.425 1
1 624 . 9 1 1 A 57 57 GLU N N 57 122.513 123.195 -0.682 1
1 625 . 9 1 1 A 58 58 VAL H H 58 8.809 9.165 -0.356 1
1 626 . 9 1 1 A 58 58 VAL HA H 58 4.817 4.818 -0.001 1
1 634 . 9 1 1 A 58 58 VAL C C 58 176.528 173.512 3.016 1
1 635 . 9 1 1 A 58 58 VAL CA C 58 58.719 59.136 -0.417 1
1 636 . 9 1 1 A 58 58 VAL CB C 58 35.523 35.980 -0.457 1
1 639 . 9 1 1 A 58 58 VAL N N 58 118.382 119.491 -1.109 1
1 640 . 9 1 1 A 59 59 GLN H H 59 8.255 8.883 -0.628 1
1 641 . 9 1 1 A 59 59 GLN HA H 59 5.030 5.226 -0.196 1
1 646 . 9 1 1 A 59 59 GLN CA C 59 54.843 54.483 0.360 1
1 647 . 9 1 1 A 59 59 GLN CB C 59 30.111 31.348 -1.237 1
1 649 . 9 1 1 A 59 59 GLN N N 59 120.933 122.636 -1.703 1
1 650 . 9 1 1 A 60 60 VAL H H 60 8.970 9.402 -0.432 1
1 651 . 9 1 1 A 60 60 VAL HA H 60 4.990 4.955 0.035 1
1 659 . 9 1 1 A 60 60 VAL C C 60 175.203 174.024 1.179 1
1 660 . 9 1 1 A 60 60 VAL CA C 60 57.404 59.039 -1.635 1
1 661 . 9 1 1 A 60 60 VAL CB C 60 35.771 35.418 0.353 1
1 664 . 9 1 1 A 60 60 VAL N N 60 111.046 120.605 -9.559 1
1 665 . 9 1 1 A 61 61 LYS H H 61 8.937 8.734 0.203 1
1 666 . 9 1 1 A 61 61 LYS HA H 61 5.100 4.790 0.310 1
1 675 . 9 1 1 A 61 61 LYS C C 61 173.610 176.377 -2.767 1
1 676 . 9 1 1 A 61 61 LYS CA C 61 53.762 54.830 -1.068 1
1 677 . 9 1 1 A 61 61 LYS CB C 61 36.273 34.231 2.042 1
1 681 . 9 1 1 A 61 61 LYS N N 61 121.930 123.600 -1.670 1
1 682 . 9 1 1 A 62 62 VAL H H 62 8.429 9.325 -0.896 1
1 683 . 9 1 1 A 62 62 VAL HA H 62 4.074 4.026 0.048 1
1 691 . 9 1 1 A 62 62 VAL C C 62 176.912 176.012 0.900 1
1 692 . 9 1 1 A 62 62 VAL CA C 62 63.188 63.455 -0.267 1
1 693 . 9 1 1 A 62 62 VAL CB C 62 30.813 31.151 -0.338 1
1 696 . 9 1 1 A 62 62 VAL N N 62 126.329 127.041 -0.712 1
1 697 . 9 1 1 A 63 63 LEU H H 63 9.109 8.970 0.139 1
1 698 . 9 1 1 A 63 63 LEU HA H 63 4.423 4.383 0.040 1
1 708 . 9 1 1 A 63 63 LEU C C 63 176.091 176.324 -0.233 1
1 709 . 9 1 1 A 63 63 LEU CA C 63 55.876 56.780 -0.904 1
1 710 . 9 1 1 A 63 63 LEU CB C 63 42.800 42.992 -0.192 1
1 714 . 9 1 1 A 63 63 LEU N N 63 129.436 130.120 -0.684 1
1 715 . 9 1 1 A 64 64 ALA H H 64 7.594 7.349 0.245 1
1 716 . 9 1 1 A 64 64 ALA HA H 64 4.455 4.732 -0.277 1
1 720 . 9 1 1 A 64 64 ALA C C 64 177.314 175.102 2.212 1
1 721 . 9 1 1 A 64 64 ALA CA C 64 52.557 51.687 0.870 1
1 722 . 9 1 1 A 64 64 ALA CB C 64 21.458 22.711 -1.253 1
1 723 . 9 1 1 A 64 64 ALA N N 64 117.791 118.291 -0.500 1
1 724 . 9 1 1 A 65 65 VAL H H 65 8.583 8.574 0.009 1
1 725 . 9 1 1 A 65 65 VAL HA H 65 4.470 4.857 -0.387 1
1 733 . 9 1 1 A 65 65 VAL C C 65 174.697 174.992 -0.295 1
1 734 . 9 1 1 A 65 65 VAL CA C 65 61.936 60.841 1.095 1
1 735 . 9 1 1 A 65 65 VAL CB C 65 35.288 35.535 -0.247 1
1 738 . 9 1 1 A 65 65 VAL N N 65 120.009 119.827 0.182 1
1 739 . 9 1 1 A 66 66 ASP H H 66 8.567 8.819 -0.252 1
1 740 . 9 1 1 A 66 66 ASP HA H 66 4.880 4.997 -0.117 1
1 743 . 9 1 1 A 66 66 ASP C C 66 174.355 176.104 -1.749 1
1 744 . 9 1 1 A 66 66 ASP CA C 66 52.681 52.899 -0.218 1
1 745 . 9 1 1 A 66 66 ASP CB C 66 41.775 41.050 0.725 1
1 746 . 9 1 1 A 66 66 ASP N N 66 126.262 125.727 0.535 1
1 747 . 9 1 1 A 67 67 GLU H H 67 9.148 8.257 0.891 1
1 748 . 9 1 1 A 67 67 GLU HA H 67 4.110 3.968 0.142 1
1 753 . 9 1 1 A 67 67 GLU C C 67 177.052 178.261 -1.209 1
1 754 . 9 1 1 A 67 67 GLU CA C 67 59.044 59.025 0.019 1
1 755 . 9 1 1 A 67 67 GLU CB C 67 29.919 29.810 0.109 1
1 757 . 9 1 1 A 67 67 GLU N N 67 125.480 124.655 0.825 1
1 758 . 9 1 1 A 68 68 GLU H H 68 8.384 8.405 -0.021 1
1 759 . 9 1 1 A 68 68 GLU HA H 68 4.140 4.099 0.041 1
1 764 . 9 1 1 A 68 68 GLU C C 68 178.383 178.621 -0.238 1
1 765 . 9 1 1 A 68 68 GLU CA C 68 59.044 59.161 -0.117 1
1 766 . 9 1 1 A 68 68 GLU CB C 68 29.919 29.358 0.561 1
1 768 . 9 1 1 A 68 68 GLU N N 68 119.760 118.481 1.279 1
1 769 . 9 1 1 A 69 69 LYS H H 69 7.799 7.470 0.329 1
1 770 . 9 1 1 A 69 69 LYS HA H 69 4.375 4.205 0.170 1
1 779 . 9 1 1 A 69 69 LYS C C 69 178.297 176.552 1.745 1
1 780 . 9 1 1 A 69 69 LYS CA C 69 55.704 57.622 -1.918 1
1 781 . 9 1 1 A 69 69 LYS CB C 69 33.622 33.861 -0.239 1
1 785 . 9 1 1 A 69 69 LYS N N 69 115.476 118.448 -2.972 1
1 786 . 9 1 1 A 70 70 GLY H H 70 7.994 8.551 -0.557 1
1 787 . 9 1 1 A 70 70 GLY HA2 H 70 3.940 4.053 -0.113 1
1 788 . 9 1 1 A 70 70 GLY HA3 H 70 3.960 4.058 -0.098 1
1 789 . 9 1 1 A 70 70 GLY C C 70 177.215 173.665 3.550 1
1 790 . 9 1 1 A 70 70 GLY CA C 70 46.773 45.288 1.485 1
1 791 . 9 1 1 A 70 70 GLY N N 70 110.245 107.294 2.951 1
1 792 . 9 1 1 A 71 71 LYS H H 71 7.560 7.599 -0.039 1
1 793 . 9 1 1 A 71 71 LYS HA H 71 4.690 4.973 -0.283 1
1 802 . 9 1 1 A 71 71 LYS C C 71 174.607 174.917 -0.310 1
1 803 . 9 1 1 A 71 71 LYS CA C 71 55.332 54.099 1.233 1
1 804 . 9 1 1 A 71 71 LYS CB C 71 34.903 36.946 -2.043 1
1 808 . 9 1 1 A 71 71 LYS N N 71 118.201 114.731 3.470 1
1 809 . 9 1 1 A 72 72 ILE H H 72 8.867 8.577 0.290 1
1 810 . 9 1 1 A 72 72 ILE HA H 72 4.630 4.828 -0.198 1
1 820 . 9 1 1 A 72 72 ILE C C 72 175.708 174.696 1.012 1
1 821 . 9 1 1 A 72 72 ILE CA C 72 61.494 59.974 1.520 1
1 822 . 9 1 1 A 72 72 ILE CB C 72 40.652 42.285 -1.633 1
1 826 . 9 1 1 A 72 72 ILE N N 72 126.827 120.692 6.135 1
1 827 . 9 1 1 A 73 73 SER H H 73 8.815 8.875 -0.060 1
1 828 . 9 1 1 A 73 73 SER HA H 73 5.110 5.408 -0.298 1
1 831 . 9 1 1 A 73 73 SER C C 73 175.122 173.020 2.102 1
1 832 . 9 1 1 A 73 73 SER CA C 73 57.487 57.392 0.095 1
1 833 . 9 1 1 A 73 73 SER CB C 73 64.386 65.781 -1.395 1
1 834 . 9 1 1 A 73 73 SER N N 73 123.640 123.707 -0.067 1
1 835 . 9 1 1 A 74 74 LEU H H 74 8.585 8.906 -0.321 1
1 836 . 9 1 1 A 74 74 LEU HA H 74 5.450 5.318 0.132 1
1 846 . 9 1 1 A 74 74 LEU C C 74 174.061 175.360 -1.299 1
1 847 . 9 1 1 A 74 74 LEU CA C 74 53.101 53.488 -0.387 1
1 848 . 9 1 1 A 74 74 LEU CB C 74 48.268 46.767 1.501 1
1 852 . 9 1 1 A 74 74 LEU N N 74 125.221 124.064 1.157 1
1 853 . 9 1 1 A 75 75 SER H H 75 8.840 8.711 0.129 1
1 854 . 9 1 1 A 75 75 SER HA H 75 5.040 5.302 -0.262 1
1 857 . 9 1 1 A 75 75 SER C C 75 176.552 173.860 2.692 1
1 858 . 9 1 1 A 75 75 SER CA C 75 57.487 56.270 1.217 1
1 859 . 9 1 1 A 75 75 SER CB C 75 64.993 66.570 -1.577 1
1 860 . 9 1 1 A 75 75 SER N N 75 111.252 113.119 -1.867 1
1 861 . 9 1 1 A 76 76 ILE H H 76 7.790 8.832 -1.042 1
1 862 . 9 1 1 A 76 76 ILE HA H 76 4.690 4.506 0.184 1
1 872 . 9 1 1 A 76 76 ILE C C 76 175.780 177.326 -1.546 1
1 873 . 9 1 1 A 76 76 ILE CA C 76 63.631 62.363 1.268 1
1 874 . 9 1 1 A 76 76 ILE CB C 76 39.484 40.009 -0.525 1
1 878 . 9 1 1 A 76 76 ILE N N 76 129.205 120.009 9.196 1
1 879 . 9 1 1 A 77 77 ARG H H 77 8.115 8.565 -0.450 1
1 880 . 9 1 1 A 77 77 ARG HA H 77 3.760 4.104 -0.344 1
1 887 . 9 1 1 A 77 77 ARG C C 77 178.704 178.206 0.498 1
1 888 . 9 1 1 A 77 77 ARG CA C 77 58.933 58.636 0.297 1
1 889 . 9 1 1 A 77 77 ARG CB C 77 29.463 29.746 -0.283 1
1 892 . 9 1 1 A 77 77 ARG N N 77 123.257 122.089 1.168 1
1 893 . 9 1 1 A 78 78 ALA H H 78 8.304 7.981 0.323 1
1 894 . 9 1 1 A 78 78 ALA HA H 78 4.296 4.069 0.227 1
1 898 . 9 1 1 A 78 78 ALA C C 78 176.870 179.806 -2.936 1
1 899 . 9 1 1 A 78 78 ALA CA C 78 53.548 55.277 -1.729 1
1 900 . 9 1 1 A 78 78 ALA CB C 78 19.872 18.228 1.644 1
1 901 . 9 1 1 A 78 78 ALA N N 78 118.764 122.162 -3.398 1
1 902 . 9 1 1 A 79 79 THR H H 79 7.931 7.670 0.261 1
1 903 . 9 1 1 A 79 79 THR HA H 79 4.370 4.175 0.195 1
1 908 . 9 1 1 A 79 79 THR C C 79 178.356 175.980 2.376 1
1 909 . 9 1 1 A 79 79 THR CA C 79 62.381 64.618 -2.237 1
1 910 . 9 1 1 A 79 79 THR CB C 79 69.693 69.079 0.614 1
1 912 . 9 1 1 A 79 79 THR N N 79 107.360 110.677 -3.317 1
1 913 . 9 1 1 A 80 80 GLN H H 80 7.651 8.396 -0.745 1
1 914 . 9 1 1 A 80 80 GLN HA H 80 4.527 4.291 0.236 1
1 921 . 9 1 1 A 80 80 GLN C C 80 174.249 177.497 -3.248 1
1 922 . 9 1 1 A 80 80 GLN CA C 80 54.760 56.827 -2.067 1
1 923 . 9 1 1 A 80 80 GLN CB C 80 30.565 28.271 2.294 1
1 925 . 9 1 1 A 80 80 GLN N N 80 121.588 120.157 1.431 1
1 927 . 9 1 1 A 81 81 ALA H H 81 8.498 7.780 0.718 1
1 928 . 9 1 1 A 81 81 ALA HA H 81 4.252 4.290 -0.038 1
1 932 . 9 1 1 A 81 81 ALA C C 81 175.693 177.897 -2.204 1
1 933 . 9 1 1 A 81 81 ALA CA C 81 52.345 53.301 -0.956 1
1 934 . 9 1 1 A 81 81 ALA CB C 81 19.062 18.927 0.135 1
1 935 . 9 1 1 A 81 81 ALA N N 81 126.423 121.357 5.066 1
1 936 . 9 1 1 A 82 82 ALA H H 82 8.324 7.276 1.048 1
1 937 . 9 1 1 A 82 82 ALA HA H 82 4.000 4.385 -0.385 1
1 941 . 9 1 1 A 82 82 ALA C C 82 177.065 177.748 -0.683 1
1 942 . 9 1 1 A 82 82 ALA CA C 82 50.240 50.759 -0.519 1
1 943 . 9 1 1 A 82 82 ALA CB C 82 17.650 18.385 -0.735 1
1 944 . 9 1 1 A 82 82 ALA N N 82 125.114 122.876 2.238 1
1 945 . 9 1 1 A 83 83 PRO HA H 83 4.350 4.356 -0.006 1
1 952 . 9 1 1 A 83 83 PRO CA C 83 63.148 64.474 -1.326 1
1 953 . 9 1 1 A 83 83 PRO CB C 83 32.054 32.092 -0.038 1
1 956 . 9 1 1 A 84 84 GLU H H 84 8.517 7.702 0.815 1
1 957 . 9 1 1 A 84 84 GLU HA H 84 4.197 4.736 -0.539 1
1 962 . 9 1 1 A 84 84 GLU C C 84 176.948 174.808 2.140 1
1 963 . 9 1 1 A 84 84 GLU CA C 84 56.674 55.386 1.288 1
1 964 . 9 1 1 A 84 84 GLU CB C 84 30.459 33.088 -2.629 1
1 966 . 9 1 1 A 84 84 GLU N N 84 121.479 116.780 4.699 1
1 967 . 9 1 1 A 85 85 LYS H H 85 8.381 8.473 -0.092 1
1 968 . 9 1 1 A 85 85 LYS HA H 85 4.309 4.598 -0.289 1
1 977 . 9 1 1 A 85 85 LYS C C 85 176.457 176.563 -0.106 1
1 978 . 9 1 1 A 85 85 LYS CA C 85 56.272 56.398 -0.126 1
1 979 . 9 1 1 A 85 85 LYS CB C 85 32.961 33.831 -0.870 1
1 983 . 9 1 1 A 85 85 LYS N N 85 123.266 122.701 0.565 1
1 984 . 9 1 1 A 86 86 LYS H H 86 8.403 7.395 1.008 1
1 985 . 9 1 1 A 86 86 LYS HA H 86 4.308 4.116 0.192 1
1 994 . 9 1 1 A 86 86 LYS C C 86 176.435 175.319 1.116 1
1 995 . 9 1 1 A 86 86 LYS CA C 86 56.272 56.779 -0.507 1
1 996 . 9 1 1 A 86 86 LYS CB C 86 32.961 33.079 -0.118 1
1 1000 . 9 1 1 A 86 86 LYS N N 86 123.688 122.101 1.587 1
1 1001 . 9 1 1 A 87 87 GLU H H 87 8.540 8.568 -0.028 1
1 1002 . 9 1 1 A 87 87 GLU HA H 87 4.358 4.834 -0.476 1
1 1007 . 9 1 1 A 87 87 GLU C C 87 176.556 175.821 0.735 1
1 1008 . 9 1 1 A 87 87 GLU CA C 87 56.406 54.842 1.564 1
1 1009 . 9 1 1 A 87 87 GLU CB C 87 30.607 33.487 -2.880 1
1 1011 . 9 1 1 A 87 87 GLU N N 87 122.633 126.117 -3.484 1
1 1012 . 9 1 1 A 88 88 SER H H 88 8.520 8.634 -0.114 1
1 1013 . 9 1 1 A 88 88 SER HA H 88 4.490 4.451 0.039 1
1 1016 . 9 1 1 A 88 88 SER C C 88 175.780 173.259 2.521 1
1 1017 . 9 1 1 A 88 88 SER CA C 88 58.431 59.140 -0.709 1
1 1018 . 9 1 1 A 88 88 SER CB C 88 63.858 63.381 0.477 1
1 1019 . 9 1 1 A 88 88 SER N N 88 118.333 117.441 0.892 1
1 1020 . 9 1 1 A 89 89 LYS H H 89 8.339 7.373 0.966 1
1 1021 . 9 1 1 A 89 89 LYS HA H 89 4.620 4.716 -0.096 1
1 1030 . 9 1 1 A 89 89 LYS C C 89 174.160 173.899 0.261 1
1 1031 . 9 1 1 A 89 89 LYS CA C 89 54.265 53.031 1.234 1
1 1032 . 9 1 1 A 89 89 LYS CB C 89 32.672 34.143 -1.471 1
1 1036 . 9 1 1 A 89 89 LYS N N 89 124.433 119.358 5.075 1
1 1037 . 9 1 1 A 90 90 PRO HA H 90 4.417 4.633 -0.216 1
1 1044 . 9 1 1 A 90 90 PRO CA C 90 63.064 62.239 0.825 1
1 1045 . 9 1 1 A 90 90 PRO CB C 90 32.266 33.220 -0.954 1
1 1048 . 9 1 1 A 91 91 ARG H H 91 8.502 8.895 -0.393 1
1 1049 . 9 1 1 A 91 91 ARG HA H 91 4.305 4.072 0.233 1
1 1056 . 9 1 1 A 91 91 ARG C C 91 176.831 177.076 -0.245 1
1 1057 . 9 1 1 A 91 91 ARG CA C 91 56.002 59.467 -3.465 1
1 1058 . 9 1 1 A 91 91 ARG CB C 91 30.913 30.161 0.752 1
1 1061 . 9 1 1 A 91 91 ARG N N 91 122.193 121.751 0.442 1
1 1062 . 9 1 1 A 92 92 LYS H H 92 8.415 7.563 0.852 1
1 1063 . 9 1 1 A 92 92 LYS HA H 92 4.610 4.405 0.205 1
1 1072 . 9 1 1 A 92 92 LYS C C 92 176.262 174.583 1.679 1
1 1073 . 9 1 1 A 92 92 LYS CA C 92 54.258 54.980 -0.722 1
1 1074 . 9 1 1 A 92 92 LYS CB C 92 32.672 31.653 1.019 1
1 1078 . 9 1 1 A 92 92 LYS N N 92 124.243 120.015 4.228 1
1 1079 . 9 1 1 A 93 93 PRO HA H 93 4.415 4.548 -0.133 1
1 1086 . 9 1 1 A 93 93 PRO CA C 93 62.899 62.985 -0.086 1
1 1087 . 9 1 1 A 93 93 PRO CB C 93 32.323 32.683 -0.360 1
1 1090 . 9 1 1 A 94 94 LYS H H 94 8.420 8.805 -0.385 1
1 1091 . 9 1 1 A 94 94 LYS HA H 94 4.290 3.993 0.297 1
1 1100 . 9 1 1 A 94 94 LYS C C 94 176.714 177.419 -0.705 1
1 1101 . 9 1 1 A 94 94 LYS CA C 94 56.585 59.186 -2.601 1
1 1102 . 9 1 1 A 94 94 LYS CB C 94 33.161 32.226 0.935 1
1 1106 . 9 1 1 A 94 94 LYS N N 94 122.121 122.281 -0.160 1
1 1107 . 9 1 1 A 95 95 ALA H H 95 8.348 7.596 0.752 1
1 1108 . 9 1 1 A 95 95 ALA HA H 95 4.250 4.259 -0.009 1
1 1112 . 9 1 1 A 95 95 ALA C C 95 176.453 177.103 -0.650 1
1 1113 . 9 1 1 A 95 95 ALA CA C 95 52.471 52.679 -0.208 1
1 1114 . 9 1 1 A 95 95 ALA CB C 95 19.347 19.344 0.003 1
1 1115 . 9 1 1 A 95 95 ALA N N 95 125.624 122.616 3.008 1
1 1116 . 9 1 1 A 96 96 ALA H H 96 8.348 8.491 -0.143 1
1 1117 . 9 1 1 A 96 96 ALA HA H 96 4.254 4.816 -0.562 1
1 1121 . 9 1 1 A 96 96 ALA C C 96 176.462 175.504 0.958 1
1 1122 . 9 1 1 A 96 96 ALA CA C 96 52.471 50.910 1.561 1
1 1123 . 9 1 1 A 96 96 ALA CB C 96 19.347 23.434 -4.087 1
1 1124 . 9 1 1 A 96 96 ALA N N 96 125.624 120.225 5.399 1
1 1125 . 9 1 1 A 97 97 GLN H H 97 8.333 8.616 -0.283 1
1 1126 . 9 1 1 A 97 97 GLN HA H 97 4.362 4.168 0.194 1
1 1133 . 9 1 1 A 97 97 GLN C C 97 177.684 175.548 2.136 1
1 1134 . 9 1 1 A 97 97 GLN CA C 97 55.848 56.767 -0.919 1
1 1135 . 9 1 1 A 97 97 GLN CB C 97 29.643 29.264 0.379 1
1 1137 . 9 1 1 A 97 97 GLN N N 97 120.049 120.165 -0.116 1
1 1139 . 9 1 1 A 98 98 VAL H H 98 8.230 8.652 -0.422 1
1 1140 . 9 1 1 A 98 98 VAL HA H 98 4.145 4.338 -0.193 1
1 1148 . 9 1 1 A 98 98 VAL C C 98 176.033 177.003 -0.970 1
1 1149 . 9 1 1 A 98 98 VAL CA C 98 62.444 61.977 0.467 1
1 1150 . 9 1 1 A 98 98 VAL CB C 98 32.942 35.212 -2.270 1
1 1153 . 9 1 1 A 98 98 VAL N N 98 121.607 126.218 -4.611 1
1 1154 . 9 1 1 A 99 99 SER H H 99 8.375 8.301 0.074 1
1 1155 . 9 1 1 A 99 99 SER HA H 99 4.473 4.322 0.151 1
1 1158 . 9 1 1 A 99 99 SER C C 99 176.204 174.655 1.549 1
1 1159 . 9 1 1 A 99 99 SER CA C 99 58.379 61.608 -3.229 1
1 1160 . 9 1 1 A 99 99 SER CB C 99 63.914 63.053 0.861 1
1 1161 . 9 1 1 A 99 99 SER N N 99 119.455 115.887 3.568 1
1 1162 . 9 1 1 A 100 100 GLU H H 100 8.547 7.959 0.588 1
1 1163 . 9 1 1 A 100 100 GLU HA H 100 4.304 4.665 -0.361 1
1 1168 . 9 1 1 A 100 100 GLU C C 100 174.620 176.403 -1.783 1
1 1169 . 9 1 1 A 100 100 GLU CA C 100 56.835 55.203 1.632 1
1 1170 . 9 1 1 A 100 100 GLU CB C 100 30.365 32.896 -2.531 1
1 1172 . 9 1 1 A 100 100 GLU N N 100 123.419 117.579 5.840 1
1 1173 . 9 1 1 A 101 101 GLU H H 101 8.432 8.974 -0.542 1
1 1174 . 9 1 1 A 101 101 GLU HA H 101 4.252 4.114 0.138 1
1 1179 . 9 1 1 A 101 101 GLU C C 101 176.693 176.247 0.446 1
1 1180 . 9 1 1 A 101 101 GLU CA C 101 56.835 58.705 -1.870 1
1 1181 . 9 1 1 A 101 101 GLU CB C 101 30.365 29.939 0.426 1
1 1183 . 9 1 1 A 101 101 GLU N N 101 122.025 124.483 -2.458 1
1 1184 . 9 1 1 A 102 102 ALA H H 102 8.324 7.694 0.630 1
1 1185 . 9 1 1 A 102 102 ALA HA H 102 4.361 4.678 -0.317 1
1 1189 . 9 1 1 A 102 102 ALA C C 102 177.065 175.767 1.298 1
1 1190 . 9 1 1 A 102 102 ALA CA C 102 52.647 51.271 1.376 1
1 1191 . 9 1 1 A 102 102 ALA CB C 102 19.227 22.584 -3.357 1
1 1192 . 9 1 1 A 102 102 ALA N N 102 125.114 120.117 4.997 1
1 1193 . 9 1 1 A 103 103 SER H H 103 8.259 8.689 -0.430 1
1 1194 . 9 1 1 A 103 103 SER HA H 103 4.473 4.474 -0.001 1
1 1197 . 9 1 1 A 103 103 SER C C 103 177.772 174.235 3.537 1
1 1198 . 9 1 1 A 103 103 SER CA C 103 58.301 58.969 -0.668 1
1 1199 . 9 1 1 A 103 103 SER CB C 103 63.961 63.734 0.227 1
1 1200 . 9 1 1 A 103 103 SER N N 103 115.109 119.325 -4.216 1
1 1201 . 9 1 1 A 104 104 THR H H 104 8.127 8.458 -0.331 1
1 1202 . 9 1 1 A 104 104 THR HA H 104 4.600 4.585 0.015 1
1 1207 . 9 1 1 A 104 104 THR C C 104 174.427 173.538 0.889 1
1 1208 . 9 1 1 A 104 104 THR CA C 104 59.954 60.562 -0.608 1
1 1209 . 9 1 1 A 104 104 THR CB C 104 69.868 68.898 0.970 1
1 1211 . 9 1 1 A 104 104 THR N N 104 117.882 115.455 2.427 1
1 1212 . 9 1 1 A 105 105 PRO HA H 105 4.414 4.318 0.096 1
1 1219 . 9 1 1 A 105 105 PRO CA C 105 63.300 63.767 -0.467 1
1 1220 . 9 1 1 A 105 105 PRO CB C 105 32.227 32.056 0.171 1
1 1223 . 9 1 1 A 106 106 GLN H H 106 8.524 8.719 -0.195 1
1 1224 . 9 1 1 A 106 106 GLN HA H 106 4.276 3.866 0.410 1
1 1229 . 9 1 1 A 106 106 GLN C C 106 177.083 175.953 1.130 1
1 1230 . 9 1 1 A 106 106 GLN CA C 106 56.209 57.535 -1.326 1
1 1231 . 9 1 1 A 106 106 GLN CB C 106 29.490 27.159 2.331 1
1 1233 . 9 1 1 A 106 106 GLN N N 106 120.754 116.649 4.105 1
1 1234 . 9 1 1 A 107 107 GLY H H 107 8.394 7.700 0.694 1
1 1235 . 9 1 1 A 107 107 GLY HA2 H 107 3.895 4.140 -0.245 1
1 1236 . 9 1 1 A 107 107 GLY HA3 H 107 3.895 4.148 -0.253 1
1 1237 . 9 1 1 A 107 107 GLY C C 107 176.651 174.009 2.642 1
1 1238 . 9 1 1 A 107 107 GLY CA C 107 45.330 45.718 -0.388 1
1 1239 . 9 1 1 A 107 107 GLY N N 107 110.026 105.170 4.856 1
1 1240 . 9 1 1 A 108 108 PHE H H 108 8.099 7.942 0.157 1
1 1241 . 9 1 1 A 108 108 PHE HA H 108 4.582 4.425 0.157 1
1 1245 . 9 1 1 A 108 108 PHE C C 108 173.944 174.964 -1.020 1
1 1246 . 9 1 1 A 108 108 PHE CA C 108 58.054 59.185 -1.131 1
1 1247 . 9 1 1 A 108 108 PHE CB C 108 39.708 39.850 -0.142 1
1 1248 . 9 1 1 A 108 108 PHE N N 108 120.180 122.065 -1.885 1
1 1249 . 9 1 1 A 109 109 ASN H H 109 8.482 7.842 0.640 1
1 1250 . 9 1 1 A 109 109 ASN HA H 109 4.691 4.904 -0.213 1
1 1255 . 9 1 1 A 109 109 ASN C C 109 175.627 173.957 1.670 1
1 1256 . 9 1 1 A 109 109 ASN CA C 109 53.402 52.058 1.344 1
1 1257 . 9 1 1 A 109 109 ASN CB C 109 38.883 41.598 -2.715 1
1 1258 . 9 1 1 A 109 109 ASN N N 109 120.752 125.436 -4.684 1
1 1260 . 9 1 1 A 110 110 THR H H 110 8.112 8.535 -0.423 1
1 1261 . 9 1 1 A 110 110 THR HA H 110 4.251 4.331 -0.080 1
1 1266 . 9 1 1 A 110 110 THR C C 110 175.275 174.646 0.629 1
1 1267 . 9 1 1 A 110 110 THR CA C 110 62.460 63.258 -0.798 1
1 1268 . 9 1 1 A 110 110 THR CB C 110 69.726 69.686 0.040 1
1 1270 . 9 1 1 A 110 110 THR N N 110 114.601 120.242 -5.641 1
1 1271 . 9 1 1 A 111 111 LEU H H 111 8.168 8.446 -0.278 1
1 1272 . 9 1 1 A 111 111 LEU HA H 111 4.308 4.895 -0.587 1
1 1282 . 9 1 1 A 111 111 LEU CA C 111 55.704 54.227 1.477 1
1 1283 . 9 1 1 A 111 111 LEU CB C 111 42.071 46.114 -4.043 1
1 1287 . 9 1 1 A 111 111 LEU N N 111 123.756 125.377 -1.621 1
1 1288 . 9 1 1 A 112 112 LYS H H 112 8.123 8.665 -0.542 1
1 1289 . 9 1 1 A 112 112 LYS HA H 112 4.242 5.043 -0.801 1
1 1298 . 9 1 1 A 112 112 LYS C C 112 177.547 174.335 3.212 1
1 1299 . 9 1 1 A 112 112 LYS CA C 112 56.928 55.615 1.313 1
1 1300 . 9 1 1 A 112 112 LYS CB C 112 33.055 36.613 -3.558 1
1 1304 . 9 1 1 A 112 112 LYS N N 112 121.442 124.971 -3.529 1
1 1305 . 9 1 1 A 113 113 ASP H H 113 8.230 8.811 -0.581 1
1 1306 . 9 1 1 A 113 113 ASP HA H 113 4.526 5.054 -0.528 1
1 1309 . 9 1 1 A 113 113 ASP C C 113 176.532 174.571 1.961 1
1 1310 . 9 1 1 A 113 113 ASP CA C 113 54.896 53.621 1.275 1
1 1311 . 9 1 1 A 113 113 ASP CB C 113 41.362 45.213 -3.851 1
1 1312 . 9 1 1 A 113 113 ASP N N 113 120.598 123.993 -3.395 1
1 1313 . 9 1 1 A 114 114 LYS H H 114 8.127 9.031 -0.904 1
1 1314 . 9 1 1 A 114 114 LYS HA H 114 4.300 4.691 -0.391 1
1 1323 . 9 1 1 A 114 114 LYS C C 114 176.303 176.784 -0.481 1
1 1324 . 9 1 1 A 114 114 LYS CA C 114 56.633 55.500 1.133 1
1 1325 . 9 1 1 A 114 114 LYS CB C 114 32.818 33.441 -0.623 1
1 1329 . 9 1 1 A 114 114 LYS N N 114 120.897 124.416 -3.519 1
1 1330 . 9 1 1 A 115 115 LEU H H 115 8.244 7.959 0.285 1
1 1331 . 9 1 1 A 115 115 LEU HA H 115 4.254 4.341 -0.087 1
1 1341 . 9 1 1 A 115 115 LEU C C 115 176.909 178.324 -1.415 1
1 1342 . 9 1 1 A 115 115 LEU CA C 115 56.282 57.752 -1.470 1
1 1343 . 9 1 1 A 115 115 LEU CB C 115 42.188 42.093 0.095 1
1 1347 . 9 1 1 A 115 115 LEU N N 115 123.251 122.254 0.997 1
1 1348 . 9 1 1 A 116 116 GLU H H 116 8.421 8.381 0.040 1
1 1349 . 9 1 1 A 116 116 GLU HA H 116 4.190 3.939 0.251 1
1 1352 . 9 1 1 A 116 116 GLU C C 116 177.828 178.877 -1.049 1
1 1353 . 9 1 1 A 116 116 GLU CA C 116 57.466 59.768 -2.302 1
1 1354 . 9 1 1 A 116 116 GLU CB C 116 30.124 29.301 0.823 1
1 1355 . 9 1 1 A 116 116 GLU N N 116 120.575 118.421 2.154 1
1 1356 . 9 1 1 A 117 117 GLU H H 117 8.255 7.611 0.644 1
1 1357 . 9 1 1 A 117 117 GLU HA H 117 4.192 3.774 0.418 1
1 1362 . 9 1 1 A 117 117 GLU CA C 117 57.491 58.098 -0.607 1
1 1363 . 9 1 1 A 117 117 GLU CB C 117 30.365 28.819 1.546 1
1 1365 . 9 1 1 A 117 117 GLU N N 117 120.933 117.000 3.933 1
1 1366 . 9 1 1 A 118 118 TRP H H 118 8.143 8.032 0.111 1
1 1367 . 9 1 1 A 118 118 TRP HA H 118 4.581 4.889 -0.308 1
1 1372 . 9 1 1 A 118 118 TRP C C 118 176.794 177.188 -0.394 1
1 1373 . 9 1 1 A 118 118 TRP CA C 118 58.363 57.033 1.330 1
1 1374 . 9 1 1 A 118 118 TRP CB C 118 29.333 30.857 -1.524 1
1 1375 . 9 1 1 A 118 118 TRP N N 118 121.592 118.489 3.103 1
1 1376 . 9 1 1 A 119 119 ILE H H 119 7.908 7.709 0.199 1
1 1377 . 9 1 1 A 119 119 ILE HA H 119 3.828 3.952 -0.124 1
1 1387 . 9 1 1 A 119 119 ILE C C 119 176.984 176.502 0.482 1
1 1388 . 9 1 1 A 119 119 ILE CA C 119 62.335 63.637 -1.302 1
1 1389 . 9 1 1 A 119 119 ILE CB C 119 38.649 38.127 0.522 1
1 1393 . 9 1 1 A 119 119 ILE N N 119 122.744 122.378 0.366 1
1 1394 . 9 1 1 A 120 120 GLU H H 120 8.143 8.031 0.112 1
1 1395 . 9 1 1 A 120 120 GLU HA H 120 4.093 4.646 -0.553 1
1 1400 . 9 1 1 A 120 120 GLU C C 120 176.565 176.026 0.539 1
1 1401 . 9 1 1 A 120 120 GLU CA C 120 57.613 55.184 2.429 1
1 1402 . 9 1 1 A 120 120 GLU CB C 120 29.834 30.331 -0.497 1
1 1404 . 9 1 1 A 120 120 GLU N N 120 123.139 121.419 1.720 1
1 1405 . 9 1 1 A 121 121 MET H H 121 8.254 8.627 -0.373 1
1 1406 . 9 1 1 A 121 121 MET HA H 121 4.357 4.246 0.111 1
1 1411 . 9 1 1 A 121 121 MET CA C 121 56.625 57.671 -1.046 1
1 1412 . 9 1 1 A 121 121 MET CB C 121 32.664 31.396 1.268 1
1 1414 . 9 1 1 A 121 121 MET N N 121 120.449 124.364 -3.915 1
1 1415 . 9 1 1 A 122 122 SER H H 122 8.199 8.704 -0.505 1
1 1416 . 9 1 1 A 122 122 SER HA H 122 4.280 4.415 -0.135 1
1 1419 . 9 1 1 A 122 122 SER C C 122 177.224 175.234 1.990 1
1 1420 . 9 1 1 A 122 122 SER CA C 122 59.635 59.450 0.185 1
1 1421 . 9 1 1 A 122 122 SER CB C 122 63.560 63.310 0.250 1
1 1422 . 9 1 1 A 122 122 SER N N 122 115.857 119.797 -3.940 1
1 1423 . 9 1 1 A 123 123 ASN H H 123 8.211 7.976 0.235 1
1 1424 . 9 1 1 A 123 123 ASN HA H 123 4.737 4.648 0.089 1
1 1429 . 9 1 1 A 123 123 ASN C C 123 174.709 175.078 -0.369 1
1 1430 . 9 1 1 A 123 123 ASN CA C 123 53.507 55.325 -1.818 1
1 1431 . 9 1 1 A 123 123 ASN CB C 123 38.800 38.625 0.175 1
1 1432 . 9 1 1 A 123 123 ASN N N 123 119.923 118.903 1.020 1
1 1434 . 9 1 1 A 124 124 ARG H H 124 7.997 6.990 1.007 1
1 1435 . 9 1 1 A 124 124 ARG HA H 124 4.305 4.286 0.019 1
1 1442 . 9 1 1 A 124 124 ARG C C 124 175.477 176.674 -1.197 1
1 1443 . 9 1 1 A 124 124 ARG CA C 124 56.709 56.478 0.231 1
1 1444 . 9 1 1 A 124 124 ARG CB C 124 30.584 30.638 -0.054 1
1 1447 . 9 1 1 A 124 124 ARG N N 124 120.821 117.319 3.502 1
1 1448 . 9 1 1 A 125 125 LYS H H 125 8.327 8.670 -0.343 1
1 1449 . 9 1 1 A 125 125 LYS HA H 125 4.254 3.981 0.273 1
1 1458 . 9 1 1 A 125 125 LYS C C 125 176.777 177.452 -0.675 1
1 1459 . 9 1 1 A 125 125 LYS CA C 125 56.860 59.200 -2.340 1
1 1460 . 9 1 1 A 125 125 LYS CB C 125 32.879 32.412 0.467 1
1 1464 . 9 1 1 A 125 125 LYS N N 125 121.891 121.848 0.043 1
1 1465 . 9 1 1 A 126 126 ASP H H 126 8.343 7.889 0.454 1
1 1466 . 9 1 1 A 126 126 ASP HA H 126 4.581 4.974 -0.393 1
1 1469 . 9 1 1 A 126 126 ASP C C 126 176.538 177.254 -0.716 1
1 1470 . 9 1 1 A 126 126 ASP CA C 126 54.540 55.668 -1.128 1
1 1471 . 9 1 1 A 126 126 ASP CB C 126 40.907 43.490 -2.583 1
1 1472 . 9 1 1 A 126 126 ASP N N 126 119.814 117.276 2.538 1
1 1473 . 9 1 1 A 127 127 LEU H H 127 7.946 8.376 -0.430 1
1 1474 . 9 1 1 A 127 127 LEU HA H 127 4.309 4.556 -0.247 1
1 1484 . 9 1 1 A 127 127 LEU C C 127 176.043 176.018 0.025 1
1 1485 . 9 1 1 A 127 127 LEU CA C 127 55.427 54.406 1.021 1
1 1486 . 9 1 1 A 127 127 LEU CB C 127 42.394 44.156 -1.762 1
1 1490 . 9 1 1 A 127 127 LEU N N 127 121.432 116.859 4.573 1
1 1491 . 9 1 1 A 128 128 ILE H H 128 7.967 7.676 0.291 1
1 1492 . 9 1 1 A 128 128 ILE HA H 128 4.141 4.837 -0.696 1
1 1502 . 9 1 1 A 128 128 ILE C C 128 177.200 174.367 2.833 1
1 1503 . 9 1 1 A 128 128 ILE CA C 128 61.150 58.248 2.902 1
1 1504 . 9 1 1 A 128 128 ILE CB C 128 38.489 42.505 -4.016 1
1 1508 . 9 1 1 A 128 128 ILE N N 128 121.579 114.811 6.768 1
1 1509 . 9 1 1 A 129 129 LYS H H 129 8.331 8.652 -0.321 1
1 1510 . 9 1 1 A 129 129 LYS HA H 129 4.328 4.737 -0.409 1
1 1519 . 9 1 1 A 129 129 LYS C C 129 175.952 174.858 1.094 1
1 1520 . 9 1 1 A 129 129 LYS CA C 129 56.330 54.957 1.373 1
1 1521 . 9 1 1 A 129 129 LYS CB C 129 33.010 36.692 -3.682 1
1 1525 . 9 1 1 A 129 129 LYS N N 129 126.955 121.664 5.291 1
1 1 . 10 1 1 A 2 2 ALA HA H 2 4.070 5.022 -0.952 1
1 5 . 10 1 1 A 2 2 ALA CA C 2 52.067 51.243 0.824 1
1 6 . 10 1 1 A 2 2 ALA CB C 2 19.577 24.410 -4.833 1
1 7 . 10 1 1 A 3 3 ALA H H 3 8.714 9.072 -0.358 1
1 8 . 10 1 1 A 3 3 ALA HA H 3 4.253 5.306 -1.053 1
1 12 . 10 1 1 A 3 3 ALA C C 3 173.672 175.987 -2.315 1
1 13 . 10 1 1 A 3 3 ALA CA C 3 52.067 50.655 1.412 1
1 14 . 10 1 1 A 3 3 ALA CB C 3 19.577 24.118 -4.541 1
1 15 . 10 1 1 A 3 3 ALA N N 3 124.480 120.765 3.715 1
1 16 . 10 1 1 A 4 4 LYS H H 4 8.227 8.565 -0.338 1
1 17 . 10 1 1 A 4 4 LYS HA H 4 3.976 4.651 -0.675 1
1 26 . 10 1 1 A 4 4 LYS C C 4 176.672 175.460 1.212 1
1 27 . 10 1 1 A 4 4 LYS CA C 4 57.274 55.354 1.920 1
1 28 . 10 1 1 A 4 4 LYS CB C 4 33.209 33.102 0.107 1
1 32 . 10 1 1 A 4 4 LYS N N 4 120.988 117.641 3.347 1
1 33 . 10 1 1 A 5 5 PHE H H 5 7.719 7.722 -0.003 1
1 34 . 10 1 1 A 5 5 PHE HA H 5 4.384 5.206 -0.822 1
1 38 . 10 1 1 A 5 5 PHE C C 5 175.364 174.501 0.863 1
1 39 . 10 1 1 A 5 5 PHE CA C 5 57.074 56.270 0.804 1
1 40 . 10 1 1 A 5 5 PHE CB C 5 39.669 43.673 -4.004 1
1 41 . 10 1 1 A 5 5 PHE N N 5 119.246 119.380 -0.134 1
1 42 . 10 1 1 A 6 6 GLU H H 6 8.515 9.102 -0.587 1
1 43 . 10 1 1 A 6 6 GLU HA H 6 4.370 5.045 -0.675 1
1 48 . 10 1 1 A 6 6 GLU CA C 6 55.669 54.771 0.898 1
1 49 . 10 1 1 A 6 6 GLU CB C 6 32.094 33.605 -1.511 1
1 51 . 10 1 1 A 6 6 GLU N N 6 122.193 119.026 3.167 1
1 52 . 10 1 1 A 7 7 VAL H H 7 8.636 8.496 0.140 1
1 53 . 10 1 1 A 7 7 VAL HA H 7 3.406 3.953 -0.547 1
1 61 . 10 1 1 A 7 7 VAL C C 7 176.611 176.357 0.254 1
1 62 . 10 1 1 A 7 7 VAL CA C 7 65.358 63.336 2.022 1
1 63 . 10 1 1 A 7 7 VAL CB C 7 31.391 31.496 -0.105 1
1 66 . 10 1 1 A 7 7 VAL N N 7 122.949 119.224 3.725 1
1 67 . 10 1 1 A 8 8 GLY H H 8 9.394 9.118 0.276 1
1 68 . 10 1 1 A 8 8 GLY HA2 H 8 3.600 4.049 -0.449 1
1 69 . 10 1 1 A 8 8 GLY HA3 H 8 4.546 4.052 0.494 1
1 70 . 10 1 1 A 8 8 GLY C C 8 178.074 174.271 3.803 1
1 71 . 10 1 1 A 8 8 GLY CA C 8 45.121 44.901 0.220 1
1 72 . 10 1 1 A 8 8 GLY N N 8 116.837 115.154 1.683 1
1 73 . 10 1 1 A 9 9 SER H H 9 8.021 7.880 0.141 1
1 74 . 10 1 1 A 9 9 SER HA H 9 4.680 4.480 0.200 1
1 77 . 10 1 1 A 9 9 SER C C 9 174.234 173.184 1.050 1
1 78 . 10 1 1 A 9 9 SER CA C 9 59.387 59.523 -0.136 1
1 79 . 10 1 1 A 9 9 SER CB C 9 65.584 64.558 1.026 1
1 80 . 10 1 1 A 9 9 SER N N 9 118.208 117.934 0.274 1
1 81 . 10 1 1 A 10 10 VAL H H 10 7.945 8.237 -0.292 1
1 82 . 10 1 1 A 10 10 VAL HA H 10 4.980 5.131 -0.151 1
1 90 . 10 1 1 A 10 10 VAL C C 10 171.388 174.211 -2.823 1
1 91 . 10 1 1 A 10 10 VAL CA C 10 61.021 61.180 -0.159 1
1 92 . 10 1 1 A 10 10 VAL CB C 10 33.400 34.669 -1.269 1
1 95 . 10 1 1 A 10 10 VAL N N 10 121.118 122.960 -1.842 1
1 96 . 10 1 1 A 11 11 TYR H H 11 9.008 9.016 -0.008 1
1 97 . 10 1 1 A 11 11 TYR HA H 11 4.850 5.273 -0.423 1
1 101 . 10 1 1 A 11 11 TYR C C 11 174.926 174.690 0.236 1
1 102 . 10 1 1 A 11 11 TYR CA C 11 56.803 56.156 0.647 1
1 103 . 10 1 1 A 11 11 TYR CB C 11 43.676 43.568 0.108 1
1 104 . 10 1 1 A 11 11 TYR N N 11 125.043 125.221 -0.178 1
1 105 . 10 1 1 A 12 12 THR H H 12 8.809 8.661 0.148 1
1 106 . 10 1 1 A 12 12 THR HA H 12 5.020 5.325 -0.305 1
1 111 . 10 1 1 A 12 12 THR C C 12 174.195 174.642 -0.447 1
1 112 . 10 1 1 A 12 12 THR CA C 12 62.487 59.985 2.502 1
1 113 . 10 1 1 A 12 12 THR CB C 12 69.743 71.390 -1.647 1
1 115 . 10 1 1 A 12 12 THR N N 12 116.850 115.193 1.657 1
1 116 . 10 1 1 A 13 13 GLY H H 13 9.179 8.695 0.484 1
1 117 . 10 1 1 A 13 13 GLY HA2 H 13 3.250 4.359 -1.109 1
1 118 . 10 1 1 A 13 13 GLY HA3 H 13 4.801 4.377 0.424 1
1 119 . 10 1 1 A 13 13 GLY C C 13 174.654 172.027 2.627 1
1 120 . 10 1 1 A 13 13 GLY CA C 13 44.377 45.521 -1.144 1
1 121 . 10 1 1 A 13 13 GLY N N 13 113.654 112.071 1.583 1
1 122 . 10 1 1 A 14 14 LYS H H 14 7.770 8.685 -0.915 1
1 123 . 10 1 1 A 14 14 LYS HA H 14 5.426 5.205 0.221 1
1 132 . 10 1 1 A 14 14 LYS C C 14 171.343 175.658 -4.315 1
1 133 . 10 1 1 A 14 14 LYS CA C 14 53.879 54.858 -0.979 1
1 134 . 10 1 1 A 14 14 LYS CB C 14 36.032 35.883 0.149 1
1 138 . 10 1 1 A 14 14 LYS N N 14 118.322 120.839 -2.517 1
1 139 . 10 1 1 A 15 15 VAL H H 15 9.206 9.228 -0.022 1
1 140 . 10 1 1 A 15 15 VAL HA H 15 4.400 4.296 0.104 1
1 148 . 10 1 1 A 15 15 VAL C C 15 176.306 177.157 -0.851 1
1 149 . 10 1 1 A 15 15 VAL CA C 15 63.648 63.477 0.171 1
1 150 . 10 1 1 A 15 15 VAL CB C 15 31.769 31.592 0.177 1
1 153 . 10 1 1 A 15 15 VAL N N 15 125.308 127.248 -1.940 1
1 154 . 10 1 1 A 16 16 THR H H 16 9.403 9.286 0.117 1
1 155 . 10 1 1 A 16 16 THR HA H 16 4.562 4.693 -0.131 1
1 160 . 10 1 1 A 16 16 THR C C 16 178.098 174.636 3.462 1
1 161 . 10 1 1 A 16 16 THR CA C 16 62.018 61.573 0.445 1
1 162 . 10 1 1 A 16 16 THR CB C 16 69.720 69.823 -0.103 1
1 164 . 10 1 1 A 16 16 THR N N 16 121.753 117.766 3.987 1
1 165 . 10 1 1 A 17 17 GLY H H 17 7.600 7.071 0.529 1
1 166 . 10 1 1 A 17 17 GLY HA2 H 17 4.110 4.107 0.003 1
1 167 . 10 1 1 A 17 17 GLY HA3 H 17 4.250 4.187 0.063 1
1 168 . 10 1 1 A 17 17 GLY C C 17 175.551 171.403 4.148 1
1 169 . 10 1 1 A 17 17 GLY CA C 17 46.258 45.552 0.706 1
1 170 . 10 1 1 A 17 17 GLY N N 17 109.407 108.738 0.669 1
1 171 . 10 1 1 A 18 18 LEU H H 18 8.820 8.466 0.354 1
1 172 . 10 1 1 A 18 18 LEU HA H 18 4.852 4.963 -0.111 1
1 182 . 10 1 1 A 18 18 LEU CA C 18 54.245 53.212 1.033 1
1 183 . 10 1 1 A 18 18 LEU CB C 18 44.906 46.070 -1.164 1
1 187 . 10 1 1 A 18 18 LEU N N 18 123.419 121.323 2.096 1
1 188 . 10 1 1 A 19 19 GLN H H 19 8.537 8.312 0.225 1
1 189 . 10 1 1 A 19 19 GLN HA H 19 4.520 4.714 -0.194 1
1 196 . 10 1 1 A 19 19 GLN C C 19 175.258 175.709 -0.451 1
1 197 . 10 1 1 A 19 19 GLN CA C 19 53.269 53.819 -0.550 1
1 198 . 10 1 1 A 19 19 GLN CB C 19 31.522 32.613 -1.091 1
1 200 . 10 1 1 A 19 19 GLN N N 19 120.187 121.592 -1.405 1
1 202 . 10 1 1 A 20 20 ALA H H 20 8.798 8.645 0.153 1
1 203 . 10 1 1 A 20 20 ALA HA H 20 4.010 4.109 -0.099 1
1 207 . 10 1 1 A 20 20 ALA C C 20 175.698 177.222 -1.524 1
1 208 . 10 1 1 A 20 20 ALA CA C 20 55.084 54.062 1.022 1
1 209 . 10 1 1 A 20 20 ALA CB C 20 18.277 18.494 -0.217 1
1 210 . 10 1 1 A 20 20 ALA N N 20 120.606 123.927 -3.321 1
1 211 . 10 1 1 A 21 21 TYR H H 21 6.618 7.596 -0.978 1
1 212 . 10 1 1 A 21 21 TYR HA H 21 4.540 4.822 -0.282 1
1 216 . 10 1 1 A 21 21 TYR C C 21 178.437 174.980 3.457 1
1 217 . 10 1 1 A 21 21 TYR CA C 21 55.120 56.879 -1.759 1
1 218 . 10 1 1 A 21 21 TYR CB C 21 37.891 40.485 -2.594 1
1 219 . 10 1 1 A 21 21 TYR N N 21 105.570 113.470 -7.900 1
1 220 . 10 1 1 A 22 22 GLY H H 22 7.203 7.016 0.187 1
1 221 . 10 1 1 A 22 22 GLY HA2 H 22 3.460 3.719 -0.259 1
1 222 . 10 1 1 A 22 22 GLY HA3 H 22 4.360 3.912 0.448 1
1 223 . 10 1 1 A 22 22 GLY C C 22 175.833 171.283 4.550 1
1 224 . 10 1 1 A 22 22 GLY CA C 22 46.356 45.328 1.028 1
1 225 . 10 1 1 A 22 22 GLY N N 22 109.854 108.401 1.453 1
1 226 . 10 1 1 A 23 23 ALA H H 23 8.549 8.566 -0.017 1
1 227 . 10 1 1 A 23 23 ALA HA H 23 4.981 5.229 -0.248 1
1 231 . 10 1 1 A 23 23 ALA C C 23 168.810 176.033 -7.223 1
1 232 . 10 1 1 A 23 23 ALA CA C 23 49.178 50.765 -1.587 1
1 233 . 10 1 1 A 23 23 ALA CB C 23 22.797 21.232 1.565 1
1 234 . 10 1 1 A 23 23 ALA N N 23 118.749 122.657 -3.908 1
1 235 . 10 1 1 A 24 24 PHE H H 24 8.812 8.598 0.214 1
1 236 . 10 1 1 A 24 24 PHE HA H 24 5.125 4.820 0.305 1
1 240 . 10 1 1 A 24 24 PHE CA C 24 58.017 58.120 -0.103 1
1 241 . 10 1 1 A 24 24 PHE CB C 24 40.475 40.495 -0.020 1
1 242 . 10 1 1 A 24 24 PHE N N 24 122.891 121.981 0.910 1
1 243 . 10 1 1 A 25 25 VAL H H 25 8.880 9.039 -0.159 1
1 244 . 10 1 1 A 25 25 VAL HA H 25 4.660 4.662 -0.002 1
1 252 . 10 1 1 A 25 25 VAL CA C 25 60.379 61.083 -0.704 1
1 253 . 10 1 1 A 25 25 VAL CB C 25 35.654 35.022 0.632 1
1 256 . 10 1 1 A 25 25 VAL N N 25 122.908 121.312 1.596 1
1 257 . 10 1 1 A 26 26 ALA H H 26 9.403 8.759 0.644 1
1 258 . 10 1 1 A 26 26 ALA HA H 26 4.750 4.348 0.402 1
1 262 . 10 1 1 A 26 26 ALA C C 26 174.445 176.772 -2.327 1
1 263 . 10 1 1 A 26 26 ALA CA C 26 51.711 52.570 -0.859 1
1 264 . 10 1 1 A 26 26 ALA CB C 26 19.319 19.080 0.239 1
1 265 . 10 1 1 A 26 26 ALA N N 26 129.425 130.324 -0.899 1
1 266 . 10 1 1 A 27 27 LEU H H 27 8.601 9.248 -0.647 1
1 267 . 10 1 1 A 27 27 LEU HA H 27 4.158 4.582 -0.424 1
1 277 . 10 1 1 A 27 27 LEU C C 27 177.814 176.314 1.500 1
1 278 . 10 1 1 A 27 27 LEU CA C 27 55.869 55.613 0.256 1
1 279 . 10 1 1 A 27 27 LEU CB C 27 42.251 43.590 -1.339 1
1 283 . 10 1 1 A 27 27 LEU N N 27 127.169 122.141 5.028 1
1 284 . 10 1 1 A 28 28 ASP H H 28 8.172 7.920 0.252 1
1 285 . 10 1 1 A 28 28 ASP HA H 28 4.420 4.892 -0.472 1
1 288 . 10 1 1 A 28 28 ASP C C 28 177.116 175.844 1.272 1
1 289 . 10 1 1 A 28 28 ASP CA C 28 53.755 53.107 0.648 1
1 290 . 10 1 1 A 28 28 ASP CB C 28 39.833 44.112 -4.279 1
1 291 . 10 1 1 A 28 28 ASP N N 28 115.657 116.845 -1.188 1
1 292 . 10 1 1 A 29 29 GLU H H 29 8.857 9.127 -0.270 1
1 293 . 10 1 1 A 29 29 GLU HA H 29 4.090 4.128 -0.038 1
1 298 . 10 1 1 A 29 29 GLU C C 29 175.965 176.496 -0.531 1
1 299 . 10 1 1 A 29 29 GLU CA C 29 59.470 58.538 0.932 1
1 300 . 10 1 1 A 29 29 GLU CB C 29 29.409 29.032 0.377 1
1 302 . 10 1 1 A 29 29 GLU N N 29 114.738 122.133 -7.395 1
1 303 . 10 1 1 A 30 30 GLU H H 30 8.326 8.147 0.179 1
1 304 . 10 1 1 A 30 30 GLU HA H 30 4.640 4.557 0.083 1
1 309 . 10 1 1 A 30 30 GLU C C 30 176.817 175.889 0.928 1
1 310 . 10 1 1 A 30 30 GLU CA C 30 56.073 55.770 0.303 1
1 311 . 10 1 1 A 30 30 GLU CB C 30 32.453 30.936 1.517 1
1 313 . 10 1 1 A 30 30 GLU N N 30 115.753 115.506 0.247 1
1 314 . 10 1 1 A 31 31 THR H H 31 7.819 7.385 0.434 1
1 315 . 10 1 1 A 31 31 THR HA H 31 4.484 5.084 -0.600 1
1 320 . 10 1 1 A 31 31 THR C C 31 176.330 173.048 3.282 1
1 321 . 10 1 1 A 31 31 THR CA C 31 63.398 61.071 2.327 1
1 322 . 10 1 1 A 31 31 THR CB C 31 69.367 72.706 -3.339 1
1 324 . 10 1 1 A 31 31 THR N N 31 118.750 115.442 3.308 1
1 325 . 10 1 1 A 32 32 GLN H H 32 8.913 8.771 0.142 1
1 326 . 10 1 1 A 32 32 GLN HA H 32 5.337 4.800 0.537 1
1 333 . 10 1 1 A 32 32 GLN C C 32 173.087 174.548 -1.461 1
1 334 . 10 1 1 A 32 32 GLN CA C 32 54.051 54.855 -0.804 1
1 335 . 10 1 1 A 32 32 GLN CB C 32 32.672 32.843 -0.171 1
1 337 . 10 1 1 A 32 32 GLN N N 32 127.294 125.071 2.223 1
1 339 . 10 1 1 A 33 33 GLY H H 33 8.900 8.454 0.446 1
1 340 . 10 1 1 A 33 33 GLY HA2 H 33 3.290 4.364 -1.074 1
1 341 . 10 1 1 A 33 33 GLY HA3 H 33 4.530 4.441 0.089 1
1 342 . 10 1 1 A 33 33 GLY C C 33 174.918 172.277 2.641 1
1 343 . 10 1 1 A 33 33 GLY CA C 33 44.534 45.113 -0.579 1
1 344 . 10 1 1 A 33 33 GLY N N 33 107.639 110.663 -3.024 1
1 345 . 10 1 1 A 34 34 LEU H H 34 8.127 8.736 -0.609 1
1 346 . 10 1 1 A 34 34 LEU HA H 34 4.950 4.851 0.099 1
1 356 . 10 1 1 A 34 34 LEU CA C 34 53.755 53.893 -0.138 1
1 357 . 10 1 1 A 34 34 LEU CB C 34 45.493 44.757 0.736 1
1 361 . 10 1 1 A 34 34 LEU N N 34 120.897 121.697 -0.800 1
1 362 . 10 1 1 A 35 35 VAL H H 35 9.386 8.790 0.596 1
1 363 . 10 1 1 A 35 35 VAL HA H 35 4.479 4.391 0.088 1
1 371 . 10 1 1 A 35 35 VAL C C 35 176.402 176.174 0.228 1
1 372 . 10 1 1 A 35 35 VAL CA C 35 59.594 63.036 -3.442 1
1 373 . 10 1 1 A 35 35 VAL CB C 35 32.590 31.490 1.100 1
1 376 . 10 1 1 A 35 35 VAL N N 35 128.897 127.943 0.954 1
1 377 . 10 1 1 A 36 36 HIS H H 36 9.194 8.991 0.203 1
1 378 . 10 1 1 A 36 36 HIS HA H 36 4.487 4.582 -0.095 1
1 381 . 10 1 1 A 36 36 HIS C C 36 174.864 176.571 -1.707 1
1 382 . 10 1 1 A 36 36 HIS CA C 36 59.426 56.321 3.105 1
1 383 . 10 1 1 A 36 36 HIS CB C 36 31.542 30.540 1.002 1
1 384 . 10 1 1 A 36 36 HIS N N 36 127.751 126.177 1.574 1
1 385 . 10 1 1 A 37 37 ILE H H 37 7.454 8.777 -1.323 1
1 386 . 10 1 1 A 37 37 ILE HA H 37 3.810 3.685 0.125 1
1 396 . 10 1 1 A 37 37 ILE C C 37 176.948 177.916 -0.968 1
1 397 . 10 1 1 A 37 37 ILE CA C 37 63.773 64.911 -1.138 1
1 398 . 10 1 1 A 37 37 ILE CB C 37 38.993 37.533 1.460 1
1 402 . 10 1 1 A 37 37 ILE N N 37 126.266 125.822 0.444 1
1 403 . 10 1 1 A 38 38 SER H H 38 8.343 8.243 0.100 1
1 404 . 10 1 1 A 38 38 SER HA H 38 4.370 4.297 0.073 1
1 407 . 10 1 1 A 38 38 SER C C 38 174.792 174.904 -0.112 1
1 408 . 10 1 1 A 38 38 SER CA C 38 60.567 60.980 -0.413 1
1 409 . 10 1 1 A 38 38 SER CB C 38 63.632 62.875 0.757 1
1 410 . 10 1 1 A 38 38 SER N N 38 118.079 118.536 -0.457 1
1 411 . 10 1 1 A 39 39 GLU H H 39 8.536 8.023 0.513 1
1 412 . 10 1 1 A 39 39 GLU HA H 39 4.503 4.546 -0.043 1
1 417 . 10 1 1 A 39 39 GLU C C 39 175.131 176.803 -1.672 1
1 418 . 10 1 1 A 39 39 GLU CA C 39 54.928 56.302 -1.374 1
1 419 . 10 1 1 A 39 39 GLU CB C 39 29.621 30.471 -0.850 1
1 421 . 10 1 1 A 39 39 GLU N N 39 118.349 118.748 -0.399 1
1 422 . 10 1 1 A 40 40 VAL H H 40 7.776 7.607 0.169 1
1 423 . 10 1 1 A 40 40 VAL HA H 40 3.616 3.884 -0.268 1
1 431 . 10 1 1 A 40 40 VAL C C 40 177.277 175.573 1.704 1
1 432 . 10 1 1 A 40 40 VAL CA C 40 66.245 64.196 2.049 1
1 433 . 10 1 1 A 40 40 VAL CB C 40 32.590 32.263 0.327 1
1 436 . 10 1 1 A 40 40 VAL N N 40 125.443 117.735 7.708 1
1 437 . 10 1 1 A 41 41 THR H H 41 7.888 7.429 0.459 1
1 438 . 10 1 1 A 41 41 THR HA H 41 4.345 4.404 -0.059 1
1 443 . 10 1 1 A 41 41 THR C C 41 173.492 173.067 0.425 1
1 444 . 10 1 1 A 41 41 THR CA C 41 59.047 60.401 -1.354 1
1 445 . 10 1 1 A 41 41 THR CB C 41 68.992 69.858 -0.866 1
1 447 . 10 1 1 A 41 41 THR N N 41 109.905 111.356 -1.451 1
1 448 . 10 1 1 A 42 42 HIS H H 42 8.063 8.995 -0.932 1
1 449 . 10 1 1 A 42 42 HIS HA H 42 4.510 4.507 0.003 1
1 452 . 10 1 1 A 42 42 HIS C C 42 172.139 176.168 -4.029 1
1 453 . 10 1 1 A 42 42 HIS CA C 42 57.735 58.374 -0.639 1
1 454 . 10 1 1 A 42 42 HIS CB C 42 31.144 29.837 1.307 1
1 455 . 10 1 1 A 42 42 HIS N N 42 121.760 121.570 0.190 1
1 456 . 10 1 1 A 43 43 GLY H H 43 8.286 7.478 0.808 1
1 457 . 10 1 1 A 43 43 GLY HA2 H 43 3.980 3.895 0.085 1
1 458 . 10 1 1 A 43 43 GLY HA3 H 43 3.980 4.011 -0.031 1
1 459 . 10 1 1 A 43 43 GLY C C 43 176.307 173.270 3.037 1
1 460 . 10 1 1 A 43 43 GLY CA C 43 44.336 44.724 -0.388 1
1 461 . 10 1 1 A 43 43 GLY N N 43 110.133 107.082 3.051 1
1 462 . 10 1 1 A 44 44 PHE H H 44 8.327 8.577 -0.250 1
1 463 . 10 1 1 A 44 44 PHE HA H 44 4.489 4.465 0.024 1
1 467 . 10 1 1 A 44 44 PHE C C 44 171.877 175.517 -3.640 1
1 468 . 10 1 1 A 44 44 PHE CA C 44 58.027 57.336 0.691 1
1 469 . 10 1 1 A 44 44 PHE CB C 44 39.850 39.435 0.415 1
1 470 . 10 1 1 A 44 44 PHE N N 44 120.049 117.261 2.788 1
1 471 . 10 1 1 A 45 45 VAL H H 45 7.939 8.756 -0.817 1
1 472 . 10 1 1 A 45 45 VAL HA H 45 3.865 3.523 0.342 1
1 480 . 10 1 1 A 45 45 VAL C C 45 175.523 175.441 0.082 1
1 481 . 10 1 1 A 45 45 VAL CA C 45 61.536 63.137 -1.601 1
1 482 . 10 1 1 A 45 45 VAL CB C 45 33.127 31.043 2.084 1
1 485 . 10 1 1 A 45 45 VAL N N 45 127.882 122.859 5.023 1
1 486 . 10 1 1 A 46 46 LYS H H 46 8.868 9.294 -0.426 1
1 487 . 10 1 1 A 46 46 LYS HA H 46 4.170 4.337 -0.167 1
1 496 . 10 1 1 A 46 46 LYS C C 46 175.728 176.193 -0.465 1
1 497 . 10 1 1 A 46 46 LYS CA C 46 57.198 58.566 -1.368 1
1 498 . 10 1 1 A 46 46 LYS CB C 46 33.299 33.145 0.154 1
1 502 . 10 1 1 A 46 46 LYS N N 46 127.308 127.983 -0.675 1
1 503 . 10 1 1 A 47 47 ASP H H 47 7.652 8.054 -0.402 1
1 504 . 10 1 1 A 47 47 ASP HA H 47 4.710 5.000 -0.290 1
1 507 . 10 1 1 A 47 47 ASP C C 47 176.411 176.166 0.245 1
1 508 . 10 1 1 A 47 47 ASP CA C 47 53.390 53.887 -0.497 1
1 509 . 10 1 1 A 47 47 ASP CB C 47 42.635 44.260 -1.625 1
1 510 . 10 1 1 A 47 47 ASP N N 47 117.932 115.179 2.753 1
1 511 . 10 1 1 A 48 48 ILE H H 48 9.230 8.709 0.521 1
1 512 . 10 1 1 A 48 48 ILE HA H 48 3.579 3.967 -0.388 1
1 522 . 10 1 1 A 48 48 ILE C C 48 177.249 177.545 -0.296 1
1 523 . 10 1 1 A 48 48 ILE CA C 48 65.525 63.761 1.764 1
1 524 . 10 1 1 A 48 48 ILE CB C 48 38.797 37.989 0.808 1
1 528 . 10 1 1 A 48 48 ILE N N 48 129.049 125.595 3.454 1
1 529 . 10 1 1 A 49 49 ASN H H 49 8.468 8.952 -0.484 1
1 530 . 10 1 1 A 49 49 ASN HA H 49 4.690 4.553 0.137 1
1 535 . 10 1 1 A 49 49 ASN C C 49 175.779 176.509 -0.730 1
1 536 . 10 1 1 A 49 49 ASN CA C 49 55.587 54.971 0.616 1
1 537 . 10 1 1 A 49 49 ASN CB C 49 38.587 36.645 1.942 1
1 538 . 10 1 1 A 49 49 ASN N N 49 118.835 117.569 1.266 1
1 540 . 10 1 1 A 50 50 GLU H H 50 7.853 8.058 -0.205 1
1 541 . 10 1 1 A 50 50 GLU HA H 50 4.040 4.076 -0.036 1
1 546 . 10 1 1 A 50 50 GLU C C 50 176.148 177.209 -1.061 1
1 547 . 10 1 1 A 50 50 GLU CA C 50 57.404 58.062 -0.658 1
1 548 . 10 1 1 A 50 50 GLU CB C 50 29.491 29.006 0.485 1
1 550 . 10 1 1 A 50 50 GLU N N 50 116.358 118.046 -1.688 1
1 551 . 10 1 1 A 51 51 HIS H H 51 7.575 7.707 -0.132 1
1 552 . 10 1 1 A 51 51 HIS HA H 51 4.431 4.717 -0.286 1
1 555 . 10 1 1 A 51 51 HIS C C 51 176.383 174.285 2.098 1
1 556 . 10 1 1 A 51 51 HIS CA C 51 57.089 56.115 0.974 1
1 557 . 10 1 1 A 51 51 HIS CB C 51 33.168 31.765 1.403 1
1 558 . 10 1 1 A 51 51 HIS N N 51 115.828 115.111 0.717 1
1 559 . 10 1 1 A 52 52 LEU H H 52 7.640 7.126 0.514 1
1 560 . 10 1 1 A 52 52 LEU HA H 52 4.796 4.653 0.143 1
1 570 . 10 1 1 A 52 52 LEU C C 52 174.452 174.398 0.054 1
1 571 . 10 1 1 A 52 52 LEU CA C 52 53.398 53.611 -0.213 1
1 572 . 10 1 1 A 52 52 LEU CB C 52 48.805 44.007 4.798 1
1 576 . 10 1 1 A 52 52 LEU N N 52 117.932 119.810 -1.878 1
1 577 . 10 1 1 A 53 53 SER H H 53 8.151 8.560 -0.409 1
1 578 . 10 1 1 A 53 53 SER HA H 53 4.680 4.906 -0.226 1
1 581 . 10 1 1 A 53 53 SER C C 53 174.304 173.052 1.252 1
1 582 . 10 1 1 A 53 53 SER CA C 53 56.714 57.469 -0.755 1
1 583 . 10 1 1 A 53 53 SER CB C 53 65.431 66.931 -1.500 1
1 584 . 10 1 1 A 53 53 SER N N 53 113.496 117.147 -3.651 1
1 585 . 10 1 1 A 54 54 VAL H H 54 8.782 8.528 0.254 1
1 586 . 10 1 1 A 54 54 VAL HA H 54 3.230 3.703 -0.473 1
1 594 . 10 1 1 A 54 54 VAL C C 54 173.745 177.525 -3.780 1
1 595 . 10 1 1 A 54 54 VAL CA C 54 66.232 64.653 1.579 1
1 596 . 10 1 1 A 54 54 VAL CB C 54 31.067 31.956 -0.889 1
1 599 . 10 1 1 A 54 54 VAL N N 54 124.401 125.382 -0.981 1
1 600 . 10 1 1 A 55 55 GLY H H 55 9.079 9.046 0.033 1
1 601 . 10 1 1 A 55 55 GLY HA2 H 55 3.530 3.845 -0.315 1
1 602 . 10 1 1 A 55 55 GLY HA3 H 55 4.553 3.847 0.706 1
1 603 . 10 1 1 A 55 55 GLY C C 55 177.219 173.191 4.028 1
1 604 . 10 1 1 A 55 55 GLY CA C 55 44.647 46.252 -1.605 1
1 605 . 10 1 1 A 55 55 GLY N N 55 117.320 114.443 2.877 1
1 606 . 10 1 1 A 56 56 ASP H H 56 7.943 7.748 0.195 1
1 607 . 10 1 1 A 56 56 ASP HA H 56 4.460 5.086 -0.626 1
1 610 . 10 1 1 A 56 56 ASP C C 56 176.055 173.788 2.267 1
1 611 . 10 1 1 A 56 56 ASP CA C 56 55.456 52.303 3.153 1
1 612 . 10 1 1 A 56 56 ASP CB C 56 40.914 44.441 -3.527 1
1 613 . 10 1 1 A 56 56 ASP N N 56 121.782 119.721 2.061 1
1 614 . 10 1 1 A 57 57 GLU H H 57 8.649 8.773 -0.124 1
1 615 . 10 1 1 A 57 57 GLU HA H 57 5.100 5.177 -0.077 1
1 620 . 10 1 1 A 57 57 GLU C C 57 175.635 175.936 -0.301 1
1 621 . 10 1 1 A 57 57 GLU CA C 57 55.805 55.388 0.417 1
1 622 . 10 1 1 A 57 57 GLU CB C 57 30.915 31.351 -0.436 1
1 624 . 10 1 1 A 57 57 GLU N N 57 122.513 123.674 -1.161 1
1 625 . 10 1 1 A 58 58 VAL H H 58 8.809 9.128 -0.319 1
1 626 . 10 1 1 A 58 58 VAL HA H 58 4.817 4.826 -0.009 1
1 634 . 10 1 1 A 58 58 VAL C C 58 176.528 173.711 2.817 1
1 635 . 10 1 1 A 58 58 VAL CA C 58 58.719 59.113 -0.394 1
1 636 . 10 1 1 A 58 58 VAL CB C 58 35.523 35.975 -0.452 1
1 639 . 10 1 1 A 58 58 VAL N N 58 118.382 119.596 -1.214 1
1 640 . 10 1 1 A 59 59 GLN H H 59 8.255 8.773 -0.518 1
1 641 . 10 1 1 A 59 59 GLN HA H 59 5.030 5.057 -0.027 1
1 646 . 10 1 1 A 59 59 GLN CA C 59 54.843 54.630 0.213 1
1 647 . 10 1 1 A 59 59 GLN CB C 59 30.111 30.652 -0.541 1
1 649 . 10 1 1 A 59 59 GLN N N 59 120.933 123.083 -2.150 1
1 650 . 10 1 1 A 60 60 VAL H H 60 8.970 9.357 -0.387 1
1 651 . 10 1 1 A 60 60 VAL HA H 60 4.990 5.039 -0.049 1
1 659 . 10 1 1 A 60 60 VAL C C 60 175.203 173.732 1.471 1
1 660 . 10 1 1 A 60 60 VAL CA C 60 57.404 58.924 -1.520 1
1 661 . 10 1 1 A 60 60 VAL CB C 60 35.771 35.461 0.310 1
1 664 . 10 1 1 A 60 60 VAL N N 60 111.046 120.427 -9.381 1
1 665 . 10 1 1 A 61 61 LYS H H 61 8.937 8.771 0.166 1
1 666 . 10 1 1 A 61 61 LYS HA H 61 5.100 5.079 0.021 1
1 675 . 10 1 1 A 61 61 LYS C C 61 173.610 176.077 -2.467 1
1 676 . 10 1 1 A 61 61 LYS CA C 61 53.762 54.673 -0.911 1
1 677 . 10 1 1 A 61 61 LYS CB C 61 36.273 35.201 1.072 1
1 681 . 10 1 1 A 61 61 LYS N N 61 121.930 122.965 -1.035 1
1 682 . 10 1 1 A 62 62 VAL H H 62 8.429 9.267 -0.838 1
1 683 . 10 1 1 A 62 62 VAL HA H 62 4.074 4.059 0.015 1
1 691 . 10 1 1 A 62 62 VAL C C 62 176.912 175.827 1.085 1
1 692 . 10 1 1 A 62 62 VAL CA C 62 63.188 63.666 -0.478 1
1 693 . 10 1 1 A 62 62 VAL CB C 62 30.813 31.799 -0.986 1
1 696 . 10 1 1 A 62 62 VAL N N 62 126.329 127.219 -0.890 1
1 697 . 10 1 1 A 63 63 LEU H H 63 9.109 9.389 -0.280 1
1 698 . 10 1 1 A 63 63 LEU HA H 63 4.423 4.510 -0.087 1
1 708 . 10 1 1 A 63 63 LEU C C 63 176.091 176.039 0.052 1
1 709 . 10 1 1 A 63 63 LEU CA C 63 55.876 55.879 -0.003 1
1 710 . 10 1 1 A 63 63 LEU CB C 63 42.800 44.550 -1.750 1
1 714 . 10 1 1 A 63 63 LEU N N 63 129.436 129.447 -0.011 1
1 715 . 10 1 1 A 64 64 ALA H H 64 7.594 7.382 0.212 1
1 716 . 10 1 1 A 64 64 ALA HA H 64 4.455 4.754 -0.299 1
1 720 . 10 1 1 A 64 64 ALA C C 64 177.314 175.217 2.097 1
1 721 . 10 1 1 A 64 64 ALA CA C 64 52.557 51.631 0.926 1
1 722 . 10 1 1 A 64 64 ALA CB C 64 21.458 22.679 -1.221 1
1 723 . 10 1 1 A 64 64 ALA N N 64 117.791 118.830 -1.039 1
1 724 . 10 1 1 A 65 65 VAL H H 65 8.583 8.618 -0.035 1
1 725 . 10 1 1 A 65 65 VAL HA H 65 4.470 4.802 -0.332 1
1 733 . 10 1 1 A 65 65 VAL C C 65 174.697 174.710 -0.013 1
1 734 . 10 1 1 A 65 65 VAL CA C 65 61.936 60.987 0.949 1
1 735 . 10 1 1 A 65 65 VAL CB C 65 35.288 35.655 -0.367 1
1 738 . 10 1 1 A 65 65 VAL N N 65 120.009 120.030 -0.021 1
1 739 . 10 1 1 A 66 66 ASP H H 66 8.567 8.913 -0.346 1
1 740 . 10 1 1 A 66 66 ASP HA H 66 4.880 5.005 -0.125 1
1 743 . 10 1 1 A 66 66 ASP C C 66 174.355 175.845 -1.490 1
1 744 . 10 1 1 A 66 66 ASP CA C 66 52.681 53.048 -0.367 1
1 745 . 10 1 1 A 66 66 ASP CB C 66 41.775 40.676 1.099 1
1 746 . 10 1 1 A 66 66 ASP N N 66 126.262 125.331 0.931 1
1 747 . 10 1 1 A 67 67 GLU H H 67 9.148 8.828 0.320 1
1 748 . 10 1 1 A 67 67 GLU HA H 67 4.110 4.148 -0.038 1
1 753 . 10 1 1 A 67 67 GLU C C 67 177.052 178.551 -1.499 1
1 754 . 10 1 1 A 67 67 GLU CA C 67 59.044 58.471 0.573 1
1 755 . 10 1 1 A 67 67 GLU CB C 67 29.919 28.691 1.228 1
1 757 . 10 1 1 A 67 67 GLU N N 67 125.480 124.298 1.182 1
1 758 . 10 1 1 A 68 68 GLU H H 68 8.384 8.160 0.224 1
1 759 . 10 1 1 A 68 68 GLU HA H 68 4.140 4.182 -0.042 1
1 764 . 10 1 1 A 68 68 GLU C C 68 178.383 179.732 -1.349 1
1 765 . 10 1 1 A 68 68 GLU CA C 68 59.044 59.123 -0.079 1
1 766 . 10 1 1 A 68 68 GLU CB C 68 29.919 29.930 -0.011 1
1 768 . 10 1 1 A 68 68 GLU N N 68 119.760 119.609 0.151 1
1 769 . 10 1 1 A 69 69 LYS H H 69 7.799 8.075 -0.276 1
1 770 . 10 1 1 A 69 69 LYS HA H 69 4.375 4.294 0.081 1
1 779 . 10 1 1 A 69 69 LYS C C 69 178.297 176.687 1.610 1
1 780 . 10 1 1 A 69 69 LYS CA C 69 55.704 57.767 -2.063 1
1 781 . 10 1 1 A 69 69 LYS CB C 69 33.622 33.337 0.285 1
1 785 . 10 1 1 A 69 69 LYS N N 69 115.476 119.389 -3.913 1
1 786 . 10 1 1 A 70 70 GLY H H 70 7.994 8.486 -0.492 1
1 787 . 10 1 1 A 70 70 GLY HA2 H 70 3.940 3.931 0.009 1
1 788 . 10 1 1 A 70 70 GLY HA3 H 70 3.960 3.935 0.025 1
1 789 . 10 1 1 A 70 70 GLY C C 70 177.215 173.876 3.339 1
1 790 . 10 1 1 A 70 70 GLY CA C 70 46.773 46.297 0.476 1
1 791 . 10 1 1 A 70 70 GLY N N 70 110.245 107.926 2.319 1
1 792 . 10 1 1 A 71 71 LYS H H 71 7.560 8.033 -0.473 1
1 793 . 10 1 1 A 71 71 LYS HA H 71 4.690 4.992 -0.302 1
1 802 . 10 1 1 A 71 71 LYS C C 71 174.607 175.002 -0.395 1
1 803 . 10 1 1 A 71 71 LYS CA C 71 55.332 54.433 0.899 1
1 804 . 10 1 1 A 71 71 LYS CB C 71 34.903 36.186 -1.283 1
1 808 . 10 1 1 A 71 71 LYS N N 71 118.201 118.838 -0.637 1
1 809 . 10 1 1 A 72 72 ILE H H 72 8.867 8.756 0.111 1
1 810 . 10 1 1 A 72 72 ILE HA H 72 4.630 4.934 -0.304 1
1 820 . 10 1 1 A 72 72 ILE C C 72 175.708 174.648 1.060 1
1 821 . 10 1 1 A 72 72 ILE CA C 72 61.494 60.173 1.321 1
1 822 . 10 1 1 A 72 72 ILE CB C 72 40.652 42.192 -1.540 1
1 826 . 10 1 1 A 72 72 ILE N N 72 126.827 121.740 5.087 1
1 827 . 10 1 1 A 73 73 SER H H 73 8.815 9.044 -0.229 1
1 828 . 10 1 1 A 73 73 SER HA H 73 5.110 5.437 -0.327 1
1 831 . 10 1 1 A 73 73 SER C C 73 175.122 173.030 2.092 1
1 832 . 10 1 1 A 73 73 SER CA C 73 57.487 57.470 0.017 1
1 833 . 10 1 1 A 73 73 SER CB C 73 64.386 65.295 -0.909 1
1 834 . 10 1 1 A 73 73 SER N N 73 123.640 125.296 -1.656 1
1 835 . 10 1 1 A 74 74 LEU H H 74 8.585 8.931 -0.346 1
1 836 . 10 1 1 A 74 74 LEU HA H 74 5.450 5.236 0.214 1
1 846 . 10 1 1 A 74 74 LEU C C 74 174.061 175.235 -1.174 1
1 847 . 10 1 1 A 74 74 LEU CA C 74 53.101 53.405 -0.304 1
1 848 . 10 1 1 A 74 74 LEU CB C 74 48.268 46.702 1.566 1
1 852 . 10 1 1 A 74 74 LEU N N 74 125.221 124.412 0.809 1
1 853 . 10 1 1 A 75 75 SER H H 75 8.840 8.440 0.400 1
1 854 . 10 1 1 A 75 75 SER HA H 75 5.040 5.232 -0.192 1
1 857 . 10 1 1 A 75 75 SER C C 75 176.552 173.641 2.911 1
1 858 . 10 1 1 A 75 75 SER CA C 75 57.487 56.489 0.998 1
1 859 . 10 1 1 A 75 75 SER CB C 75 64.993 66.499 -1.506 1
1 860 . 10 1 1 A 75 75 SER N N 75 111.252 112.434 -1.182 1
1 861 . 10 1 1 A 76 76 ILE H H 76 7.790 8.823 -1.033 1
1 862 . 10 1 1 A 76 76 ILE HA H 76 4.690 4.468 0.222 1
1 872 . 10 1 1 A 76 76 ILE C C 76 175.780 177.195 -1.415 1
1 873 . 10 1 1 A 76 76 ILE CA C 76 63.631 62.201 1.430 1
1 874 . 10 1 1 A 76 76 ILE CB C 76 39.484 39.624 -0.140 1
1 878 . 10 1 1 A 76 76 ILE N N 76 129.205 120.056 9.149 1
1 879 . 10 1 1 A 77 77 ARG H H 77 8.115 8.485 -0.370 1
1 880 . 10 1 1 A 77 77 ARG HA H 77 3.760 4.107 -0.347 1
1 887 . 10 1 1 A 77 77 ARG C C 77 178.704 177.633 1.071 1
1 888 . 10 1 1 A 77 77 ARG CA C 77 58.933 58.068 0.865 1
1 889 . 10 1 1 A 77 77 ARG CB C 77 29.463 29.348 0.115 1
1 892 . 10 1 1 A 77 77 ARG N N 77 123.257 121.569 1.688 1
1 893 . 10 1 1 A 78 78 ALA H H 78 8.304 7.660 0.644 1
1 894 . 10 1 1 A 78 78 ALA HA H 78 4.296 4.132 0.164 1
1 898 . 10 1 1 A 78 78 ALA C C 78 176.870 178.520 -1.650 1
1 899 . 10 1 1 A 78 78 ALA CA C 78 53.548 54.144 -0.596 1
1 900 . 10 1 1 A 78 78 ALA CB C 78 19.872 18.392 1.480 1
1 901 . 10 1 1 A 78 78 ALA N N 78 118.764 122.081 -3.317 1
1 902 . 10 1 1 A 79 79 THR H H 79 7.931 7.726 0.205 1
1 903 . 10 1 1 A 79 79 THR HA H 79 4.370 4.559 -0.189 1
1 908 . 10 1 1 A 79 79 THR C C 79 178.356 174.002 4.354 1
1 909 . 10 1 1 A 79 79 THR CA C 79 62.381 62.154 0.227 1
1 910 . 10 1 1 A 79 79 THR CB C 79 69.693 70.298 -0.605 1
1 912 . 10 1 1 A 79 79 THR N N 79 107.360 103.964 3.396 1
1 913 . 10 1 1 A 80 80 GLN H H 80 7.651 7.932 -0.281 1
1 914 . 10 1 1 A 80 80 GLN HA H 80 4.527 4.623 -0.096 1
1 921 . 10 1 1 A 80 80 GLN C C 80 174.249 173.173 1.076 1
1 922 . 10 1 1 A 80 80 GLN CA C 80 54.760 54.620 0.140 1
1 923 . 10 1 1 A 80 80 GLN CB C 80 30.565 30.382 0.183 1
1 925 . 10 1 1 A 80 80 GLN N N 80 121.588 118.035 3.553 1
1 927 . 10 1 1 A 81 81 ALA H H 81 8.498 8.722 -0.224 1
1 928 . 10 1 1 A 81 81 ALA HA H 81 4.252 5.227 -0.975 1
1 932 . 10 1 1 A 81 81 ALA C C 81 175.693 175.426 0.267 1
1 933 . 10 1 1 A 81 81 ALA CA C 81 52.345 50.894 1.451 1
1 934 . 10 1 1 A 81 81 ALA CB C 81 19.062 24.148 -5.086 1
1 935 . 10 1 1 A 81 81 ALA N N 81 126.423 121.632 4.791 1
1 936 . 10 1 1 A 82 82 ALA H H 82 8.324 8.287 0.037 1
1 937 . 10 1 1 A 82 82 ALA HA H 82 4.000 4.875 -0.875 1
1 941 . 10 1 1 A 82 82 ALA C C 82 177.065 175.692 1.373 1
1 942 . 10 1 1 A 82 82 ALA CA C 82 50.240 49.777 0.463 1
1 943 . 10 1 1 A 82 82 ALA CB C 82 17.650 18.869 -1.219 1
1 944 . 10 1 1 A 82 82 ALA N N 82 125.114 120.547 4.567 1
1 945 . 10 1 1 A 83 83 PRO HA H 83 4.350 4.448 -0.098 1
1 952 . 10 1 1 A 83 83 PRO CA C 83 63.148 64.772 -1.624 1
1 953 . 10 1 1 A 83 83 PRO CB C 83 32.054 31.945 0.109 1
1 956 . 10 1 1 A 84 84 GLU H H 84 8.517 7.689 0.828 1
1 957 . 10 1 1 A 84 84 GLU HA H 84 4.197 4.453 -0.256 1
1 962 . 10 1 1 A 84 84 GLU C C 84 176.948 174.534 2.414 1
1 963 . 10 1 1 A 84 84 GLU CA C 84 56.674 55.803 0.871 1
1 964 . 10 1 1 A 84 84 GLU CB C 84 30.459 32.300 -1.841 1
1 966 . 10 1 1 A 84 84 GLU N N 84 121.479 116.267 5.212 1
1 967 . 10 1 1 A 85 85 LYS H H 85 8.381 8.748 -0.367 1
1 968 . 10 1 1 A 85 85 LYS HA H 85 4.309 4.412 -0.103 1
1 977 . 10 1 1 A 85 85 LYS C C 85 176.457 176.014 0.443 1
1 978 . 10 1 1 A 85 85 LYS CA C 85 56.272 56.652 -0.380 1
1 979 . 10 1 1 A 85 85 LYS CB C 85 32.961 33.020 -0.059 1
1 983 . 10 1 1 A 85 85 LYS N N 85 123.266 128.055 -4.789 1
1 984 . 10 1 1 A 86 86 LYS H H 86 8.403 8.706 -0.303 1
1 985 . 10 1 1 A 86 86 LYS HA H 86 4.308 5.115 -0.807 1
1 994 . 10 1 1 A 86 86 LYS C C 86 176.435 174.541 1.894 1
1 995 . 10 1 1 A 86 86 LYS CA C 86 56.272 54.486 1.786 1
1 996 . 10 1 1 A 86 86 LYS CB C 86 32.961 37.067 -4.106 1
1 1000 . 10 1 1 A 86 86 LYS N N 86 123.688 122.594 1.094 1
1 1001 . 10 1 1 A 87 87 GLU H H 87 8.540 8.592 -0.052 1
1 1002 . 10 1 1 A 87 87 GLU HA H 87 4.358 4.674 -0.316 1
1 1007 . 10 1 1 A 87 87 GLU C C 87 176.556 175.679 0.877 1
1 1008 . 10 1 1 A 87 87 GLU CA C 87 56.406 55.604 0.802 1
1 1009 . 10 1 1 A 87 87 GLU CB C 87 30.607 33.453 -2.846 1
1 1011 . 10 1 1 A 87 87 GLU N N 87 122.633 119.918 2.715 1
1 1012 . 10 1 1 A 88 88 SER H H 88 8.520 8.725 -0.205 1
1 1013 . 10 1 1 A 88 88 SER HA H 88 4.490 4.524 -0.034 1
1 1016 . 10 1 1 A 88 88 SER C C 88 175.780 174.328 1.452 1
1 1017 . 10 1 1 A 88 88 SER CA C 88 58.431 59.188 -0.757 1
1 1018 . 10 1 1 A 88 88 SER CB C 88 63.858 63.406 0.452 1
1 1019 . 10 1 1 A 88 88 SER N N 88 118.333 117.352 0.981 1
1 1020 . 10 1 1 A 89 89 LYS H H 89 8.339 7.546 0.793 1
1 1021 . 10 1 1 A 89 89 LYS HA H 89 4.620 4.820 -0.200 1
1 1030 . 10 1 1 A 89 89 LYS C C 89 174.160 173.525 0.635 1
1 1031 . 10 1 1 A 89 89 LYS CA C 89 54.265 53.855 0.410 1
1 1032 . 10 1 1 A 89 89 LYS CB C 89 32.672 34.940 -2.268 1
1 1036 . 10 1 1 A 89 89 LYS N N 89 124.433 117.833 6.600 1
1 1037 . 10 1 1 A 90 90 PRO HA H 90 4.417 4.466 -0.049 1
1 1044 . 10 1 1 A 90 90 PRO CA C 90 63.064 62.593 0.471 1
1 1045 . 10 1 1 A 90 90 PRO CB C 90 32.266 31.996 0.270 1
1 1048 . 10 1 1 A 91 91 ARG H H 91 8.502 8.344 0.158 1
1 1049 . 10 1 1 A 91 91 ARG HA H 91 4.305 4.302 0.003 1
1 1056 . 10 1 1 A 91 91 ARG C C 91 176.831 176.316 0.515 1
1 1057 . 10 1 1 A 91 91 ARG CA C 91 56.002 56.200 -0.198 1
1 1058 . 10 1 1 A 91 91 ARG CB C 91 30.913 30.560 0.353 1
1 1061 . 10 1 1 A 91 91 ARG N N 91 122.193 122.285 -0.092 1
1 1062 . 10 1 1 A 92 92 LYS H H 92 8.415 8.467 -0.052 1
1 1063 . 10 1 1 A 92 92 LYS HA H 92 4.610 4.506 0.104 1
1 1072 . 10 1 1 A 92 92 LYS C C 92 176.262 174.397 1.865 1
1 1073 . 10 1 1 A 92 92 LYS CA C 92 54.258 54.677 -0.419 1
1 1074 . 10 1 1 A 92 92 LYS CB C 92 32.672 31.236 1.436 1
1 1078 . 10 1 1 A 92 92 LYS N N 92 124.243 125.737 -1.494 1
1 1079 . 10 1 1 A 93 93 PRO HA H 93 4.415 4.545 -0.130 1
1 1086 . 10 1 1 A 93 93 PRO CA C 93 62.899 62.934 -0.035 1
1 1087 . 10 1 1 A 93 93 PRO CB C 93 32.323 32.703 -0.380 1
1 1090 . 10 1 1 A 94 94 LYS H H 94 8.420 8.897 -0.477 1
1 1091 . 10 1 1 A 94 94 LYS HA H 94 4.290 4.120 0.170 1
1 1100 . 10 1 1 A 94 94 LYS C C 94 176.714 176.501 0.213 1
1 1101 . 10 1 1 A 94 94 LYS CA C 94 56.585 59.214 -2.629 1
1 1102 . 10 1 1 A 94 94 LYS CB C 94 33.161 33.051 0.110 1
1 1106 . 10 1 1 A 94 94 LYS N N 94 122.121 121.541 0.580 1
1 1107 . 10 1 1 A 95 95 ALA H H 95 8.348 7.541 0.807 1
1 1108 . 10 1 1 A 95 95 ALA HA H 95 4.250 4.576 -0.326 1
1 1112 . 10 1 1 A 95 95 ALA C C 95 176.453 175.534 0.919 1
1 1113 . 10 1 1 A 95 95 ALA CA C 95 52.471 51.378 1.093 1
1 1114 . 10 1 1 A 95 95 ALA CB C 95 19.347 22.711 -3.364 1
1 1115 . 10 1 1 A 95 95 ALA N N 95 125.624 116.824 8.800 1
1 1116 . 10 1 1 A 96 96 ALA H H 96 8.348 8.515 -0.167 1
1 1117 . 10 1 1 A 96 96 ALA HA H 96 4.254 4.001 0.253 1
1 1121 . 10 1 1 A 96 96 ALA C C 96 176.462 178.152 -1.690 1
1 1122 . 10 1 1 A 96 96 ALA CA C 96 52.471 53.343 -0.872 1
1 1123 . 10 1 1 A 96 96 ALA CB C 96 19.347 18.598 0.749 1
1 1124 . 10 1 1 A 96 96 ALA N N 96 125.624 123.293 2.331 1
1 1125 . 10 1 1 A 97 97 GLN H H 97 8.333 8.941 -0.608 1
1 1126 . 10 1 1 A 97 97 GLN HA H 97 4.362 4.231 0.131 1
1 1133 . 10 1 1 A 97 97 GLN C C 97 177.684 176.493 1.191 1
1 1134 . 10 1 1 A 97 97 GLN CA C 97 55.848 57.450 -1.602 1
1 1135 . 10 1 1 A 97 97 GLN CB C 97 29.643 28.571 1.072 1
1 1137 . 10 1 1 A 97 97 GLN N N 97 120.049 121.644 -1.595 1
1 1139 . 10 1 1 A 98 98 VAL H H 98 8.230 8.080 0.150 1
1 1140 . 10 1 1 A 98 98 VAL HA H 98 4.145 3.820 0.325 1
1 1148 . 10 1 1 A 98 98 VAL C C 98 176.033 176.665 -0.632 1
1 1149 . 10 1 1 A 98 98 VAL CA C 98 62.444 65.885 -3.441 1
1 1150 . 10 1 1 A 98 98 VAL CB C 98 32.942 31.917 1.025 1
1 1153 . 10 1 1 A 98 98 VAL N N 98 121.607 118.916 2.691 1
1 1154 . 10 1 1 A 99 99 SER H H 99 8.375 7.536 0.839 1
1 1155 . 10 1 1 A 99 99 SER HA H 99 4.473 4.339 0.134 1
1 1158 . 10 1 1 A 99 99 SER C C 99 176.204 175.650 0.554 1
1 1159 . 10 1 1 A 99 99 SER CA C 99 58.379 59.731 -1.352 1
1 1160 . 10 1 1 A 99 99 SER CB C 99 63.914 63.923 -0.009 1
1 1161 . 10 1 1 A 99 99 SER N N 99 119.455 116.977 2.478 1
1 1162 . 10 1 1 A 100 100 GLU H H 100 8.547 8.923 -0.376 1
1 1163 . 10 1 1 A 100 100 GLU HA H 100 4.304 4.113 0.191 1
1 1168 . 10 1 1 A 100 100 GLU C C 100 174.620 176.623 -2.003 1
1 1169 . 10 1 1 A 100 100 GLU CA C 100 56.835 58.426 -1.591 1
1 1170 . 10 1 1 A 100 100 GLU CB C 100 30.365 29.165 1.200 1
1 1172 . 10 1 1 A 100 100 GLU N N 100 123.419 122.854 0.565 1
1 1173 . 10 1 1 A 101 101 GLU H H 101 8.432 7.885 0.547 1
1 1174 . 10 1 1 A 101 101 GLU HA H 101 4.252 4.592 -0.340 1
1 1179 . 10 1 1 A 101 101 GLU C C 101 176.693 176.191 0.502 1
1 1180 . 10 1 1 A 101 101 GLU CA C 101 56.835 55.177 1.658 1
1 1181 . 10 1 1 A 101 101 GLU CB C 101 30.365 30.091 0.274 1
1 1183 . 10 1 1 A 101 101 GLU N N 101 122.025 120.365 1.660 1
1 1184 . 10 1 1 A 102 102 ALA H H 102 8.324 8.303 0.021 1
1 1185 . 10 1 1 A 102 102 ALA HA H 102 4.361 4.154 0.207 1
1 1189 . 10 1 1 A 102 102 ALA C C 102 177.065 177.988 -0.923 1
1 1190 . 10 1 1 A 102 102 ALA CA C 102 52.647 53.040 -0.393 1
1 1191 . 10 1 1 A 102 102 ALA CB C 102 19.227 18.931 0.296 1
1 1192 . 10 1 1 A 102 102 ALA N N 102 125.114 126.934 -1.820 1
1 1193 . 10 1 1 A 103 103 SER H H 103 8.259 7.640 0.619 1
1 1194 . 10 1 1 A 103 103 SER HA H 103 4.473 4.492 -0.019 1
1 1197 . 10 1 1 A 103 103 SER C C 103 177.772 174.541 3.231 1
1 1198 . 10 1 1 A 103 103 SER CA C 103 58.301 59.259 -0.958 1
1 1199 . 10 1 1 A 103 103 SER CB C 103 63.961 63.988 -0.027 1
1 1200 . 10 1 1 A 103 103 SER N N 103 115.109 115.994 -0.885 1
1 1201 . 10 1 1 A 104 104 THR H H 104 8.127 8.553 -0.426 1
1 1202 . 10 1 1 A 104 104 THR HA H 104 4.600 4.615 -0.015 1
1 1207 . 10 1 1 A 104 104 THR C C 104 174.427 173.780 0.647 1
1 1208 . 10 1 1 A 104 104 THR CA C 104 59.954 60.769 -0.815 1
1 1209 . 10 1 1 A 104 104 THR CB C 104 69.868 69.067 0.801 1
1 1211 . 10 1 1 A 104 104 THR N N 104 117.882 115.774 2.108 1
1 1212 . 10 1 1 A 105 105 PRO HA H 105 4.414 4.571 -0.157 1
1 1219 . 10 1 1 A 105 105 PRO CA C 105 63.300 62.444 0.856 1
1 1220 . 10 1 1 A 105 105 PRO CB C 105 32.227 32.032 0.195 1
1 1223 . 10 1 1 A 106 106 GLN H H 106 8.524 8.534 -0.010 1
1 1224 . 10 1 1 A 106 106 GLN HA H 106 4.276 3.950 0.326 1
1 1229 . 10 1 1 A 106 106 GLN C C 106 177.083 177.169 -0.086 1
1 1230 . 10 1 1 A 106 106 GLN CA C 106 56.209 57.678 -1.469 1
1 1231 . 10 1 1 A 106 106 GLN CB C 106 29.490 28.308 1.182 1
1 1233 . 10 1 1 A 106 106 GLN N N 106 120.754 122.068 -1.314 1
1 1234 . 10 1 1 A 107 107 GLY H H 107 8.394 8.962 -0.568 1
1 1235 . 10 1 1 A 107 107 GLY HA2 H 107 3.895 3.908 -0.013 1
1 1236 . 10 1 1 A 107 107 GLY HA3 H 107 3.895 3.924 -0.029 1
1 1237 . 10 1 1 A 107 107 GLY C C 107 176.651 174.460 2.191 1
1 1238 . 10 1 1 A 107 107 GLY CA C 107 45.330 46.623 -1.293 1
1 1239 . 10 1 1 A 107 107 GLY N N 107 110.026 114.642 -4.616 1
1 1240 . 10 1 1 A 108 108 PHE H H 108 8.099 8.588 -0.489 1
1 1241 . 10 1 1 A 108 108 PHE HA H 108 4.582 4.233 0.349 1
1 1245 . 10 1 1 A 108 108 PHE C C 108 173.944 175.672 -1.728 1
1 1246 . 10 1 1 A 108 108 PHE CA C 108 58.054 58.776 -0.722 1
1 1247 . 10 1 1 A 108 108 PHE CB C 108 39.708 37.176 2.532 1
1 1248 . 10 1 1 A 108 108 PHE N N 108 120.180 118.151 2.029 1
1 1249 . 10 1 1 A 109 109 ASN H H 109 8.482 7.989 0.493 1
1 1250 . 10 1 1 A 109 109 ASN HA H 109 4.691 4.664 0.027 1
1 1255 . 10 1 1 A 109 109 ASN C C 109 175.627 175.399 0.228 1
1 1256 . 10 1 1 A 109 109 ASN CA C 109 53.402 53.452 -0.050 1
1 1257 . 10 1 1 A 109 109 ASN CB C 109 38.883 39.603 -0.720 1
1 1258 . 10 1 1 A 109 109 ASN N N 109 120.752 118.689 2.063 1
1 1260 . 10 1 1 A 110 110 THR H H 110 8.112 8.780 -0.668 1
1 1261 . 10 1 1 A 110 110 THR HA H 110 4.251 4.599 -0.348 1
1 1266 . 10 1 1 A 110 110 THR C C 110 175.275 173.423 1.852 1
1 1267 . 10 1 1 A 110 110 THR CA C 110 62.460 60.548 1.912 1
1 1268 . 10 1 1 A 110 110 THR CB C 110 69.726 69.839 -0.113 1
1 1270 . 10 1 1 A 110 110 THR N N 110 114.601 115.279 -0.678 1
1 1271 . 10 1 1 A 111 111 LEU H H 111 8.168 7.294 0.874 1
1 1272 . 10 1 1 A 111 111 LEU HA H 111 4.308 4.990 -0.682 1
1 1282 . 10 1 1 A 111 111 LEU CA C 111 55.704 53.582 2.122 1
1 1283 . 10 1 1 A 111 111 LEU CB C 111 42.071 45.297 -3.226 1
1 1287 . 10 1 1 A 111 111 LEU N N 111 123.756 118.310 5.446 1
1 1288 . 10 1 1 A 112 112 LYS H H 112 8.123 8.607 -0.484 1
1 1289 . 10 1 1 A 112 112 LYS HA H 112 4.242 4.342 -0.100 1
1 1298 . 10 1 1 A 112 112 LYS C C 112 177.547 176.003 1.544 1
1 1299 . 10 1 1 A 112 112 LYS CA C 112 56.928 56.663 0.265 1
1 1300 . 10 1 1 A 112 112 LYS CB C 112 33.055 32.680 0.375 1
1 1304 . 10 1 1 A 112 112 LYS N N 112 121.442 121.997 -0.555 1
1 1305 . 10 1 1 A 113 113 ASP H H 113 8.230 8.254 -0.024 1
1 1306 . 10 1 1 A 113 113 ASP HA H 113 4.526 4.453 0.073 1
1 1309 . 10 1 1 A 113 113 ASP C C 113 176.532 176.330 0.202 1
1 1310 . 10 1 1 A 113 113 ASP CA C 113 54.896 54.795 0.101 1
1 1311 . 10 1 1 A 113 113 ASP CB C 113 41.362 41.519 -0.157 1
1 1312 . 10 1 1 A 113 113 ASP N N 113 120.598 128.040 -7.442 1
1 1313 . 10 1 1 A 114 114 LYS H H 114 8.127 8.631 -0.504 1
1 1314 . 10 1 1 A 114 114 LYS HA H 114 4.300 4.218 0.082 1
1 1323 . 10 1 1 A 114 114 LYS C C 114 176.303 177.181 -0.878 1
1 1324 . 10 1 1 A 114 114 LYS CA C 114 56.633 56.441 0.192 1
1 1325 . 10 1 1 A 114 114 LYS CB C 114 32.818 33.416 -0.598 1
1 1329 . 10 1 1 A 114 114 LYS N N 114 120.897 124.861 -3.964 1
1 1330 . 10 1 1 A 115 115 LEU H H 115 8.244 8.888 -0.644 1
1 1331 . 10 1 1 A 115 115 LEU HA H 115 4.254 3.960 0.294 1
1 1341 . 10 1 1 A 115 115 LEU C C 115 176.909 177.076 -0.167 1
1 1342 . 10 1 1 A 115 115 LEU CA C 115 56.282 55.622 0.660 1
1 1343 . 10 1 1 A 115 115 LEU CB C 115 42.188 40.460 1.728 1
1 1347 . 10 1 1 A 115 115 LEU N N 115 123.251 123.074 0.177 1
1 1348 . 10 1 1 A 116 116 GLU H H 116 8.421 8.027 0.394 1
1 1349 . 10 1 1 A 116 116 GLU HA H 116 4.190 3.956 0.234 1
1 1352 . 10 1 1 A 116 116 GLU C C 116 177.828 175.905 1.923 1
1 1353 . 10 1 1 A 116 116 GLU CA C 116 57.466 58.977 -1.511 1
1 1354 . 10 1 1 A 116 116 GLU CB C 116 30.124 30.193 -0.069 1
1 1355 . 10 1 1 A 116 116 GLU N N 116 120.575 120.873 -0.298 1
1 1356 . 10 1 1 A 117 117 GLU H H 117 8.255 7.705 0.550 1
1 1357 . 10 1 1 A 117 117 GLU HA H 117 4.192 4.391 -0.199 1
1 1362 . 10 1 1 A 117 117 GLU CA C 117 57.491 54.109 3.382 1
1 1363 . 10 1 1 A 117 117 GLU CB C 117 30.365 34.846 -4.481 1
1 1365 . 10 1 1 A 117 117 GLU N N 117 120.933 115.649 5.284 1
1 1366 . 10 1 1 A 118 118 TRP H H 118 8.143 8.327 -0.184 1
1 1367 . 10 1 1 A 118 118 TRP HA H 118 4.581 4.873 -0.292 1
1 1372 . 10 1 1 A 118 118 TRP C C 118 176.794 176.335 0.459 1
1 1373 . 10 1 1 A 118 118 TRP CA C 118 58.363 57.603 0.760 1
1 1374 . 10 1 1 A 118 118 TRP CB C 118 29.333 30.259 -0.926 1
1 1375 . 10 1 1 A 118 118 TRP N N 118 121.592 121.005 0.587 1
1 1376 . 10 1 1 A 119 119 ILE H H 119 7.908 8.669 -0.761 1
1 1377 . 10 1 1 A 119 119 ILE HA H 119 3.828 4.870 -1.042 1
1 1387 . 10 1 1 A 119 119 ILE C C 119 176.984 174.301 2.683 1
1 1388 . 10 1 1 A 119 119 ILE CA C 119 62.335 59.058 3.277 1
1 1389 . 10 1 1 A 119 119 ILE CB C 119 38.649 41.997 -3.348 1
1 1393 . 10 1 1 A 119 119 ILE N N 119 122.744 116.196 6.548 1
1 1394 . 10 1 1 A 120 120 GLU H H 120 8.143 8.736 -0.593 1
1 1395 . 10 1 1 A 120 120 GLU HA H 120 4.093 4.170 -0.077 1
1 1400 . 10 1 1 A 120 120 GLU C C 120 176.565 177.822 -1.257 1
1 1401 . 10 1 1 A 120 120 GLU CA C 120 57.613 56.868 0.745 1
1 1402 . 10 1 1 A 120 120 GLU CB C 120 29.834 31.806 -1.972 1
1 1404 . 10 1 1 A 120 120 GLU N N 120 123.139 124.612 -1.473 1
1 1405 . 10 1 1 A 121 121 MET H H 121 8.254 8.648 -0.394 1
1 1406 . 10 1 1 A 121 121 MET HA H 121 4.357 4.169 0.188 1
1 1411 . 10 1 1 A 121 121 MET CA C 121 56.625 58.243 -1.618 1
1 1412 . 10 1 1 A 121 121 MET CB C 121 32.664 32.194 0.470 1
1 1414 . 10 1 1 A 121 121 MET N N 121 120.449 124.490 -4.041 1
1 1415 . 10 1 1 A 122 122 SER H H 122 8.199 8.207 -0.008 1
1 1416 . 10 1 1 A 122 122 SER HA H 122 4.280 4.470 -0.190 1
1 1419 . 10 1 1 A 122 122 SER C C 122 177.224 174.893 2.331 1
1 1420 . 10 1 1 A 122 122 SER CA C 122 59.635 60.701 -1.066 1
1 1421 . 10 1 1 A 122 122 SER CB C 122 63.560 63.114 0.446 1
1 1422 . 10 1 1 A 122 122 SER N N 122 115.857 116.436 -0.579 1
1 1423 . 10 1 1 A 123 123 ASN H H 123 8.211 7.978 0.233 1
1 1424 . 10 1 1 A 123 123 ASN HA H 123 4.737 4.737 0.000 1
1 1429 . 10 1 1 A 123 123 ASN C C 123 174.709 174.833 -0.124 1
1 1430 . 10 1 1 A 123 123 ASN CA C 123 53.507 52.882 0.625 1
1 1431 . 10 1 1 A 123 123 ASN CB C 123 38.800 38.912 -0.112 1
1 1432 . 10 1 1 A 123 123 ASN N N 123 119.923 117.950 1.973 1
1 1434 . 10 1 1 A 124 124 ARG H H 124 7.997 7.468 0.529 1
1 1435 . 10 1 1 A 124 124 ARG HA H 124 4.305 4.789 -0.484 1
1 1442 . 10 1 1 A 124 124 ARG C C 124 175.477 176.470 -0.993 1
1 1443 . 10 1 1 A 124 124 ARG CA C 124 56.709 54.146 2.563 1
1 1444 . 10 1 1 A 124 124 ARG CB C 124 30.584 34.146 -3.562 1
1 1447 . 10 1 1 A 124 124 ARG N N 124 120.821 118.747 2.074 1
1 1448 . 10 1 1 A 125 125 LYS H H 125 8.327 8.791 -0.464 1
1 1449 . 10 1 1 A 125 125 LYS HA H 125 4.254 3.949 0.305 1
1 1458 . 10 1 1 A 125 125 LYS C C 125 176.777 177.336 -0.559 1
1 1459 . 10 1 1 A 125 125 LYS CA C 125 56.860 59.175 -2.315 1
1 1460 . 10 1 1 A 125 125 LYS CB C 125 32.879 32.041 0.838 1
1 1464 . 10 1 1 A 125 125 LYS N N 125 121.891 123.948 -2.057 1
1 1465 . 10 1 1 A 126 126 ASP H H 126 8.343 7.846 0.497 1
1 1466 . 10 1 1 A 126 126 ASP HA H 126 4.581 4.450 0.131 1
1 1469 . 10 1 1 A 126 126 ASP C C 126 176.538 176.098 0.440 1
1 1470 . 10 1 1 A 126 126 ASP CA C 126 54.540 56.256 -1.716 1
1 1471 . 10 1 1 A 126 126 ASP CB C 126 40.907 40.820 0.087 1
1 1472 . 10 1 1 A 126 126 ASP N N 126 119.814 119.187 0.627 1
1 1473 . 10 1 1 A 127 127 LEU H H 127 7.946 7.645 0.301 1
1 1474 . 10 1 1 A 127 127 LEU HA H 127 4.309 4.874 -0.565 1
1 1484 . 10 1 1 A 127 127 LEU C C 127 176.043 174.668 1.375 1
1 1485 . 10 1 1 A 127 127 LEU CA C 127 55.427 54.495 0.932 1
1 1486 . 10 1 1 A 127 127 LEU CB C 127 42.394 45.076 -2.682 1
1 1490 . 10 1 1 A 127 127 LEU N N 127 121.432 118.169 3.263 1
1 1491 . 10 1 1 A 128 128 ILE H H 128 7.967 8.842 -0.875 1
1 1492 . 10 1 1 A 128 128 ILE HA H 128 4.141 4.955 -0.814 1
1 1502 . 10 1 1 A 128 128 ILE C C 128 177.200 174.515 2.685 1
1 1503 . 10 1 1 A 128 128 ILE CA C 128 61.150 58.383 2.767 1
1 1504 . 10 1 1 A 128 128 ILE CB C 128 38.489 41.741 -3.252 1
1 1508 . 10 1 1 A 128 128 ILE N N 128 121.579 121.920 -0.341 1
1 1509 . 10 1 1 A 129 129 LYS H H 129 8.331 8.534 -0.203 1
1 1510 . 10 1 1 A 129 129 LYS HA H 129 4.328 4.063 0.265 1
1 1519 . 10 1 1 A 129 129 LYS C C 129 175.952 177.015 -1.063 1
1 1520 . 10 1 1 A 129 129 LYS CA C 129 56.330 57.181 -0.851 1
1 1521 . 10 1 1 A 129 129 LYS CB C 129 33.010 32.929 0.081 1
1 1525 . 10 1 1 A 129 129 LYS N N 129 126.955 124.049 2.906 1
1 1 . 11 1 1 A 2 2 ALA HA H 2 4.070 4.274 -0.204 1
1 5 . 11 1 1 A 2 2 ALA CA C 2 52.067 52.349 -0.282 1
1 6 . 11 1 1 A 2 2 ALA CB C 2 19.577 18.953 0.624 1
1 7 . 11 1 1 A 3 3 ALA H H 3 8.714 8.672 0.042 1
1 8 . 11 1 1 A 3 3 ALA HA H 3 4.253 4.459 -0.206 1
1 12 . 11 1 1 A 3 3 ALA C C 3 173.672 178.935 -5.263 1
1 13 . 11 1 1 A 3 3 ALA CA C 3 52.067 52.142 -0.075 1
1 14 . 11 1 1 A 3 3 ALA CB C 3 19.577 20.093 -0.516 1
1 15 . 11 1 1 A 3 3 ALA N N 3 124.480 123.201 1.279 1
1 16 . 11 1 1 A 4 4 LYS H H 4 8.227 8.756 -0.529 1
1 17 . 11 1 1 A 4 4 LYS HA H 4 3.976 3.956 0.020 1
1 26 . 11 1 1 A 4 4 LYS C C 4 176.672 176.839 -0.167 1
1 27 . 11 1 1 A 4 4 LYS CA C 4 57.274 58.586 -1.312 1
1 28 . 11 1 1 A 4 4 LYS CB C 4 33.209 31.769 1.440 1
1 32 . 11 1 1 A 4 4 LYS N N 4 120.988 119.120 1.868 1
1 33 . 11 1 1 A 5 5 PHE H H 5 7.719 7.530 0.189 1
1 34 . 11 1 1 A 5 5 PHE HA H 5 4.384 4.655 -0.271 1
1 38 . 11 1 1 A 5 5 PHE C C 5 175.364 176.174 -0.810 1
1 39 . 11 1 1 A 5 5 PHE CA C 5 57.074 58.842 -1.768 1
1 40 . 11 1 1 A 5 5 PHE CB C 5 39.669 40.176 -0.507 1
1 41 . 11 1 1 A 5 5 PHE N N 5 119.246 119.906 -0.660 1
1 42 . 11 1 1 A 6 6 GLU H H 6 8.515 9.150 -0.635 1
1 43 . 11 1 1 A 6 6 GLU HA H 6 4.370 4.972 -0.602 1
1 48 . 11 1 1 A 6 6 GLU CA C 6 55.669 54.443 1.226 1
1 49 . 11 1 1 A 6 6 GLU CB C 6 32.094 33.789 -1.695 1
1 51 . 11 1 1 A 6 6 GLU N N 6 122.193 120.756 1.437 1
1 52 . 11 1 1 A 7 7 VAL H H 7 8.636 8.649 -0.013 1
1 53 . 11 1 1 A 7 7 VAL HA H 7 3.406 3.500 -0.094 1
1 61 . 11 1 1 A 7 7 VAL C C 7 176.611 177.081 -0.470 1
1 62 . 11 1 1 A 7 7 VAL CA C 7 65.358 65.636 -0.278 1
1 63 . 11 1 1 A 7 7 VAL CB C 7 31.391 31.469 -0.078 1
1 66 . 11 1 1 A 7 7 VAL N N 7 122.949 122.746 0.203 1
1 67 . 11 1 1 A 8 8 GLY H H 8 9.394 9.123 0.271 1
1 68 . 11 1 1 A 8 8 GLY HA2 H 8 3.600 4.045 -0.445 1
1 69 . 11 1 1 A 8 8 GLY HA3 H 8 4.546 4.046 0.500 1
1 70 . 11 1 1 A 8 8 GLY C C 8 178.074 174.479 3.595 1
1 71 . 11 1 1 A 8 8 GLY CA C 8 45.121 44.825 0.296 1
1 72 . 11 1 1 A 8 8 GLY N N 8 116.837 115.946 0.891 1
1 73 . 11 1 1 A 9 9 SER H H 9 8.021 8.049 -0.028 1
1 74 . 11 1 1 A 9 9 SER HA H 9 4.680 4.469 0.211 1
1 77 . 11 1 1 A 9 9 SER C C 9 174.234 173.045 1.189 1
1 78 . 11 1 1 A 9 9 SER CA C 9 59.387 59.429 -0.042 1
1 79 . 11 1 1 A 9 9 SER CB C 9 65.584 64.661 0.923 1
1 80 . 11 1 1 A 9 9 SER N N 9 118.208 117.867 0.341 1
1 81 . 11 1 1 A 10 10 VAL H H 10 7.945 8.250 -0.305 1
1 82 . 11 1 1 A 10 10 VAL HA H 10 4.980 5.149 -0.169 1
1 90 . 11 1 1 A 10 10 VAL C C 10 171.388 174.272 -2.884 1
1 91 . 11 1 1 A 10 10 VAL CA C 10 61.021 61.015 0.006 1
1 92 . 11 1 1 A 10 10 VAL CB C 10 33.400 34.976 -1.576 1
1 95 . 11 1 1 A 10 10 VAL N N 10 121.118 122.459 -1.341 1
1 96 . 11 1 1 A 11 11 TYR H H 11 9.008 9.181 -0.173 1
1 97 . 11 1 1 A 11 11 TYR HA H 11 4.850 5.295 -0.445 1
1 101 . 11 1 1 A 11 11 TYR C C 11 174.926 174.667 0.259 1
1 102 . 11 1 1 A 11 11 TYR CA C 11 56.803 56.276 0.527 1
1 103 . 11 1 1 A 11 11 TYR CB C 11 43.676 43.686 -0.010 1
1 104 . 11 1 1 A 11 11 TYR N N 11 125.043 125.349 -0.306 1
1 105 . 11 1 1 A 12 12 THR H H 12 8.809 8.637 0.172 1
1 106 . 11 1 1 A 12 12 THR HA H 12 5.020 5.448 -0.428 1
1 111 . 11 1 1 A 12 12 THR C C 12 174.195 174.490 -0.295 1
1 112 . 11 1 1 A 12 12 THR CA C 12 62.487 60.020 2.467 1
1 113 . 11 1 1 A 12 12 THR CB C 12 69.743 71.981 -2.238 1
1 115 . 11 1 1 A 12 12 THR N N 12 116.850 115.325 1.525 1
1 116 . 11 1 1 A 13 13 GLY H H 13 9.179 8.449 0.730 1
1 117 . 11 1 1 A 13 13 GLY HA2 H 13 3.250 4.328 -1.078 1
1 118 . 11 1 1 A 13 13 GLY HA3 H 13 4.801 4.346 0.455 1
1 119 . 11 1 1 A 13 13 GLY C C 13 174.654 171.673 2.981 1
1 120 . 11 1 1 A 13 13 GLY CA C 13 44.377 45.346 -0.969 1
1 121 . 11 1 1 A 13 13 GLY N N 13 113.654 111.964 1.690 1
1 122 . 11 1 1 A 14 14 LYS H H 14 7.770 8.552 -0.782 1
1 123 . 11 1 1 A 14 14 LYS HA H 14 5.426 5.088 0.338 1
1 132 . 11 1 1 A 14 14 LYS C C 14 171.343 176.083 -4.740 1
1 133 . 11 1 1 A 14 14 LYS CA C 14 53.879 54.531 -0.652 1
1 134 . 11 1 1 A 14 14 LYS CB C 14 36.032 34.907 1.125 1
1 138 . 11 1 1 A 14 14 LYS N N 14 118.322 120.308 -1.986 1
1 139 . 11 1 1 A 15 15 VAL H H 15 9.206 9.307 -0.101 1
1 140 . 11 1 1 A 15 15 VAL HA H 15 4.400 4.263 0.137 1
1 148 . 11 1 1 A 15 15 VAL C C 15 176.306 177.330 -1.024 1
1 149 . 11 1 1 A 15 15 VAL CA C 15 63.648 63.450 0.198 1
1 150 . 11 1 1 A 15 15 VAL CB C 15 31.769 31.704 0.065 1
1 153 . 11 1 1 A 15 15 VAL N N 15 125.308 123.961 1.347 1
1 154 . 11 1 1 A 16 16 THR H H 16 9.403 9.294 0.109 1
1 155 . 11 1 1 A 16 16 THR HA H 16 4.562 4.731 -0.169 1
1 160 . 11 1 1 A 16 16 THR C C 16 178.098 174.509 3.589 1
1 161 . 11 1 1 A 16 16 THR CA C 16 62.018 61.416 0.602 1
1 162 . 11 1 1 A 16 16 THR CB C 16 69.720 69.919 -0.199 1
1 164 . 11 1 1 A 16 16 THR N N 16 121.753 117.233 4.520 1
1 165 . 11 1 1 A 17 17 GLY H H 17 7.600 7.065 0.535 1
1 166 . 11 1 1 A 17 17 GLY HA2 H 17 4.110 4.088 0.022 1
1 167 . 11 1 1 A 17 17 GLY HA3 H 17 4.250 4.180 0.070 1
1 168 . 11 1 1 A 17 17 GLY C C 17 175.551 171.426 4.125 1
1 169 . 11 1 1 A 17 17 GLY CA C 17 46.258 45.541 0.717 1
1 170 . 11 1 1 A 17 17 GLY N N 17 109.407 108.836 0.571 1
1 171 . 11 1 1 A 18 18 LEU H H 18 8.820 8.446 0.374 1
1 172 . 11 1 1 A 18 18 LEU HA H 18 4.852 5.012 -0.160 1
1 182 . 11 1 1 A 18 18 LEU CA C 18 54.245 53.215 1.030 1
1 183 . 11 1 1 A 18 18 LEU CB C 18 44.906 46.043 -1.137 1
1 187 . 11 1 1 A 18 18 LEU N N 18 123.419 121.647 1.772 1
1 188 . 11 1 1 A 19 19 GLN H H 19 8.537 8.289 0.248 1
1 189 . 11 1 1 A 19 19 GLN HA H 19 4.520 4.638 -0.118 1
1 196 . 11 1 1 A 19 19 GLN C C 19 175.258 175.659 -0.401 1
1 197 . 11 1 1 A 19 19 GLN CA C 19 53.269 53.754 -0.485 1
1 198 . 11 1 1 A 19 19 GLN CB C 19 31.522 32.609 -1.087 1
1 200 . 11 1 1 A 19 19 GLN N N 19 120.187 121.203 -1.016 1
1 202 . 11 1 1 A 20 20 ALA H H 20 8.798 8.604 0.194 1
1 203 . 11 1 1 A 20 20 ALA HA H 20 4.010 3.970 0.040 1
1 207 . 11 1 1 A 20 20 ALA C C 20 175.698 177.157 -1.459 1
1 208 . 11 1 1 A 20 20 ALA CA C 20 55.084 53.953 1.131 1
1 209 . 11 1 1 A 20 20 ALA CB C 20 18.277 18.378 -0.101 1
1 210 . 11 1 1 A 20 20 ALA N N 20 120.606 123.834 -3.228 1
1 211 . 11 1 1 A 21 21 TYR H H 21 6.618 7.564 -0.946 1
1 212 . 11 1 1 A 21 21 TYR HA H 21 4.540 4.784 -0.244 1
1 216 . 11 1 1 A 21 21 TYR C C 21 178.437 174.949 3.488 1
1 217 . 11 1 1 A 21 21 TYR CA C 21 55.120 56.844 -1.724 1
1 218 . 11 1 1 A 21 21 TYR CB C 21 37.891 40.456 -2.565 1
1 219 . 11 1 1 A 21 21 TYR N N 21 105.570 113.041 -7.471 1
1 220 . 11 1 1 A 22 22 GLY H H 22 7.203 6.995 0.208 1
1 221 . 11 1 1 A 22 22 GLY HA2 H 22 3.460 3.707 -0.247 1
1 222 . 11 1 1 A 22 22 GLY HA3 H 22 4.360 3.895 0.465 1
1 223 . 11 1 1 A 22 22 GLY C C 22 175.833 171.270 4.563 1
1 224 . 11 1 1 A 22 22 GLY CA C 22 46.356 45.461 0.895 1
1 225 . 11 1 1 A 22 22 GLY N N 22 109.854 108.404 1.450 1
1 226 . 11 1 1 A 23 23 ALA H H 23 8.549 8.515 0.034 1
1 227 . 11 1 1 A 23 23 ALA HA H 23 4.981 5.190 -0.209 1
1 231 . 11 1 1 A 23 23 ALA C C 23 168.810 176.091 -7.281 1
1 232 . 11 1 1 A 23 23 ALA CA C 23 49.178 50.752 -1.574 1
1 233 . 11 1 1 A 23 23 ALA CB C 23 22.797 21.227 1.570 1
1 234 . 11 1 1 A 23 23 ALA N N 23 118.749 122.595 -3.846 1
1 235 . 11 1 1 A 24 24 PHE H H 24 8.812 8.691 0.121 1
1 236 . 11 1 1 A 24 24 PHE HA H 24 5.125 4.803 0.322 1
1 240 . 11 1 1 A 24 24 PHE CA C 24 58.017 58.263 -0.246 1
1 241 . 11 1 1 A 24 24 PHE CB C 24 40.475 40.551 -0.076 1
1 242 . 11 1 1 A 24 24 PHE N N 24 122.891 121.867 1.024 1
1 243 . 11 1 1 A 25 25 VAL H H 25 8.880 8.975 -0.095 1
1 244 . 11 1 1 A 25 25 VAL HA H 25 4.660 4.722 -0.062 1
1 252 . 11 1 1 A 25 25 VAL CA C 25 60.379 61.056 -0.677 1
1 253 . 11 1 1 A 25 25 VAL CB C 25 35.654 35.016 0.638 1
1 256 . 11 1 1 A 25 25 VAL N N 25 122.908 121.296 1.612 1
1 257 . 11 1 1 A 26 26 ALA H H 26 9.403 8.794 0.609 1
1 258 . 11 1 1 A 26 26 ALA HA H 26 4.750 4.344 0.406 1
1 262 . 11 1 1 A 26 26 ALA C C 26 174.445 176.741 -2.296 1
1 263 . 11 1 1 A 26 26 ALA CA C 26 51.711 52.450 -0.739 1
1 264 . 11 1 1 A 26 26 ALA CB C 26 19.319 19.064 0.255 1
1 265 . 11 1 1 A 26 26 ALA N N 26 129.425 130.618 -1.193 1
1 266 . 11 1 1 A 27 27 LEU H H 27 8.601 9.276 -0.675 1
1 267 . 11 1 1 A 27 27 LEU HA H 27 4.158 4.608 -0.450 1
1 277 . 11 1 1 A 27 27 LEU C C 27 177.814 176.360 1.454 1
1 278 . 11 1 1 A 27 27 LEU CA C 27 55.869 55.519 0.350 1
1 279 . 11 1 1 A 27 27 LEU CB C 27 42.251 43.826 -1.575 1
1 283 . 11 1 1 A 27 27 LEU N N 27 127.169 121.978 5.191 1
1 284 . 11 1 1 A 28 28 ASP H H 28 8.172 7.903 0.269 1
1 285 . 11 1 1 A 28 28 ASP HA H 28 4.420 4.917 -0.497 1
1 288 . 11 1 1 A 28 28 ASP C C 28 177.116 175.888 1.228 1
1 289 . 11 1 1 A 28 28 ASP CA C 28 53.755 53.328 0.427 1
1 290 . 11 1 1 A 28 28 ASP CB C 28 39.833 43.963 -4.130 1
1 291 . 11 1 1 A 28 28 ASP N N 28 115.657 117.489 -1.832 1
1 292 . 11 1 1 A 29 29 GLU H H 29 8.857 8.993 -0.136 1
1 293 . 11 1 1 A 29 29 GLU HA H 29 4.090 4.132 -0.042 1
1 298 . 11 1 1 A 29 29 GLU C C 29 175.965 176.574 -0.609 1
1 299 . 11 1 1 A 29 29 GLU CA C 29 59.470 58.696 0.774 1
1 300 . 11 1 1 A 29 29 GLU CB C 29 29.409 28.943 0.466 1
1 302 . 11 1 1 A 29 29 GLU N N 29 114.738 122.608 -7.870 1
1 303 . 11 1 1 A 30 30 GLU H H 30 8.326 8.255 0.071 1
1 304 . 11 1 1 A 30 30 GLU HA H 30 4.640 4.485 0.155 1
1 309 . 11 1 1 A 30 30 GLU C C 30 176.817 174.929 1.888 1
1 310 . 11 1 1 A 30 30 GLU CA C 30 56.073 55.858 0.215 1
1 311 . 11 1 1 A 30 30 GLU CB C 30 32.453 30.802 1.651 1
1 313 . 11 1 1 A 30 30 GLU N N 30 115.753 118.162 -2.409 1
1 314 . 11 1 1 A 31 31 THR H H 31 7.819 7.563 0.256 1
1 315 . 11 1 1 A 31 31 THR HA H 31 4.484 5.072 -0.588 1
1 320 . 11 1 1 A 31 31 THR C C 31 176.330 173.136 3.194 1
1 321 . 11 1 1 A 31 31 THR CA C 31 63.398 61.057 2.341 1
1 322 . 11 1 1 A 31 31 THR CB C 31 69.367 72.618 -3.251 1
1 324 . 11 1 1 A 31 31 THR N N 31 118.750 115.019 3.731 1
1 325 . 11 1 1 A 32 32 GLN H H 32 8.913 8.712 0.201 1
1 326 . 11 1 1 A 32 32 GLN HA H 32 5.337 4.813 0.524 1
1 333 . 11 1 1 A 32 32 GLN C C 32 173.087 174.408 -1.321 1
1 334 . 11 1 1 A 32 32 GLN CA C 32 54.051 54.944 -0.893 1
1 335 . 11 1 1 A 32 32 GLN CB C 32 32.672 32.885 -0.213 1
1 337 . 11 1 1 A 32 32 GLN N N 32 127.294 125.018 2.276 1
1 339 . 11 1 1 A 33 33 GLY H H 33 8.900 8.420 0.480 1
1 340 . 11 1 1 A 33 33 GLY HA2 H 33 3.290 4.357 -1.067 1
1 341 . 11 1 1 A 33 33 GLY HA3 H 33 4.530 4.430 0.100 1
1 342 . 11 1 1 A 33 33 GLY C C 33 174.918 172.146 2.772 1
1 343 . 11 1 1 A 33 33 GLY CA C 33 44.534 45.011 -0.477 1
1 344 . 11 1 1 A 33 33 GLY N N 33 107.639 110.456 -2.817 1
1 345 . 11 1 1 A 34 34 LEU H H 34 8.127 8.656 -0.529 1
1 346 . 11 1 1 A 34 34 LEU HA H 34 4.950 4.882 0.068 1
1 356 . 11 1 1 A 34 34 LEU CA C 34 53.755 53.803 -0.048 1
1 357 . 11 1 1 A 34 34 LEU CB C 34 45.493 44.687 0.806 1
1 361 . 11 1 1 A 34 34 LEU N N 34 120.897 122.041 -1.144 1
1 362 . 11 1 1 A 35 35 VAL H H 35 9.386 8.854 0.532 1
1 363 . 11 1 1 A 35 35 VAL HA H 35 4.479 4.327 0.152 1
1 371 . 11 1 1 A 35 35 VAL C C 35 176.402 176.129 0.273 1
1 372 . 11 1 1 A 35 35 VAL CA C 35 59.594 63.032 -3.438 1
1 373 . 11 1 1 A 35 35 VAL CB C 35 32.590 31.476 1.114 1
1 376 . 11 1 1 A 35 35 VAL N N 35 128.897 127.868 1.029 1
1 377 . 11 1 1 A 36 36 HIS H H 36 9.194 8.436 0.758 1
1 378 . 11 1 1 A 36 36 HIS HA H 36 4.487 4.565 -0.078 1
1 381 . 11 1 1 A 36 36 HIS C C 36 174.864 176.579 -1.715 1
1 382 . 11 1 1 A 36 36 HIS CA C 36 59.426 56.729 2.697 1
1 383 . 11 1 1 A 36 36 HIS CB C 36 31.542 30.216 1.326 1
1 384 . 11 1 1 A 36 36 HIS N N 36 127.751 126.074 1.677 1
1 385 . 11 1 1 A 37 37 ILE H H 37 7.454 8.742 -1.288 1
1 386 . 11 1 1 A 37 37 ILE HA H 37 3.810 3.655 0.155 1
1 396 . 11 1 1 A 37 37 ILE C C 37 176.948 177.794 -0.846 1
1 397 . 11 1 1 A 37 37 ILE CA C 37 63.773 64.950 -1.177 1
1 398 . 11 1 1 A 37 37 ILE CB C 37 38.993 37.418 1.575 1
1 402 . 11 1 1 A 37 37 ILE N N 37 126.266 126.306 -0.040 1
1 403 . 11 1 1 A 38 38 SER H H 38 8.343 8.223 0.120 1
1 404 . 11 1 1 A 38 38 SER HA H 38 4.370 4.242 0.128 1
1 407 . 11 1 1 A 38 38 SER C C 38 174.792 174.872 -0.080 1
1 408 . 11 1 1 A 38 38 SER CA C 38 60.567 60.873 -0.306 1
1 409 . 11 1 1 A 38 38 SER CB C 38 63.632 62.920 0.712 1
1 410 . 11 1 1 A 38 38 SER N N 38 118.079 118.806 -0.727 1
1 411 . 11 1 1 A 39 39 GLU H H 39 8.536 7.983 0.553 1
1 412 . 11 1 1 A 39 39 GLU HA H 39 4.503 4.605 -0.102 1
1 417 . 11 1 1 A 39 39 GLU C C 39 175.131 176.776 -1.645 1
1 418 . 11 1 1 A 39 39 GLU CA C 39 54.928 55.999 -1.071 1
1 419 . 11 1 1 A 39 39 GLU CB C 39 29.621 30.307 -0.686 1
1 421 . 11 1 1 A 39 39 GLU N N 39 118.349 118.165 0.184 1
1 422 . 11 1 1 A 40 40 VAL H H 40 7.776 7.829 -0.053 1
1 423 . 11 1 1 A 40 40 VAL HA H 40 3.616 3.893 -0.277 1
1 431 . 11 1 1 A 40 40 VAL C C 40 177.277 175.730 1.547 1
1 432 . 11 1 1 A 40 40 VAL CA C 40 66.245 64.181 2.064 1
1 433 . 11 1 1 A 40 40 VAL CB C 40 32.590 31.998 0.592 1
1 436 . 11 1 1 A 40 40 VAL N N 40 125.443 118.698 6.745 1
1 437 . 11 1 1 A 41 41 THR H H 41 7.888 7.421 0.467 1
1 438 . 11 1 1 A 41 41 THR HA H 41 4.345 4.417 -0.072 1
1 443 . 11 1 1 A 41 41 THR C C 41 173.492 173.975 -0.483 1
1 444 . 11 1 1 A 41 41 THR CA C 41 59.047 59.919 -0.872 1
1 445 . 11 1 1 A 41 41 THR CB C 41 68.992 70.492 -1.500 1
1 447 . 11 1 1 A 41 41 THR N N 41 109.905 111.286 -1.381 1
1 448 . 11 1 1 A 42 42 HIS H H 42 8.063 8.549 -0.486 1
1 449 . 11 1 1 A 42 42 HIS HA H 42 4.510 4.008 0.502 1
1 452 . 11 1 1 A 42 42 HIS C C 42 172.139 174.966 -2.827 1
1 453 . 11 1 1 A 42 42 HIS CA C 42 57.735 59.587 -1.852 1
1 454 . 11 1 1 A 42 42 HIS CB C 42 31.144 30.219 0.925 1
1 455 . 11 1 1 A 42 42 HIS N N 42 121.760 124.034 -2.274 1
1 456 . 11 1 1 A 43 43 GLY H H 43 8.286 7.577 0.709 1
1 457 . 11 1 1 A 43 43 GLY HA2 H 43 3.980 3.656 0.324 1
1 458 . 11 1 1 A 43 43 GLY HA3 H 43 3.980 3.766 0.214 1
1 459 . 11 1 1 A 43 43 GLY C C 43 176.307 175.704 0.603 1
1 460 . 11 1 1 A 43 43 GLY CA C 43 44.336 45.135 -0.799 1
1 461 . 11 1 1 A 43 43 GLY N N 43 110.133 106.723 3.410 1
1 462 . 11 1 1 A 44 44 PHE H H 44 8.327 7.237 1.090 1
1 463 . 11 1 1 A 44 44 PHE HA H 44 4.489 4.582 -0.093 1
1 467 . 11 1 1 A 44 44 PHE C C 44 171.877 175.925 -4.048 1
1 468 . 11 1 1 A 44 44 PHE CA C 44 58.027 58.481 -0.454 1
1 469 . 11 1 1 A 44 44 PHE CB C 44 39.850 38.279 1.571 1
1 470 . 11 1 1 A 44 44 PHE N N 44 120.049 119.666 0.383 1
1 471 . 11 1 1 A 45 45 VAL H H 45 7.939 7.671 0.268 1
1 472 . 11 1 1 A 45 45 VAL HA H 45 3.865 3.855 0.010 1
1 480 . 11 1 1 A 45 45 VAL C C 45 175.523 176.998 -1.475 1
1 481 . 11 1 1 A 45 45 VAL CA C 45 61.536 61.437 0.099 1
1 482 . 11 1 1 A 45 45 VAL CB C 45 33.127 28.907 4.220 1
1 485 . 11 1 1 A 45 45 VAL N N 45 127.882 119.731 8.151 1
1 486 . 11 1 1 A 46 46 LYS H H 46 8.868 8.123 0.745 1
1 487 . 11 1 1 A 46 46 LYS HA H 46 4.170 4.158 0.012 1
1 496 . 11 1 1 A 46 46 LYS C C 46 175.728 176.018 -0.290 1
1 497 . 11 1 1 A 46 46 LYS CA C 46 57.198 58.757 -1.559 1
1 498 . 11 1 1 A 46 46 LYS CB C 46 33.299 32.239 1.060 1
1 502 . 11 1 1 A 46 46 LYS N N 46 127.308 121.813 5.495 1
1 503 . 11 1 1 A 47 47 ASP H H 47 7.652 8.039 -0.387 1
1 504 . 11 1 1 A 47 47 ASP HA H 47 4.710 4.961 -0.251 1
1 507 . 11 1 1 A 47 47 ASP C C 47 176.411 176.185 0.226 1
1 508 . 11 1 1 A 47 47 ASP CA C 47 53.390 53.716 -0.326 1
1 509 . 11 1 1 A 47 47 ASP CB C 47 42.635 43.538 -0.903 1
1 510 . 11 1 1 A 47 47 ASP N N 47 117.932 118.230 -0.298 1
1 511 . 11 1 1 A 48 48 ILE H H 48 9.230 8.633 0.597 1
1 512 . 11 1 1 A 48 48 ILE HA H 48 3.579 4.024 -0.445 1
1 522 . 11 1 1 A 48 48 ILE C C 48 177.249 177.565 -0.316 1
1 523 . 11 1 1 A 48 48 ILE CA C 48 65.525 63.653 1.872 1
1 524 . 11 1 1 A 48 48 ILE CB C 48 38.797 37.702 1.095 1
1 528 . 11 1 1 A 48 48 ILE N N 48 129.049 126.271 2.778 1
1 529 . 11 1 1 A 49 49 ASN H H 49 8.468 8.521 -0.053 1
1 530 . 11 1 1 A 49 49 ASN HA H 49 4.690 4.552 0.138 1
1 535 . 11 1 1 A 49 49 ASN C C 49 175.779 176.648 -0.869 1
1 536 . 11 1 1 A 49 49 ASN CA C 49 55.587 54.931 0.656 1
1 537 . 11 1 1 A 49 49 ASN CB C 49 38.587 36.938 1.649 1
1 538 . 11 1 1 A 49 49 ASN N N 49 118.835 118.403 0.432 1
1 540 . 11 1 1 A 50 50 GLU H H 50 7.853 7.902 -0.049 1
1 541 . 11 1 1 A 50 50 GLU HA H 50 4.040 4.097 -0.057 1
1 546 . 11 1 1 A 50 50 GLU C C 50 176.148 177.062 -0.914 1
1 547 . 11 1 1 A 50 50 GLU CA C 50 57.404 58.018 -0.614 1
1 548 . 11 1 1 A 50 50 GLU CB C 50 29.491 29.120 0.371 1
1 550 . 11 1 1 A 50 50 GLU N N 50 116.358 118.243 -1.885 1
1 551 . 11 1 1 A 51 51 HIS H H 51 7.575 7.887 -0.312 1
1 552 . 11 1 1 A 51 51 HIS HA H 51 4.431 4.738 -0.307 1
1 555 . 11 1 1 A 51 51 HIS C C 51 176.383 174.702 1.681 1
1 556 . 11 1 1 A 51 51 HIS CA C 51 57.089 56.510 0.579 1
1 557 . 11 1 1 A 51 51 HIS CB C 51 33.168 32.036 1.132 1
1 558 . 11 1 1 A 51 51 HIS N N 51 115.828 115.191 0.637 1
1 559 . 11 1 1 A 52 52 LEU H H 52 7.640 7.567 0.073 1
1 560 . 11 1 1 A 52 52 LEU HA H 52 4.796 4.672 0.124 1
1 570 . 11 1 1 A 52 52 LEU C C 52 174.452 174.323 0.129 1
1 571 . 11 1 1 A 52 52 LEU CA C 52 53.398 53.525 -0.127 1
1 572 . 11 1 1 A 52 52 LEU CB C 52 48.805 44.423 4.382 1
1 576 . 11 1 1 A 52 52 LEU N N 52 117.932 119.788 -1.856 1
1 577 . 11 1 1 A 53 53 SER H H 53 8.151 8.750 -0.599 1
1 578 . 11 1 1 A 53 53 SER HA H 53 4.680 4.925 -0.245 1
1 581 . 11 1 1 A 53 53 SER C C 53 174.304 173.227 1.077 1
1 582 . 11 1 1 A 53 53 SER CA C 53 56.714 57.498 -0.784 1
1 583 . 11 1 1 A 53 53 SER CB C 53 65.431 66.627 -1.196 1
1 584 . 11 1 1 A 53 53 SER N N 53 113.496 116.977 -3.481 1
1 585 . 11 1 1 A 54 54 VAL H H 54 8.782 8.520 0.262 1
1 586 . 11 1 1 A 54 54 VAL HA H 54 3.230 3.667 -0.437 1
1 594 . 11 1 1 A 54 54 VAL C C 54 173.745 177.415 -3.670 1
1 595 . 11 1 1 A 54 54 VAL CA C 54 66.232 65.012 1.220 1
1 596 . 11 1 1 A 54 54 VAL CB C 54 31.067 31.788 -0.721 1
1 599 . 11 1 1 A 54 54 VAL N N 54 124.401 125.746 -1.345 1
1 600 . 11 1 1 A 55 55 GLY H H 55 9.079 8.993 0.086 1
1 601 . 11 1 1 A 55 55 GLY HA2 H 55 3.530 3.858 -0.328 1
1 602 . 11 1 1 A 55 55 GLY HA3 H 55 4.553 3.859 0.694 1
1 603 . 11 1 1 A 55 55 GLY C C 55 177.219 173.375 3.844 1
1 604 . 11 1 1 A 55 55 GLY CA C 55 44.647 46.591 -1.944 1
1 605 . 11 1 1 A 55 55 GLY N N 55 117.320 114.460 2.860 1
1 606 . 11 1 1 A 56 56 ASP H H 56 7.943 7.774 0.169 1
1 607 . 11 1 1 A 56 56 ASP HA H 56 4.460 5.151 -0.691 1
1 610 . 11 1 1 A 56 56 ASP C C 56 176.055 173.822 2.233 1
1 611 . 11 1 1 A 56 56 ASP CA C 56 55.456 52.531 2.925 1
1 612 . 11 1 1 A 56 56 ASP CB C 56 40.914 44.369 -3.455 1
1 613 . 11 1 1 A 56 56 ASP N N 56 121.782 119.749 2.033 1
1 614 . 11 1 1 A 57 57 GLU H H 57 8.649 8.663 -0.014 1
1 615 . 11 1 1 A 57 57 GLU HA H 57 5.100 5.154 -0.054 1
1 620 . 11 1 1 A 57 57 GLU C C 57 175.635 176.076 -0.441 1
1 621 . 11 1 1 A 57 57 GLU CA C 57 55.805 55.637 0.168 1
1 622 . 11 1 1 A 57 57 GLU CB C 57 30.915 31.307 -0.392 1
1 624 . 11 1 1 A 57 57 GLU N N 57 122.513 123.808 -1.295 1
1 625 . 11 1 1 A 58 58 VAL H H 58 8.809 9.086 -0.277 1
1 626 . 11 1 1 A 58 58 VAL HA H 58 4.817 4.821 -0.004 1
1 634 . 11 1 1 A 58 58 VAL C C 58 176.528 173.977 2.551 1
1 635 . 11 1 1 A 58 58 VAL CA C 58 58.719 59.236 -0.517 1
1 636 . 11 1 1 A 58 58 VAL CB C 58 35.523 35.851 -0.328 1
1 639 . 11 1 1 A 58 58 VAL N N 58 118.382 119.858 -1.476 1
1 640 . 11 1 1 A 59 59 GLN H H 59 8.255 8.803 -0.548 1
1 641 . 11 1 1 A 59 59 GLN HA H 59 5.030 4.853 0.177 1
1 646 . 11 1 1 A 59 59 GLN CA C 59 54.843 54.950 -0.107 1
1 647 . 11 1 1 A 59 59 GLN CB C 59 30.111 30.303 -0.192 1
1 649 . 11 1 1 A 59 59 GLN N N 59 120.933 123.720 -2.787 1
1 650 . 11 1 1 A 60 60 VAL H H 60 8.970 9.413 -0.443 1
1 651 . 11 1 1 A 60 60 VAL HA H 60 4.990 5.011 -0.021 1
1 659 . 11 1 1 A 60 60 VAL C C 60 175.203 174.029 1.174 1
1 660 . 11 1 1 A 60 60 VAL CA C 60 57.404 59.193 -1.789 1
1 661 . 11 1 1 A 60 60 VAL CB C 60 35.771 35.417 0.354 1
1 664 . 11 1 1 A 60 60 VAL N N 60 111.046 120.412 -9.366 1
1 665 . 11 1 1 A 61 61 LYS H H 61 8.937 8.555 0.382 1
1 666 . 11 1 1 A 61 61 LYS HA H 61 5.100 4.787 0.313 1
1 675 . 11 1 1 A 61 61 LYS C C 61 173.610 176.368 -2.758 1
1 676 . 11 1 1 A 61 61 LYS CA C 61 53.762 55.111 -1.349 1
1 677 . 11 1 1 A 61 61 LYS CB C 61 36.273 34.163 2.110 1
1 681 . 11 1 1 A 61 61 LYS N N 61 121.930 124.226 -2.296 1
1 682 . 11 1 1 A 62 62 VAL H H 62 8.429 9.323 -0.894 1
1 683 . 11 1 1 A 62 62 VAL HA H 62 4.074 4.055 0.019 1
1 691 . 11 1 1 A 62 62 VAL C C 62 176.912 175.932 0.980 1
1 692 . 11 1 1 A 62 62 VAL CA C 62 63.188 63.591 -0.403 1
1 693 . 11 1 1 A 62 62 VAL CB C 62 30.813 31.339 -0.526 1
1 696 . 11 1 1 A 62 62 VAL N N 62 126.329 127.154 -0.825 1
1 697 . 11 1 1 A 63 63 LEU H H 63 9.109 9.163 -0.054 1
1 698 . 11 1 1 A 63 63 LEU HA H 63 4.423 4.436 -0.013 1
1 708 . 11 1 1 A 63 63 LEU C C 63 176.091 176.134 -0.043 1
1 709 . 11 1 1 A 63 63 LEU CA C 63 55.876 56.211 -0.335 1
1 710 . 11 1 1 A 63 63 LEU CB C 63 42.800 43.750 -0.950 1
1 714 . 11 1 1 A 63 63 LEU N N 63 129.436 129.923 -0.487 1
1 715 . 11 1 1 A 64 64 ALA H H 64 7.594 7.335 0.259 1
1 716 . 11 1 1 A 64 64 ALA HA H 64 4.455 4.726 -0.271 1
1 720 . 11 1 1 A 64 64 ALA C C 64 177.314 175.191 2.123 1
1 721 . 11 1 1 A 64 64 ALA CA C 64 52.557 51.732 0.825 1
1 722 . 11 1 1 A 64 64 ALA CB C 64 21.458 22.587 -1.129 1
1 723 . 11 1 1 A 64 64 ALA N N 64 117.791 118.762 -0.971 1
1 724 . 11 1 1 A 65 65 VAL H H 65 8.583 8.543 0.040 1
1 725 . 11 1 1 A 65 65 VAL HA H 65 4.470 4.890 -0.420 1
1 733 . 11 1 1 A 65 65 VAL C C 65 174.697 174.865 -0.168 1
1 734 . 11 1 1 A 65 65 VAL CA C 65 61.936 60.613 1.323 1
1 735 . 11 1 1 A 65 65 VAL CB C 65 35.288 35.842 -0.554 1
1 738 . 11 1 1 A 65 65 VAL N N 65 120.009 119.762 0.247 1
1 739 . 11 1 1 A 66 66 ASP H H 66 8.567 8.956 -0.389 1
1 740 . 11 1 1 A 66 66 ASP HA H 66 4.880 4.985 -0.105 1
1 743 . 11 1 1 A 66 66 ASP C C 66 174.355 175.814 -1.459 1
1 744 . 11 1 1 A 66 66 ASP CA C 66 52.681 52.941 -0.260 1
1 745 . 11 1 1 A 66 66 ASP CB C 66 41.775 40.673 1.102 1
1 746 . 11 1 1 A 66 66 ASP N N 66 126.262 125.067 1.195 1
1 747 . 11 1 1 A 67 67 GLU H H 67 9.148 8.668 0.480 1
1 748 . 11 1 1 A 67 67 GLU HA H 67 4.110 4.106 0.004 1
1 753 . 11 1 1 A 67 67 GLU C C 67 177.052 178.425 -1.373 1
1 754 . 11 1 1 A 67 67 GLU CA C 67 59.044 58.611 0.433 1
1 755 . 11 1 1 A 67 67 GLU CB C 67 29.919 28.877 1.042 1
1 757 . 11 1 1 A 67 67 GLU N N 67 125.480 124.415 1.065 1
1 758 . 11 1 1 A 68 68 GLU H H 68 8.384 7.932 0.452 1
1 759 . 11 1 1 A 68 68 GLU HA H 68 4.140 4.125 0.015 1
1 764 . 11 1 1 A 68 68 GLU C C 68 178.383 177.543 0.840 1
1 765 . 11 1 1 A 68 68 GLU CA C 68 59.044 59.140 -0.096 1
1 766 . 11 1 1 A 68 68 GLU CB C 68 29.919 29.279 0.640 1
1 768 . 11 1 1 A 68 68 GLU N N 68 119.760 119.052 0.708 1
1 769 . 11 1 1 A 69 69 LYS H H 69 7.799 7.676 0.123 1
1 770 . 11 1 1 A 69 69 LYS HA H 69 4.375 4.524 -0.149 1
1 779 . 11 1 1 A 69 69 LYS C C 69 178.297 176.965 1.332 1
1 780 . 11 1 1 A 69 69 LYS CA C 69 55.704 55.675 0.029 1
1 781 . 11 1 1 A 69 69 LYS CB C 69 33.622 34.241 -0.619 1
1 785 . 11 1 1 A 69 69 LYS N N 69 115.476 117.194 -1.718 1
1 786 . 11 1 1 A 70 70 GLY H H 70 7.994 7.833 0.161 1
1 787 . 11 1 1 A 70 70 GLY HA2 H 70 3.940 3.932 0.008 1
1 788 . 11 1 1 A 70 70 GLY HA3 H 70 3.960 3.939 0.021 1
1 789 . 11 1 1 A 70 70 GLY C C 70 177.215 174.364 2.851 1
1 790 . 11 1 1 A 70 70 GLY CA C 70 46.773 46.602 0.171 1
1 791 . 11 1 1 A 70 70 GLY N N 70 110.245 109.730 0.515 1
1 792 . 11 1 1 A 71 71 LYS H H 71 7.560 7.844 -0.284 1
1 793 . 11 1 1 A 71 71 LYS HA H 71 4.690 4.852 -0.162 1
1 802 . 11 1 1 A 71 71 LYS C C 71 174.607 175.652 -1.045 1
1 803 . 11 1 1 A 71 71 LYS CA C 71 55.332 54.361 0.971 1
1 804 . 11 1 1 A 71 71 LYS CB C 71 34.903 35.366 -0.463 1
1 808 . 11 1 1 A 71 71 LYS N N 71 118.201 118.557 -0.356 1
1 809 . 11 1 1 A 72 72 ILE H H 72 8.867 8.730 0.137 1
1 810 . 11 1 1 A 72 72 ILE HA H 72 4.630 4.890 -0.260 1
1 820 . 11 1 1 A 72 72 ILE C C 72 175.708 174.741 0.967 1
1 821 . 11 1 1 A 72 72 ILE CA C 72 61.494 60.154 1.340 1
1 822 . 11 1 1 A 72 72 ILE CB C 72 40.652 42.232 -1.580 1
1 826 . 11 1 1 A 72 72 ILE N N 72 126.827 121.583 5.244 1
1 827 . 11 1 1 A 73 73 SER H H 73 8.815 9.003 -0.188 1
1 828 . 11 1 1 A 73 73 SER HA H 73 5.110 5.424 -0.314 1
1 831 . 11 1 1 A 73 73 SER C C 73 175.122 173.024 2.098 1
1 832 . 11 1 1 A 73 73 SER CA C 73 57.487 57.460 0.027 1
1 833 . 11 1 1 A 73 73 SER CB C 73 64.386 65.524 -1.138 1
1 834 . 11 1 1 A 73 73 SER N N 73 123.640 124.960 -1.320 1
1 835 . 11 1 1 A 74 74 LEU H H 74 8.585 8.966 -0.381 1
1 836 . 11 1 1 A 74 74 LEU HA H 74 5.450 5.279 0.171 1
1 846 . 11 1 1 A 74 74 LEU C C 74 174.061 175.295 -1.234 1
1 847 . 11 1 1 A 74 74 LEU CA C 74 53.101 53.420 -0.319 1
1 848 . 11 1 1 A 74 74 LEU CB C 74 48.268 46.749 1.519 1
1 852 . 11 1 1 A 74 74 LEU N N 74 125.221 124.279 0.942 1
1 853 . 11 1 1 A 75 75 SER H H 75 8.840 8.813 0.027 1
1 854 . 11 1 1 A 75 75 SER HA H 75 5.040 5.226 -0.186 1
1 857 . 11 1 1 A 75 75 SER C C 75 176.552 173.034 3.518 1
1 858 . 11 1 1 A 75 75 SER CA C 75 57.487 56.517 0.970 1
1 859 . 11 1 1 A 75 75 SER CB C 75 64.993 65.609 -0.616 1
1 860 . 11 1 1 A 75 75 SER N N 75 111.252 114.262 -3.010 1
1 861 . 11 1 1 A 76 76 ILE H H 76 7.790 8.960 -1.170 1
1 862 . 11 1 1 A 76 76 ILE HA H 76 4.690 4.556 0.134 1
1 872 . 11 1 1 A 76 76 ILE C C 76 175.780 177.033 -1.253 1
1 873 . 11 1 1 A 76 76 ILE CA C 76 63.631 61.868 1.763 1
1 874 . 11 1 1 A 76 76 ILE CB C 76 39.484 39.551 -0.067 1
1 878 . 11 1 1 A 76 76 ILE N N 76 129.205 126.779 2.426 1
1 879 . 11 1 1 A 77 77 ARG H H 77 8.115 8.636 -0.521 1
1 880 . 11 1 1 A 77 77 ARG HA H 77 3.760 4.061 -0.301 1
1 887 . 11 1 1 A 77 77 ARG C C 77 178.704 178.084 0.620 1
1 888 . 11 1 1 A 77 77 ARG CA C 77 58.933 58.597 0.336 1
1 889 . 11 1 1 A 77 77 ARG CB C 77 29.463 29.681 -0.218 1
1 892 . 11 1 1 A 77 77 ARG N N 77 123.257 121.729 1.528 1
1 893 . 11 1 1 A 78 78 ALA H H 78 8.304 7.487 0.817 1
1 894 . 11 1 1 A 78 78 ALA HA H 78 4.296 4.123 0.173 1
1 898 . 11 1 1 A 78 78 ALA C C 78 176.870 178.541 -1.671 1
1 899 . 11 1 1 A 78 78 ALA CA C 78 53.548 54.594 -1.046 1
1 900 . 11 1 1 A 78 78 ALA CB C 78 19.872 18.097 1.775 1
1 901 . 11 1 1 A 78 78 ALA N N 78 118.764 121.930 -3.166 1
1 902 . 11 1 1 A 79 79 THR H H 79 7.931 7.680 0.251 1
1 903 . 11 1 1 A 79 79 THR HA H 79 4.370 4.511 -0.141 1
1 908 . 11 1 1 A 79 79 THR C C 79 178.356 174.998 3.358 1
1 909 . 11 1 1 A 79 79 THR CA C 79 62.381 62.531 -0.150 1
1 910 . 11 1 1 A 79 79 THR CB C 79 69.693 70.320 -0.627 1
1 912 . 11 1 1 A 79 79 THR N N 79 107.360 105.762 1.598 1
1 913 . 11 1 1 A 80 80 GLN H H 80 7.651 8.331 -0.680 1
1 914 . 11 1 1 A 80 80 GLN HA H 80 4.527 4.609 -0.082 1
1 921 . 11 1 1 A 80 80 GLN C C 80 174.249 175.334 -1.085 1
1 922 . 11 1 1 A 80 80 GLN CA C 80 54.760 54.856 -0.096 1
1 923 . 11 1 1 A 80 80 GLN CB C 80 30.565 28.528 2.037 1
1 925 . 11 1 1 A 80 80 GLN N N 80 121.588 118.200 3.388 1
1 927 . 11 1 1 A 81 81 ALA H H 81 8.498 8.064 0.434 1
1 928 . 11 1 1 A 81 81 ALA HA H 81 4.252 4.345 -0.093 1
1 932 . 11 1 1 A 81 81 ALA C C 81 175.693 176.443 -0.750 1
1 933 . 11 1 1 A 81 81 ALA CA C 81 52.345 50.975 1.370 1
1 934 . 11 1 1 A 81 81 ALA CB C 81 19.062 17.125 1.937 1
1 935 . 11 1 1 A 81 81 ALA N N 81 126.423 123.658 2.765 1
1 936 . 11 1 1 A 82 82 ALA H H 82 8.324 8.189 0.135 1
1 937 . 11 1 1 A 82 82 ALA HA H 82 4.000 4.063 -0.063 1
1 941 . 11 1 1 A 82 82 ALA C C 82 177.065 178.077 -1.012 1
1 942 . 11 1 1 A 82 82 ALA CA C 82 50.240 52.896 -2.656 1
1 943 . 11 1 1 A 82 82 ALA CB C 82 17.650 17.429 0.221 1
1 944 . 11 1 1 A 82 82 ALA N N 82 125.114 117.731 7.383 1
1 945 . 11 1 1 A 83 83 PRO HA H 83 4.350 4.432 -0.082 1
1 952 . 11 1 1 A 83 83 PRO CA C 83 63.148 64.176 -1.028 1
1 953 . 11 1 1 A 83 83 PRO CB C 83 32.054 31.877 0.177 1
1 956 . 11 1 1 A 84 84 GLU H H 84 8.517 7.835 0.682 1
1 957 . 11 1 1 A 84 84 GLU HA H 84 4.197 4.871 -0.674 1
1 962 . 11 1 1 A 84 84 GLU C C 84 176.948 175.844 1.104 1
1 963 . 11 1 1 A 84 84 GLU CA C 84 56.674 54.643 2.031 1
1 964 . 11 1 1 A 84 84 GLU CB C 84 30.459 33.339 -2.880 1
1 966 . 11 1 1 A 84 84 GLU N N 84 121.479 118.458 3.021 1
1 967 . 11 1 1 A 85 85 LYS H H 85 8.381 8.354 0.027 1
1 968 . 11 1 1 A 85 85 LYS HA H 85 4.309 4.349 -0.040 1
1 977 . 11 1 1 A 85 85 LYS C C 85 176.457 176.935 -0.478 1
1 978 . 11 1 1 A 85 85 LYS CA C 85 56.272 57.210 -0.938 1
1 979 . 11 1 1 A 85 85 LYS CB C 85 32.961 32.982 -0.021 1
1 983 . 11 1 1 A 85 85 LYS N N 85 123.266 120.901 2.365 1
1 984 . 11 1 1 A 86 86 LYS H H 86 8.403 8.484 -0.081 1
1 985 . 11 1 1 A 86 86 LYS HA H 86 4.308 4.300 0.008 1
1 994 . 11 1 1 A 86 86 LYS C C 86 176.435 176.190 0.245 1
1 995 . 11 1 1 A 86 86 LYS CA C 86 56.272 56.630 -0.358 1
1 996 . 11 1 1 A 86 86 LYS CB C 86 32.961 32.853 0.108 1
1 1000 . 11 1 1 A 86 86 LYS N N 86 123.688 121.624 2.064 1
1 1001 . 11 1 1 A 87 87 GLU H H 87 8.540 8.903 -0.363 1
1 1002 . 11 1 1 A 87 87 GLU HA H 87 4.358 4.479 -0.121 1
1 1007 . 11 1 1 A 87 87 GLU C C 87 176.556 176.502 0.054 1
1 1008 . 11 1 1 A 87 87 GLU CA C 87 56.406 55.324 1.082 1
1 1009 . 11 1 1 A 87 87 GLU CB C 87 30.607 27.822 2.785 1
1 1011 . 11 1 1 A 87 87 GLU N N 87 122.633 122.458 0.175 1
1 1012 . 11 1 1 A 88 88 SER H H 88 8.520 8.634 -0.114 1
1 1013 . 11 1 1 A 88 88 SER HA H 88 4.490 4.221 0.269 1
1 1016 . 11 1 1 A 88 88 SER C C 88 175.780 174.616 1.164 1
1 1017 . 11 1 1 A 88 88 SER CA C 88 58.431 61.446 -3.015 1
1 1018 . 11 1 1 A 88 88 SER CB C 88 63.858 63.212 0.646 1
1 1019 . 11 1 1 A 88 88 SER N N 88 118.333 121.452 -3.119 1
1 1020 . 11 1 1 A 89 89 LYS H H 89 8.339 7.529 0.810 1
1 1021 . 11 1 1 A 89 89 LYS HA H 89 4.620 4.960 -0.340 1
1 1030 . 11 1 1 A 89 89 LYS C C 89 174.160 174.052 0.108 1
1 1031 . 11 1 1 A 89 89 LYS CA C 89 54.265 53.706 0.559 1
1 1032 . 11 1 1 A 89 89 LYS CB C 89 32.672 35.042 -2.370 1
1 1036 . 11 1 1 A 89 89 LYS N N 89 124.433 115.913 8.520 1
1 1037 . 11 1 1 A 90 90 PRO HA H 90 4.417 4.513 -0.096 1
1 1044 . 11 1 1 A 90 90 PRO CA C 90 63.064 62.749 0.315 1
1 1045 . 11 1 1 A 90 90 PRO CB C 90 32.266 32.947 -0.681 1
1 1048 . 11 1 1 A 91 91 ARG H H 91 8.502 8.941 -0.439 1
1 1049 . 11 1 1 A 91 91 ARG HA H 91 4.305 4.080 0.225 1
1 1056 . 11 1 1 A 91 91 ARG C C 91 176.831 176.503 0.328 1
1 1057 . 11 1 1 A 91 91 ARG CA C 91 56.002 58.438 -2.436 1
1 1058 . 11 1 1 A 91 91 ARG CB C 91 30.913 29.964 0.949 1
1 1061 . 11 1 1 A 91 91 ARG N N 91 122.193 121.143 1.050 1
1 1062 . 11 1 1 A 92 92 LYS H H 92 8.415 7.899 0.516 1
1 1063 . 11 1 1 A 92 92 LYS HA H 92 4.610 4.681 -0.071 1
1 1072 . 11 1 1 A 92 92 LYS C C 92 176.262 174.151 2.111 1
1 1073 . 11 1 1 A 92 92 LYS CA C 92 54.258 53.448 0.810 1
1 1074 . 11 1 1 A 92 92 LYS CB C 92 32.672 33.410 -0.738 1
1 1078 . 11 1 1 A 92 92 LYS N N 92 124.243 119.413 4.830 1
1 1079 . 11 1 1 A 93 93 PRO HA H 93 4.415 4.280 0.135 1
1 1086 . 11 1 1 A 93 93 PRO CA C 93 62.899 65.298 -2.399 1
1 1087 . 11 1 1 A 93 93 PRO CB C 93 32.323 31.782 0.541 1
1 1090 . 11 1 1 A 94 94 LYS H H 94 8.420 7.822 0.598 1
1 1091 . 11 1 1 A 94 94 LYS HA H 94 4.290 4.650 -0.360 1
1 1100 . 11 1 1 A 94 94 LYS C C 94 176.714 175.311 1.403 1
1 1101 . 11 1 1 A 94 94 LYS CA C 94 56.585 57.654 -1.069 1
1 1102 . 11 1 1 A 94 94 LYS CB C 94 33.161 35.065 -1.904 1
1 1106 . 11 1 1 A 94 94 LYS N N 94 122.121 116.285 5.836 1
1 1107 . 11 1 1 A 95 95 ALA H H 95 8.348 7.858 0.490 1
1 1108 . 11 1 1 A 95 95 ALA HA H 95 4.250 4.538 -0.288 1
1 1112 . 11 1 1 A 95 95 ALA C C 95 176.453 177.125 -0.672 1
1 1113 . 11 1 1 A 95 95 ALA CA C 95 52.471 51.146 1.325 1
1 1114 . 11 1 1 A 95 95 ALA CB C 95 19.347 22.268 -2.921 1
1 1115 . 11 1 1 A 95 95 ALA N N 95 125.624 118.831 6.793 1
1 1116 . 11 1 1 A 96 96 ALA H H 96 8.348 8.475 -0.127 1
1 1117 . 11 1 1 A 96 96 ALA HA H 96 4.254 4.257 -0.003 1
1 1121 . 11 1 1 A 96 96 ALA C C 96 176.462 177.132 -0.670 1
1 1122 . 11 1 1 A 96 96 ALA CA C 96 52.471 53.709 -1.238 1
1 1123 . 11 1 1 A 96 96 ALA CB C 96 19.347 19.095 0.252 1
1 1124 . 11 1 1 A 96 96 ALA N N 96 125.624 121.030 4.594 1
1 1125 . 11 1 1 A 97 97 GLN H H 97 8.333 7.653 0.680 1
1 1126 . 11 1 1 A 97 97 GLN HA H 97 4.362 4.689 -0.327 1
1 1133 . 11 1 1 A 97 97 GLN C C 97 177.684 176.098 1.586 1
1 1134 . 11 1 1 A 97 97 GLN CA C 97 55.848 54.014 1.834 1
1 1135 . 11 1 1 A 97 97 GLN CB C 97 29.643 32.250 -2.607 1
1 1137 . 11 1 1 A 97 97 GLN N N 97 120.049 116.422 3.627 1
1 1139 . 11 1 1 A 98 98 VAL H H 98 8.230 8.750 -0.520 1
1 1140 . 11 1 1 A 98 98 VAL HA H 98 4.145 3.836 0.309 1
1 1148 . 11 1 1 A 98 98 VAL C C 98 176.033 175.505 0.528 1
1 1149 . 11 1 1 A 98 98 VAL CA C 98 62.444 63.203 -0.759 1
1 1150 . 11 1 1 A 98 98 VAL CB C 98 32.942 29.606 3.336 1
1 1153 . 11 1 1 A 98 98 VAL N N 98 121.607 124.080 -2.473 1
1 1154 . 11 1 1 A 99 99 SER H H 99 8.375 7.893 0.482 1
1 1155 . 11 1 1 A 99 99 SER HA H 99 4.473 4.428 0.045 1
1 1158 . 11 1 1 A 99 99 SER C C 99 176.204 174.070 2.134 1
1 1159 . 11 1 1 A 99 99 SER CA C 99 58.379 59.676 -1.297 1
1 1160 . 11 1 1 A 99 99 SER CB C 99 63.914 63.859 0.055 1
1 1161 . 11 1 1 A 99 99 SER N N 99 119.455 118.130 1.325 1
1 1162 . 11 1 1 A 100 100 GLU H H 100 8.547 8.624 -0.077 1
1 1163 . 11 1 1 A 100 100 GLU HA H 100 4.304 4.708 -0.404 1
1 1168 . 11 1 1 A 100 100 GLU C C 100 174.620 176.073 -1.453 1
1 1169 . 11 1 1 A 100 100 GLU CA C 100 56.835 55.434 1.401 1
1 1170 . 11 1 1 A 100 100 GLU CB C 100 30.365 33.524 -3.159 1
1 1172 . 11 1 1 A 100 100 GLU N N 100 123.419 123.970 -0.551 1
1 1173 . 11 1 1 A 101 101 GLU H H 101 8.432 8.959 -0.527 1
1 1174 . 11 1 1 A 101 101 GLU HA H 101 4.252 4.207 0.045 1
1 1179 . 11 1 1 A 101 101 GLU C C 101 176.693 176.586 0.107 1
1 1180 . 11 1 1 A 101 101 GLU CA C 101 56.835 58.500 -1.665 1
1 1181 . 11 1 1 A 101 101 GLU CB C 101 30.365 30.703 -0.338 1
1 1183 . 11 1 1 A 101 101 GLU N N 101 122.025 122.149 -0.124 1
1 1184 . 11 1 1 A 102 102 ALA H H 102 8.324 7.625 0.699 1
1 1185 . 11 1 1 A 102 102 ALA HA H 102 4.361 4.698 -0.337 1
1 1189 . 11 1 1 A 102 102 ALA C C 102 177.065 175.220 1.845 1
1 1190 . 11 1 1 A 102 102 ALA CA C 102 52.647 51.579 1.068 1
1 1191 . 11 1 1 A 102 102 ALA CB C 102 19.227 23.303 -4.076 1
1 1192 . 11 1 1 A 102 102 ALA N N 102 125.114 119.540 5.574 1
1 1193 . 11 1 1 A 103 103 SER H H 103 8.259 8.794 -0.535 1
1 1194 . 11 1 1 A 103 103 SER HA H 103 4.473 4.994 -0.521 1
1 1197 . 11 1 1 A 103 103 SER C C 103 177.772 173.602 4.170 1
1 1198 . 11 1 1 A 103 103 SER CA C 103 58.301 57.483 0.818 1
1 1199 . 11 1 1 A 103 103 SER CB C 103 63.961 66.896 -2.935 1
1 1200 . 11 1 1 A 103 103 SER N N 103 115.109 115.195 -0.086 1
1 1201 . 11 1 1 A 104 104 THR H H 104 8.127 8.439 -0.312 1
1 1202 . 11 1 1 A 104 104 THR HA H 104 4.600 4.422 0.178 1
1 1207 . 11 1 1 A 104 104 THR C C 104 174.427 175.539 -1.112 1
1 1208 . 11 1 1 A 104 104 THR CA C 104 59.954 60.725 -0.771 1
1 1209 . 11 1 1 A 104 104 THR CB C 104 69.868 68.868 1.000 1
1 1211 . 11 1 1 A 104 104 THR N N 104 117.882 114.490 3.392 1
1 1212 . 11 1 1 A 105 105 PRO HA H 105 4.414 4.489 -0.075 1
1 1219 . 11 1 1 A 105 105 PRO CA C 105 63.300 64.225 -0.925 1
1 1220 . 11 1 1 A 105 105 PRO CB C 105 32.227 31.658 0.569 1
1 1223 . 11 1 1 A 106 106 GLN H H 106 8.524 7.570 0.954 1
1 1224 . 11 1 1 A 106 106 GLN HA H 106 4.276 4.926 -0.650 1
1 1229 . 11 1 1 A 106 106 GLN C C 106 177.083 175.333 1.750 1
1 1230 . 11 1 1 A 106 106 GLN CA C 106 56.209 54.014 2.195 1
1 1231 . 11 1 1 A 106 106 GLN CB C 106 29.490 32.782 -3.292 1
1 1233 . 11 1 1 A 106 106 GLN N N 106 120.754 119.077 1.677 1
1 1234 . 11 1 1 A 107 107 GLY H H 107 8.394 8.451 -0.057 1
1 1235 . 11 1 1 A 107 107 GLY HA2 H 107 3.895 4.086 -0.191 1
1 1236 . 11 1 1 A 107 107 GLY HA3 H 107 3.895 4.264 -0.369 1
1 1237 . 11 1 1 A 107 107 GLY C C 107 176.651 172.708 3.943 1
1 1238 . 11 1 1 A 107 107 GLY CA C 107 45.330 45.057 0.273 1
1 1239 . 11 1 1 A 107 107 GLY N N 107 110.026 107.578 2.448 1
1 1240 . 11 1 1 A 108 108 PHE H H 108 8.099 8.481 -0.382 1
1 1241 . 11 1 1 A 108 108 PHE HA H 108 4.582 4.641 -0.059 1
1 1245 . 11 1 1 A 108 108 PHE C C 108 173.944 175.517 -1.573 1
1 1246 . 11 1 1 A 108 108 PHE CA C 108 58.054 56.657 1.397 1
1 1247 . 11 1 1 A 108 108 PHE CB C 108 39.708 36.571 3.137 1
1 1248 . 11 1 1 A 108 108 PHE N N 108 120.180 118.875 1.305 1
1 1249 . 11 1 1 A 109 109 ASN H H 109 8.482 8.495 -0.013 1
1 1250 . 11 1 1 A 109 109 ASN HA H 109 4.691 5.046 -0.355 1
1 1255 . 11 1 1 A 109 109 ASN C C 109 175.627 174.576 1.051 1
1 1256 . 11 1 1 A 109 109 ASN CA C 109 53.402 54.406 -1.004 1
1 1257 . 11 1 1 A 109 109 ASN CB C 109 38.883 41.566 -2.683 1
1 1258 . 11 1 1 A 109 109 ASN N N 109 120.752 117.836 2.916 1
1 1260 . 11 1 1 A 110 110 THR H H 110 8.112 7.536 0.576 1
1 1261 . 11 1 1 A 110 110 THR HA H 110 4.251 4.353 -0.102 1
1 1266 . 11 1 1 A 110 110 THR C C 110 175.275 173.839 1.436 1
1 1267 . 11 1 1 A 110 110 THR CA C 110 62.460 61.512 0.948 1
1 1268 . 11 1 1 A 110 110 THR CB C 110 69.726 70.592 -0.866 1
1 1270 . 11 1 1 A 110 110 THR N N 110 114.601 110.764 3.837 1
1 1271 . 11 1 1 A 111 111 LEU H H 111 8.168 8.495 -0.327 1
1 1272 . 11 1 1 A 111 111 LEU HA H 111 4.308 4.978 -0.670 1
1 1282 . 11 1 1 A 111 111 LEU CA C 111 55.704 54.270 1.434 1
1 1283 . 11 1 1 A 111 111 LEU CB C 111 42.071 45.961 -3.890 1
1 1287 . 11 1 1 A 111 111 LEU N N 111 123.756 122.996 0.760 1
1 1288 . 11 1 1 A 112 112 LYS H H 112 8.123 8.376 -0.253 1
1 1289 . 11 1 1 A 112 112 LYS HA H 112 4.242 4.856 -0.614 1
1 1298 . 11 1 1 A 112 112 LYS C C 112 177.547 176.029 1.518 1
1 1299 . 11 1 1 A 112 112 LYS CA C 112 56.928 54.467 2.461 1
1 1300 . 11 1 1 A 112 112 LYS CB C 112 33.055 35.945 -2.890 1
1 1304 . 11 1 1 A 112 112 LYS N N 112 121.442 125.215 -3.773 1
1 1305 . 11 1 1 A 113 113 ASP H H 113 8.230 9.364 -1.134 1
1 1306 . 11 1 1 A 113 113 ASP HA H 113 4.526 4.485 0.041 1
1 1309 . 11 1 1 A 113 113 ASP C C 113 176.532 175.809 0.723 1
1 1310 . 11 1 1 A 113 113 ASP CA C 113 54.896 56.550 -1.654 1
1 1311 . 11 1 1 A 113 113 ASP CB C 113 41.362 41.231 0.131 1
1 1312 . 11 1 1 A 113 113 ASP N N 113 120.598 123.165 -2.567 1
1 1313 . 11 1 1 A 114 114 LYS H H 114 8.127 7.537 0.590 1
1 1314 . 11 1 1 A 114 114 LYS HA H 114 4.300 4.704 -0.404 1
1 1323 . 11 1 1 A 114 114 LYS C C 114 176.303 176.742 -0.439 1
1 1324 . 11 1 1 A 114 114 LYS CA C 114 56.633 54.367 2.266 1
1 1325 . 11 1 1 A 114 114 LYS CB C 114 32.818 36.175 -3.357 1
1 1329 . 11 1 1 A 114 114 LYS N N 114 120.897 116.255 4.642 1
1 1330 . 11 1 1 A 115 115 LEU H H 115 8.244 8.615 -0.371 1
1 1331 . 11 1 1 A 115 115 LEU HA H 115 4.254 4.068 0.186 1
1 1341 . 11 1 1 A 115 115 LEU C C 115 176.909 175.600 1.309 1
1 1342 . 11 1 1 A 115 115 LEU CA C 115 56.282 58.224 -1.942 1
1 1343 . 11 1 1 A 115 115 LEU CB C 115 42.188 42.412 -0.224 1
1 1347 . 11 1 1 A 115 115 LEU N N 115 123.251 124.095 -0.844 1
1 1348 . 11 1 1 A 116 116 GLU H H 116 8.421 7.774 0.647 1
1 1349 . 11 1 1 A 116 116 GLU HA H 116 4.190 4.810 -0.620 1
1 1352 . 11 1 1 A 116 116 GLU C C 116 177.828 175.269 2.559 1
1 1353 . 11 1 1 A 116 116 GLU CA C 116 57.466 55.471 1.995 1
1 1354 . 11 1 1 A 116 116 GLU CB C 116 30.124 33.310 -3.186 1
1 1355 . 11 1 1 A 116 116 GLU N N 116 120.575 117.973 2.602 1
1 1356 . 11 1 1 A 117 117 GLU H H 117 8.255 8.904 -0.649 1
1 1357 . 11 1 1 A 117 117 GLU HA H 117 4.192 4.594 -0.402 1
1 1362 . 11 1 1 A 117 117 GLU CA C 117 57.491 56.863 0.628 1
1 1363 . 11 1 1 A 117 117 GLU CB C 117 30.365 32.637 -2.272 1
1 1365 . 11 1 1 A 117 117 GLU N N 117 120.933 124.723 -3.790 1
1 1366 . 11 1 1 A 118 118 TRP H H 118 8.143 7.472 0.671 1
1 1367 . 11 1 1 A 118 118 TRP HA H 118 4.581 4.938 -0.357 1
1 1372 . 11 1 1 A 118 118 TRP C C 118 176.794 174.143 2.651 1
1 1373 . 11 1 1 A 118 118 TRP CA C 118 58.363 56.661 1.702 1
1 1374 . 11 1 1 A 118 118 TRP CB C 118 29.333 32.806 -3.473 1
1 1375 . 11 1 1 A 118 118 TRP N N 118 121.592 119.343 2.249 1
1 1376 . 11 1 1 A 119 119 ILE H H 119 7.908 7.930 -0.022 1
1 1377 . 11 1 1 A 119 119 ILE HA H 119 3.828 4.262 -0.434 1
1 1387 . 11 1 1 A 119 119 ILE C C 119 176.984 173.687 3.297 1
1 1388 . 11 1 1 A 119 119 ILE CA C 119 62.335 59.110 3.225 1
1 1389 . 11 1 1 A 119 119 ILE CB C 119 38.649 40.995 -2.346 1
1 1393 . 11 1 1 A 119 119 ILE N N 119 122.744 125.625 -2.881 1
1 1394 . 11 1 1 A 120 120 GLU H H 120 8.143 8.056 0.087 1
1 1395 . 11 1 1 A 120 120 GLU HA H 120 4.093 4.309 -0.216 1
1 1400 . 11 1 1 A 120 120 GLU C C 120 176.565 175.451 1.114 1
1 1401 . 11 1 1 A 120 120 GLU CA C 120 57.613 57.470 0.143 1
1 1402 . 11 1 1 A 120 120 GLU CB C 120 29.834 32.258 -2.424 1
1 1404 . 11 1 1 A 120 120 GLU N N 120 123.139 127.573 -4.434 1
1 1405 . 11 1 1 A 121 121 MET H H 121 8.254 7.788 0.466 1
1 1406 . 11 1 1 A 121 121 MET HA H 121 4.357 4.707 -0.350 1
1 1411 . 11 1 1 A 121 121 MET CA C 121 56.625 54.024 2.601 1
1 1412 . 11 1 1 A 121 121 MET CB C 121 32.664 35.380 -2.716 1
1 1414 . 11 1 1 A 121 121 MET N N 121 120.449 114.625 5.824 1
1 1415 . 11 1 1 A 122 122 SER H H 122 8.199 8.623 -0.424 1
1 1416 . 11 1 1 A 122 122 SER HA H 122 4.280 4.053 0.227 1
1 1419 . 11 1 1 A 122 122 SER C C 122 177.224 173.412 3.812 1
1 1420 . 11 1 1 A 122 122 SER CA C 122 59.635 58.972 0.663 1
1 1421 . 11 1 1 A 122 122 SER CB C 122 63.560 61.846 1.714 1
1 1422 . 11 1 1 A 122 122 SER N N 122 115.857 113.288 2.569 1
1 1423 . 11 1 1 A 123 123 ASN H H 123 8.211 7.952 0.259 1
1 1424 . 11 1 1 A 123 123 ASN HA H 123 4.737 4.883 -0.146 1
1 1429 . 11 1 1 A 123 123 ASN C C 123 174.709 175.432 -0.723 1
1 1430 . 11 1 1 A 123 123 ASN CA C 123 53.507 53.284 0.223 1
1 1431 . 11 1 1 A 123 123 ASN CB C 123 38.800 39.548 -0.748 1
1 1432 . 11 1 1 A 123 123 ASN N N 123 119.923 118.545 1.378 1
1 1434 . 11 1 1 A 124 124 ARG H H 124 7.997 8.581 -0.584 1
1 1435 . 11 1 1 A 124 124 ARG HA H 124 4.305 4.330 -0.025 1
1 1442 . 11 1 1 A 124 124 ARG C C 124 175.477 176.798 -1.321 1
1 1443 . 11 1 1 A 124 124 ARG CA C 124 56.709 56.359 0.350 1
1 1444 . 11 1 1 A 124 124 ARG CB C 124 30.584 31.123 -0.539 1
1 1447 . 11 1 1 A 124 124 ARG N N 124 120.821 123.416 -2.595 1
1 1448 . 11 1 1 A 125 125 LYS H H 125 8.327 8.692 -0.365 1
1 1449 . 11 1 1 A 125 125 LYS HA H 125 4.254 4.303 -0.049 1
1 1458 . 11 1 1 A 125 125 LYS C C 125 176.777 177.333 -0.556 1
1 1459 . 11 1 1 A 125 125 LYS CA C 125 56.860 57.001 -0.141 1
1 1460 . 11 1 1 A 125 125 LYS CB C 125 32.879 33.412 -0.533 1
1 1464 . 11 1 1 A 125 125 LYS N N 125 121.891 121.212 0.679 1
1 1465 . 11 1 1 A 126 126 ASP H H 126 8.343 8.699 -0.356 1
1 1466 . 11 1 1 A 126 126 ASP HA H 126 4.581 4.460 0.121 1
1 1469 . 11 1 1 A 126 126 ASP C C 126 176.538 176.356 0.182 1
1 1470 . 11 1 1 A 126 126 ASP CA C 126 54.540 56.234 -1.694 1
1 1471 . 11 1 1 A 126 126 ASP CB C 126 40.907 41.185 -0.278 1
1 1472 . 11 1 1 A 126 126 ASP N N 126 119.814 122.390 -2.576 1
1 1473 . 11 1 1 A 127 127 LEU H H 127 7.946 7.346 0.600 1
1 1474 . 11 1 1 A 127 127 LEU HA H 127 4.309 4.175 0.134 1
1 1484 . 11 1 1 A 127 127 LEU C C 127 176.043 176.042 0.001 1
1 1485 . 11 1 1 A 127 127 LEU CA C 127 55.427 55.591 -0.164 1
1 1486 . 11 1 1 A 127 127 LEU CB C 127 42.394 42.844 -0.450 1
1 1490 . 11 1 1 A 127 127 LEU N N 127 121.432 119.493 1.939 1
1 1491 . 11 1 1 A 128 128 ILE H H 128 7.967 8.377 -0.410 1
1 1492 . 11 1 1 A 128 128 ILE HA H 128 4.141 4.128 0.013 1
1 1502 . 11 1 1 A 128 128 ILE C C 128 177.200 177.216 -0.016 1
1 1503 . 11 1 1 A 128 128 ILE CA C 128 61.150 61.271 -0.121 1
1 1504 . 11 1 1 A 128 128 ILE CB C 128 38.489 38.971 -0.482 1
1 1508 . 11 1 1 A 128 128 ILE N N 128 121.579 122.296 -0.717 1
1 1509 . 11 1 1 A 129 129 LYS H H 129 8.331 8.789 -0.458 1
1 1510 . 11 1 1 A 129 129 LYS HA H 129 4.328 3.974 0.354 1
1 1519 . 11 1 1 A 129 129 LYS C C 129 175.952 178.597 -2.645 1
1 1520 . 11 1 1 A 129 129 LYS CA C 129 56.330 58.825 -2.495 1
1 1521 . 11 1 1 A 129 129 LYS CB C 129 33.010 31.762 1.248 1
1 1525 . 11 1 1 A 129 129 LYS N N 129 126.955 120.972 5.983 1
1 1 . 12 1 1 A 2 2 ALA HA H 2 4.070 4.317 -0.247 1
1 5 . 12 1 1 A 2 2 ALA CA C 2 52.067 52.980 -0.913 1
1 6 . 12 1 1 A 2 2 ALA CB C 2 19.577 19.347 0.230 1
1 7 . 12 1 1 A 3 3 ALA H H 3 8.714 8.662 0.052 1
1 8 . 12 1 1 A 3 3 ALA HA H 3 4.253 4.630 -0.377 1
1 12 . 12 1 1 A 3 3 ALA C C 3 173.672 177.381 -3.709 1
1 13 . 12 1 1 A 3 3 ALA CA C 3 52.067 51.338 0.729 1
1 14 . 12 1 1 A 3 3 ALA CB C 3 19.577 20.521 -0.944 1
1 15 . 12 1 1 A 3 3 ALA N N 3 124.480 122.485 1.995 1
1 16 . 12 1 1 A 4 4 LYS H H 4 8.227 8.465 -0.238 1
1 17 . 12 1 1 A 4 4 LYS HA H 4 3.976 3.943 0.033 1
1 26 . 12 1 1 A 4 4 LYS C C 4 176.672 175.833 0.839 1
1 27 . 12 1 1 A 4 4 LYS CA C 4 57.274 58.353 -1.079 1
1 28 . 12 1 1 A 4 4 LYS CB C 4 33.209 32.732 0.477 1
1 32 . 12 1 1 A 4 4 LYS N N 4 120.988 115.693 5.295 1
1 33 . 12 1 1 A 5 5 PHE H H 5 7.719 7.729 -0.010 1
1 34 . 12 1 1 A 5 5 PHE HA H 5 4.384 5.201 -0.817 1
1 38 . 12 1 1 A 5 5 PHE C C 5 175.364 174.183 1.181 1
1 39 . 12 1 1 A 5 5 PHE CA C 5 57.074 56.379 0.695 1
1 40 . 12 1 1 A 5 5 PHE CB C 5 39.669 43.131 -3.462 1
1 41 . 12 1 1 A 5 5 PHE N N 5 119.246 116.644 2.602 1
1 42 . 12 1 1 A 6 6 GLU H H 6 8.515 8.949 -0.434 1
1 43 . 12 1 1 A 6 6 GLU HA H 6 4.370 4.972 -0.602 1
1 48 . 12 1 1 A 6 6 GLU CA C 6 55.669 54.784 0.885 1
1 49 . 12 1 1 A 6 6 GLU CB C 6 32.094 33.767 -1.673 1
1 51 . 12 1 1 A 6 6 GLU N N 6 122.193 118.734 3.459 1
1 52 . 12 1 1 A 7 7 VAL H H 7 8.636 8.540 0.096 1
1 53 . 12 1 1 A 7 7 VAL HA H 7 3.406 3.962 -0.556 1
1 61 . 12 1 1 A 7 7 VAL C C 7 176.611 176.358 0.253 1
1 62 . 12 1 1 A 7 7 VAL CA C 7 65.358 63.367 1.991 1
1 63 . 12 1 1 A 7 7 VAL CB C 7 31.391 31.440 -0.049 1
1 66 . 12 1 1 A 7 7 VAL N N 7 122.949 122.295 0.654 1
1 67 . 12 1 1 A 8 8 GLY H H 8 9.394 9.145 0.249 1
1 68 . 12 1 1 A 8 8 GLY HA2 H 8 3.600 4.043 -0.443 1
1 69 . 12 1 1 A 8 8 GLY HA3 H 8 4.546 4.045 0.501 1
1 70 . 12 1 1 A 8 8 GLY C C 8 178.074 174.334 3.740 1
1 71 . 12 1 1 A 8 8 GLY CA C 8 45.121 44.947 0.174 1
1 72 . 12 1 1 A 8 8 GLY N N 8 116.837 115.212 1.625 1
1 73 . 12 1 1 A 9 9 SER H H 9 8.021 7.902 0.119 1
1 74 . 12 1 1 A 9 9 SER HA H 9 4.680 4.466 0.214 1
1 77 . 12 1 1 A 9 9 SER C C 9 174.234 173.040 1.194 1
1 78 . 12 1 1 A 9 9 SER CA C 9 59.387 59.252 0.135 1
1 79 . 12 1 1 A 9 9 SER CB C 9 65.584 64.607 0.977 1
1 80 . 12 1 1 A 9 9 SER N N 9 118.208 117.725 0.483 1
1 81 . 12 1 1 A 10 10 VAL H H 10 7.945 8.225 -0.280 1
1 82 . 12 1 1 A 10 10 VAL HA H 10 4.980 5.132 -0.152 1
1 90 . 12 1 1 A 10 10 VAL C C 10 171.388 174.300 -2.912 1
1 91 . 12 1 1 A 10 10 VAL CA C 10 61.021 61.079 -0.058 1
1 92 . 12 1 1 A 10 10 VAL CB C 10 33.400 35.006 -1.606 1
1 95 . 12 1 1 A 10 10 VAL N N 10 121.118 122.422 -1.304 1
1 96 . 12 1 1 A 11 11 TYR H H 11 9.008 9.168 -0.160 1
1 97 . 12 1 1 A 11 11 TYR HA H 11 4.850 5.316 -0.466 1
1 101 . 12 1 1 A 11 11 TYR C C 11 174.926 174.833 0.093 1
1 102 . 12 1 1 A 11 11 TYR CA C 11 56.803 56.207 0.596 1
1 103 . 12 1 1 A 11 11 TYR CB C 11 43.676 43.585 0.091 1
1 104 . 12 1 1 A 11 11 TYR N N 11 125.043 125.403 -0.360 1
1 105 . 12 1 1 A 12 12 THR H H 12 8.809 8.656 0.153 1
1 106 . 12 1 1 A 12 12 THR HA H 12 5.020 5.419 -0.399 1
1 111 . 12 1 1 A 12 12 THR C C 12 174.195 174.671 -0.476 1
1 112 . 12 1 1 A 12 12 THR CA C 12 62.487 60.080 2.407 1
1 113 . 12 1 1 A 12 12 THR CB C 12 69.743 71.616 -1.873 1
1 115 . 12 1 1 A 12 12 THR N N 12 116.850 115.375 1.475 1
1 116 . 12 1 1 A 13 13 GLY H H 13 9.179 8.562 0.617 1
1 117 . 12 1 1 A 13 13 GLY HA2 H 13 3.250 4.347 -1.097 1
1 118 . 12 1 1 A 13 13 GLY HA3 H 13 4.801 4.361 0.440 1
1 119 . 12 1 1 A 13 13 GLY C C 13 174.654 171.877 2.777 1
1 120 . 12 1 1 A 13 13 GLY CA C 13 44.377 45.531 -1.154 1
1 121 . 12 1 1 A 13 13 GLY N N 13 113.654 111.884 1.770 1
1 122 . 12 1 1 A 14 14 LYS H H 14 7.770 8.560 -0.790 1
1 123 . 12 1 1 A 14 14 LYS HA H 14 5.426 5.206 0.220 1
1 132 . 12 1 1 A 14 14 LYS C C 14 171.343 175.774 -4.431 1
1 133 . 12 1 1 A 14 14 LYS CA C 14 53.879 54.542 -0.663 1
1 134 . 12 1 1 A 14 14 LYS CB C 14 36.032 35.857 0.175 1
1 138 . 12 1 1 A 14 14 LYS N N 14 118.322 120.573 -2.251 1
1 139 . 12 1 1 A 15 15 VAL H H 15 9.206 9.308 -0.102 1
1 140 . 12 1 1 A 15 15 VAL HA H 15 4.400 4.344 0.056 1
1 148 . 12 1 1 A 15 15 VAL C C 15 176.306 177.068 -0.762 1
1 149 . 12 1 1 A 15 15 VAL CA C 15 63.648 63.395 0.253 1
1 150 . 12 1 1 A 15 15 VAL CB C 15 31.769 31.500 0.269 1
1 153 . 12 1 1 A 15 15 VAL N N 15 125.308 123.584 1.724 1
1 154 . 12 1 1 A 16 16 THR H H 16 9.403 9.376 0.027 1
1 155 . 12 1 1 A 16 16 THR HA H 16 4.562 4.727 -0.165 1
1 160 . 12 1 1 A 16 16 THR C C 16 178.098 174.589 3.509 1
1 161 . 12 1 1 A 16 16 THR CA C 16 62.018 61.489 0.529 1
1 162 . 12 1 1 A 16 16 THR CB C 16 69.720 69.882 -0.162 1
1 164 . 12 1 1 A 16 16 THR N N 16 121.753 117.617 4.136 1
1 165 . 12 1 1 A 17 17 GLY H H 17 7.600 7.173 0.427 1
1 166 . 12 1 1 A 17 17 GLY HA2 H 17 4.110 4.139 -0.029 1
1 167 . 12 1 1 A 17 17 GLY HA3 H 17 4.250 4.236 0.014 1
1 168 . 12 1 1 A 17 17 GLY C C 17 175.551 171.375 4.176 1
1 169 . 12 1 1 A 17 17 GLY CA C 17 46.258 45.591 0.667 1
1 170 . 12 1 1 A 17 17 GLY N N 17 109.407 108.864 0.543 1
1 171 . 12 1 1 A 18 18 LEU H H 18 8.820 8.573 0.247 1
1 172 . 12 1 1 A 18 18 LEU HA H 18 4.852 5.126 -0.274 1
1 182 . 12 1 1 A 18 18 LEU CA C 18 54.245 53.306 0.939 1
1 183 . 12 1 1 A 18 18 LEU CB C 18 44.906 46.263 -1.357 1
1 187 . 12 1 1 A 18 18 LEU N N 18 123.419 121.022 2.397 1
1 188 . 12 1 1 A 19 19 GLN H H 19 8.537 8.546 -0.009 1
1 189 . 12 1 1 A 19 19 GLN HA H 19 4.520 4.797 -0.277 1
1 196 . 12 1 1 A 19 19 GLN C C 19 175.258 175.854 -0.596 1
1 197 . 12 1 1 A 19 19 GLN CA C 19 53.269 53.991 -0.722 1
1 198 . 12 1 1 A 19 19 GLN CB C 19 31.522 32.941 -1.419 1
1 200 . 12 1 1 A 19 19 GLN N N 19 120.187 121.732 -1.545 1
1 202 . 12 1 1 A 20 20 ALA H H 20 8.798 8.786 0.012 1
1 203 . 12 1 1 A 20 20 ALA HA H 20 4.010 4.147 -0.137 1
1 207 . 12 1 1 A 20 20 ALA C C 20 175.698 177.399 -1.701 1
1 208 . 12 1 1 A 20 20 ALA CA C 20 55.084 54.162 0.922 1
1 209 . 12 1 1 A 20 20 ALA CB C 20 18.277 18.539 -0.262 1
1 210 . 12 1 1 A 20 20 ALA N N 20 120.606 124.008 -3.402 1
1 211 . 12 1 1 A 21 21 TYR H H 21 6.618 8.065 -1.447 1
1 212 . 12 1 1 A 21 21 TYR HA H 21 4.540 4.726 -0.186 1
1 216 . 12 1 1 A 21 21 TYR C C 21 178.437 175.261 3.176 1
1 217 . 12 1 1 A 21 21 TYR CA C 21 55.120 57.955 -2.835 1
1 218 . 12 1 1 A 21 21 TYR CB C 21 37.891 39.701 -1.810 1
1 219 . 12 1 1 A 21 21 TYR N N 21 105.570 119.039 -13.469 1
1 220 . 12 1 1 A 22 22 GLY H H 22 7.203 7.242 -0.039 1
1 221 . 12 1 1 A 22 22 GLY HA2 H 22 3.460 3.850 -0.390 1
1 222 . 12 1 1 A 22 22 GLY HA3 H 22 4.360 3.941 0.419 1
1 223 . 12 1 1 A 22 22 GLY C C 22 175.833 171.361 4.472 1
1 224 . 12 1 1 A 22 22 GLY CA C 22 46.356 45.405 0.951 1
1 225 . 12 1 1 A 22 22 GLY N N 22 109.854 107.840 2.014 1
1 226 . 12 1 1 A 23 23 ALA H H 23 8.549 8.584 -0.035 1
1 227 . 12 1 1 A 23 23 ALA HA H 23 4.981 5.270 -0.289 1
1 231 . 12 1 1 A 23 23 ALA C C 23 168.810 176.107 -7.297 1
1 232 . 12 1 1 A 23 23 ALA CA C 23 49.178 50.896 -1.718 1
1 233 . 12 1 1 A 23 23 ALA CB C 23 22.797 21.421 1.376 1
1 234 . 12 1 1 A 23 23 ALA N N 23 118.749 122.409 -3.660 1
1 235 . 12 1 1 A 24 24 PHE H H 24 8.812 8.646 0.166 1
1 236 . 12 1 1 A 24 24 PHE HA H 24 5.125 4.873 0.252 1
1 240 . 12 1 1 A 24 24 PHE CA C 24 58.017 58.197 -0.180 1
1 241 . 12 1 1 A 24 24 PHE CB C 24 40.475 40.570 -0.095 1
1 242 . 12 1 1 A 24 24 PHE N N 24 122.891 122.056 0.835 1
1 243 . 12 1 1 A 25 25 VAL H H 25 8.880 9.081 -0.201 1
1 244 . 12 1 1 A 25 25 VAL HA H 25 4.660 4.730 -0.070 1
1 252 . 12 1 1 A 25 25 VAL CA C 25 60.379 61.161 -0.782 1
1 253 . 12 1 1 A 25 25 VAL CB C 25 35.654 34.961 0.693 1
1 256 . 12 1 1 A 25 25 VAL N N 25 122.908 121.324 1.584 1
1 257 . 12 1 1 A 26 26 ALA H H 26 9.403 8.787 0.616 1
1 258 . 12 1 1 A 26 26 ALA HA H 26 4.750 4.368 0.382 1
1 262 . 12 1 1 A 26 26 ALA C C 26 174.445 176.883 -2.438 1
1 263 . 12 1 1 A 26 26 ALA CA C 26 51.711 52.644 -0.933 1
1 264 . 12 1 1 A 26 26 ALA CB C 26 19.319 19.038 0.281 1
1 265 . 12 1 1 A 26 26 ALA N N 26 129.425 130.662 -1.237 1
1 266 . 12 1 1 A 27 27 LEU H H 27 8.601 9.252 -0.651 1
1 267 . 12 1 1 A 27 27 LEU HA H 27 4.158 4.584 -0.426 1
1 277 . 12 1 1 A 27 27 LEU C C 27 177.814 176.445 1.369 1
1 278 . 12 1 1 A 27 27 LEU CA C 27 55.869 55.770 0.099 1
1 279 . 12 1 1 A 27 27 LEU CB C 27 42.251 43.599 -1.348 1
1 283 . 12 1 1 A 27 27 LEU N N 27 127.169 122.595 4.574 1
1 284 . 12 1 1 A 28 28 ASP H H 28 8.172 7.875 0.297 1
1 285 . 12 1 1 A 28 28 ASP HA H 28 4.420 4.939 -0.519 1
1 288 . 12 1 1 A 28 28 ASP C C 28 177.116 175.307 1.809 1
1 289 . 12 1 1 A 28 28 ASP CA C 28 53.755 53.205 0.550 1
1 290 . 12 1 1 A 28 28 ASP CB C 28 39.833 44.015 -4.182 1
1 291 . 12 1 1 A 28 28 ASP N N 28 115.657 116.942 -1.285 1
1 292 . 12 1 1 A 29 29 GLU H H 29 8.857 8.676 0.181 1
1 293 . 12 1 1 A 29 29 GLU HA H 29 4.090 4.126 -0.036 1
1 298 . 12 1 1 A 29 29 GLU C C 29 175.965 176.678 -0.713 1
1 299 . 12 1 1 A 29 29 GLU CA C 29 59.470 58.947 0.523 1
1 300 . 12 1 1 A 29 29 GLU CB C 29 29.409 29.296 0.113 1
1 302 . 12 1 1 A 29 29 GLU N N 29 114.738 123.044 -8.306 1
1 303 . 12 1 1 A 30 30 GLU H H 30 8.326 8.066 0.260 1
1 304 . 12 1 1 A 30 30 GLU HA H 30 4.640 4.556 0.084 1
1 309 . 12 1 1 A 30 30 GLU C C 30 176.817 175.368 1.449 1
1 310 . 12 1 1 A 30 30 GLU CA C 30 56.073 55.987 0.086 1
1 311 . 12 1 1 A 30 30 GLU CB C 30 32.453 31.398 1.055 1
1 313 . 12 1 1 A 30 30 GLU N N 30 115.753 117.487 -1.734 1
1 314 . 12 1 1 A 31 31 THR H H 31 7.819 7.462 0.357 1
1 315 . 12 1 1 A 31 31 THR HA H 31 4.484 5.093 -0.609 1
1 320 . 12 1 1 A 31 31 THR C C 31 176.330 173.064 3.266 1
1 321 . 12 1 1 A 31 31 THR CA C 31 63.398 61.097 2.301 1
1 322 . 12 1 1 A 31 31 THR CB C 31 69.367 72.835 -3.468 1
1 324 . 12 1 1 A 31 31 THR N N 31 118.750 115.471 3.279 1
1 325 . 12 1 1 A 32 32 GLN H H 32 8.913 8.734 0.179 1
1 326 . 12 1 1 A 32 32 GLN HA H 32 5.337 4.798 0.539 1
1 333 . 12 1 1 A 32 32 GLN C C 32 173.087 174.547 -1.460 1
1 334 . 12 1 1 A 32 32 GLN CA C 32 54.051 54.863 -0.812 1
1 335 . 12 1 1 A 32 32 GLN CB C 32 32.672 32.883 -0.211 1
1 337 . 12 1 1 A 32 32 GLN N N 32 127.294 124.897 2.397 1
1 339 . 12 1 1 A 33 33 GLY H H 33 8.900 8.598 0.302 1
1 340 . 12 1 1 A 33 33 GLY HA2 H 33 3.290 4.360 -1.070 1
1 341 . 12 1 1 A 33 33 GLY HA3 H 33 4.530 4.435 0.095 1
1 342 . 12 1 1 A 33 33 GLY C C 33 174.918 172.304 2.614 1
1 343 . 12 1 1 A 33 33 GLY CA C 33 44.534 44.823 -0.289 1
1 344 . 12 1 1 A 33 33 GLY N N 33 107.639 110.781 -3.142 1
1 345 . 12 1 1 A 34 34 LEU H H 34 8.127 8.719 -0.592 1
1 346 . 12 1 1 A 34 34 LEU HA H 34 4.950 4.754 0.196 1
1 356 . 12 1 1 A 34 34 LEU CA C 34 53.755 54.077 -0.322 1
1 357 . 12 1 1 A 34 34 LEU CB C 34 45.493 44.739 0.754 1
1 361 . 12 1 1 A 34 34 LEU N N 34 120.897 121.391 -0.494 1
1 362 . 12 1 1 A 35 35 VAL H H 35 9.386 8.760 0.626 1
1 363 . 12 1 1 A 35 35 VAL HA H 35 4.479 4.367 0.112 1
1 371 . 12 1 1 A 35 35 VAL C C 35 176.402 176.163 0.239 1
1 372 . 12 1 1 A 35 35 VAL CA C 35 59.594 63.024 -3.430 1
1 373 . 12 1 1 A 35 35 VAL CB C 35 32.590 31.400 1.190 1
1 376 . 12 1 1 A 35 35 VAL N N 35 128.897 127.859 1.038 1
1 377 . 12 1 1 A 36 36 HIS H H 36 9.194 8.415 0.779 1
1 378 . 12 1 1 A 36 36 HIS HA H 36 4.487 4.478 0.009 1
1 381 . 12 1 1 A 36 36 HIS C C 36 174.864 176.496 -1.632 1
1 382 . 12 1 1 A 36 36 HIS CA C 36 59.426 56.394 3.032 1
1 383 . 12 1 1 A 36 36 HIS CB C 36 31.542 30.367 1.175 1
1 384 . 12 1 1 A 36 36 HIS N N 36 127.751 126.131 1.620 1
1 385 . 12 1 1 A 37 37 ILE H H 37 7.454 8.578 -1.124 1
1 386 . 12 1 1 A 37 37 ILE HA H 37 3.810 3.643 0.167 1
1 396 . 12 1 1 A 37 37 ILE C C 37 176.948 177.977 -1.029 1
1 397 . 12 1 1 A 37 37 ILE CA C 37 63.773 64.802 -1.029 1
1 398 . 12 1 1 A 37 37 ILE CB C 37 38.993 37.354 1.639 1
1 402 . 12 1 1 A 37 37 ILE N N 37 126.266 125.554 0.712 1
1 403 . 12 1 1 A 38 38 SER H H 38 8.343 8.044 0.299 1
1 404 . 12 1 1 A 38 38 SER HA H 38 4.370 4.259 0.111 1
1 407 . 12 1 1 A 38 38 SER C C 38 174.792 175.022 -0.230 1
1 408 . 12 1 1 A 38 38 SER CA C 38 60.567 60.665 -0.098 1
1 409 . 12 1 1 A 38 38 SER CB C 38 63.632 62.840 0.792 1
1 410 . 12 1 1 A 38 38 SER N N 38 118.079 118.126 -0.047 1
1 411 . 12 1 1 A 39 39 GLU H H 39 8.536 8.008 0.528 1
1 412 . 12 1 1 A 39 39 GLU HA H 39 4.503 4.567 -0.064 1
1 417 . 12 1 1 A 39 39 GLU C C 39 175.131 176.983 -1.852 1
1 418 . 12 1 1 A 39 39 GLU CA C 39 54.928 56.175 -1.247 1
1 419 . 12 1 1 A 39 39 GLU CB C 39 29.621 30.770 -1.149 1
1 421 . 12 1 1 A 39 39 GLU N N 39 118.349 118.438 -0.089 1
1 422 . 12 1 1 A 40 40 VAL H H 40 7.776 7.606 0.170 1
1 423 . 12 1 1 A 40 40 VAL HA H 40 3.616 3.833 -0.217 1
1 431 . 12 1 1 A 40 40 VAL C C 40 177.277 175.700 1.577 1
1 432 . 12 1 1 A 40 40 VAL CA C 40 66.245 64.604 1.641 1
1 433 . 12 1 1 A 40 40 VAL CB C 40 32.590 32.036 0.554 1
1 436 . 12 1 1 A 40 40 VAL N N 40 125.443 117.796 7.647 1
1 437 . 12 1 1 A 41 41 THR H H 41 7.888 7.390 0.498 1
1 438 . 12 1 1 A 41 41 THR HA H 41 4.345 4.453 -0.108 1
1 443 . 12 1 1 A 41 41 THR C C 41 173.492 174.157 -0.665 1
1 444 . 12 1 1 A 41 41 THR CA C 41 59.047 59.946 -0.899 1
1 445 . 12 1 1 A 41 41 THR CB C 41 68.992 69.778 -0.786 1
1 447 . 12 1 1 A 41 41 THR N N 41 109.905 111.354 -1.449 1
1 448 . 12 1 1 A 42 42 HIS H H 42 8.063 8.923 -0.860 1
1 449 . 12 1 1 A 42 42 HIS HA H 42 4.510 4.426 0.084 1
1 452 . 12 1 1 A 42 42 HIS C C 42 172.139 174.841 -2.702 1
1 453 . 12 1 1 A 42 42 HIS CA C 42 57.735 56.980 0.755 1
1 454 . 12 1 1 A 42 42 HIS CB C 42 31.144 29.580 1.564 1
1 455 . 12 1 1 A 42 42 HIS N N 42 121.760 121.383 0.377 1
1 456 . 12 1 1 A 43 43 GLY H H 43 8.286 7.209 1.077 1
1 457 . 12 1 1 A 43 43 GLY HA2 H 43 3.980 3.715 0.265 1
1 458 . 12 1 1 A 43 43 GLY HA3 H 43 3.980 3.886 0.094 1
1 459 . 12 1 1 A 43 43 GLY C C 43 176.307 172.181 4.126 1
1 460 . 12 1 1 A 43 43 GLY CA C 43 44.336 45.922 -1.586 1
1 461 . 12 1 1 A 43 43 GLY N N 43 110.133 107.241 2.892 1
1 462 . 12 1 1 A 44 44 PHE H H 44 8.327 8.403 -0.076 1
1 463 . 12 1 1 A 44 44 PHE HA H 44 4.489 4.473 0.016 1
1 467 . 12 1 1 A 44 44 PHE C C 44 171.877 176.756 -4.879 1
1 468 . 12 1 1 A 44 44 PHE CA C 44 58.027 58.638 -0.611 1
1 469 . 12 1 1 A 44 44 PHE CB C 44 39.850 39.965 -0.115 1
1 470 . 12 1 1 A 44 44 PHE N N 44 120.049 120.256 -0.207 1
1 471 . 12 1 1 A 45 45 VAL H H 45 7.939 7.911 0.028 1
1 472 . 12 1 1 A 45 45 VAL HA H 45 3.865 4.133 -0.268 1
1 480 . 12 1 1 A 45 45 VAL C C 45 175.523 176.634 -1.111 1
1 481 . 12 1 1 A 45 45 VAL CA C 45 61.536 62.563 -1.027 1
1 482 . 12 1 1 A 45 45 VAL CB C 45 33.127 32.002 1.125 1
1 485 . 12 1 1 A 45 45 VAL N N 45 127.882 123.730 4.152 1
1 486 . 12 1 1 A 46 46 LYS H H 46 8.868 6.403 2.465 1
1 487 . 12 1 1 A 46 46 LYS HA H 46 4.170 3.657 0.513 1
1 496 . 12 1 1 A 46 46 LYS C C 46 175.728 174.246 1.482 1
1 497 . 12 1 1 A 46 46 LYS CA C 46 57.198 58.294 -1.096 1
1 498 . 12 1 1 A 46 46 LYS CB C 46 33.299 30.255 3.044 1
1 502 . 12 1 1 A 46 46 LYS N N 46 127.308 115.907 11.401 1
1 503 . 12 1 1 A 47 47 ASP H H 47 7.652 7.745 -0.093 1
1 504 . 12 1 1 A 47 47 ASP HA H 47 4.710 4.781 -0.071 1
1 507 . 12 1 1 A 47 47 ASP C C 47 176.411 175.852 0.559 1
1 508 . 12 1 1 A 47 47 ASP CA C 47 53.390 53.721 -0.331 1
1 509 . 12 1 1 A 47 47 ASP CB C 47 42.635 44.268 -1.633 1
1 510 . 12 1 1 A 47 47 ASP N N 47 117.932 116.464 1.468 1
1 511 . 12 1 1 A 48 48 ILE H H 48 9.230 8.655 0.575 1
1 512 . 12 1 1 A 48 48 ILE HA H 48 3.579 3.887 -0.308 1
1 522 . 12 1 1 A 48 48 ILE C C 48 177.249 177.502 -0.253 1
1 523 . 12 1 1 A 48 48 ILE CA C 48 65.525 63.654 1.871 1
1 524 . 12 1 1 A 48 48 ILE CB C 48 38.797 37.921 0.876 1
1 528 . 12 1 1 A 48 48 ILE N N 48 129.049 125.322 3.727 1
1 529 . 12 1 1 A 49 49 ASN H H 49 8.468 9.014 -0.546 1
1 530 . 12 1 1 A 49 49 ASN HA H 49 4.690 4.525 0.165 1
1 535 . 12 1 1 A 49 49 ASN C C 49 175.779 176.312 -0.533 1
1 536 . 12 1 1 A 49 49 ASN CA C 49 55.587 54.947 0.640 1
1 537 . 12 1 1 A 49 49 ASN CB C 49 38.587 36.719 1.868 1
1 538 . 12 1 1 A 49 49 ASN N N 49 118.835 117.594 1.241 1
1 540 . 12 1 1 A 50 50 GLU H H 50 7.853 8.033 -0.180 1
1 541 . 12 1 1 A 50 50 GLU HA H 50 4.040 4.174 -0.134 1
1 546 . 12 1 1 A 50 50 GLU C C 50 176.148 176.706 -0.558 1
1 547 . 12 1 1 A 50 50 GLU CA C 50 57.404 57.744 -0.340 1
1 548 . 12 1 1 A 50 50 GLU CB C 50 29.491 29.761 -0.270 1
1 550 . 12 1 1 A 50 50 GLU N N 50 116.358 118.252 -1.894 1
1 551 . 12 1 1 A 51 51 HIS H H 51 7.575 7.864 -0.289 1
1 552 . 12 1 1 A 51 51 HIS HA H 51 4.431 4.755 -0.324 1
1 555 . 12 1 1 A 51 51 HIS C C 51 176.383 174.343 2.040 1
1 556 . 12 1 1 A 51 51 HIS CA C 51 57.089 55.893 1.196 1
1 557 . 12 1 1 A 51 51 HIS CB C 51 33.168 31.750 1.418 1
1 558 . 12 1 1 A 51 51 HIS N N 51 115.828 118.345 -2.517 1
1 559 . 12 1 1 A 52 52 LEU H H 52 7.640 7.334 0.306 1
1 560 . 12 1 1 A 52 52 LEU HA H 52 4.796 4.706 0.090 1
1 570 . 12 1 1 A 52 52 LEU C C 52 174.452 174.213 0.239 1
1 571 . 12 1 1 A 52 52 LEU CA C 52 53.398 53.529 -0.131 1
1 572 . 12 1 1 A 52 52 LEU CB C 52 48.805 44.348 4.457 1
1 576 . 12 1 1 A 52 52 LEU N N 52 117.932 119.446 -1.514 1
1 577 . 12 1 1 A 53 53 SER H H 53 8.151 8.771 -0.620 1
1 578 . 12 1 1 A 53 53 SER HA H 53 4.680 5.001 -0.321 1
1 581 . 12 1 1 A 53 53 SER C C 53 174.304 172.751 1.553 1
1 582 . 12 1 1 A 53 53 SER CA C 53 56.714 57.432 -0.718 1
1 583 . 12 1 1 A 53 53 SER CB C 53 65.431 66.512 -1.081 1
1 584 . 12 1 1 A 53 53 SER N N 53 113.496 117.244 -3.748 1
1 585 . 12 1 1 A 54 54 VAL H H 54 8.782 8.632 0.150 1
1 586 . 12 1 1 A 54 54 VAL HA H 54 3.230 3.880 -0.650 1
1 594 . 12 1 1 A 54 54 VAL C C 54 173.745 177.122 -3.377 1
1 595 . 12 1 1 A 54 54 VAL CA C 54 66.232 63.346 2.886 1
1 596 . 12 1 1 A 54 54 VAL CB C 54 31.067 32.055 -0.988 1
1 599 . 12 1 1 A 54 54 VAL N N 54 124.401 126.145 -1.744 1
1 600 . 12 1 1 A 55 55 GLY H H 55 9.079 9.111 -0.032 1
1 601 . 12 1 1 A 55 55 GLY HA2 H 55 3.530 3.874 -0.344 1
1 602 . 12 1 1 A 55 55 GLY HA3 H 55 4.553 3.875 0.678 1
1 603 . 12 1 1 A 55 55 GLY C C 55 177.219 173.327 3.892 1
1 604 . 12 1 1 A 55 55 GLY CA C 55 44.647 46.372 -1.725 1
1 605 . 12 1 1 A 55 55 GLY N N 55 117.320 115.711 1.609 1
1 606 . 12 1 1 A 56 56 ASP H H 56 7.943 7.772 0.171 1
1 607 . 12 1 1 A 56 56 ASP HA H 56 4.460 5.158 -0.698 1
1 610 . 12 1 1 A 56 56 ASP C C 56 176.055 173.842 2.213 1
1 611 . 12 1 1 A 56 56 ASP CA C 56 55.456 52.456 3.000 1
1 612 . 12 1 1 A 56 56 ASP CB C 56 40.914 44.732 -3.818 1
1 613 . 12 1 1 A 56 56 ASP N N 56 121.782 119.699 2.083 1
1 614 . 12 1 1 A 57 57 GLU H H 57 8.649 8.843 -0.194 1
1 615 . 12 1 1 A 57 57 GLU HA H 57 5.100 5.259 -0.159 1
1 620 . 12 1 1 A 57 57 GLU C C 57 175.635 175.725 -0.090 1
1 621 . 12 1 1 A 57 57 GLU CA C 57 55.805 55.431 0.374 1
1 622 . 12 1 1 A 57 57 GLU CB C 57 30.915 31.618 -0.703 1
1 624 . 12 1 1 A 57 57 GLU N N 57 122.513 123.614 -1.101 1
1 625 . 12 1 1 A 58 58 VAL H H 58 8.809 9.117 -0.308 1
1 626 . 12 1 1 A 58 58 VAL HA H 58 4.817 4.820 -0.003 1
1 634 . 12 1 1 A 58 58 VAL C C 58 176.528 173.846 2.682 1
1 635 . 12 1 1 A 58 58 VAL CA C 58 58.719 59.222 -0.503 1
1 636 . 12 1 1 A 58 58 VAL CB C 58 35.523 36.024 -0.501 1
1 639 . 12 1 1 A 58 58 VAL N N 58 118.382 119.508 -1.126 1
1 640 . 12 1 1 A 59 59 GLN H H 59 8.255 8.479 -0.224 1
1 641 . 12 1 1 A 59 59 GLN HA H 59 5.030 5.025 0.005 1
1 646 . 12 1 1 A 59 59 GLN CA C 59 54.843 55.556 -0.713 1
1 647 . 12 1 1 A 59 59 GLN CB C 59 30.111 30.212 -0.101 1
1 649 . 12 1 1 A 59 59 GLN N N 59 120.933 122.234 -1.301 1
1 650 . 12 1 1 A 60 60 VAL H H 60 8.970 9.285 -0.315 1
1 651 . 12 1 1 A 60 60 VAL HA H 60 4.990 4.936 0.054 1
1 659 . 12 1 1 A 60 60 VAL C C 60 175.203 173.897 1.306 1
1 660 . 12 1 1 A 60 60 VAL CA C 60 57.404 59.027 -1.623 1
1 661 . 12 1 1 A 60 60 VAL CB C 60 35.771 35.504 0.267 1
1 664 . 12 1 1 A 60 60 VAL N N 60 111.046 118.470 -7.424 1
1 665 . 12 1 1 A 61 61 LYS H H 61 8.937 8.672 0.265 1
1 666 . 12 1 1 A 61 61 LYS HA H 61 5.100 4.954 0.146 1
1 675 . 12 1 1 A 61 61 LYS C C 61 173.610 176.329 -2.719 1
1 676 . 12 1 1 A 61 61 LYS CA C 61 53.762 54.901 -1.139 1
1 677 . 12 1 1 A 61 61 LYS CB C 61 36.273 34.583 1.690 1
1 681 . 12 1 1 A 61 61 LYS N N 61 121.930 123.586 -1.656 1
1 682 . 12 1 1 A 62 62 VAL H H 62 8.429 9.301 -0.872 1
1 683 . 12 1 1 A 62 62 VAL HA H 62 4.074 4.028 0.046 1
1 691 . 12 1 1 A 62 62 VAL C C 62 176.912 175.883 1.029 1
1 692 . 12 1 1 A 62 62 VAL CA C 62 63.188 63.577 -0.389 1
1 693 . 12 1 1 A 62 62 VAL CB C 62 30.813 31.317 -0.504 1
1 696 . 12 1 1 A 62 62 VAL N N 62 126.329 127.131 -0.802 1
1 697 . 12 1 1 A 63 63 LEU H H 63 9.109 9.187 -0.078 1
1 698 . 12 1 1 A 63 63 LEU HA H 63 4.423 4.445 -0.022 1
1 708 . 12 1 1 A 63 63 LEU C C 63 176.091 176.125 -0.034 1
1 709 . 12 1 1 A 63 63 LEU CA C 63 55.876 56.176 -0.300 1
1 710 . 12 1 1 A 63 63 LEU CB C 63 42.800 43.622 -0.822 1
1 714 . 12 1 1 A 63 63 LEU N N 63 129.436 129.906 -0.470 1
1 715 . 12 1 1 A 64 64 ALA H H 64 7.594 7.321 0.273 1
1 716 . 12 1 1 A 64 64 ALA HA H 64 4.455 4.740 -0.285 1
1 720 . 12 1 1 A 64 64 ALA C C 64 177.314 175.103 2.211 1
1 721 . 12 1 1 A 64 64 ALA CA C 64 52.557 51.642 0.915 1
1 722 . 12 1 1 A 64 64 ALA CB C 64 21.458 22.628 -1.170 1
1 723 . 12 1 1 A 64 64 ALA N N 64 117.791 118.539 -0.748 1
1 724 . 12 1 1 A 65 65 VAL H H 65 8.583 8.648 -0.065 1
1 725 . 12 1 1 A 65 65 VAL HA H 65 4.470 4.926 -0.456 1
1 733 . 12 1 1 A 65 65 VAL C C 65 174.697 173.013 1.684 1
1 734 . 12 1 1 A 65 65 VAL CA C 65 61.936 60.454 1.482 1
1 735 . 12 1 1 A 65 65 VAL CB C 65 35.288 35.407 -0.119 1
1 738 . 12 1 1 A 65 65 VAL N N 65 120.009 118.367 1.642 1
1 739 . 12 1 1 A 66 66 ASP H H 66 8.567 8.801 -0.234 1
1 740 . 12 1 1 A 66 66 ASP HA H 66 4.880 4.969 -0.089 1
1 743 . 12 1 1 A 66 66 ASP C C 66 174.355 176.072 -1.717 1
1 744 . 12 1 1 A 66 66 ASP CA C 66 52.681 53.701 -1.020 1
1 745 . 12 1 1 A 66 66 ASP CB C 66 41.775 42.402 -0.627 1
1 746 . 12 1 1 A 66 66 ASP N N 66 126.262 127.462 -1.200 1
1 747 . 12 1 1 A 67 67 GLU H H 67 9.148 8.887 0.261 1
1 748 . 12 1 1 A 67 67 GLU HA H 67 4.110 4.109 0.001 1
1 753 . 12 1 1 A 67 67 GLU C C 67 177.052 178.075 -1.023 1
1 754 . 12 1 1 A 67 67 GLU CA C 67 59.044 59.108 -0.064 1
1 755 . 12 1 1 A 67 67 GLU CB C 67 29.919 29.577 0.342 1
1 757 . 12 1 1 A 67 67 GLU N N 67 125.480 125.949 -0.469 1
1 758 . 12 1 1 A 68 68 GLU H H 68 8.384 8.023 0.361 1
1 759 . 12 1 1 A 68 68 GLU HA H 68 4.140 4.148 -0.008 1
1 764 . 12 1 1 A 68 68 GLU C C 68 178.383 179.340 -0.957 1
1 765 . 12 1 1 A 68 68 GLU CA C 68 59.044 59.106 -0.062 1
1 766 . 12 1 1 A 68 68 GLU CB C 68 29.919 29.948 -0.029 1
1 768 . 12 1 1 A 68 68 GLU N N 68 119.760 118.864 0.896 1
1 769 . 12 1 1 A 69 69 LYS H H 69 7.799 8.012 -0.213 1
1 770 . 12 1 1 A 69 69 LYS HA H 69 4.375 4.155 0.220 1
1 779 . 12 1 1 A 69 69 LYS C C 69 178.297 177.443 0.854 1
1 780 . 12 1 1 A 69 69 LYS CA C 69 55.704 56.535 -0.831 1
1 781 . 12 1 1 A 69 69 LYS CB C 69 33.622 32.739 0.883 1
1 785 . 12 1 1 A 69 69 LYS N N 69 115.476 116.954 -1.478 1
1 786 . 12 1 1 A 70 70 GLY H H 70 7.994 8.172 -0.178 1
1 787 . 12 1 1 A 70 70 GLY HA2 H 70 3.940 3.939 0.001 1
1 788 . 12 1 1 A 70 70 GLY HA3 H 70 3.960 3.945 0.015 1
1 789 . 12 1 1 A 70 70 GLY C C 70 177.215 174.145 3.070 1
1 790 . 12 1 1 A 70 70 GLY CA C 70 46.773 46.659 0.114 1
1 791 . 12 1 1 A 70 70 GLY N N 70 110.245 108.287 1.958 1
1 792 . 12 1 1 A 71 71 LYS H H 71 7.560 7.965 -0.405 1
1 793 . 12 1 1 A 71 71 LYS HA H 71 4.690 4.973 -0.283 1
1 802 . 12 1 1 A 71 71 LYS C C 71 174.607 174.832 -0.225 1
1 803 . 12 1 1 A 71 71 LYS CA C 71 55.332 54.552 0.780 1
1 804 . 12 1 1 A 71 71 LYS CB C 71 34.903 36.077 -1.174 1
1 808 . 12 1 1 A 71 71 LYS N N 71 118.201 118.535 -0.334 1
1 809 . 12 1 1 A 72 72 ILE H H 72 8.867 8.734 0.133 1
1 810 . 12 1 1 A 72 72 ILE HA H 72 4.630 5.032 -0.402 1
1 820 . 12 1 1 A 72 72 ILE C C 72 175.708 174.622 1.086 1
1 821 . 12 1 1 A 72 72 ILE CA C 72 61.494 60.207 1.287 1
1 822 . 12 1 1 A 72 72 ILE CB C 72 40.652 42.152 -1.500 1
1 826 . 12 1 1 A 72 72 ILE N N 72 126.827 121.735 5.092 1
1 827 . 12 1 1 A 73 73 SER H H 73 8.815 8.987 -0.172 1
1 828 . 12 1 1 A 73 73 SER HA H 73 5.110 5.345 -0.235 1
1 831 . 12 1 1 A 73 73 SER C C 73 175.122 173.151 1.971 1
1 832 . 12 1 1 A 73 73 SER CA C 73 57.487 58.057 -0.570 1
1 833 . 12 1 1 A 73 73 SER CB C 73 64.386 64.726 -0.340 1
1 834 . 12 1 1 A 73 73 SER N N 73 123.640 124.886 -1.246 1
1 835 . 12 1 1 A 74 74 LEU H H 74 8.585 8.741 -0.156 1
1 836 . 12 1 1 A 74 74 LEU HA H 74 5.450 5.305 0.145 1
1 846 . 12 1 1 A 74 74 LEU C C 74 174.061 175.925 -1.864 1
1 847 . 12 1 1 A 74 74 LEU CA C 74 53.101 53.485 -0.384 1
1 848 . 12 1 1 A 74 74 LEU CB C 74 48.268 46.848 1.420 1
1 852 . 12 1 1 A 74 74 LEU N N 74 125.221 124.294 0.927 1
1 853 . 12 1 1 A 75 75 SER H H 75 8.840 8.767 0.073 1
1 854 . 12 1 1 A 75 75 SER HA H 75 5.040 5.137 -0.097 1
1 857 . 12 1 1 A 75 75 SER C C 75 176.552 173.441 3.111 1
1 858 . 12 1 1 A 75 75 SER CA C 75 57.487 57.352 0.135 1
1 859 . 12 1 1 A 75 75 SER CB C 75 64.993 66.622 -1.629 1
1 860 . 12 1 1 A 75 75 SER N N 75 111.252 116.275 -5.023 1
1 861 . 12 1 1 A 76 76 ILE H H 76 7.790 8.824 -1.034 1
1 862 . 12 1 1 A 76 76 ILE HA H 76 4.690 4.502 0.188 1
1 872 . 12 1 1 A 76 76 ILE C C 76 175.780 177.298 -1.518 1
1 873 . 12 1 1 A 76 76 ILE CA C 76 63.631 61.584 2.047 1
1 874 . 12 1 1 A 76 76 ILE CB C 76 39.484 39.259 0.225 1
1 878 . 12 1 1 A 76 76 ILE N N 76 129.205 124.448 4.757 1
1 879 . 12 1 1 A 77 77 ARG H H 77 8.115 8.506 -0.391 1
1 880 . 12 1 1 A 77 77 ARG HA H 77 3.760 4.092 -0.332 1
1 887 . 12 1 1 A 77 77 ARG C C 77 178.704 178.011 0.693 1
1 888 . 12 1 1 A 77 77 ARG CA C 77 58.933 58.542 0.391 1
1 889 . 12 1 1 A 77 77 ARG CB C 77 29.463 29.789 -0.326 1
1 892 . 12 1 1 A 77 77 ARG N N 77 123.257 122.023 1.234 1
1 893 . 12 1 1 A 78 78 ALA H H 78 8.304 7.726 0.578 1
1 894 . 12 1 1 A 78 78 ALA HA H 78 4.296 4.145 0.151 1
1 898 . 12 1 1 A 78 78 ALA C C 78 176.870 178.820 -1.950 1
1 899 . 12 1 1 A 78 78 ALA CA C 78 53.548 54.800 -1.252 1
1 900 . 12 1 1 A 78 78 ALA CB C 78 19.872 18.160 1.712 1
1 901 . 12 1 1 A 78 78 ALA N N 78 118.764 122.018 -3.254 1
1 902 . 12 1 1 A 79 79 THR H H 79 7.931 7.644 0.287 1
1 903 . 12 1 1 A 79 79 THR HA H 79 4.370 4.470 -0.100 1
1 908 . 12 1 1 A 79 79 THR C C 79 178.356 175.495 2.861 1
1 909 . 12 1 1 A 79 79 THR CA C 79 62.381 62.733 -0.352 1
1 910 . 12 1 1 A 79 79 THR CB C 79 69.693 69.942 -0.249 1
1 912 . 12 1 1 A 79 79 THR N N 79 107.360 107.611 -0.251 1
1 913 . 12 1 1 A 80 80 GLN H H 80 7.651 7.994 -0.343 1
1 914 . 12 1 1 A 80 80 GLN HA H 80 4.527 4.744 -0.217 1
1 921 . 12 1 1 A 80 80 GLN C C 80 174.249 176.020 -1.771 1
1 922 . 12 1 1 A 80 80 GLN CA C 80 54.760 54.848 -0.088 1
1 923 . 12 1 1 A 80 80 GLN CB C 80 30.565 29.267 1.298 1
1 925 . 12 1 1 A 80 80 GLN N N 80 121.588 119.331 2.257 1
1 927 . 12 1 1 A 81 81 ALA H H 81 8.498 8.099 0.399 1
1 928 . 12 1 1 A 81 81 ALA HA H 81 4.252 4.148 0.104 1
1 932 . 12 1 1 A 81 81 ALA C C 81 175.693 178.945 -3.252 1
1 933 . 12 1 1 A 81 81 ALA CA C 81 52.345 55.083 -2.738 1
1 934 . 12 1 1 A 81 81 ALA CB C 81 19.062 18.476 0.586 1
1 935 . 12 1 1 A 81 81 ALA N N 81 126.423 122.210 4.213 1
1 936 . 12 1 1 A 82 82 ALA H H 82 8.324 7.628 0.696 1
1 937 . 12 1 1 A 82 82 ALA HA H 82 4.000 4.409 -0.409 1
1 941 . 12 1 1 A 82 82 ALA C C 82 177.065 176.113 0.952 1
1 942 . 12 1 1 A 82 82 ALA CA C 82 50.240 50.635 -0.395 1
1 943 . 12 1 1 A 82 82 ALA CB C 82 17.650 18.348 -0.698 1
1 944 . 12 1 1 A 82 82 ALA N N 82 125.114 120.916 4.198 1
1 945 . 12 1 1 A 83 83 PRO HA H 83 4.350 4.327 0.023 1
1 952 . 12 1 1 A 83 83 PRO CA C 83 63.148 63.343 -0.195 1
1 953 . 12 1 1 A 83 83 PRO CB C 83 32.054 31.809 0.245 1
1 956 . 12 1 1 A 84 84 GLU H H 84 8.517 8.525 -0.008 1
1 957 . 12 1 1 A 84 84 GLU HA H 84 4.197 4.824 -0.627 1
1 962 . 12 1 1 A 84 84 GLU C C 84 176.948 175.408 1.540 1
1 963 . 12 1 1 A 84 84 GLU CA C 84 56.674 55.014 1.660 1
1 964 . 12 1 1 A 84 84 GLU CB C 84 30.459 34.575 -4.116 1
1 966 . 12 1 1 A 84 84 GLU N N 84 121.479 124.468 -2.989 1
1 967 . 12 1 1 A 85 85 LYS H H 85 8.381 8.547 -0.166 1
1 968 . 12 1 1 A 85 85 LYS HA H 85 4.309 4.655 -0.346 1
1 977 . 12 1 1 A 85 85 LYS C C 85 176.457 176.028 0.429 1
1 978 . 12 1 1 A 85 85 LYS CA C 85 56.272 53.925 2.347 1
1 979 . 12 1 1 A 85 85 LYS CB C 85 32.961 36.497 -3.536 1
1 983 . 12 1 1 A 85 85 LYS N N 85 123.266 120.473 2.793 1
1 984 . 12 1 1 A 86 86 LYS H H 86 8.403 8.092 0.311 1
1 985 . 12 1 1 A 86 86 LYS HA H 86 4.308 4.147 0.161 1
1 994 . 12 1 1 A 86 86 LYS C C 86 176.435 176.100 0.335 1
1 995 . 12 1 1 A 86 86 LYS CA C 86 56.272 56.354 -0.082 1
1 996 . 12 1 1 A 86 86 LYS CB C 86 32.961 32.840 0.121 1
1 1000 . 12 1 1 A 86 86 LYS N N 86 123.688 121.331 2.357 1
1 1001 . 12 1 1 A 87 87 GLU H H 87 8.540 8.644 -0.104 1
1 1002 . 12 1 1 A 87 87 GLU HA H 87 4.358 4.982 -0.624 1
1 1007 . 12 1 1 A 87 87 GLU C C 87 176.556 175.645 0.911 1
1 1008 . 12 1 1 A 87 87 GLU CA C 87 56.406 54.815 1.591 1
1 1009 . 12 1 1 A 87 87 GLU CB C 87 30.607 33.736 -3.129 1
1 1011 . 12 1 1 A 87 87 GLU N N 87 122.633 119.400 3.233 1
1 1012 . 12 1 1 A 88 88 SER H H 88 8.520 8.817 -0.297 1
1 1013 . 12 1 1 A 88 88 SER HA H 88 4.490 4.774 -0.284 1
1 1016 . 12 1 1 A 88 88 SER C C 88 175.780 175.935 -0.155 1
1 1017 . 12 1 1 A 88 88 SER CA C 88 58.431 59.204 -0.773 1
1 1018 . 12 1 1 A 88 88 SER CB C 88 63.858 65.751 -1.893 1
1 1019 . 12 1 1 A 88 88 SER N N 88 118.333 116.221 2.112 1
1 1020 . 12 1 1 A 89 89 LYS H H 89 8.339 7.859 0.480 1
1 1021 . 12 1 1 A 89 89 LYS HA H 89 4.620 4.130 0.490 1
1 1030 . 12 1 1 A 89 89 LYS C C 89 174.160 177.195 -3.035 1
1 1031 . 12 1 1 A 89 89 LYS CA C 89 54.265 59.140 -4.875 1
1 1032 . 12 1 1 A 89 89 LYS CB C 89 32.672 31.769 0.903 1
1 1036 . 12 1 1 A 89 89 LYS N N 89 124.433 120.146 4.287 1
1 1037 . 12 1 1 A 90 90 PRO HA H 90 4.417 4.567 -0.150 1
1 1044 . 12 1 1 A 90 90 PRO CA C 90 63.064 62.739 0.325 1
1 1045 . 12 1 1 A 90 90 PRO CB C 90 32.266 32.328 -0.062 1
1 1048 . 12 1 1 A 91 91 ARG H H 91 8.502 8.414 0.088 1
1 1049 . 12 1 1 A 91 91 ARG HA H 91 4.305 4.325 -0.020 1
1 1056 . 12 1 1 A 91 91 ARG C C 91 176.831 176.994 -0.163 1
1 1057 . 12 1 1 A 91 91 ARG CA C 91 56.002 56.666 -0.664 1
1 1058 . 12 1 1 A 91 91 ARG CB C 91 30.913 31.111 -0.198 1
1 1061 . 12 1 1 A 91 91 ARG N N 91 122.193 122.629 -0.436 1
1 1062 . 12 1 1 A 92 92 LYS H H 92 8.415 8.775 -0.360 1
1 1063 . 12 1 1 A 92 92 LYS HA H 92 4.610 4.123 0.487 1
1 1072 . 12 1 1 A 92 92 LYS C C 92 176.262 176.471 -0.209 1
1 1073 . 12 1 1 A 92 92 LYS CA C 92 54.258 61.332 -7.074 1
1 1074 . 12 1 1 A 92 92 LYS CB C 92 32.672 30.713 1.959 1
1 1078 . 12 1 1 A 92 92 LYS N N 92 124.243 128.283 -4.040 1
1 1079 . 12 1 1 A 93 93 PRO HA H 93 4.415 4.547 -0.132 1
1 1086 . 12 1 1 A 93 93 PRO CA C 93 62.899 62.938 -0.039 1
1 1087 . 12 1 1 A 93 93 PRO CB C 93 32.323 32.641 -0.318 1
1 1090 . 12 1 1 A 94 94 LYS H H 94 8.420 8.668 -0.248 1
1 1091 . 12 1 1 A 94 94 LYS HA H 94 4.290 4.527 -0.237 1
1 1100 . 12 1 1 A 94 94 LYS C C 94 176.714 176.355 0.359 1
1 1101 . 12 1 1 A 94 94 LYS CA C 94 56.585 55.803 0.782 1
1 1102 . 12 1 1 A 94 94 LYS CB C 94 33.161 33.906 -0.745 1
1 1106 . 12 1 1 A 94 94 LYS N N 94 122.121 119.521 2.600 1
1 1107 . 12 1 1 A 95 95 ALA H H 95 8.348 7.315 1.033 1
1 1108 . 12 1 1 A 95 95 ALA HA H 95 4.250 4.267 -0.017 1
1 1112 . 12 1 1 A 95 95 ALA C C 95 176.453 177.523 -1.070 1
1 1113 . 12 1 1 A 95 95 ALA CA C 95 52.471 52.263 0.208 1
1 1114 . 12 1 1 A 95 95 ALA CB C 95 19.347 19.746 -0.399 1
1 1115 . 12 1 1 A 95 95 ALA N N 95 125.624 123.021 2.603 1
1 1116 . 12 1 1 A 96 96 ALA H H 96 8.348 8.577 -0.229 1
1 1117 . 12 1 1 A 96 96 ALA HA H 96 4.254 4.163 0.091 1
1 1121 . 12 1 1 A 96 96 ALA C C 96 176.462 177.565 -1.103 1
1 1122 . 12 1 1 A 96 96 ALA CA C 96 52.471 53.907 -1.436 1
1 1123 . 12 1 1 A 96 96 ALA CB C 96 19.347 18.693 0.654 1
1 1124 . 12 1 1 A 96 96 ALA N N 96 125.624 121.352 4.272 1
1 1125 . 12 1 1 A 97 97 GLN H H 97 8.333 7.621 0.712 1
1 1126 . 12 1 1 A 97 97 GLN HA H 97 4.362 4.174 0.188 1
1 1133 . 12 1 1 A 97 97 GLN C C 97 177.684 175.281 2.403 1
1 1134 . 12 1 1 A 97 97 GLN CA C 97 55.848 56.303 -0.455 1
1 1135 . 12 1 1 A 97 97 GLN CB C 97 29.643 29.477 0.166 1
1 1137 . 12 1 1 A 97 97 GLN N N 97 120.049 119.150 0.899 1
1 1139 . 12 1 1 A 98 98 VAL H H 98 8.230 8.859 -0.629 1
1 1140 . 12 1 1 A 98 98 VAL HA H 98 4.145 5.112 -0.967 1
1 1148 . 12 1 1 A 98 98 VAL C C 98 176.033 174.294 1.739 1
1 1149 . 12 1 1 A 98 98 VAL CA C 98 62.444 59.492 2.952 1
1 1150 . 12 1 1 A 98 98 VAL CB C 98 32.942 35.987 -3.045 1
1 1153 . 12 1 1 A 98 98 VAL N N 98 121.607 120.033 1.574 1
1 1154 . 12 1 1 A 99 99 SER H H 99 8.375 9.109 -0.734 1
1 1155 . 12 1 1 A 99 99 SER HA H 99 4.473 4.911 -0.438 1
1 1158 . 12 1 1 A 99 99 SER C C 99 176.204 175.133 1.071 1
1 1159 . 12 1 1 A 99 99 SER CA C 99 58.379 57.237 1.142 1
1 1160 . 12 1 1 A 99 99 SER CB C 99 63.914 66.734 -2.820 1
1 1161 . 12 1 1 A 99 99 SER N N 99 119.455 118.662 0.793 1
1 1162 . 12 1 1 A 100 100 GLU H H 100 8.547 8.918 -0.371 1
1 1163 . 12 1 1 A 100 100 GLU HA H 100 4.304 3.977 0.327 1
1 1168 . 12 1 1 A 100 100 GLU C C 100 174.620 176.889 -2.269 1
1 1169 . 12 1 1 A 100 100 GLU CA C 100 56.835 59.612 -2.777 1
1 1170 . 12 1 1 A 100 100 GLU CB C 100 30.365 29.343 1.022 1
1 1172 . 12 1 1 A 100 100 GLU N N 100 123.419 122.250 1.169 1
1 1173 . 12 1 1 A 101 101 GLU H H 101 8.432 7.867 0.565 1
1 1174 . 12 1 1 A 101 101 GLU HA H 101 4.252 3.956 0.296 1
1 1179 . 12 1 1 A 101 101 GLU C C 101 176.693 175.968 0.725 1
1 1180 . 12 1 1 A 101 101 GLU CA C 101 56.835 57.481 -0.646 1
1 1181 . 12 1 1 A 101 101 GLU CB C 101 30.365 27.263 3.102 1
1 1183 . 12 1 1 A 101 101 GLU N N 101 122.025 115.324 6.701 1
1 1184 . 12 1 1 A 102 102 ALA H H 102 8.324 8.049 0.275 1
1 1185 . 12 1 1 A 102 102 ALA HA H 102 4.361 4.523 -0.162 1
1 1189 . 12 1 1 A 102 102 ALA C C 102 177.065 176.836 0.229 1
1 1190 . 12 1 1 A 102 102 ALA CA C 102 52.647 51.298 1.349 1
1 1191 . 12 1 1 A 102 102 ALA CB C 102 19.227 20.774 -1.547 1
1 1192 . 12 1 1 A 102 102 ALA N N 102 125.114 119.485 5.629 1
1 1193 . 12 1 1 A 103 103 SER H H 103 8.259 7.480 0.779 1
1 1194 . 12 1 1 A 103 103 SER HA H 103 4.473 4.508 -0.035 1
1 1197 . 12 1 1 A 103 103 SER C C 103 177.772 174.184 3.588 1
1 1198 . 12 1 1 A 103 103 SER CA C 103 58.301 59.053 -0.752 1
1 1199 . 12 1 1 A 103 103 SER CB C 103 63.961 63.982 -0.021 1
1 1200 . 12 1 1 A 103 103 SER N N 103 115.109 114.945 0.164 1
1 1201 . 12 1 1 A 104 104 THR H H 104 8.127 8.494 -0.367 1
1 1202 . 12 1 1 A 104 104 THR HA H 104 4.600 4.519 0.081 1
1 1207 . 12 1 1 A 104 104 THR C C 104 174.427 173.525 0.902 1
1 1208 . 12 1 1 A 104 104 THR CA C 104 59.954 60.637 -0.683 1
1 1209 . 12 1 1 A 104 104 THR CB C 104 69.868 68.749 1.119 1
1 1211 . 12 1 1 A 104 104 THR N N 104 117.882 115.607 2.275 1
1 1212 . 12 1 1 A 105 105 PRO HA H 105 4.414 4.487 -0.073 1
1 1219 . 12 1 1 A 105 105 PRO CA C 105 63.300 63.003 0.297 1
1 1220 . 12 1 1 A 105 105 PRO CB C 105 32.227 32.370 -0.143 1
1 1223 . 12 1 1 A 106 106 GLN H H 106 8.524 8.373 0.151 1
1 1224 . 12 1 1 A 106 106 GLN HA H 106 4.276 4.990 -0.714 1
1 1229 . 12 1 1 A 106 106 GLN C C 106 177.083 175.044 2.039 1
1 1230 . 12 1 1 A 106 106 GLN CA C 106 56.209 54.313 1.896 1
1 1231 . 12 1 1 A 106 106 GLN CB C 106 29.490 33.432 -3.942 1
1 1233 . 12 1 1 A 106 106 GLN N N 106 120.754 119.345 1.409 1
1 1234 . 12 1 1 A 107 107 GLY H H 107 8.394 8.385 0.009 1
1 1235 . 12 1 1 A 107 107 GLY HA2 H 107 3.895 4.002 -0.107 1
1 1236 . 12 1 1 A 107 107 GLY HA3 H 107 3.895 4.157 -0.262 1
1 1237 . 12 1 1 A 107 107 GLY C C 107 176.651 174.262 2.389 1
1 1238 . 12 1 1 A 107 107 GLY CA C 107 45.330 45.780 -0.450 1
1 1239 . 12 1 1 A 107 107 GLY N N 107 110.026 108.636 1.390 1
1 1240 . 12 1 1 A 108 108 PHE H H 108 8.099 8.608 -0.509 1
1 1241 . 12 1 1 A 108 108 PHE HA H 108 4.582 4.387 0.195 1
1 1245 . 12 1 1 A 108 108 PHE C C 108 173.944 175.073 -1.129 1
1 1246 . 12 1 1 A 108 108 PHE CA C 108 58.054 58.600 -0.546 1
1 1247 . 12 1 1 A 108 108 PHE CB C 108 39.708 38.424 1.284 1
1 1248 . 12 1 1 A 108 108 PHE N N 108 120.180 117.632 2.548 1
1 1249 . 12 1 1 A 109 109 ASN H H 109 8.482 7.330 1.152 1
1 1250 . 12 1 1 A 109 109 ASN HA H 109 4.691 5.158 -0.467 1
1 1255 . 12 1 1 A 109 109 ASN C C 109 175.627 173.462 2.165 1
1 1256 . 12 1 1 A 109 109 ASN CA C 109 53.402 51.891 1.511 1
1 1257 . 12 1 1 A 109 109 ASN CB C 109 38.883 41.662 -2.779 1
1 1258 . 12 1 1 A 109 109 ASN N N 109 120.752 118.411 2.341 1
1 1260 . 12 1 1 A 110 110 THR H H 110 8.112 8.498 -0.386 1
1 1261 . 12 1 1 A 110 110 THR HA H 110 4.251 3.774 0.477 1
1 1266 . 12 1 1 A 110 110 THR C C 110 175.275 175.133 0.142 1
1 1267 . 12 1 1 A 110 110 THR CA C 110 62.460 64.855 -2.395 1
1 1268 . 12 1 1 A 110 110 THR CB C 110 69.726 68.570 1.156 1
1 1270 . 12 1 1 A 110 110 THR N N 110 114.601 117.881 -3.280 1
1 1271 . 12 1 1 A 111 111 LEU H H 111 8.168 9.362 -1.194 1
1 1272 . 12 1 1 A 111 111 LEU HA H 111 4.308 4.093 0.215 1
1 1282 . 12 1 1 A 111 111 LEU CA C 111 55.704 56.313 -0.609 1
1 1283 . 12 1 1 A 111 111 LEU CB C 111 42.071 40.456 1.615 1
1 1287 . 12 1 1 A 111 111 LEU N N 111 123.756 127.369 -3.613 1
1 1288 . 12 1 1 A 112 112 LYS H H 112 8.123 8.353 -0.230 1
1 1289 . 12 1 1 A 112 112 LYS HA H 112 4.242 3.895 0.347 1
1 1298 . 12 1 1 A 112 112 LYS C C 112 177.547 175.725 1.822 1
1 1299 . 12 1 1 A 112 112 LYS CA C 112 56.928 58.532 -1.604 1
1 1300 . 12 1 1 A 112 112 LYS CB C 112 33.055 32.101 0.954 1
1 1304 . 12 1 1 A 112 112 LYS N N 112 121.442 115.879 5.563 1
1 1305 . 12 1 1 A 113 113 ASP H H 113 8.230 8.316 -0.086 1
1 1306 . 12 1 1 A 113 113 ASP HA H 113 4.526 4.819 -0.293 1
1 1309 . 12 1 1 A 113 113 ASP C C 113 176.532 175.687 0.845 1
1 1310 . 12 1 1 A 113 113 ASP CA C 113 54.896 53.172 1.724 1
1 1311 . 12 1 1 A 113 113 ASP CB C 113 41.362 42.868 -1.506 1
1 1312 . 12 1 1 A 113 113 ASP N N 113 120.598 119.976 0.622 1
1 1313 . 12 1 1 A 114 114 LYS H H 114 8.127 7.450 0.677 1
1 1314 . 12 1 1 A 114 114 LYS HA H 114 4.300 4.138 0.162 1
1 1323 . 12 1 1 A 114 114 LYS C C 114 176.303 175.211 1.092 1
1 1324 . 12 1 1 A 114 114 LYS CA C 114 56.633 56.916 -0.283 1
1 1325 . 12 1 1 A 114 114 LYS CB C 114 32.818 33.196 -0.378 1
1 1329 . 12 1 1 A 114 114 LYS N N 114 120.897 120.601 0.296 1
1 1330 . 12 1 1 A 115 115 LEU H H 115 8.244 8.546 -0.302 1
1 1331 . 12 1 1 A 115 115 LEU HA H 115 4.254 5.022 -0.768 1
1 1341 . 12 1 1 A 115 115 LEU C C 115 176.909 174.640 2.269 1
1 1342 . 12 1 1 A 115 115 LEU CA C 115 56.282 53.296 2.986 1
1 1343 . 12 1 1 A 115 115 LEU CB C 115 42.188 45.090 -2.902 1
1 1347 . 12 1 1 A 115 115 LEU N N 115 123.251 125.711 -2.460 1
1 1348 . 12 1 1 A 116 116 GLU H H 116 8.421 8.973 -0.552 1
1 1349 . 12 1 1 A 116 116 GLU HA H 116 4.190 5.120 -0.930 1
1 1352 . 12 1 1 A 116 116 GLU C C 116 177.828 174.438 3.390 1
1 1353 . 12 1 1 A 116 116 GLU CA C 116 57.466 54.468 2.998 1
1 1354 . 12 1 1 A 116 116 GLU CB C 116 30.124 33.975 -3.851 1
1 1355 . 12 1 1 A 116 116 GLU N N 116 120.575 121.141 -0.566 1
1 1356 . 12 1 1 A 117 117 GLU H H 117 8.255 8.719 -0.464 1
1 1357 . 12 1 1 A 117 117 GLU HA H 117 4.192 5.026 -0.834 1
1 1362 . 12 1 1 A 117 117 GLU CA C 117 57.491 54.611 2.880 1
1 1363 . 12 1 1 A 117 117 GLU CB C 117 30.365 34.401 -4.036 1
1 1365 . 12 1 1 A 117 117 GLU N N 117 120.933 118.829 2.104 1
1 1366 . 12 1 1 A 118 118 TRP H H 118 8.143 8.693 -0.550 1
1 1367 . 12 1 1 A 118 118 TRP HA H 118 4.581 4.926 -0.345 1
1 1372 . 12 1 1 A 118 118 TRP C C 118 176.794 175.942 0.852 1
1 1373 . 12 1 1 A 118 118 TRP CA C 118 58.363 56.197 2.166 1
1 1374 . 12 1 1 A 118 118 TRP CB C 118 29.333 30.118 -0.785 1
1 1375 . 12 1 1 A 118 118 TRP N N 118 121.592 123.607 -2.015 1
1 1376 . 12 1 1 A 119 119 ILE H H 119 7.908 8.111 -0.203 1
1 1377 . 12 1 1 A 119 119 ILE HA H 119 3.828 3.796 0.032 1
1 1387 . 12 1 1 A 119 119 ILE C C 119 176.984 177.538 -0.554 1
1 1388 . 12 1 1 A 119 119 ILE CA C 119 62.335 63.548 -1.213 1
1 1389 . 12 1 1 A 119 119 ILE CB C 119 38.649 37.611 1.038 1
1 1393 . 12 1 1 A 119 119 ILE N N 119 122.744 118.993 3.751 1
1 1394 . 12 1 1 A 120 120 GLU H H 120 8.143 8.847 -0.704 1
1 1395 . 12 1 1 A 120 120 GLU HA H 120 4.093 4.048 0.045 1
1 1400 . 12 1 1 A 120 120 GLU C C 120 176.565 177.255 -0.690 1
1 1401 . 12 1 1 A 120 120 GLU CA C 120 57.613 58.635 -1.022 1
1 1402 . 12 1 1 A 120 120 GLU CB C 120 29.834 28.716 1.118 1
1 1404 . 12 1 1 A 120 120 GLU N N 120 123.139 123.572 -0.433 1
1 1405 . 12 1 1 A 121 121 MET H H 121 8.254 7.534 0.720 1
1 1406 . 12 1 1 A 121 121 MET HA H 121 4.357 4.284 0.073 1
1 1411 . 12 1 1 A 121 121 MET CA C 121 56.625 54.884 1.741 1
1 1412 . 12 1 1 A 121 121 MET CB C 121 32.664 31.580 1.084 1
1 1414 . 12 1 1 A 121 121 MET N N 121 120.449 117.765 2.684 1
1 1415 . 12 1 1 A 122 122 SER H H 122 8.199 7.736 0.463 1
1 1416 . 12 1 1 A 122 122 SER HA H 122 4.280 4.635 -0.355 1
1 1419 . 12 1 1 A 122 122 SER C C 122 177.224 173.007 4.217 1
1 1420 . 12 1 1 A 122 122 SER CA C 122 59.635 57.749 1.886 1
1 1421 . 12 1 1 A 122 122 SER CB C 122 63.560 64.806 -1.246 1
1 1422 . 12 1 1 A 122 122 SER N N 122 115.857 114.862 0.995 1
1 1423 . 12 1 1 A 123 123 ASN H H 123 8.211 7.156 1.055 1
1 1424 . 12 1 1 A 123 123 ASN HA H 123 4.737 4.997 -0.260 1
1 1429 . 12 1 1 A 123 123 ASN C C 123 174.709 174.614 0.095 1
1 1430 . 12 1 1 A 123 123 ASN CA C 123 53.507 51.722 1.785 1
1 1431 . 12 1 1 A 123 123 ASN CB C 123 38.800 41.727 -2.927 1
1 1432 . 12 1 1 A 123 123 ASN N N 123 119.923 119.132 0.791 1
1 1434 . 12 1 1 A 124 124 ARG H H 124 7.997 9.004 -1.007 1
1 1435 . 12 1 1 A 124 124 ARG HA H 124 4.305 3.922 0.383 1
1 1442 . 12 1 1 A 124 124 ARG C C 124 175.477 178.624 -3.147 1
1 1443 . 12 1 1 A 124 124 ARG CA C 124 56.709 59.527 -2.818 1
1 1444 . 12 1 1 A 124 124 ARG CB C 124 30.584 29.829 0.755 1
1 1447 . 12 1 1 A 124 124 ARG N N 124 120.821 123.593 -2.772 1
1 1448 . 12 1 1 A 125 125 LYS H H 125 8.327 7.627 0.700 1
1 1449 . 12 1 1 A 125 125 LYS HA H 125 4.254 4.037 0.217 1
1 1458 . 12 1 1 A 125 125 LYS C C 125 176.777 175.919 0.858 1
1 1459 . 12 1 1 A 125 125 LYS CA C 125 56.860 58.870 -2.010 1
1 1460 . 12 1 1 A 125 125 LYS CB C 125 32.879 32.995 -0.116 1
1 1464 . 12 1 1 A 125 125 LYS N N 125 121.891 119.189 2.702 1
1 1465 . 12 1 1 A 126 126 ASP H H 126 8.343 7.617 0.726 1
1 1466 . 12 1 1 A 126 126 ASP HA H 126 4.581 4.940 -0.359 1
1 1469 . 12 1 1 A 126 126 ASP C C 126 176.538 174.139 2.399 1
1 1470 . 12 1 1 A 126 126 ASP CA C 126 54.540 53.998 0.542 1
1 1471 . 12 1 1 A 126 126 ASP CB C 126 40.907 43.593 -2.686 1
1 1472 . 12 1 1 A 126 126 ASP N N 126 119.814 118.286 1.528 1
1 1473 . 12 1 1 A 127 127 LEU H H 127 7.946 8.776 -0.830 1
1 1474 . 12 1 1 A 127 127 LEU HA H 127 4.309 4.844 -0.535 1
1 1484 . 12 1 1 A 127 127 LEU C C 127 176.043 175.631 0.412 1
1 1485 . 12 1 1 A 127 127 LEU CA C 127 55.427 53.750 1.677 1
1 1486 . 12 1 1 A 127 127 LEU CB C 127 42.394 44.941 -2.547 1
1 1490 . 12 1 1 A 127 127 LEU N N 127 121.432 122.369 -0.937 1
1 1491 . 12 1 1 A 128 128 ILE H H 128 7.967 8.363 -0.396 1
1 1492 . 12 1 1 A 128 128 ILE HA H 128 4.141 4.089 0.052 1
1 1502 . 12 1 1 A 128 128 ILE C C 128 177.200 175.784 1.416 1
1 1503 . 12 1 1 A 128 128 ILE CA C 128 61.150 61.089 0.061 1
1 1504 . 12 1 1 A 128 128 ILE CB C 128 38.489 38.913 -0.424 1
1 1508 . 12 1 1 A 128 128 ILE N N 128 121.579 118.175 3.404 1
1 1509 . 12 1 1 A 129 129 LYS H H 129 8.331 8.919 -0.588 1
1 1510 . 12 1 1 A 129 129 LYS HA H 129 4.328 4.848 -0.520 1
1 1519 . 12 1 1 A 129 129 LYS C C 129 175.952 176.313 -0.361 1
1 1520 . 12 1 1 A 129 129 LYS CA C 129 56.330 54.038 2.292 1
1 1521 . 12 1 1 A 129 129 LYS CB C 129 33.010 36.757 -3.747 1
1 1525 . 12 1 1 A 129 129 LYS N N 129 126.955 121.548 5.407 1
1 1 . 13 1 1 A 2 2 ALA HA H 2 4.070 3.823 0.247 1
1 5 . 13 1 1 A 2 2 ALA CA C 2 52.067 53.351 -1.284 1
1 6 . 13 1 1 A 2 2 ALA CB C 2 19.577 17.340 2.237 1
1 7 . 13 1 1 A 3 3 ALA H H 3 8.714 7.950 0.764 1
1 8 . 13 1 1 A 3 3 ALA HA H 3 4.253 4.333 -0.080 1
1 12 . 13 1 1 A 3 3 ALA C C 3 173.672 177.786 -4.114 1
1 13 . 13 1 1 A 3 3 ALA CA C 3 52.067 51.562 0.505 1
1 14 . 13 1 1 A 3 3 ALA CB C 3 19.577 20.919 -1.342 1
1 15 . 13 1 1 A 3 3 ALA N N 3 124.480 118.185 6.295 1
1 16 . 13 1 1 A 4 4 LYS H H 4 8.227 8.405 -0.178 1
1 17 . 13 1 1 A 4 4 LYS HA H 4 3.976 3.777 0.199 1
1 26 . 13 1 1 A 4 4 LYS C C 4 176.672 176.374 0.298 1
1 27 . 13 1 1 A 4 4 LYS CA C 4 57.274 58.799 -1.525 1
1 28 . 13 1 1 A 4 4 LYS CB C 4 33.209 32.233 0.976 1
1 32 . 13 1 1 A 4 4 LYS N N 4 120.988 119.188 1.800 1
1 33 . 13 1 1 A 5 5 PHE H H 5 7.719 7.731 -0.012 1
1 34 . 13 1 1 A 5 5 PHE HA H 5 4.384 5.271 -0.887 1
1 38 . 13 1 1 A 5 5 PHE C C 5 175.364 174.759 0.605 1
1 39 . 13 1 1 A 5 5 PHE CA C 5 57.074 56.449 0.625 1
1 40 . 13 1 1 A 5 5 PHE CB C 5 39.669 42.875 -3.206 1
1 41 . 13 1 1 A 5 5 PHE N N 5 119.246 115.098 4.148 1
1 42 . 13 1 1 A 6 6 GLU H H 6 8.515 8.915 -0.400 1
1 43 . 13 1 1 A 6 6 GLU HA H 6 4.370 4.987 -0.617 1
1 48 . 13 1 1 A 6 6 GLU CA C 6 55.669 54.487 1.182 1
1 49 . 13 1 1 A 6 6 GLU CB C 6 32.094 33.953 -1.859 1
1 51 . 13 1 1 A 6 6 GLU N N 6 122.193 120.348 1.845 1
1 52 . 13 1 1 A 7 7 VAL H H 7 8.636 8.470 0.166 1
1 53 . 13 1 1 A 7 7 VAL HA H 7 3.406 3.951 -0.545 1
1 61 . 13 1 1 A 7 7 VAL C C 7 176.611 176.387 0.224 1
1 62 . 13 1 1 A 7 7 VAL CA C 7 65.358 63.528 1.830 1
1 63 . 13 1 1 A 7 7 VAL CB C 7 31.391 31.357 0.034 1
1 66 . 13 1 1 A 7 7 VAL N N 7 122.949 121.993 0.956 1
1 67 . 13 1 1 A 8 8 GLY H H 8 9.394 9.099 0.295 1
1 68 . 13 1 1 A 8 8 GLY HA2 H 8 3.600 4.066 -0.466 1
1 69 . 13 1 1 A 8 8 GLY HA3 H 8 4.546 4.067 0.479 1
1 70 . 13 1 1 A 8 8 GLY C C 8 178.074 174.352 3.722 1
1 71 . 13 1 1 A 8 8 GLY CA C 8 45.121 44.909 0.212 1
1 72 . 13 1 1 A 8 8 GLY N N 8 116.837 115.354 1.483 1
1 73 . 13 1 1 A 9 9 SER H H 9 8.021 8.108 -0.087 1
1 74 . 13 1 1 A 9 9 SER HA H 9 4.680 4.508 0.172 1
1 77 . 13 1 1 A 9 9 SER C C 9 174.234 173.188 1.046 1
1 78 . 13 1 1 A 9 9 SER CA C 9 59.387 59.362 0.025 1
1 79 . 13 1 1 A 9 9 SER CB C 9 65.584 64.621 0.963 1
1 80 . 13 1 1 A 9 9 SER N N 9 118.208 117.981 0.227 1
1 81 . 13 1 1 A 10 10 VAL H H 10 7.945 8.629 -0.684 1
1 82 . 13 1 1 A 10 10 VAL HA H 10 4.980 5.231 -0.251 1
1 90 . 13 1 1 A 10 10 VAL C C 10 171.388 174.333 -2.945 1
1 91 . 13 1 1 A 10 10 VAL CA C 10 61.021 61.017 0.004 1
1 92 . 13 1 1 A 10 10 VAL CB C 10 33.400 34.661 -1.261 1
1 95 . 13 1 1 A 10 10 VAL N N 10 121.118 122.560 -1.442 1
1 96 . 13 1 1 A 11 11 TYR H H 11 9.008 9.226 -0.218 1
1 97 . 13 1 1 A 11 11 TYR HA H 11 4.850 5.328 -0.478 1
1 101 . 13 1 1 A 11 11 TYR C C 11 174.926 174.706 0.220 1
1 102 . 13 1 1 A 11 11 TYR CA C 11 56.803 56.163 0.640 1
1 103 . 13 1 1 A 11 11 TYR CB C 11 43.676 43.530 0.146 1
1 104 . 13 1 1 A 11 11 TYR N N 11 125.043 125.498 -0.455 1
1 105 . 13 1 1 A 12 12 THR H H 12 8.809 8.681 0.128 1
1 106 . 13 1 1 A 12 12 THR HA H 12 5.020 5.346 -0.326 1
1 111 . 13 1 1 A 12 12 THR C C 12 174.195 174.615 -0.420 1
1 112 . 13 1 1 A 12 12 THR CA C 12 62.487 60.039 2.448 1
1 113 . 13 1 1 A 12 12 THR CB C 12 69.743 71.531 -1.788 1
1 115 . 13 1 1 A 12 12 THR N N 12 116.850 115.292 1.558 1
1 116 . 13 1 1 A 13 13 GLY H H 13 9.179 8.619 0.560 1
1 117 . 13 1 1 A 13 13 GLY HA2 H 13 3.250 4.377 -1.127 1
1 118 . 13 1 1 A 13 13 GLY HA3 H 13 4.801 4.395 0.406 1
1 119 . 13 1 1 A 13 13 GLY C C 13 174.654 171.932 2.722 1
1 120 . 13 1 1 A 13 13 GLY CA C 13 44.377 45.396 -1.019 1
1 121 . 13 1 1 A 13 13 GLY N N 13 113.654 111.733 1.921 1
1 122 . 13 1 1 A 14 14 LYS H H 14 7.770 8.581 -0.811 1
1 123 . 13 1 1 A 14 14 LYS HA H 14 5.426 5.123 0.303 1
1 132 . 13 1 1 A 14 14 LYS C C 14 171.343 175.801 -4.458 1
1 133 . 13 1 1 A 14 14 LYS CA C 14 53.879 54.580 -0.701 1
1 134 . 13 1 1 A 14 14 LYS CB C 14 36.032 35.623 0.409 1
1 138 . 13 1 1 A 14 14 LYS N N 14 118.322 120.383 -2.061 1
1 139 . 13 1 1 A 15 15 VAL H H 15 9.206 9.247 -0.041 1
1 140 . 13 1 1 A 15 15 VAL HA H 15 4.400 4.253 0.147 1
1 148 . 13 1 1 A 15 15 VAL C C 15 176.306 176.862 -0.556 1
1 149 . 13 1 1 A 15 15 VAL CA C 15 63.648 63.358 0.290 1
1 150 . 13 1 1 A 15 15 VAL CB C 15 31.769 31.466 0.303 1
1 153 . 13 1 1 A 15 15 VAL N N 15 125.308 123.586 1.722 1
1 154 . 13 1 1 A 16 16 THR H H 16 9.403 9.124 0.279 1
1 155 . 13 1 1 A 16 16 THR HA H 16 4.562 4.658 -0.096 1
1 160 . 13 1 1 A 16 16 THR C C 16 178.098 174.739 3.359 1
1 161 . 13 1 1 A 16 16 THR CA C 16 62.018 61.934 0.084 1
1 162 . 13 1 1 A 16 16 THR CB C 16 69.720 69.795 -0.075 1
1 164 . 13 1 1 A 16 16 THR N N 16 121.753 117.986 3.767 1
1 165 . 13 1 1 A 17 17 GLY H H 17 7.600 7.031 0.569 1
1 166 . 13 1 1 A 17 17 GLY HA2 H 17 4.110 4.118 -0.008 1
1 167 . 13 1 1 A 17 17 GLY HA3 H 17 4.250 4.189 0.061 1
1 168 . 13 1 1 A 17 17 GLY C C 17 175.551 171.455 4.096 1
1 169 . 13 1 1 A 17 17 GLY CA C 17 46.258 45.503 0.755 1
1 170 . 13 1 1 A 17 17 GLY N N 17 109.407 108.696 0.711 1
1 171 . 13 1 1 A 18 18 LEU H H 18 8.820 8.548 0.272 1
1 172 . 13 1 1 A 18 18 LEU HA H 18 4.852 5.154 -0.302 1
1 182 . 13 1 1 A 18 18 LEU CA C 18 54.245 53.278 0.967 1
1 183 . 13 1 1 A 18 18 LEU CB C 18 44.906 45.496 -0.590 1
1 187 . 13 1 1 A 18 18 LEU N N 18 123.419 121.746 1.673 1
1 188 . 13 1 1 A 19 19 GLN H H 19 8.537 8.384 0.153 1
1 189 . 13 1 1 A 19 19 GLN HA H 19 4.520 4.643 -0.123 1
1 196 . 13 1 1 A 19 19 GLN C C 19 175.258 175.767 -0.509 1
1 197 . 13 1 1 A 19 19 GLN CA C 19 53.269 53.694 -0.425 1
1 198 . 13 1 1 A 19 19 GLN CB C 19 31.522 31.958 -0.436 1
1 200 . 13 1 1 A 19 19 GLN N N 19 120.187 121.223 -1.036 1
1 202 . 13 1 1 A 20 20 ALA H H 20 8.798 8.652 0.146 1
1 203 . 13 1 1 A 20 20 ALA HA H 20 4.010 4.013 -0.003 1
1 207 . 13 1 1 A 20 20 ALA C C 20 175.698 177.206 -1.508 1
1 208 . 13 1 1 A 20 20 ALA CA C 20 55.084 54.264 0.820 1
1 209 . 13 1 1 A 20 20 ALA CB C 20 18.277 18.621 -0.344 1
1 210 . 13 1 1 A 20 20 ALA N N 20 120.606 123.773 -3.167 1
1 211 . 13 1 1 A 21 21 TYR H H 21 6.618 7.302 -0.684 1
1 212 . 13 1 1 A 21 21 TYR HA H 21 4.540 4.806 -0.266 1
1 216 . 13 1 1 A 21 21 TYR C C 21 178.437 175.031 3.406 1
1 217 . 13 1 1 A 21 21 TYR CA C 21 55.120 56.851 -1.731 1
1 218 . 13 1 1 A 21 21 TYR CB C 21 37.891 40.357 -2.466 1
1 219 . 13 1 1 A 21 21 TYR N N 21 105.570 113.603 -8.033 1
1 220 . 13 1 1 A 22 22 GLY H H 22 7.203 6.986 0.217 1
1 221 . 13 1 1 A 22 22 GLY HA2 H 22 3.460 3.936 -0.476 1
1 222 . 13 1 1 A 22 22 GLY HA3 H 22 4.360 3.945 0.415 1
1 223 . 13 1 1 A 22 22 GLY C C 22 175.833 171.238 4.595 1
1 224 . 13 1 1 A 22 22 GLY CA C 22 46.356 45.419 0.937 1
1 225 . 13 1 1 A 22 22 GLY N N 22 109.854 108.371 1.483 1
1 226 . 13 1 1 A 23 23 ALA H H 23 8.549 8.392 0.157 1
1 227 . 13 1 1 A 23 23 ALA HA H 23 4.981 5.205 -0.224 1
1 231 . 13 1 1 A 23 23 ALA C C 23 168.810 176.245 -7.435 1
1 232 . 13 1 1 A 23 23 ALA CA C 23 49.178 50.882 -1.704 1
1 233 . 13 1 1 A 23 23 ALA CB C 23 22.797 21.212 1.585 1
1 234 . 13 1 1 A 23 23 ALA N N 23 118.749 122.547 -3.798 1
1 235 . 13 1 1 A 24 24 PHE H H 24 8.812 8.756 0.056 1
1 236 . 13 1 1 A 24 24 PHE HA H 24 5.125 4.820 0.305 1
1 240 . 13 1 1 A 24 24 PHE CA C 24 58.017 58.227 -0.210 1
1 241 . 13 1 1 A 24 24 PHE CB C 24 40.475 40.670 -0.195 1
1 242 . 13 1 1 A 24 24 PHE N N 24 122.891 121.967 0.924 1
1 243 . 13 1 1 A 25 25 VAL H H 25 8.880 8.873 0.007 1
1 244 . 13 1 1 A 25 25 VAL HA H 25 4.660 4.708 -0.048 1
1 252 . 13 1 1 A 25 25 VAL CA C 25 60.379 61.116 -0.737 1
1 253 . 13 1 1 A 25 25 VAL CB C 25 35.654 35.132 0.522 1
1 256 . 13 1 1 A 25 25 VAL N N 25 122.908 121.202 1.706 1
1 257 . 13 1 1 A 26 26 ALA H H 26 9.403 8.845 0.558 1
1 258 . 13 1 1 A 26 26 ALA HA H 26 4.750 4.358 0.392 1
1 262 . 13 1 1 A 26 26 ALA C C 26 174.445 176.881 -2.436 1
1 263 . 13 1 1 A 26 26 ALA CA C 26 51.711 52.637 -0.926 1
1 264 . 13 1 1 A 26 26 ALA CB C 26 19.319 18.998 0.321 1
1 265 . 13 1 1 A 26 26 ALA N N 26 129.425 130.301 -0.876 1
1 266 . 13 1 1 A 27 27 LEU H H 27 8.601 9.151 -0.550 1
1 267 . 13 1 1 A 27 27 LEU HA H 27 4.158 4.613 -0.455 1
1 277 . 13 1 1 A 27 27 LEU C C 27 177.814 176.394 1.420 1
1 278 . 13 1 1 A 27 27 LEU CA C 27 55.869 55.650 0.219 1
1 279 . 13 1 1 A 27 27 LEU CB C 27 42.251 43.666 -1.415 1
1 283 . 13 1 1 A 27 27 LEU N N 27 127.169 122.275 4.894 1
1 284 . 13 1 1 A 28 28 ASP H H 28 8.172 7.922 0.250 1
1 285 . 13 1 1 A 28 28 ASP HA H 28 4.420 4.972 -0.552 1
1 288 . 13 1 1 A 28 28 ASP C C 28 177.116 175.443 1.673 1
1 289 . 13 1 1 A 28 28 ASP CA C 28 53.755 53.250 0.505 1
1 290 . 13 1 1 A 28 28 ASP CB C 28 39.833 43.979 -4.146 1
1 291 . 13 1 1 A 28 28 ASP N N 28 115.657 117.165 -1.508 1
1 292 . 13 1 1 A 29 29 GLU H H 29 8.857 8.653 0.204 1
1 293 . 13 1 1 A 29 29 GLU HA H 29 4.090 4.107 -0.017 1
1 298 . 13 1 1 A 29 29 GLU C C 29 175.965 176.791 -0.826 1
1 299 . 13 1 1 A 29 29 GLU CA C 29 59.470 59.015 0.455 1
1 300 . 13 1 1 A 29 29 GLU CB C 29 29.409 29.418 -0.009 1
1 302 . 13 1 1 A 29 29 GLU N N 29 114.738 123.034 -8.296 1
1 303 . 13 1 1 A 30 30 GLU H H 30 8.326 7.972 0.354 1
1 304 . 13 1 1 A 30 30 GLU HA H 30 4.640 4.569 0.071 1
1 309 . 13 1 1 A 30 30 GLU C C 30 176.817 175.286 1.531 1
1 310 . 13 1 1 A 30 30 GLU CA C 30 56.073 55.970 0.103 1
1 311 . 13 1 1 A 30 30 GLU CB C 30 32.453 31.239 1.214 1
1 313 . 13 1 1 A 30 30 GLU N N 30 115.753 117.376 -1.623 1
1 314 . 13 1 1 A 31 31 THR H H 31 7.819 7.448 0.371 1
1 315 . 13 1 1 A 31 31 THR HA H 31 4.484 5.092 -0.608 1
1 320 . 13 1 1 A 31 31 THR C C 31 176.330 173.074 3.256 1
1 321 . 13 1 1 A 31 31 THR CA C 31 63.398 61.092 2.306 1
1 322 . 13 1 1 A 31 31 THR CB C 31 69.367 72.823 -3.456 1
1 324 . 13 1 1 A 31 31 THR N N 31 118.750 115.478 3.272 1
1 325 . 13 1 1 A 32 32 GLN H H 32 8.913 8.748 0.165 1
1 326 . 13 1 1 A 32 32 GLN HA H 32 5.337 4.789 0.548 1
1 333 . 13 1 1 A 32 32 GLN C C 32 173.087 174.478 -1.391 1
1 334 . 13 1 1 A 32 32 GLN CA C 32 54.051 54.981 -0.930 1
1 335 . 13 1 1 A 32 32 GLN CB C 32 32.672 32.970 -0.298 1
1 337 . 13 1 1 A 32 32 GLN N N 32 127.294 124.880 2.414 1
1 339 . 13 1 1 A 33 33 GLY H H 33 8.900 8.449 0.451 1
1 340 . 13 1 1 A 33 33 GLY HA2 H 33 3.290 4.351 -1.061 1
1 341 . 13 1 1 A 33 33 GLY HA3 H 33 4.530 4.421 0.109 1
1 342 . 13 1 1 A 33 33 GLY C C 33 174.918 172.336 2.582 1
1 343 . 13 1 1 A 33 33 GLY CA C 33 44.534 45.198 -0.664 1
1 344 . 13 1 1 A 33 33 GLY N N 33 107.639 110.630 -2.991 1
1 345 . 13 1 1 A 34 34 LEU H H 34 8.127 8.387 -0.260 1
1 346 . 13 1 1 A 34 34 LEU HA H 34 4.950 4.881 0.069 1
1 356 . 13 1 1 A 34 34 LEU CA C 34 53.755 53.968 -0.213 1
1 357 . 13 1 1 A 34 34 LEU CB C 34 45.493 45.282 0.211 1
1 361 . 13 1 1 A 34 34 LEU N N 34 120.897 121.037 -0.140 1
1 362 . 13 1 1 A 35 35 VAL H H 35 9.386 8.949 0.437 1
1 363 . 13 1 1 A 35 35 VAL HA H 35 4.479 4.407 0.072 1
1 371 . 13 1 1 A 35 35 VAL C C 35 176.402 175.886 0.516 1
1 372 . 13 1 1 A 35 35 VAL CA C 35 59.594 62.937 -3.343 1
1 373 . 13 1 1 A 35 35 VAL CB C 35 32.590 31.589 1.001 1
1 376 . 13 1 1 A 35 35 VAL N N 35 128.897 127.781 1.116 1
1 377 . 13 1 1 A 36 36 HIS H H 36 9.194 8.403 0.791 1
1 378 . 13 1 1 A 36 36 HIS HA H 36 4.487 4.594 -0.107 1
1 381 . 13 1 1 A 36 36 HIS C C 36 174.864 176.370 -1.506 1
1 382 . 13 1 1 A 36 36 HIS CA C 36 59.426 56.874 2.552 1
1 383 . 13 1 1 A 36 36 HIS CB C 36 31.542 30.659 0.883 1
1 384 . 13 1 1 A 36 36 HIS N N 36 127.751 127.025 0.726 1
1 385 . 13 1 1 A 37 37 ILE H H 37 7.454 8.345 -0.891 1
1 386 . 13 1 1 A 37 37 ILE HA H 37 3.810 3.568 0.242 1
1 396 . 13 1 1 A 37 37 ILE C C 37 176.948 177.700 -0.752 1
1 397 . 13 1 1 A 37 37 ILE CA C 37 63.773 64.665 -0.892 1
1 398 . 13 1 1 A 37 37 ILE CB C 37 38.993 37.275 1.718 1
1 402 . 13 1 1 A 37 37 ILE N N 37 126.266 126.933 -0.667 1
1 403 . 13 1 1 A 38 38 SER H H 38 8.343 7.528 0.815 1
1 404 . 13 1 1 A 38 38 SER HA H 38 4.370 4.199 0.171 1
1 407 . 13 1 1 A 38 38 SER C C 38 174.792 174.850 -0.058 1
1 408 . 13 1 1 A 38 38 SER CA C 38 60.567 60.859 -0.292 1
1 409 . 13 1 1 A 38 38 SER CB C 38 63.632 62.825 0.807 1
1 410 . 13 1 1 A 38 38 SER N N 38 118.079 117.940 0.139 1
1 411 . 13 1 1 A 39 39 GLU H H 39 8.536 7.836 0.700 1
1 412 . 13 1 1 A 39 39 GLU HA H 39 4.503 4.599 -0.096 1
1 417 . 13 1 1 A 39 39 GLU C C 39 175.131 176.802 -1.671 1
1 418 . 13 1 1 A 39 39 GLU CA C 39 54.928 56.189 -1.261 1
1 419 . 13 1 1 A 39 39 GLU CB C 39 29.621 30.359 -0.738 1
1 421 . 13 1 1 A 39 39 GLU N N 39 118.349 118.719 -0.370 1
1 422 . 13 1 1 A 40 40 VAL H H 40 7.776 7.756 0.020 1
1 423 . 13 1 1 A 40 40 VAL HA H 40 3.616 3.898 -0.282 1
1 431 . 13 1 1 A 40 40 VAL C C 40 177.277 176.191 1.086 1
1 432 . 13 1 1 A 40 40 VAL CA C 40 66.245 64.559 1.686 1
1 433 . 13 1 1 A 40 40 VAL CB C 40 32.590 32.020 0.570 1
1 436 . 13 1 1 A 40 40 VAL N N 40 125.443 117.817 7.626 1
1 437 . 13 1 1 A 41 41 THR H H 41 7.888 7.716 0.172 1
1 438 . 13 1 1 A 41 41 THR HA H 41 4.345 5.026 -0.681 1
1 443 . 13 1 1 A 41 41 THR C C 41 173.492 173.248 0.244 1
1 444 . 13 1 1 A 41 41 THR CA C 41 59.047 61.575 -2.528 1
1 445 . 13 1 1 A 41 41 THR CB C 41 68.992 72.793 -3.801 1
1 447 . 13 1 1 A 41 41 THR N N 41 109.905 113.743 -3.838 1
1 448 . 13 1 1 A 42 42 HIS H H 42 8.063 8.795 -0.732 1
1 449 . 13 1 1 A 42 42 HIS HA H 42 4.510 4.725 -0.215 1
1 452 . 13 1 1 A 42 42 HIS C C 42 172.139 173.818 -1.679 1
1 453 . 13 1 1 A 42 42 HIS CA C 42 57.735 54.981 2.754 1
1 454 . 13 1 1 A 42 42 HIS CB C 42 31.144 27.962 3.182 1
1 455 . 13 1 1 A 42 42 HIS N N 42 121.760 125.686 -3.926 1
1 456 . 13 1 1 A 43 43 GLY H H 43 8.286 7.417 0.869 1
1 457 . 13 1 1 A 43 43 GLY HA2 H 43 3.980 3.938 0.042 1
1 458 . 13 1 1 A 43 43 GLY HA3 H 43 3.980 4.082 -0.102 1
1 459 . 13 1 1 A 43 43 GLY C C 43 176.307 171.720 4.587 1
1 460 . 13 1 1 A 43 43 GLY CA C 43 44.336 45.997 -1.661 1
1 461 . 13 1 1 A 43 43 GLY N N 43 110.133 108.956 1.177 1
1 462 . 13 1 1 A 44 44 PHE H H 44 8.327 8.405 -0.078 1
1 463 . 13 1 1 A 44 44 PHE HA H 44 4.489 4.473 0.016 1
1 467 . 13 1 1 A 44 44 PHE C C 44 171.877 175.921 -4.044 1
1 468 . 13 1 1 A 44 44 PHE CA C 44 58.027 58.608 -0.581 1
1 469 . 13 1 1 A 44 44 PHE CB C 44 39.850 39.911 -0.061 1
1 470 . 13 1 1 A 44 44 PHE N N 44 120.049 120.796 -0.747 1
1 471 . 13 1 1 A 45 45 VAL H H 45 7.939 8.447 -0.508 1
1 472 . 13 1 1 A 45 45 VAL HA H 45 3.865 3.428 0.437 1
1 480 . 13 1 1 A 45 45 VAL C C 45 175.523 175.949 -0.426 1
1 481 . 13 1 1 A 45 45 VAL CA C 45 61.536 61.044 0.492 1
1 482 . 13 1 1 A 45 45 VAL CB C 45 33.127 32.179 0.948 1
1 485 . 13 1 1 A 45 45 VAL N N 45 127.882 121.287 6.595 1
1 486 . 13 1 1 A 46 46 LYS H H 46 8.868 8.497 0.371 1
1 487 . 13 1 1 A 46 46 LYS HA H 46 4.170 4.025 0.145 1
1 496 . 13 1 1 A 46 46 LYS C C 46 175.728 175.567 0.161 1
1 497 . 13 1 1 A 46 46 LYS CA C 46 57.198 58.772 -1.574 1
1 498 . 13 1 1 A 46 46 LYS CB C 46 33.299 32.925 0.374 1
1 502 . 13 1 1 A 46 46 LYS N N 46 127.308 129.068 -1.760 1
1 503 . 13 1 1 A 47 47 ASP H H 47 7.652 7.933 -0.281 1
1 504 . 13 1 1 A 47 47 ASP HA H 47 4.710 4.926 -0.216 1
1 507 . 13 1 1 A 47 47 ASP C C 47 176.411 176.104 0.307 1
1 508 . 13 1 1 A 47 47 ASP CA C 47 53.390 53.900 -0.510 1
1 509 . 13 1 1 A 47 47 ASP CB C 47 42.635 43.850 -1.215 1
1 510 . 13 1 1 A 47 47 ASP N N 47 117.932 117.765 0.167 1
1 511 . 13 1 1 A 48 48 ILE H H 48 9.230 8.653 0.577 1
1 512 . 13 1 1 A 48 48 ILE HA H 48 3.579 3.932 -0.353 1
1 522 . 13 1 1 A 48 48 ILE C C 48 177.249 177.579 -0.330 1
1 523 . 13 1 1 A 48 48 ILE CA C 48 65.525 63.640 1.885 1
1 524 . 13 1 1 A 48 48 ILE CB C 48 38.797 37.683 1.114 1
1 528 . 13 1 1 A 48 48 ILE N N 48 129.049 125.479 3.570 1
1 529 . 13 1 1 A 49 49 ASN H H 49 8.468 8.926 -0.458 1
1 530 . 13 1 1 A 49 49 ASN HA H 49 4.690 4.597 0.093 1
1 535 . 13 1 1 A 49 49 ASN C C 49 175.779 176.708 -0.929 1
1 536 . 13 1 1 A 49 49 ASN CA C 49 55.587 54.942 0.645 1
1 537 . 13 1 1 A 49 49 ASN CB C 49 38.587 36.962 1.625 1
1 538 . 13 1 1 A 49 49 ASN N N 49 118.835 118.193 0.642 1
1 540 . 13 1 1 A 50 50 GLU H H 50 7.853 8.114 -0.261 1
1 541 . 13 1 1 A 50 50 GLU HA H 50 4.040 4.251 -0.211 1
1 546 . 13 1 1 A 50 50 GLU C C 50 176.148 177.292 -1.144 1
1 547 . 13 1 1 A 50 50 GLU CA C 50 57.404 57.390 0.014 1
1 548 . 13 1 1 A 50 50 GLU CB C 50 29.491 29.564 -0.073 1
1 550 . 13 1 1 A 50 50 GLU N N 50 116.358 118.264 -1.906 1
1 551 . 13 1 1 A 51 51 HIS H H 51 7.575 7.872 -0.297 1
1 552 . 13 1 1 A 51 51 HIS HA H 51 4.431 4.730 -0.299 1
1 555 . 13 1 1 A 51 51 HIS C C 51 176.383 174.877 1.506 1
1 556 . 13 1 1 A 51 51 HIS CA C 51 57.089 56.711 0.378 1
1 557 . 13 1 1 A 51 51 HIS CB C 51 33.168 32.143 1.025 1
1 558 . 13 1 1 A 51 51 HIS N N 51 115.828 115.584 0.244 1
1 559 . 13 1 1 A 52 52 LEU H H 52 7.640 7.581 0.059 1
1 560 . 13 1 1 A 52 52 LEU HA H 52 4.796 4.663 0.133 1
1 570 . 13 1 1 A 52 52 LEU C C 52 174.452 174.455 -0.003 1
1 571 . 13 1 1 A 52 52 LEU CA C 52 53.398 54.063 -0.665 1
1 572 . 13 1 1 A 52 52 LEU CB C 52 48.805 45.544 3.261 1
1 576 . 13 1 1 A 52 52 LEU N N 52 117.932 120.147 -2.215 1
1 577 . 13 1 1 A 53 53 SER H H 53 8.151 8.654 -0.503 1
1 578 . 13 1 1 A 53 53 SER HA H 53 4.680 4.975 -0.295 1
1 581 . 13 1 1 A 53 53 SER C C 53 174.304 173.232 1.072 1
1 582 . 13 1 1 A 53 53 SER CA C 53 56.714 57.509 -0.795 1
1 583 . 13 1 1 A 53 53 SER CB C 53 65.431 66.529 -1.098 1
1 584 . 13 1 1 A 53 53 SER N N 53 113.496 116.882 -3.386 1
1 585 . 13 1 1 A 54 54 VAL H H 54 8.782 8.518 0.264 1
1 586 . 13 1 1 A 54 54 VAL HA H 54 3.230 3.678 -0.448 1
1 594 . 13 1 1 A 54 54 VAL C C 54 173.745 177.465 -3.720 1
1 595 . 13 1 1 A 54 54 VAL CA C 54 66.232 64.872 1.360 1
1 596 . 13 1 1 A 54 54 VAL CB C 54 31.067 31.793 -0.726 1
1 599 . 13 1 1 A 54 54 VAL N N 54 124.401 125.560 -1.159 1
1 600 . 13 1 1 A 55 55 GLY H H 55 9.079 9.084 -0.005 1
1 601 . 13 1 1 A 55 55 GLY HA2 H 55 3.530 3.856 -0.326 1
1 602 . 13 1 1 A 55 55 GLY HA3 H 55 4.553 3.858 0.695 1
1 603 . 13 1 1 A 55 55 GLY C C 55 177.219 173.273 3.946 1
1 604 . 13 1 1 A 55 55 GLY CA C 55 44.647 46.262 -1.615 1
1 605 . 13 1 1 A 55 55 GLY N N 55 117.320 114.393 2.927 1
1 606 . 13 1 1 A 56 56 ASP H H 56 7.943 7.791 0.152 1
1 607 . 13 1 1 A 56 56 ASP HA H 56 4.460 5.090 -0.630 1
1 610 . 13 1 1 A 56 56 ASP C C 56 176.055 173.915 2.140 1
1 611 . 13 1 1 A 56 56 ASP CA C 56 55.456 52.355 3.101 1
1 612 . 13 1 1 A 56 56 ASP CB C 56 40.914 44.489 -3.575 1
1 613 . 13 1 1 A 56 56 ASP N N 56 121.782 119.771 2.011 1
1 614 . 13 1 1 A 57 57 GLU H H 57 8.649 8.796 -0.147 1
1 615 . 13 1 1 A 57 57 GLU HA H 57 5.100 5.193 -0.093 1
1 620 . 13 1 1 A 57 57 GLU C C 57 175.635 175.884 -0.249 1
1 621 . 13 1 1 A 57 57 GLU CA C 57 55.805 55.504 0.301 1
1 622 . 13 1 1 A 57 57 GLU CB C 57 30.915 31.328 -0.413 1
1 624 . 13 1 1 A 57 57 GLU N N 57 122.513 123.760 -1.247 1
1 625 . 13 1 1 A 58 58 VAL H H 58 8.809 9.071 -0.262 1
1 626 . 13 1 1 A 58 58 VAL HA H 58 4.817 4.822 -0.005 1
1 634 . 13 1 1 A 58 58 VAL C C 58 176.528 174.227 2.301 1
1 635 . 13 1 1 A 58 58 VAL CA C 58 58.719 59.200 -0.481 1
1 636 . 13 1 1 A 58 58 VAL CB C 58 35.523 36.018 -0.495 1
1 639 . 13 1 1 A 58 58 VAL N N 58 118.382 119.585 -1.203 1
1 640 . 13 1 1 A 59 59 GLN H H 59 8.255 8.528 -0.273 1
1 641 . 13 1 1 A 59 59 GLN HA H 59 5.030 5.026 0.004 1
1 646 . 13 1 1 A 59 59 GLN CA C 59 54.843 55.063 -0.220 1
1 647 . 13 1 1 A 59 59 GLN CB C 59 30.111 29.658 0.453 1
1 649 . 13 1 1 A 59 59 GLN N N 59 120.933 121.630 -0.697 1
1 650 . 13 1 1 A 60 60 VAL H H 60 8.970 9.348 -0.378 1
1 651 . 13 1 1 A 60 60 VAL HA H 60 4.990 5.014 -0.024 1
1 659 . 13 1 1 A 60 60 VAL C C 60 175.203 173.983 1.220 1
1 660 . 13 1 1 A 60 60 VAL CA C 60 57.404 59.054 -1.650 1
1 661 . 13 1 1 A 60 60 VAL CB C 60 35.771 35.429 0.342 1
1 664 . 13 1 1 A 60 60 VAL N N 60 111.046 118.201 -7.155 1
1 665 . 13 1 1 A 61 61 LYS H H 61 8.937 8.751 0.186 1
1 666 . 13 1 1 A 61 61 LYS HA H 61 5.100 4.930 0.170 1
1 675 . 13 1 1 A 61 61 LYS C C 61 173.610 176.346 -2.736 1
1 676 . 13 1 1 A 61 61 LYS CA C 61 53.762 54.847 -1.085 1
1 677 . 13 1 1 A 61 61 LYS CB C 61 36.273 34.510 1.763 1
1 681 . 13 1 1 A 61 61 LYS N N 61 121.930 123.630 -1.700 1
1 682 . 13 1 1 A 62 62 VAL H H 62 8.429 9.345 -0.916 1
1 683 . 13 1 1 A 62 62 VAL HA H 62 4.074 4.048 0.026 1
1 691 . 13 1 1 A 62 62 VAL C C 62 176.912 175.896 1.016 1
1 692 . 13 1 1 A 62 62 VAL CA C 62 63.188 63.690 -0.502 1
1 693 . 13 1 1 A 62 62 VAL CB C 62 30.813 31.342 -0.529 1
1 696 . 13 1 1 A 62 62 VAL N N 62 126.329 127.158 -0.829 1
1 697 . 13 1 1 A 63 63 LEU H H 63 9.109 9.127 -0.018 1
1 698 . 13 1 1 A 63 63 LEU HA H 63 4.423 4.473 -0.050 1
1 708 . 13 1 1 A 63 63 LEU C C 63 176.091 176.166 -0.075 1
1 709 . 13 1 1 A 63 63 LEU CA C 63 55.876 56.218 -0.342 1
1 710 . 13 1 1 A 63 63 LEU CB C 63 42.800 43.611 -0.811 1
1 714 . 13 1 1 A 63 63 LEU N N 63 129.436 129.938 -0.502 1
1 715 . 13 1 1 A 64 64 ALA H H 64 7.594 7.372 0.222 1
1 716 . 13 1 1 A 64 64 ALA HA H 64 4.455 4.740 -0.285 1
1 720 . 13 1 1 A 64 64 ALA C C 64 177.314 175.201 2.113 1
1 721 . 13 1 1 A 64 64 ALA CA C 64 52.557 51.631 0.926 1
1 722 . 13 1 1 A 64 64 ALA CB C 64 21.458 22.717 -1.259 1
1 723 . 13 1 1 A 64 64 ALA N N 64 117.791 118.587 -0.796 1
1 724 . 13 1 1 A 65 65 VAL H H 65 8.583 8.606 -0.023 1
1 725 . 13 1 1 A 65 65 VAL HA H 65 4.470 4.861 -0.391 1
1 733 . 13 1 1 A 65 65 VAL C C 65 174.697 174.862 -0.165 1
1 734 . 13 1 1 A 65 65 VAL CA C 65 61.936 60.591 1.345 1
1 735 . 13 1 1 A 65 65 VAL CB C 65 35.288 35.848 -0.560 1
1 738 . 13 1 1 A 65 65 VAL N N 65 120.009 119.997 0.012 1
1 739 . 13 1 1 A 66 66 ASP H H 66 8.567 8.947 -0.380 1
1 740 . 13 1 1 A 66 66 ASP HA H 66 4.880 4.996 -0.116 1
1 743 . 13 1 1 A 66 66 ASP C C 66 174.355 175.808 -1.453 1
1 744 . 13 1 1 A 66 66 ASP CA C 66 52.681 52.997 -0.316 1
1 745 . 13 1 1 A 66 66 ASP CB C 66 41.775 40.741 1.034 1
1 746 . 13 1 1 A 66 66 ASP N N 66 126.262 125.231 1.031 1
1 747 . 13 1 1 A 67 67 GLU H H 67 9.148 8.549 0.599 1
1 748 . 13 1 1 A 67 67 GLU HA H 67 4.110 4.116 -0.006 1
1 753 . 13 1 1 A 67 67 GLU C C 67 177.052 178.236 -1.184 1
1 754 . 13 1 1 A 67 67 GLU CA C 67 59.044 58.566 0.478 1
1 755 . 13 1 1 A 67 67 GLU CB C 67 29.919 28.929 0.990 1
1 757 . 13 1 1 A 67 67 GLU N N 67 125.480 123.873 1.607 1
1 758 . 13 1 1 A 68 68 GLU H H 68 8.384 7.979 0.405 1
1 759 . 13 1 1 A 68 68 GLU HA H 68 4.140 4.127 0.013 1
1 764 . 13 1 1 A 68 68 GLU C C 68 178.383 177.554 0.829 1
1 765 . 13 1 1 A 68 68 GLU CA C 68 59.044 59.045 -0.001 1
1 766 . 13 1 1 A 68 68 GLU CB C 68 29.919 29.289 0.630 1
1 768 . 13 1 1 A 68 68 GLU N N 68 119.760 119.028 0.732 1
1 769 . 13 1 1 A 69 69 LYS H H 69 7.799 7.699 0.100 1
1 770 . 13 1 1 A 69 69 LYS HA H 69 4.375 4.513 -0.138 1
1 779 . 13 1 1 A 69 69 LYS C C 69 178.297 176.953 1.344 1
1 780 . 13 1 1 A 69 69 LYS CA C 69 55.704 55.664 0.040 1
1 781 . 13 1 1 A 69 69 LYS CB C 69 33.622 34.253 -0.631 1
1 785 . 13 1 1 A 69 69 LYS N N 69 115.476 117.261 -1.785 1
1 786 . 13 1 1 A 70 70 GLY H H 70 7.994 7.820 0.174 1
1 787 . 13 1 1 A 70 70 GLY HA2 H 70 3.940 3.936 0.004 1
1 788 . 13 1 1 A 70 70 GLY HA3 H 70 3.960 3.944 0.016 1
1 789 . 13 1 1 A 70 70 GLY C C 70 177.215 174.257 2.958 1
1 790 . 13 1 1 A 70 70 GLY CA C 70 46.773 46.556 0.217 1
1 791 . 13 1 1 A 70 70 GLY N N 70 110.245 109.695 0.550 1
1 792 . 13 1 1 A 71 71 LYS H H 71 7.560 7.848 -0.288 1
1 793 . 13 1 1 A 71 71 LYS HA H 71 4.690 4.869 -0.179 1
1 802 . 13 1 1 A 71 71 LYS C C 71 174.607 175.582 -0.975 1
1 803 . 13 1 1 A 71 71 LYS CA C 71 55.332 54.315 1.017 1
1 804 . 13 1 1 A 71 71 LYS CB C 71 34.903 35.715 -0.812 1
1 808 . 13 1 1 A 71 71 LYS N N 71 118.201 118.750 -0.549 1
1 809 . 13 1 1 A 72 72 ILE H H 72 8.867 8.681 0.186 1
1 810 . 13 1 1 A 72 72 ILE HA H 72 4.630 4.895 -0.265 1
1 820 . 13 1 1 A 72 72 ILE C C 72 175.708 174.699 1.009 1
1 821 . 13 1 1 A 72 72 ILE CA C 72 61.494 60.139 1.355 1
1 822 . 13 1 1 A 72 72 ILE CB C 72 40.652 42.299 -1.647 1
1 826 . 13 1 1 A 72 72 ILE N N 72 126.827 121.827 5.000 1
1 827 . 13 1 1 A 73 73 SER H H 73 8.815 8.995 -0.180 1
1 828 . 13 1 1 A 73 73 SER HA H 73 5.110 5.284 -0.174 1
1 831 . 13 1 1 A 73 73 SER C C 73 175.122 173.047 2.075 1
1 832 . 13 1 1 A 73 73 SER CA C 73 57.487 57.618 -0.131 1
1 833 . 13 1 1 A 73 73 SER CB C 73 64.386 65.213 -0.827 1
1 834 . 13 1 1 A 73 73 SER N N 73 123.640 124.586 -0.946 1
1 835 . 13 1 1 A 74 74 LEU H H 74 8.585 8.943 -0.358 1
1 836 . 13 1 1 A 74 74 LEU HA H 74 5.450 5.290 0.160 1
1 846 . 13 1 1 A 74 74 LEU C C 74 174.061 175.967 -1.906 1
1 847 . 13 1 1 A 74 74 LEU CA C 74 53.101 53.507 -0.406 1
1 848 . 13 1 1 A 74 74 LEU CB C 74 48.268 46.915 1.353 1
1 852 . 13 1 1 A 74 74 LEU N N 74 125.221 123.992 1.229 1
1 853 . 13 1 1 A 75 75 SER H H 75 8.840 8.766 0.074 1
1 854 . 13 1 1 A 75 75 SER HA H 75 5.040 5.152 -0.112 1
1 857 . 13 1 1 A 75 75 SER C C 75 176.552 173.452 3.100 1
1 858 . 13 1 1 A 75 75 SER CA C 75 57.487 57.237 0.250 1
1 859 . 13 1 1 A 75 75 SER CB C 75 64.993 66.503 -1.510 1
1 860 . 13 1 1 A 75 75 SER N N 75 111.252 116.494 -5.242 1
1 861 . 13 1 1 A 76 76 ILE H H 76 7.790 8.966 -1.176 1
1 862 . 13 1 1 A 76 76 ILE HA H 76 4.690 4.478 0.212 1
1 872 . 13 1 1 A 76 76 ILE C C 76 175.780 177.385 -1.605 1
1 873 . 13 1 1 A 76 76 ILE CA C 76 63.631 61.955 1.676 1
1 874 . 13 1 1 A 76 76 ILE CB C 76 39.484 39.468 0.016 1
1 878 . 13 1 1 A 76 76 ILE N N 76 129.205 124.412 4.793 1
1 879 . 13 1 1 A 77 77 ARG H H 77 8.115 8.588 -0.473 1
1 880 . 13 1 1 A 77 77 ARG HA H 77 3.760 4.167 -0.407 1
1 887 . 13 1 1 A 77 77 ARG C C 77 178.704 178.259 0.445 1
1 888 . 13 1 1 A 77 77 ARG CA C 77 58.933 58.659 0.274 1
1 889 . 13 1 1 A 77 77 ARG CB C 77 29.463 29.751 -0.288 1
1 892 . 13 1 1 A 77 77 ARG N N 77 123.257 121.747 1.510 1
1 893 . 13 1 1 A 78 78 ALA H H 78 8.304 7.943 0.361 1
1 894 . 13 1 1 A 78 78 ALA HA H 78 4.296 4.222 0.074 1
1 898 . 13 1 1 A 78 78 ALA C C 78 176.870 179.064 -2.194 1
1 899 . 13 1 1 A 78 78 ALA CA C 78 53.548 54.932 -1.384 1
1 900 . 13 1 1 A 78 78 ALA CB C 78 19.872 18.256 1.616 1
1 901 . 13 1 1 A 78 78 ALA N N 78 118.764 121.625 -2.861 1
1 902 . 13 1 1 A 79 79 THR H H 79 7.931 7.774 0.157 1
1 903 . 13 1 1 A 79 79 THR HA H 79 4.370 4.336 0.034 1
1 908 . 13 1 1 A 79 79 THR C C 79 178.356 176.804 1.552 1
1 909 . 13 1 1 A 79 79 THR CA C 79 62.381 63.761 -1.380 1
1 910 . 13 1 1 A 79 79 THR CB C 79 69.693 69.405 0.288 1
1 912 . 13 1 1 A 79 79 THR N N 79 107.360 110.199 -2.839 1
1 913 . 13 1 1 A 80 80 GLN H H 80 7.651 8.113 -0.462 1
1 914 . 13 1 1 A 80 80 GLN HA H 80 4.527 4.019 0.508 1
1 921 . 13 1 1 A 80 80 GLN C C 80 174.249 176.369 -2.120 1
1 922 . 13 1 1 A 80 80 GLN CA C 80 54.760 58.796 -4.036 1
1 923 . 13 1 1 A 80 80 GLN CB C 80 30.565 28.428 2.137 1
1 925 . 13 1 1 A 80 80 GLN N N 80 121.588 121.676 -0.088 1
1 927 . 13 1 1 A 81 81 ALA H H 81 8.498 7.532 0.966 1
1 928 . 13 1 1 A 81 81 ALA HA H 81 4.252 4.222 0.030 1
1 932 . 13 1 1 A 81 81 ALA C C 81 175.693 176.272 -0.579 1
1 933 . 13 1 1 A 81 81 ALA CA C 81 52.345 54.117 -1.772 1
1 934 . 13 1 1 A 81 81 ALA CB C 81 19.062 17.738 1.324 1
1 935 . 13 1 1 A 81 81 ALA N N 81 126.423 122.309 4.114 1
1 936 . 13 1 1 A 82 82 ALA H H 82 8.324 8.054 0.270 1
1 937 . 13 1 1 A 82 82 ALA HA H 82 4.000 4.598 -0.598 1
1 941 . 13 1 1 A 82 82 ALA C C 82 177.065 176.642 0.423 1
1 942 . 13 1 1 A 82 82 ALA CA C 82 50.240 49.839 0.401 1
1 943 . 13 1 1 A 82 82 ALA CB C 82 17.650 21.531 -3.881 1
1 944 . 13 1 1 A 82 82 ALA N N 82 125.114 121.093 4.021 1
1 945 . 13 1 1 A 83 83 PRO HA H 83 4.350 4.231 0.119 1
1 952 . 13 1 1 A 83 83 PRO CA C 83 63.148 64.404 -1.256 1
1 953 . 13 1 1 A 83 83 PRO CB C 83 32.054 31.909 0.145 1
1 956 . 13 1 1 A 84 84 GLU H H 84 8.517 8.825 -0.308 1
1 957 . 13 1 1 A 84 84 GLU HA H 84 4.197 4.048 0.149 1
1 962 . 13 1 1 A 84 84 GLU C C 84 176.948 176.696 0.252 1
1 963 . 13 1 1 A 84 84 GLU CA C 84 56.674 58.185 -1.511 1
1 964 . 13 1 1 A 84 84 GLU CB C 84 30.459 29.633 0.826 1
1 966 . 13 1 1 A 84 84 GLU N N 84 121.479 118.366 3.113 1
1 967 . 13 1 1 A 85 85 LYS H H 85 8.381 7.546 0.835 1
1 968 . 13 1 1 A 85 85 LYS HA H 85 4.309 4.817 -0.508 1
1 977 . 13 1 1 A 85 85 LYS C C 85 176.457 175.275 1.182 1
1 978 . 13 1 1 A 85 85 LYS CA C 85 56.272 54.846 1.426 1
1 979 . 13 1 1 A 85 85 LYS CB C 85 32.961 35.344 -2.383 1
1 983 . 13 1 1 A 85 85 LYS N N 85 123.266 115.673 7.593 1
1 984 . 13 1 1 A 86 86 LYS H H 86 8.403 7.825 0.578 1
1 985 . 13 1 1 A 86 86 LYS HA H 86 4.308 4.150 0.158 1
1 994 . 13 1 1 A 86 86 LYS C C 86 176.435 176.240 0.195 1
1 995 . 13 1 1 A 86 86 LYS CA C 86 56.272 56.494 -0.222 1
1 996 . 13 1 1 A 86 86 LYS CB C 86 32.961 32.621 0.340 1
1 1000 . 13 1 1 A 86 86 LYS N N 86 123.688 119.129 4.559 1
1 1001 . 13 1 1 A 87 87 GLU H H 87 8.540 8.591 -0.051 1
1 1002 . 13 1 1 A 87 87 GLU HA H 87 4.358 4.152 0.206 1
1 1007 . 13 1 1 A 87 87 GLU C C 87 176.556 176.280 0.276 1
1 1008 . 13 1 1 A 87 87 GLU CA C 87 56.406 56.895 -0.489 1
1 1009 . 13 1 1 A 87 87 GLU CB C 87 30.607 29.771 0.836 1
1 1011 . 13 1 1 A 87 87 GLU N N 87 122.633 120.881 1.752 1
1 1012 . 13 1 1 A 88 88 SER H H 88 8.520 8.054 0.466 1
1 1013 . 13 1 1 A 88 88 SER HA H 88 4.490 4.494 -0.004 1
1 1016 . 13 1 1 A 88 88 SER C C 88 175.780 174.123 1.657 1
1 1017 . 13 1 1 A 88 88 SER CA C 88 58.431 59.092 -0.661 1
1 1018 . 13 1 1 A 88 88 SER CB C 88 63.858 64.002 -0.144 1
1 1019 . 13 1 1 A 88 88 SER N N 88 118.333 119.530 -1.197 1
1 1020 . 13 1 1 A 89 89 LYS H H 89 8.339 8.334 0.005 1
1 1021 . 13 1 1 A 89 89 LYS HA H 89 4.620 4.644 -0.024 1
1 1030 . 13 1 1 A 89 89 LYS C C 89 174.160 174.697 -0.537 1
1 1031 . 13 1 1 A 89 89 LYS CA C 89 54.265 52.893 1.372 1
1 1032 . 13 1 1 A 89 89 LYS CB C 89 32.672 36.485 -3.813 1
1 1036 . 13 1 1 A 89 89 LYS N N 89 124.433 123.469 0.964 1
1 1037 . 13 1 1 A 90 90 PRO HA H 90 4.417 4.356 0.061 1
1 1044 . 13 1 1 A 90 90 PRO CA C 90 63.064 63.102 -0.038 1
1 1045 . 13 1 1 A 90 90 PRO CB C 90 32.266 32.505 -0.239 1
1 1048 . 13 1 1 A 91 91 ARG H H 91 8.502 8.958 -0.456 1
1 1049 . 13 1 1 A 91 91 ARG HA H 91 4.305 4.611 -0.306 1
1 1056 . 13 1 1 A 91 91 ARG C C 91 176.831 173.811 3.020 1
1 1057 . 13 1 1 A 91 91 ARG CA C 91 56.002 55.272 0.730 1
1 1058 . 13 1 1 A 91 91 ARG CB C 91 30.913 34.236 -3.323 1
1 1061 . 13 1 1 A 91 91 ARG N N 91 122.193 125.275 -3.082 1
1 1062 . 13 1 1 A 92 92 LYS H H 92 8.415 8.735 -0.320 1
1 1063 . 13 1 1 A 92 92 LYS HA H 92 4.610 4.967 -0.357 1
1 1072 . 13 1 1 A 92 92 LYS C C 92 176.262 175.339 0.923 1
1 1073 . 13 1 1 A 92 92 LYS CA C 92 54.258 52.913 1.345 1
1 1074 . 13 1 1 A 92 92 LYS CB C 92 32.672 36.779 -4.107 1
1 1078 . 13 1 1 A 92 92 LYS N N 92 124.243 123.127 1.116 1
1 1079 . 13 1 1 A 93 93 PRO HA H 93 4.415 4.481 -0.066 1
1 1086 . 13 1 1 A 93 93 PRO CA C 93 62.899 63.684 -0.785 1
1 1087 . 13 1 1 A 93 93 PRO CB C 93 32.323 31.823 0.500 1
1 1090 . 13 1 1 A 94 94 LYS H H 94 8.420 8.080 0.340 1
1 1091 . 13 1 1 A 94 94 LYS HA H 94 4.290 4.063 0.227 1
1 1100 . 13 1 1 A 94 94 LYS C C 94 176.714 175.826 0.888 1
1 1101 . 13 1 1 A 94 94 LYS CA C 94 56.585 59.301 -2.716 1
1 1102 . 13 1 1 A 94 94 LYS CB C 94 33.161 32.795 0.366 1
1 1106 . 13 1 1 A 94 94 LYS N N 94 122.121 120.050 2.071 1
1 1107 . 13 1 1 A 95 95 ALA H H 95 8.348 7.633 0.715 1
1 1108 . 13 1 1 A 95 95 ALA HA H 95 4.250 4.647 -0.397 1
1 1112 . 13 1 1 A 95 95 ALA C C 95 176.453 175.823 0.630 1
1 1113 . 13 1 1 A 95 95 ALA CA C 95 52.471 50.908 1.563 1
1 1114 . 13 1 1 A 95 95 ALA CB C 95 19.347 22.958 -3.611 1
1 1115 . 13 1 1 A 95 95 ALA N N 95 125.624 117.905 7.719 1
1 1116 . 13 1 1 A 96 96 ALA H H 96 8.348 8.299 0.049 1
1 1117 . 13 1 1 A 96 96 ALA HA H 96 4.254 4.264 -0.010 1
1 1121 . 13 1 1 A 96 96 ALA C C 96 176.462 177.332 -0.870 1
1 1122 . 13 1 1 A 96 96 ALA CA C 96 52.471 52.664 -0.193 1
1 1123 . 13 1 1 A 96 96 ALA CB C 96 19.347 19.208 0.139 1
1 1124 . 13 1 1 A 96 96 ALA N N 96 125.624 122.039 3.585 1
1 1125 . 13 1 1 A 97 97 GLN H H 97 8.333 8.417 -0.084 1
1 1126 . 13 1 1 A 97 97 GLN HA H 97 4.362 5.219 -0.857 1
1 1133 . 13 1 1 A 97 97 GLN C C 97 177.684 174.974 2.710 1
1 1134 . 13 1 1 A 97 97 GLN CA C 97 55.848 54.357 1.491 1
1 1135 . 13 1 1 A 97 97 GLN CB C 97 29.643 32.117 -2.474 1
1 1137 . 13 1 1 A 97 97 GLN N N 97 120.049 117.962 2.087 1
1 1139 . 13 1 1 A 98 98 VAL H H 98 8.230 8.483 -0.253 1
1 1140 . 13 1 1 A 98 98 VAL HA H 98 4.145 4.559 -0.414 1
1 1148 . 13 1 1 A 98 98 VAL C C 98 176.033 174.489 1.544 1
1 1149 . 13 1 1 A 98 98 VAL CA C 98 62.444 59.414 3.030 1
1 1150 . 13 1 1 A 98 98 VAL CB C 98 32.942 35.449 -2.507 1
1 1153 . 13 1 1 A 98 98 VAL N N 98 121.607 118.572 3.035 1
1 1154 . 13 1 1 A 99 99 SER H H 99 8.375 8.561 -0.186 1
1 1155 . 13 1 1 A 99 99 SER HA H 99 4.473 4.081 0.392 1
1 1158 . 13 1 1 A 99 99 SER C C 99 176.204 173.116 3.088 1
1 1159 . 13 1 1 A 99 99 SER CA C 99 58.379 59.755 -1.376 1
1 1160 . 13 1 1 A 99 99 SER CB C 99 63.914 61.730 2.184 1
1 1161 . 13 1 1 A 99 99 SER N N 99 119.455 115.302 4.153 1
1 1162 . 13 1 1 A 100 100 GLU H H 100 8.547 7.556 0.991 1
1 1163 . 13 1 1 A 100 100 GLU HA H 100 4.304 4.799 -0.495 1
1 1168 . 13 1 1 A 100 100 GLU C C 100 174.620 176.679 -2.059 1
1 1169 . 13 1 1 A 100 100 GLU CA C 100 56.835 54.957 1.878 1
1 1170 . 13 1 1 A 100 100 GLU CB C 100 30.365 32.769 -2.404 1
1 1172 . 13 1 1 A 100 100 GLU N N 100 123.419 119.546 3.873 1
1 1173 . 13 1 1 A 101 101 GLU H H 101 8.432 9.110 -0.678 1
1 1174 . 13 1 1 A 101 101 GLU HA H 101 4.252 4.150 0.102 1
1 1179 . 13 1 1 A 101 101 GLU C C 101 176.693 178.307 -1.614 1
1 1180 . 13 1 1 A 101 101 GLU CA C 101 56.835 59.619 -2.784 1
1 1181 . 13 1 1 A 101 101 GLU CB C 101 30.365 29.299 1.066 1
1 1183 . 13 1 1 A 101 101 GLU N N 101 122.025 123.871 -1.846 1
1 1184 . 13 1 1 A 102 102 ALA H H 102 8.324 7.772 0.552 1
1 1185 . 13 1 1 A 102 102 ALA HA H 102 4.361 4.174 0.187 1
1 1189 . 13 1 1 A 102 102 ALA C C 102 177.065 177.895 -0.830 1
1 1190 . 13 1 1 A 102 102 ALA CA C 102 52.647 53.844 -1.197 1
1 1191 . 13 1 1 A 102 102 ALA CB C 102 19.227 18.595 0.632 1
1 1192 . 13 1 1 A 102 102 ALA N N 102 125.114 121.913 3.201 1
1 1193 . 13 1 1 A 103 103 SER H H 103 8.259 8.117 0.142 1
1 1194 . 13 1 1 A 103 103 SER HA H 103 4.473 4.665 -0.192 1
1 1197 . 13 1 1 A 103 103 SER C C 103 177.772 173.602 4.170 1
1 1198 . 13 1 1 A 103 103 SER CA C 103 58.301 58.498 -0.197 1
1 1199 . 13 1 1 A 103 103 SER CB C 103 63.961 65.273 -1.312 1
1 1200 . 13 1 1 A 103 103 SER N N 103 115.109 112.770 2.339 1
1 1201 . 13 1 1 A 104 104 THR H H 104 8.127 7.333 0.794 1
1 1202 . 13 1 1 A 104 104 THR HA H 104 4.600 4.892 -0.292 1
1 1207 . 13 1 1 A 104 104 THR C C 104 174.427 171.906 2.521 1
1 1208 . 13 1 1 A 104 104 THR CA C 104 59.954 58.778 1.176 1
1 1209 . 13 1 1 A 104 104 THR CB C 104 69.868 70.759 -0.891 1
1 1211 . 13 1 1 A 104 104 THR N N 104 117.882 111.451 6.431 1
1 1212 . 13 1 1 A 105 105 PRO HA H 105 4.414 4.514 -0.100 1
1 1219 . 13 1 1 A 105 105 PRO CA C 105 63.300 62.811 0.489 1
1 1220 . 13 1 1 A 105 105 PRO CB C 105 32.227 32.684 -0.457 1
1 1223 . 13 1 1 A 106 106 GLN H H 106 8.524 8.442 0.082 1
1 1224 . 13 1 1 A 106 106 GLN HA H 106 4.276 4.105 0.171 1
1 1229 . 13 1 1 A 106 106 GLN C C 106 177.083 175.824 1.259 1
1 1230 . 13 1 1 A 106 106 GLN CA C 106 56.209 56.910 -0.701 1
1 1231 . 13 1 1 A 106 106 GLN CB C 106 29.490 28.401 1.089 1
1 1233 . 13 1 1 A 106 106 GLN N N 106 120.754 118.907 1.847 1
1 1234 . 13 1 1 A 107 107 GLY H H 107 8.394 7.478 0.916 1
1 1235 . 13 1 1 A 107 107 GLY HA2 H 107 3.895 4.083 -0.188 1
1 1236 . 13 1 1 A 107 107 GLY HA3 H 107 3.895 4.107 -0.212 1
1 1237 . 13 1 1 A 107 107 GLY C C 107 176.651 171.526 5.125 1
1 1238 . 13 1 1 A 107 107 GLY CA C 107 45.330 45.875 -0.545 1
1 1239 . 13 1 1 A 107 107 GLY N N 107 110.026 107.099 2.927 1
1 1240 . 13 1 1 A 108 108 PHE H H 108 8.099 8.754 -0.655 1
1 1241 . 13 1 1 A 108 108 PHE HA H 108 4.582 5.033 -0.451 1
1 1245 . 13 1 1 A 108 108 PHE C C 108 173.944 175.609 -1.665 1
1 1246 . 13 1 1 A 108 108 PHE CA C 108 58.054 57.642 0.412 1
1 1247 . 13 1 1 A 108 108 PHE CB C 108 39.708 41.560 -1.852 1
1 1248 . 13 1 1 A 108 108 PHE N N 108 120.180 120.432 -0.252 1
1 1249 . 13 1 1 A 109 109 ASN H H 109 8.482 7.368 1.114 1
1 1250 . 13 1 1 A 109 109 ASN HA H 109 4.691 4.082 0.609 1
1 1255 . 13 1 1 A 109 109 ASN C C 109 175.627 176.953 -1.326 1
1 1256 . 13 1 1 A 109 109 ASN CA C 109 53.402 56.408 -3.006 1
1 1257 . 13 1 1 A 109 109 ASN CB C 109 38.883 38.016 0.867 1
1 1258 . 13 1 1 A 109 109 ASN N N 109 120.752 122.247 -1.495 1
1 1260 . 13 1 1 A 110 110 THR H H 110 8.112 7.899 0.213 1
1 1261 . 13 1 1 A 110 110 THR HA H 110 4.251 4.017 0.234 1
1 1266 . 13 1 1 A 110 110 THR C C 110 175.275 176.199 -0.924 1
1 1267 . 13 1 1 A 110 110 THR CA C 110 62.460 66.812 -4.352 1
1 1268 . 13 1 1 A 110 110 THR CB C 110 69.726 68.975 0.751 1
1 1270 . 13 1 1 A 110 110 THR N N 110 114.601 116.281 -1.680 1
1 1271 . 13 1 1 A 111 111 LEU H H 111 8.168 7.858 0.310 1
1 1272 . 13 1 1 A 111 111 LEU HA H 111 4.308 4.094 0.214 1
1 1282 . 13 1 1 A 111 111 LEU CA C 111 55.704 57.607 -1.903 1
1 1283 . 13 1 1 A 111 111 LEU CB C 111 42.071 41.633 0.438 1
1 1287 . 13 1 1 A 111 111 LEU N N 111 123.756 121.736 2.020 1
1 1288 . 13 1 1 A 112 112 LYS H H 112 8.123 8.254 -0.131 1
1 1289 . 13 1 1 A 112 112 LYS HA H 112 4.242 4.663 -0.421 1
1 1298 . 13 1 1 A 112 112 LYS C C 112 177.547 177.418 0.129 1
1 1299 . 13 1 1 A 112 112 LYS CA C 112 56.928 55.677 1.251 1
1 1300 . 13 1 1 A 112 112 LYS CB C 112 33.055 33.274 -0.219 1
1 1304 . 13 1 1 A 112 112 LYS N N 112 121.442 115.985 5.457 1
1 1305 . 13 1 1 A 113 113 ASP H H 113 8.230 8.343 -0.113 1
1 1306 . 13 1 1 A 113 113 ASP HA H 113 4.526 4.434 0.092 1
1 1309 . 13 1 1 A 113 113 ASP C C 113 176.532 175.649 0.883 1
1 1310 . 13 1 1 A 113 113 ASP CA C 113 54.896 56.489 -1.593 1
1 1311 . 13 1 1 A 113 113 ASP CB C 113 41.362 41.093 0.269 1
1 1312 . 13 1 1 A 113 113 ASP N N 113 120.598 120.046 0.552 1
1 1313 . 13 1 1 A 114 114 LYS H H 114 8.127 7.769 0.358 1
1 1314 . 13 1 1 A 114 114 LYS HA H 114 4.300 4.820 -0.520 1
1 1323 . 13 1 1 A 114 114 LYS C C 114 176.303 176.231 0.072 1
1 1324 . 13 1 1 A 114 114 LYS CA C 114 56.633 54.547 2.086 1
1 1325 . 13 1 1 A 114 114 LYS CB C 114 32.818 36.095 -3.277 1
1 1329 . 13 1 1 A 114 114 LYS N N 114 120.897 116.582 4.315 1
1 1330 . 13 1 1 A 115 115 LEU H H 115 8.244 8.539 -0.295 1
1 1331 . 13 1 1 A 115 115 LEU HA H 115 4.254 4.784 -0.530 1
1 1341 . 13 1 1 A 115 115 LEU C C 115 176.909 178.186 -1.277 1
1 1342 . 13 1 1 A 115 115 LEU CA C 115 56.282 55.486 0.796 1
1 1343 . 13 1 1 A 115 115 LEU CB C 115 42.188 45.529 -3.341 1
1 1347 . 13 1 1 A 115 115 LEU N N 115 123.251 123.238 0.013 1
1 1348 . 13 1 1 A 116 116 GLU H H 116 8.421 8.248 0.173 1
1 1349 . 13 1 1 A 116 116 GLU HA H 116 4.190 3.904 0.286 1
1 1352 . 13 1 1 A 116 116 GLU C C 116 177.828 178.827 -0.999 1
1 1353 . 13 1 1 A 116 116 GLU CA C 116 57.466 59.932 -2.466 1
1 1354 . 13 1 1 A 116 116 GLU CB C 116 30.124 29.345 0.779 1
1 1355 . 13 1 1 A 116 116 GLU N N 116 120.575 120.262 0.313 1
1 1356 . 13 1 1 A 117 117 GLU H H 117 8.255 8.754 -0.499 1
1 1357 . 13 1 1 A 117 117 GLU HA H 117 4.192 3.987 0.205 1
1 1362 . 13 1 1 A 117 117 GLU CA C 117 57.491 57.859 -0.368 1
1 1363 . 13 1 1 A 117 117 GLU CB C 117 30.365 28.107 2.258 1
1 1365 . 13 1 1 A 117 117 GLU N N 117 120.933 117.373 3.560 1
1 1366 . 13 1 1 A 118 118 TRP H H 118 8.143 8.041 0.102 1
1 1367 . 13 1 1 A 118 118 TRP HA H 118 4.581 4.925 -0.344 1
1 1372 . 13 1 1 A 118 118 TRP C C 118 176.794 175.810 0.984 1
1 1373 . 13 1 1 A 118 118 TRP CA C 118 58.363 56.992 1.371 1
1 1374 . 13 1 1 A 118 118 TRP CB C 118 29.333 30.678 -1.345 1
1 1375 . 13 1 1 A 118 118 TRP N N 118 121.592 119.026 2.566 1
1 1376 . 13 1 1 A 119 119 ILE H H 119 7.908 7.393 0.515 1
1 1377 . 13 1 1 A 119 119 ILE HA H 119 3.828 4.066 -0.238 1
1 1387 . 13 1 1 A 119 119 ILE C C 119 176.984 177.081 -0.097 1
1 1388 . 13 1 1 A 119 119 ILE CA C 119 62.335 61.703 0.632 1
1 1389 . 13 1 1 A 119 119 ILE CB C 119 38.649 39.974 -1.325 1
1 1393 . 13 1 1 A 119 119 ILE N N 119 122.744 122.644 0.100 1
1 1394 . 13 1 1 A 120 120 GLU H H 120 8.143 8.601 -0.458 1
1 1395 . 13 1 1 A 120 120 GLU HA H 120 4.093 4.118 -0.025 1
1 1400 . 13 1 1 A 120 120 GLU C C 120 176.565 176.928 -0.363 1
1 1401 . 13 1 1 A 120 120 GLU CA C 120 57.613 58.924 -1.311 1
1 1402 . 13 1 1 A 120 120 GLU CB C 120 29.834 29.725 0.109 1
1 1404 . 13 1 1 A 120 120 GLU N N 120 123.139 126.789 -3.650 1
1 1405 . 13 1 1 A 121 121 MET H H 121 8.254 8.132 0.122 1
1 1406 . 13 1 1 A 121 121 MET HA H 121 4.357 4.306 0.051 1
1 1411 . 13 1 1 A 121 121 MET CA C 121 56.625 56.892 -0.267 1
1 1412 . 13 1 1 A 121 121 MET CB C 121 32.664 31.141 1.523 1
1 1414 . 13 1 1 A 121 121 MET N N 121 120.449 116.078 4.371 1
1 1415 . 13 1 1 A 122 122 SER H H 122 8.199 7.941 0.258 1
1 1416 . 13 1 1 A 122 122 SER HA H 122 4.280 4.272 0.008 1
1 1419 . 13 1 1 A 122 122 SER C C 122 177.224 176.152 1.072 1
1 1420 . 13 1 1 A 122 122 SER CA C 122 59.635 61.283 -1.648 1
1 1421 . 13 1 1 A 122 122 SER CB C 122 63.560 63.038 0.522 1
1 1422 . 13 1 1 A 122 122 SER N N 122 115.857 113.520 2.337 1
1 1423 . 13 1 1 A 123 123 ASN H H 123 8.211 8.250 -0.039 1
1 1424 . 13 1 1 A 123 123 ASN HA H 123 4.737 4.505 0.232 1
1 1429 . 13 1 1 A 123 123 ASN C C 123 174.709 177.569 -2.860 1
1 1430 . 13 1 1 A 123 123 ASN CA C 123 53.507 56.077 -2.570 1
1 1431 . 13 1 1 A 123 123 ASN CB C 123 38.800 39.381 -0.581 1
1 1432 . 13 1 1 A 123 123 ASN N N 123 119.923 120.295 -0.372 1
1 1434 . 13 1 1 A 124 124 ARG H H 124 7.997 8.107 -0.110 1
1 1435 . 13 1 1 A 124 124 ARG HA H 124 4.305 4.190 0.115 1
1 1442 . 13 1 1 A 124 124 ARG C C 124 175.477 176.332 -0.855 1
1 1443 . 13 1 1 A 124 124 ARG CA C 124 56.709 58.124 -1.415 1
1 1444 . 13 1 1 A 124 124 ARG CB C 124 30.584 29.747 0.837 1
1 1447 . 13 1 1 A 124 124 ARG N N 124 120.821 116.584 4.237 1
1 1448 . 13 1 1 A 125 125 LYS H H 125 8.327 7.492 0.835 1
1 1449 . 13 1 1 A 125 125 LYS HA H 125 4.254 3.998 0.256 1
1 1458 . 13 1 1 A 125 125 LYS C C 125 176.777 177.470 -0.693 1
1 1459 . 13 1 1 A 125 125 LYS CA C 125 56.860 56.687 0.173 1
1 1460 . 13 1 1 A 125 125 LYS CB C 125 32.879 33.722 -0.843 1
1 1464 . 13 1 1 A 125 125 LYS N N 125 121.891 120.031 1.860 1
1 1465 . 13 1 1 A 126 126 ASP H H 126 8.343 8.787 -0.444 1
1 1466 . 13 1 1 A 126 126 ASP HA H 126 4.581 4.441 0.140 1
1 1469 . 13 1 1 A 126 126 ASP C C 126 176.538 175.622 0.916 1
1 1470 . 13 1 1 A 126 126 ASP CA C 126 54.540 56.924 -2.384 1
1 1471 . 13 1 1 A 126 126 ASP CB C 126 40.907 40.938 -0.031 1
1 1472 . 13 1 1 A 126 126 ASP N N 126 119.814 126.737 -6.923 1
1 1473 . 13 1 1 A 127 127 LEU H H 127 7.946 7.773 0.173 1
1 1474 . 13 1 1 A 127 127 LEU HA H 127 4.309 4.856 -0.547 1
1 1484 . 13 1 1 A 127 127 LEU C C 127 176.043 174.293 1.750 1
1 1485 . 13 1 1 A 127 127 LEU CA C 127 55.427 54.350 1.077 1
1 1486 . 13 1 1 A 127 127 LEU CB C 127 42.394 45.898 -3.504 1
1 1490 . 13 1 1 A 127 127 LEU N N 127 121.432 117.999 3.433 1
1 1491 . 13 1 1 A 128 128 ILE H H 128 7.967 8.636 -0.669 1
1 1492 . 13 1 1 A 128 128 ILE HA H 128 4.141 4.934 -0.793 1
1 1502 . 13 1 1 A 128 128 ILE C C 128 177.200 173.037 4.163 1
1 1503 . 13 1 1 A 128 128 ILE CA C 128 61.150 59.111 2.039 1
1 1504 . 13 1 1 A 128 128 ILE CB C 128 38.489 42.061 -3.572 1
1 1508 . 13 1 1 A 128 128 ILE N N 128 121.579 123.803 -2.224 1
1 1509 . 13 1 1 A 129 129 LYS H H 129 8.331 8.596 -0.265 1
1 1510 . 13 1 1 A 129 129 LYS HA H 129 4.328 4.847 -0.519 1
1 1519 . 13 1 1 A 129 129 LYS C C 129 175.952 176.403 -0.451 1
1 1520 . 13 1 1 A 129 129 LYS CA C 129 56.330 53.925 2.405 1
1 1521 . 13 1 1 A 129 129 LYS CB C 129 33.010 36.929 -3.919 1
1 1525 . 13 1 1 A 129 129 LYS N N 129 126.955 126.770 0.185 1
1 1 . 14 1 1 A 2 2 ALA HA H 2 4.070 4.363 -0.293 1
1 5 . 14 1 1 A 2 2 ALA CA C 2 52.067 52.370 -0.303 1
1 6 . 14 1 1 A 2 2 ALA CB C 2 19.577 19.602 -0.025 1
1 7 . 14 1 1 A 3 3 ALA H H 3 8.714 8.838 -0.124 1
1 8 . 14 1 1 A 3 3 ALA HA H 3 4.253 5.171 -0.918 1
1 12 . 14 1 1 A 3 3 ALA C C 3 173.672 175.993 -2.321 1
1 13 . 14 1 1 A 3 3 ALA CA C 3 52.067 50.431 1.636 1
1 14 . 14 1 1 A 3 3 ALA CB C 3 19.577 23.767 -4.190 1
1 15 . 14 1 1 A 3 3 ALA N N 3 124.480 120.963 3.517 1
1 16 . 14 1 1 A 4 4 LYS H H 4 8.227 8.628 -0.401 1
1 17 . 14 1 1 A 4 4 LYS HA H 4 3.976 4.754 -0.778 1
1 26 . 14 1 1 A 4 4 LYS C C 4 176.672 175.611 1.061 1
1 27 . 14 1 1 A 4 4 LYS CA C 4 57.274 55.657 1.617 1
1 28 . 14 1 1 A 4 4 LYS CB C 4 33.209 33.516 -0.307 1
1 32 . 14 1 1 A 4 4 LYS N N 4 120.988 117.631 3.357 1
1 33 . 14 1 1 A 5 5 PHE H H 5 7.719 7.781 -0.062 1
1 34 . 14 1 1 A 5 5 PHE HA H 5 4.384 5.139 -0.755 1
1 38 . 14 1 1 A 5 5 PHE C C 5 175.364 174.040 1.324 1
1 39 . 14 1 1 A 5 5 PHE CA C 5 57.074 56.340 0.734 1
1 40 . 14 1 1 A 5 5 PHE CB C 5 39.669 43.708 -4.039 1
1 41 . 14 1 1 A 5 5 PHE N N 5 119.246 119.404 -0.158 1
1 42 . 14 1 1 A 6 6 GLU H H 6 8.515 8.409 0.106 1
1 43 . 14 1 1 A 6 6 GLU HA H 6 4.370 4.906 -0.536 1
1 48 . 14 1 1 A 6 6 GLU CA C 6 55.669 54.662 1.007 1
1 49 . 14 1 1 A 6 6 GLU CB C 6 32.094 33.610 -1.516 1
1 51 . 14 1 1 A 6 6 GLU N N 6 122.193 120.553 1.640 1
1 52 . 14 1 1 A 7 7 VAL H H 7 8.636 8.449 0.187 1
1 53 . 14 1 1 A 7 7 VAL HA H 7 3.406 3.923 -0.517 1
1 61 . 14 1 1 A 7 7 VAL C C 7 176.611 176.352 0.259 1
1 62 . 14 1 1 A 7 7 VAL CA C 7 65.358 63.384 1.974 1
1 63 . 14 1 1 A 7 7 VAL CB C 7 31.391 31.358 0.033 1
1 66 . 14 1 1 A 7 7 VAL N N 7 122.949 123.088 -0.139 1
1 67 . 14 1 1 A 8 8 GLY H H 8 9.394 9.148 0.246 1
1 68 . 14 1 1 A 8 8 GLY HA2 H 8 3.600 4.051 -0.451 1
1 69 . 14 1 1 A 8 8 GLY HA3 H 8 4.546 4.056 0.490 1
1 70 . 14 1 1 A 8 8 GLY C C 8 178.074 174.246 3.828 1
1 71 . 14 1 1 A 8 8 GLY CA C 8 45.121 44.858 0.263 1
1 72 . 14 1 1 A 8 8 GLY N N 8 116.837 115.297 1.540 1
1 73 . 14 1 1 A 9 9 SER H H 9 8.021 7.995 0.026 1
1 74 . 14 1 1 A 9 9 SER HA H 9 4.680 4.482 0.198 1
1 77 . 14 1 1 A 9 9 SER C C 9 174.234 173.119 1.115 1
1 78 . 14 1 1 A 9 9 SER CA C 9 59.387 59.638 -0.251 1
1 79 . 14 1 1 A 9 9 SER CB C 9 65.584 64.423 1.161 1
1 80 . 14 1 1 A 9 9 SER N N 9 118.208 118.028 0.180 1
1 81 . 14 1 1 A 10 10 VAL H H 10 7.945 8.433 -0.488 1
1 82 . 14 1 1 A 10 10 VAL HA H 10 4.980 5.146 -0.166 1
1 90 . 14 1 1 A 10 10 VAL C C 10 171.388 174.523 -3.135 1
1 91 . 14 1 1 A 10 10 VAL CA C 10 61.021 61.170 -0.149 1
1 92 . 14 1 1 A 10 10 VAL CB C 10 33.400 34.555 -1.155 1
1 95 . 14 1 1 A 10 10 VAL N N 10 121.118 123.455 -2.337 1
1 96 . 14 1 1 A 11 11 TYR H H 11 9.008 9.269 -0.261 1
1 97 . 14 1 1 A 11 11 TYR HA H 11 4.850 5.030 -0.180 1
1 101 . 14 1 1 A 11 11 TYR C C 11 174.926 173.787 1.139 1
1 102 . 14 1 1 A 11 11 TYR CA C 11 56.803 56.873 -0.070 1
1 103 . 14 1 1 A 11 11 TYR CB C 11 43.676 40.901 2.775 1
1 104 . 14 1 1 A 11 11 TYR N N 11 125.043 128.158 -3.115 1
1 105 . 14 1 1 A 12 12 THR H H 12 8.809 8.213 0.596 1
1 106 . 14 1 1 A 12 12 THR HA H 12 5.020 5.205 -0.185 1
1 111 . 14 1 1 A 12 12 THR C C 12 174.195 173.319 0.876 1
1 112 . 14 1 1 A 12 12 THR CA C 12 62.487 60.762 1.725 1
1 113 . 14 1 1 A 12 12 THR CB C 12 69.743 72.172 -2.429 1
1 115 . 14 1 1 A 12 12 THR N N 12 116.850 116.212 0.638 1
1 116 . 14 1 1 A 13 13 GLY H H 13 9.179 8.386 0.793 1
1 117 . 14 1 1 A 13 13 GLY HA2 H 13 3.250 4.141 -0.891 1
1 118 . 14 1 1 A 13 13 GLY HA3 H 13 4.801 4.163 0.638 1
1 119 . 14 1 1 A 13 13 GLY C C 13 174.654 171.928 2.726 1
1 120 . 14 1 1 A 13 13 GLY CA C 13 44.377 45.010 -0.633 1
1 121 . 14 1 1 A 13 13 GLY N N 13 113.654 111.802 1.852 1
1 122 . 14 1 1 A 14 14 LYS H H 14 7.770 8.690 -0.920 1
1 123 . 14 1 1 A 14 14 LYS HA H 14 5.426 5.196 0.230 1
1 132 . 14 1 1 A 14 14 LYS C C 14 171.343 175.846 -4.503 1
1 133 . 14 1 1 A 14 14 LYS CA C 14 53.879 54.659 -0.780 1
1 134 . 14 1 1 A 14 14 LYS CB C 14 36.032 35.172 0.860 1
1 138 . 14 1 1 A 14 14 LYS N N 14 118.322 120.633 -2.311 1
1 139 . 14 1 1 A 15 15 VAL H H 15 9.206 9.177 0.029 1
1 140 . 14 1 1 A 15 15 VAL HA H 15 4.400 4.222 0.178 1
1 148 . 14 1 1 A 15 15 VAL C C 15 176.306 177.119 -0.813 1
1 149 . 14 1 1 A 15 15 VAL CA C 15 63.648 63.513 0.135 1
1 150 . 14 1 1 A 15 15 VAL CB C 15 31.769 31.567 0.202 1
1 153 . 14 1 1 A 15 15 VAL N N 15 125.308 127.258 -1.950 1
1 154 . 14 1 1 A 16 16 THR H H 16 9.403 9.163 0.240 1
1 155 . 14 1 1 A 16 16 THR HA H 16 4.562 4.607 -0.045 1
1 160 . 14 1 1 A 16 16 THR C C 16 178.098 174.835 3.263 1
1 161 . 14 1 1 A 16 16 THR CA C 16 62.018 62.013 0.005 1
1 162 . 14 1 1 A 16 16 THR CB C 16 69.720 69.713 0.007 1
1 164 . 14 1 1 A 16 16 THR N N 16 121.753 118.079 3.674 1
1 165 . 14 1 1 A 17 17 GLY H H 17 7.600 7.038 0.562 1
1 166 . 14 1 1 A 17 17 GLY HA2 H 17 4.110 4.138 -0.028 1
1 167 . 14 1 1 A 17 17 GLY HA3 H 17 4.250 4.250 0.000 1
1 168 . 14 1 1 A 17 17 GLY C C 17 175.551 171.340 4.211 1
1 169 . 14 1 1 A 17 17 GLY CA C 17 46.258 45.561 0.697 1
1 170 . 14 1 1 A 17 17 GLY N N 17 109.407 108.636 0.771 1
1 171 . 14 1 1 A 18 18 LEU H H 18 8.820 8.566 0.254 1
1 172 . 14 1 1 A 18 18 LEU HA H 18 4.852 5.142 -0.290 1
1 182 . 14 1 1 A 18 18 LEU CA C 18 54.245 53.297 0.948 1
1 183 . 14 1 1 A 18 18 LEU CB C 18 44.906 46.248 -1.342 1
1 187 . 14 1 1 A 18 18 LEU N N 18 123.419 121.120 2.299 1
1 188 . 14 1 1 A 19 19 GLN H H 19 8.537 8.335 0.202 1
1 189 . 14 1 1 A 19 19 GLN HA H 19 4.520 4.744 -0.224 1
1 196 . 14 1 1 A 19 19 GLN C C 19 175.258 176.011 -0.753 1
1 197 . 14 1 1 A 19 19 GLN CA C 19 53.269 53.879 -0.610 1
1 198 . 14 1 1 A 19 19 GLN CB C 19 31.522 32.468 -0.946 1
1 200 . 14 1 1 A 19 19 GLN N N 19 120.187 121.409 -1.222 1
1 202 . 14 1 1 A 20 20 ALA H H 20 8.798 8.689 0.109 1
1 203 . 14 1 1 A 20 20 ALA HA H 20 4.010 4.076 -0.066 1
1 207 . 14 1 1 A 20 20 ALA C C 20 175.698 177.383 -1.685 1
1 208 . 14 1 1 A 20 20 ALA CA C 20 55.084 54.556 0.528 1
1 209 . 14 1 1 A 20 20 ALA CB C 20 18.277 18.740 -0.463 1
1 210 . 14 1 1 A 20 20 ALA N N 20 120.606 123.725 -3.119 1
1 211 . 14 1 1 A 21 21 TYR H H 21 6.618 8.003 -1.385 1
1 212 . 14 1 1 A 21 21 TYR HA H 21 4.540 4.730 -0.190 1
1 216 . 14 1 1 A 21 21 TYR C C 21 178.437 175.196 3.241 1
1 217 . 14 1 1 A 21 21 TYR CA C 21 55.120 57.599 -2.479 1
1 218 . 14 1 1 A 21 21 TYR CB C 21 37.891 39.443 -1.552 1
1 219 . 14 1 1 A 21 21 TYR N N 21 105.570 119.156 -13.586 1
1 220 . 14 1 1 A 22 22 GLY H H 22 7.203 7.171 0.032 1
1 221 . 14 1 1 A 22 22 GLY HA2 H 22 3.460 3.941 -0.481 1
1 222 . 14 1 1 A 22 22 GLY HA3 H 22 4.360 3.953 0.407 1
1 223 . 14 1 1 A 22 22 GLY C C 22 175.833 171.299 4.534 1
1 224 . 14 1 1 A 22 22 GLY CA C 22 46.356 45.690 0.666 1
1 225 . 14 1 1 A 22 22 GLY N N 22 109.854 108.233 1.621 1
1 226 . 14 1 1 A 23 23 ALA H H 23 8.549 8.507 0.042 1
1 227 . 14 1 1 A 23 23 ALA HA H 23 4.981 5.173 -0.192 1
1 231 . 14 1 1 A 23 23 ALA C C 23 168.810 175.637 -6.827 1
1 232 . 14 1 1 A 23 23 ALA CA C 23 49.178 50.594 -1.416 1
1 233 . 14 1 1 A 23 23 ALA CB C 23 22.797 22.060 0.737 1
1 234 . 14 1 1 A 23 23 ALA N N 23 118.749 122.560 -3.811 1
1 235 . 14 1 1 A 24 24 PHE H H 24 8.812 8.569 0.243 1
1 236 . 14 1 1 A 24 24 PHE HA H 24 5.125 4.963 0.162 1
1 240 . 14 1 1 A 24 24 PHE CA C 24 58.017 57.683 0.334 1
1 241 . 14 1 1 A 24 24 PHE CB C 24 40.475 40.550 -0.075 1
1 242 . 14 1 1 A 24 24 PHE N N 24 122.891 121.201 1.690 1
1 243 . 14 1 1 A 25 25 VAL H H 25 8.880 8.765 0.115 1
1 244 . 14 1 1 A 25 25 VAL HA H 25 4.660 4.695 -0.035 1
1 252 . 14 1 1 A 25 25 VAL CA C 25 60.379 60.736 -0.357 1
1 253 . 14 1 1 A 25 25 VAL CB C 25 35.654 35.462 0.192 1
1 256 . 14 1 1 A 25 25 VAL N N 25 122.908 120.930 1.978 1
1 257 . 14 1 1 A 26 26 ALA H H 26 9.403 8.877 0.526 1
1 258 . 14 1 1 A 26 26 ALA HA H 26 4.750 4.582 0.168 1
1 262 . 14 1 1 A 26 26 ALA C C 26 174.445 176.736 -2.291 1
1 263 . 14 1 1 A 26 26 ALA CA C 26 51.711 51.307 0.404 1
1 264 . 14 1 1 A 26 26 ALA CB C 26 19.319 19.707 -0.388 1
1 265 . 14 1 1 A 26 26 ALA N N 26 129.425 128.923 0.502 1
1 266 . 14 1 1 A 27 27 LEU H H 27 8.601 9.179 -0.578 1
1 267 . 14 1 1 A 27 27 LEU HA H 27 4.158 4.228 -0.070 1
1 277 . 14 1 1 A 27 27 LEU C C 27 177.814 176.120 1.694 1
1 278 . 14 1 1 A 27 27 LEU CA C 27 55.869 55.483 0.386 1
1 279 . 14 1 1 A 27 27 LEU CB C 27 42.251 43.590 -1.339 1
1 283 . 14 1 1 A 27 27 LEU N N 27 127.169 123.095 4.074 1
1 284 . 14 1 1 A 28 28 ASP H H 28 8.172 7.910 0.262 1
1 285 . 14 1 1 A 28 28 ASP HA H 28 4.420 4.778 -0.358 1
1 288 . 14 1 1 A 28 28 ASP C C 28 177.116 175.299 1.817 1
1 289 . 14 1 1 A 28 28 ASP CA C 28 53.755 53.383 0.372 1
1 290 . 14 1 1 A 28 28 ASP CB C 28 39.833 43.759 -3.926 1
1 291 . 14 1 1 A 28 28 ASP N N 28 115.657 115.443 0.214 1
1 292 . 14 1 1 A 29 29 GLU H H 29 8.857 8.708 0.149 1
1 293 . 14 1 1 A 29 29 GLU HA H 29 4.090 4.095 -0.005 1
1 298 . 14 1 1 A 29 29 GLU C C 29 175.965 176.925 -0.960 1
1 299 . 14 1 1 A 29 29 GLU CA C 29 59.470 59.166 0.304 1
1 300 . 14 1 1 A 29 29 GLU CB C 29 29.409 29.429 -0.020 1
1 302 . 14 1 1 A 29 29 GLU N N 29 114.738 122.761 -8.023 1
1 303 . 14 1 1 A 30 30 GLU H H 30 8.326 8.003 0.323 1
1 304 . 14 1 1 A 30 30 GLU HA H 30 4.640 4.578 0.062 1
1 309 . 14 1 1 A 30 30 GLU C C 30 176.817 175.078 1.739 1
1 310 . 14 1 1 A 30 30 GLU CA C 30 56.073 55.910 0.163 1
1 311 . 14 1 1 A 30 30 GLU CB C 30 32.453 31.054 1.399 1
1 313 . 14 1 1 A 30 30 GLU N N 30 115.753 117.412 -1.659 1
1 314 . 14 1 1 A 31 31 THR H H 31 7.819 7.446 0.373 1
1 315 . 14 1 1 A 31 31 THR HA H 31 4.484 5.008 -0.524 1
1 320 . 14 1 1 A 31 31 THR C C 31 176.330 172.866 3.464 1
1 321 . 14 1 1 A 31 31 THR CA C 31 63.398 61.306 2.092 1
1 322 . 14 1 1 A 31 31 THR CB C 31 69.367 72.099 -2.732 1
1 324 . 14 1 1 A 31 31 THR N N 31 118.750 115.444 3.306 1
1 325 . 14 1 1 A 32 32 GLN H H 32 8.913 8.737 0.176 1
1 326 . 14 1 1 A 32 32 GLN HA H 32 5.337 4.973 0.364 1
1 333 . 14 1 1 A 32 32 GLN C C 32 173.087 174.543 -1.456 1
1 334 . 14 1 1 A 32 32 GLN CA C 32 54.051 55.255 -1.204 1
1 335 . 14 1 1 A 32 32 GLN CB C 32 32.672 32.498 0.174 1
1 337 . 14 1 1 A 32 32 GLN N N 32 127.294 125.636 1.658 1
1 339 . 14 1 1 A 33 33 GLY H H 33 8.900 8.523 0.377 1
1 340 . 14 1 1 A 33 33 GLY HA2 H 33 3.290 4.351 -1.061 1
1 341 . 14 1 1 A 33 33 GLY HA3 H 33 4.530 4.377 0.153 1
1 342 . 14 1 1 A 33 33 GLY C C 33 174.918 171.999 2.919 1
1 343 . 14 1 1 A 33 33 GLY CA C 33 44.534 45.621 -1.087 1
1 344 . 14 1 1 A 33 33 GLY N N 33 107.639 111.229 -3.590 1
1 345 . 14 1 1 A 34 34 LEU H H 34 8.127 8.672 -0.545 1
1 346 . 14 1 1 A 34 34 LEU HA H 34 4.950 5.038 -0.088 1
1 356 . 14 1 1 A 34 34 LEU CA C 34 53.755 53.927 -0.172 1
1 357 . 14 1 1 A 34 34 LEU CB C 34 45.493 45.272 0.221 1
1 361 . 14 1 1 A 34 34 LEU N N 34 120.897 120.732 0.165 1
1 362 . 14 1 1 A 35 35 VAL H H 35 9.386 8.903 0.483 1
1 363 . 14 1 1 A 35 35 VAL HA H 35 4.479 4.218 0.261 1
1 371 . 14 1 1 A 35 35 VAL C C 35 176.402 175.738 0.664 1
1 372 . 14 1 1 A 35 35 VAL CA C 35 59.594 62.549 -2.955 1
1 373 . 14 1 1 A 35 35 VAL CB C 35 32.590 31.721 0.869 1
1 376 . 14 1 1 A 35 35 VAL N N 35 128.897 128.210 0.687 1
1 377 . 14 1 1 A 36 36 HIS H H 36 9.194 8.666 0.528 1
1 378 . 14 1 1 A 36 36 HIS HA H 36 4.487 4.557 -0.070 1
1 381 . 14 1 1 A 36 36 HIS C C 36 174.864 176.369 -1.505 1
1 382 . 14 1 1 A 36 36 HIS CA C 36 59.426 56.220 3.206 1
1 383 . 14 1 1 A 36 36 HIS CB C 36 31.542 30.596 0.946 1
1 384 . 14 1 1 A 36 36 HIS N N 36 127.751 125.843 1.908 1
1 385 . 14 1 1 A 37 37 ILE H H 37 7.454 8.666 -1.212 1
1 386 . 14 1 1 A 37 37 ILE HA H 37 3.810 3.605 0.205 1
1 396 . 14 1 1 A 37 37 ILE C C 37 176.948 177.771 -0.823 1
1 397 . 14 1 1 A 37 37 ILE CA C 37 63.773 64.665 -0.892 1
1 398 . 14 1 1 A 37 37 ILE CB C 37 38.993 37.275 1.718 1
1 402 . 14 1 1 A 37 37 ILE N N 37 126.266 125.626 0.640 1
1 403 . 14 1 1 A 38 38 SER H H 38 8.343 7.896 0.447 1
1 404 . 14 1 1 A 38 38 SER HA H 38 4.370 4.161 0.209 1
1 407 . 14 1 1 A 38 38 SER C C 38 174.792 174.834 -0.042 1
1 408 . 14 1 1 A 38 38 SER CA C 38 60.567 61.006 -0.439 1
1 409 . 14 1 1 A 38 38 SER CB C 38 63.632 62.740 0.892 1
1 410 . 14 1 1 A 38 38 SER N N 38 118.079 118.248 -0.169 1
1 411 . 14 1 1 A 39 39 GLU H H 39 8.536 7.932 0.604 1
1 412 . 14 1 1 A 39 39 GLU HA H 39 4.503 4.548 -0.045 1
1 417 . 14 1 1 A 39 39 GLU C C 39 175.131 176.966 -1.835 1
1 418 . 14 1 1 A 39 39 GLU CA C 39 54.928 56.300 -1.372 1
1 419 . 14 1 1 A 39 39 GLU CB C 39 29.621 30.762 -1.141 1
1 421 . 14 1 1 A 39 39 GLU N N 39 118.349 118.220 0.129 1
1 422 . 14 1 1 A 40 40 VAL H H 40 7.776 7.712 0.064 1
1 423 . 14 1 1 A 40 40 VAL HA H 40 3.616 3.894 -0.278 1
1 431 . 14 1 1 A 40 40 VAL C C 40 177.277 176.160 1.117 1
1 432 . 14 1 1 A 40 40 VAL CA C 40 66.245 64.604 1.641 1
1 433 . 14 1 1 A 40 40 VAL CB C 40 32.590 32.239 0.351 1
1 436 . 14 1 1 A 40 40 VAL N N 40 125.443 117.976 7.467 1
1 437 . 14 1 1 A 41 41 THR H H 41 7.888 7.865 0.023 1
1 438 . 14 1 1 A 41 41 THR HA H 41 4.345 4.776 -0.431 1
1 443 . 14 1 1 A 41 41 THR C C 41 173.492 174.723 -1.231 1
1 444 . 14 1 1 A 41 41 THR CA C 41 59.047 60.973 -1.926 1
1 445 . 14 1 1 A 41 41 THR CB C 41 68.992 73.076 -4.084 1
1 447 . 14 1 1 A 41 41 THR N N 41 109.905 112.921 -3.016 1
1 448 . 14 1 1 A 42 42 HIS H H 42 8.063 8.942 -0.879 1
1 449 . 14 1 1 A 42 42 HIS HA H 42 4.510 4.138 0.372 1
1 452 . 14 1 1 A 42 42 HIS C C 42 172.139 175.815 -3.676 1
1 453 . 14 1 1 A 42 42 HIS CA C 42 57.735 59.858 -2.123 1
1 454 . 14 1 1 A 42 42 HIS CB C 42 31.144 30.532 0.612 1
1 455 . 14 1 1 A 42 42 HIS N N 42 121.760 124.140 -2.380 1
1 456 . 14 1 1 A 43 43 GLY H H 43 8.286 7.444 0.842 1
1 457 . 14 1 1 A 43 43 GLY HA2 H 43 3.980 3.477 0.503 1
1 458 . 14 1 1 A 43 43 GLY HA3 H 43 3.980 3.690 0.290 1
1 459 . 14 1 1 A 43 43 GLY C C 43 176.307 174.942 1.365 1
1 460 . 14 1 1 A 43 43 GLY CA C 43 44.336 45.233 -0.897 1
1 461 . 14 1 1 A 43 43 GLY N N 43 110.133 106.272 3.861 1
1 462 . 14 1 1 A 44 44 PHE H H 44 8.327 7.684 0.643 1
1 463 . 14 1 1 A 44 44 PHE HA H 44 4.489 4.601 -0.112 1
1 467 . 14 1 1 A 44 44 PHE C C 44 171.877 175.403 -3.526 1
1 468 . 14 1 1 A 44 44 PHE CA C 44 58.027 56.963 1.064 1
1 469 . 14 1 1 A 44 44 PHE CB C 44 39.850 37.609 2.241 1
1 470 . 14 1 1 A 44 44 PHE N N 44 120.049 119.940 0.109 1
1 471 . 14 1 1 A 45 45 VAL H H 45 7.939 7.133 0.806 1
1 472 . 14 1 1 A 45 45 VAL HA H 45 3.865 3.193 0.672 1
1 480 . 14 1 1 A 45 45 VAL C C 45 175.523 175.484 0.039 1
1 481 . 14 1 1 A 45 45 VAL CA C 45 61.536 62.966 -1.430 1
1 482 . 14 1 1 A 45 45 VAL CB C 45 33.127 30.962 2.165 1
1 485 . 14 1 1 A 45 45 VAL N N 45 127.882 120.238 7.644 1
1 486 . 14 1 1 A 46 46 LYS H H 46 8.868 8.720 0.148 1
1 487 . 14 1 1 A 46 46 LYS HA H 46 4.170 4.115 0.055 1
1 496 . 14 1 1 A 46 46 LYS C C 46 175.728 176.152 -0.424 1
1 497 . 14 1 1 A 46 46 LYS CA C 46 57.198 58.480 -1.282 1
1 498 . 14 1 1 A 46 46 LYS CB C 46 33.299 33.133 0.166 1
1 502 . 14 1 1 A 46 46 LYS N N 46 127.308 128.285 -0.977 1
1 503 . 14 1 1 A 47 47 ASP H H 47 7.652 8.005 -0.353 1
1 504 . 14 1 1 A 47 47 ASP HA H 47 4.710 4.959 -0.249 1
1 507 . 14 1 1 A 47 47 ASP C C 47 176.411 176.175 0.236 1
1 508 . 14 1 1 A 47 47 ASP CA C 47 53.390 53.884 -0.494 1
1 509 . 14 1 1 A 47 47 ASP CB C 47 42.635 44.108 -1.473 1
1 510 . 14 1 1 A 47 47 ASP N N 47 117.932 115.802 2.130 1
1 511 . 14 1 1 A 48 48 ILE H H 48 9.230 8.693 0.537 1
1 512 . 14 1 1 A 48 48 ILE HA H 48 3.579 3.949 -0.370 1
1 522 . 14 1 1 A 48 48 ILE C C 48 177.249 177.644 -0.395 1
1 523 . 14 1 1 A 48 48 ILE CA C 48 65.525 63.750 1.775 1
1 524 . 14 1 1 A 48 48 ILE CB C 48 38.797 37.741 1.056 1
1 528 . 14 1 1 A 48 48 ILE N N 48 129.049 125.368 3.681 1
1 529 . 14 1 1 A 49 49 ASN H H 49 8.468 9.180 -0.712 1
1 530 . 14 1 1 A 49 49 ASN HA H 49 4.690 4.577 0.113 1
1 535 . 14 1 1 A 49 49 ASN C C 49 175.779 176.095 -0.316 1
1 536 . 14 1 1 A 49 49 ASN CA C 49 55.587 54.631 0.956 1
1 537 . 14 1 1 A 49 49 ASN CB C 49 38.587 36.786 1.801 1
1 538 . 14 1 1 A 49 49 ASN N N 49 118.835 117.383 1.452 1
1 540 . 14 1 1 A 50 50 GLU H H 50 7.853 7.921 -0.068 1
1 541 . 14 1 1 A 50 50 GLU HA H 50 4.040 4.175 -0.135 1
1 546 . 14 1 1 A 50 50 GLU C C 50 176.148 177.185 -1.037 1
1 547 . 14 1 1 A 50 50 GLU CA C 50 57.404 57.091 0.313 1
1 548 . 14 1 1 A 50 50 GLU CB C 50 29.491 29.773 -0.282 1
1 550 . 14 1 1 A 50 50 GLU N N 50 116.358 118.248 -1.890 1
1 551 . 14 1 1 A 51 51 HIS H H 51 7.575 7.873 -0.298 1
1 552 . 14 1 1 A 51 51 HIS HA H 51 4.431 4.752 -0.321 1
1 555 . 14 1 1 A 51 51 HIS C C 51 176.383 174.445 1.938 1
1 556 . 14 1 1 A 51 51 HIS CA C 51 57.089 56.272 0.817 1
1 557 . 14 1 1 A 51 51 HIS CB C 51 33.168 31.857 1.311 1
1 558 . 14 1 1 A 51 51 HIS N N 51 115.828 115.237 0.591 1
1 559 . 14 1 1 A 52 52 LEU H H 52 7.640 7.478 0.162 1
1 560 . 14 1 1 A 52 52 LEU HA H 52 4.796 4.692 0.104 1
1 570 . 14 1 1 A 52 52 LEU C C 52 174.452 174.492 -0.040 1
1 571 . 14 1 1 A 52 52 LEU CA C 52 53.398 53.465 -0.067 1
1 572 . 14 1 1 A 52 52 LEU CB C 52 48.805 44.162 4.643 1
1 576 . 14 1 1 A 52 52 LEU N N 52 117.932 119.587 -1.655 1
1 577 . 14 1 1 A 53 53 SER H H 53 8.151 8.546 -0.395 1
1 578 . 14 1 1 A 53 53 SER HA H 53 4.680 4.955 -0.275 1
1 581 . 14 1 1 A 53 53 SER C C 53 174.304 172.771 1.533 1
1 582 . 14 1 1 A 53 53 SER CA C 53 56.714 57.697 -0.983 1
1 583 . 14 1 1 A 53 53 SER CB C 53 65.431 66.880 -1.449 1
1 584 . 14 1 1 A 53 53 SER N N 53 113.496 116.983 -3.487 1
1 585 . 14 1 1 A 54 54 VAL H H 54 8.782 8.516 0.266 1
1 586 . 14 1 1 A 54 54 VAL HA H 54 3.230 3.782 -0.552 1
1 594 . 14 1 1 A 54 54 VAL C C 54 173.745 177.181 -3.436 1
1 595 . 14 1 1 A 54 54 VAL CA C 54 66.232 63.550 2.682 1
1 596 . 14 1 1 A 54 54 VAL CB C 54 31.067 31.766 -0.699 1
1 599 . 14 1 1 A 54 54 VAL N N 54 124.401 125.550 -1.149 1
1 600 . 14 1 1 A 55 55 GLY H H 55 9.079 9.023 0.056 1
1 601 . 14 1 1 A 55 55 GLY HA2 H 55 3.530 3.850 -0.320 1
1 602 . 14 1 1 A 55 55 GLY HA3 H 55 4.553 3.853 0.700 1
1 603 . 14 1 1 A 55 55 GLY C C 55 177.219 173.265 3.954 1
1 604 . 14 1 1 A 55 55 GLY CA C 55 44.647 46.258 -1.611 1
1 605 . 14 1 1 A 55 55 GLY N N 55 117.320 116.010 1.310 1
1 606 . 14 1 1 A 56 56 ASP H H 56 7.943 7.740 0.203 1
1 607 . 14 1 1 A 56 56 ASP HA H 56 4.460 5.134 -0.674 1
1 610 . 14 1 1 A 56 56 ASP C C 56 176.055 173.761 2.294 1
1 611 . 14 1 1 A 56 56 ASP CA C 56 55.456 52.419 3.037 1
1 612 . 14 1 1 A 56 56 ASP CB C 56 40.914 44.809 -3.895 1
1 613 . 14 1 1 A 56 56 ASP N N 56 121.782 119.662 2.120 1
1 614 . 14 1 1 A 57 57 GLU H H 57 8.649 8.918 -0.269 1
1 615 . 14 1 1 A 57 57 GLU HA H 57 5.100 5.234 -0.134 1
1 620 . 14 1 1 A 57 57 GLU C C 57 175.635 175.590 0.045 1
1 621 . 14 1 1 A 57 57 GLU CA C 57 55.805 55.270 0.535 1
1 622 . 14 1 1 A 57 57 GLU CB C 57 30.915 32.314 -1.399 1
1 624 . 14 1 1 A 57 57 GLU N N 57 122.513 123.466 -0.953 1
1 625 . 14 1 1 A 58 58 VAL H H 58 8.809 9.043 -0.234 1
1 626 . 14 1 1 A 58 58 VAL HA H 58 4.817 4.842 -0.025 1
1 634 . 14 1 1 A 58 58 VAL C C 58 176.528 174.320 2.208 1
1 635 . 14 1 1 A 58 58 VAL CA C 58 58.719 59.165 -0.446 1
1 636 . 14 1 1 A 58 58 VAL CB C 58 35.523 35.809 -0.286 1
1 639 . 14 1 1 A 58 58 VAL N N 58 118.382 119.891 -1.509 1
1 640 . 14 1 1 A 59 59 GLN H H 59 8.255 8.516 -0.261 1
1 641 . 14 1 1 A 59 59 GLN HA H 59 5.030 4.814 0.216 1
1 646 . 14 1 1 A 59 59 GLN CA C 59 54.843 56.336 -1.493 1
1 647 . 14 1 1 A 59 59 GLN CB C 59 30.111 29.335 0.776 1
1 649 . 14 1 1 A 59 59 GLN N N 59 120.933 122.633 -1.700 1
1 650 . 14 1 1 A 60 60 VAL H H 60 8.970 9.132 -0.162 1
1 651 . 14 1 1 A 60 60 VAL HA H 60 4.990 5.113 -0.123 1
1 659 . 14 1 1 A 60 60 VAL C C 60 175.203 173.673 1.530 1
1 660 . 14 1 1 A 60 60 VAL CA C 60 57.404 58.978 -1.574 1
1 661 . 14 1 1 A 60 60 VAL CB C 60 35.771 35.711 0.060 1
1 664 . 14 1 1 A 60 60 VAL N N 60 111.046 118.560 -7.514 1
1 665 . 14 1 1 A 61 61 LYS H H 61 8.937 8.951 -0.014 1
1 666 . 14 1 1 A 61 61 LYS HA H 61 5.100 5.143 -0.043 1
1 675 . 14 1 1 A 61 61 LYS C C 61 173.610 176.124 -2.514 1
1 676 . 14 1 1 A 61 61 LYS CA C 61 53.762 54.673 -0.911 1
1 677 . 14 1 1 A 61 61 LYS CB C 61 36.273 35.343 0.930 1
1 681 . 14 1 1 A 61 61 LYS N N 61 121.930 122.840 -0.910 1
1 682 . 14 1 1 A 62 62 VAL H H 62 8.429 9.314 -0.885 1
1 683 . 14 1 1 A 62 62 VAL HA H 62 4.074 4.076 -0.002 1
1 691 . 14 1 1 A 62 62 VAL C C 62 176.912 175.877 1.035 1
1 692 . 14 1 1 A 62 62 VAL CA C 62 63.188 63.680 -0.492 1
1 693 . 14 1 1 A 62 62 VAL CB C 62 30.813 31.747 -0.934 1
1 696 . 14 1 1 A 62 62 VAL N N 62 126.329 127.225 -0.896 1
1 697 . 14 1 1 A 63 63 LEU H H 63 9.109 9.443 -0.334 1
1 698 . 14 1 1 A 63 63 LEU HA H 63 4.423 4.550 -0.127 1
1 708 . 14 1 1 A 63 63 LEU C C 63 176.091 176.011 0.080 1
1 709 . 14 1 1 A 63 63 LEU CA C 63 55.876 55.931 -0.055 1
1 710 . 14 1 1 A 63 63 LEU CB C 63 42.800 44.626 -1.826 1
1 714 . 14 1 1 A 63 63 LEU N N 63 129.436 129.484 -0.048 1
1 715 . 14 1 1 A 64 64 ALA H H 64 7.594 7.345 0.249 1
1 716 . 14 1 1 A 64 64 ALA HA H 64 4.455 4.795 -0.340 1
1 720 . 14 1 1 A 64 64 ALA C C 64 177.314 175.151 2.163 1
1 721 . 14 1 1 A 64 64 ALA CA C 64 52.557 51.694 0.863 1
1 722 . 14 1 1 A 64 64 ALA CB C 64 21.458 22.698 -1.240 1
1 723 . 14 1 1 A 64 64 ALA N N 64 117.791 118.870 -1.079 1
1 724 . 14 1 1 A 65 65 VAL H H 65 8.583 8.570 0.013 1
1 725 . 14 1 1 A 65 65 VAL HA H 65 4.470 4.878 -0.408 1
1 733 . 14 1 1 A 65 65 VAL C C 65 174.697 174.747 -0.050 1
1 734 . 14 1 1 A 65 65 VAL CA C 65 61.936 60.825 1.111 1
1 735 . 14 1 1 A 65 65 VAL CB C 65 35.288 35.468 -0.180 1
1 738 . 14 1 1 A 65 65 VAL N N 65 120.009 119.844 0.165 1
1 739 . 14 1 1 A 66 66 ASP H H 66 8.567 8.918 -0.351 1
1 740 . 14 1 1 A 66 66 ASP HA H 66 4.880 4.959 -0.079 1
1 743 . 14 1 1 A 66 66 ASP C C 66 174.355 176.059 -1.704 1
1 744 . 14 1 1 A 66 66 ASP CA C 66 52.681 53.133 -0.452 1
1 745 . 14 1 1 A 66 66 ASP CB C 66 41.775 41.098 0.677 1
1 746 . 14 1 1 A 66 66 ASP N N 66 126.262 125.158 1.104 1
1 747 . 14 1 1 A 67 67 GLU H H 67 9.148 8.814 0.334 1
1 748 . 14 1 1 A 67 67 GLU HA H 67 4.110 4.141 -0.031 1
1 753 . 14 1 1 A 67 67 GLU C C 67 177.052 178.635 -1.583 1
1 754 . 14 1 1 A 67 67 GLU CA C 67 59.044 59.284 -0.240 1
1 755 . 14 1 1 A 67 67 GLU CB C 67 29.919 29.423 0.496 1
1 757 . 14 1 1 A 67 67 GLU N N 67 125.480 124.653 0.827 1
1 758 . 14 1 1 A 68 68 GLU H H 68 8.384 8.254 0.130 1
1 759 . 14 1 1 A 68 68 GLU HA H 68 4.140 4.145 -0.005 1
1 764 . 14 1 1 A 68 68 GLU C C 68 178.383 179.794 -1.411 1
1 765 . 14 1 1 A 68 68 GLU CA C 68 59.044 58.928 0.116 1
1 766 . 14 1 1 A 68 68 GLU CB C 68 29.919 29.764 0.155 1
1 768 . 14 1 1 A 68 68 GLU N N 68 119.760 120.618 -0.858 1
1 769 . 14 1 1 A 69 69 LYS H H 69 7.799 8.016 -0.217 1
1 770 . 14 1 1 A 69 69 LYS HA H 69 4.375 4.312 0.063 1
1 779 . 14 1 1 A 69 69 LYS C C 69 178.297 176.742 1.555 1
1 780 . 14 1 1 A 69 69 LYS CA C 69 55.704 57.638 -1.934 1
1 781 . 14 1 1 A 69 69 LYS CB C 69 33.622 33.260 0.362 1
1 785 . 14 1 1 A 69 69 LYS N N 69 115.476 119.519 -4.043 1
1 786 . 14 1 1 A 70 70 GLY H H 70 7.994 8.392 -0.398 1
1 787 . 14 1 1 A 70 70 GLY HA2 H 70 3.940 3.969 -0.029 1
1 788 . 14 1 1 A 70 70 GLY HA3 H 70 3.960 3.977 -0.017 1
1 789 . 14 1 1 A 70 70 GLY C C 70 177.215 173.922 3.293 1
1 790 . 14 1 1 A 70 70 GLY CA C 70 46.773 46.466 0.307 1
1 791 . 14 1 1 A 70 70 GLY N N 70 110.245 108.350 1.895 1
1 792 . 14 1 1 A 71 71 LYS H H 71 7.560 7.994 -0.434 1
1 793 . 14 1 1 A 71 71 LYS HA H 71 4.690 4.956 -0.266 1
1 802 . 14 1 1 A 71 71 LYS C C 71 174.607 174.943 -0.336 1
1 803 . 14 1 1 A 71 71 LYS CA C 71 55.332 54.668 0.664 1
1 804 . 14 1 1 A 71 71 LYS CB C 71 34.903 36.138 -1.235 1
1 808 . 14 1 1 A 71 71 LYS N N 71 118.201 118.756 -0.555 1
1 809 . 14 1 1 A 72 72 ILE H H 72 8.867 8.634 0.233 1
1 810 . 14 1 1 A 72 72 ILE HA H 72 4.630 4.925 -0.295 1
1 820 . 14 1 1 A 72 72 ILE C C 72 175.708 174.588 1.120 1
1 821 . 14 1 1 A 72 72 ILE CA C 72 61.494 60.177 1.317 1
1 822 . 14 1 1 A 72 72 ILE CB C 72 40.652 41.948 -1.296 1
1 826 . 14 1 1 A 72 72 ILE N N 72 126.827 121.893 4.934 1
1 827 . 14 1 1 A 73 73 SER H H 73 8.815 9.020 -0.205 1
1 828 . 14 1 1 A 73 73 SER HA H 73 5.110 5.123 -0.013 1
1 831 . 14 1 1 A 73 73 SER C C 73 175.122 173.341 1.781 1
1 832 . 14 1 1 A 73 73 SER CA C 73 57.487 58.509 -1.022 1
1 833 . 14 1 1 A 73 73 SER CB C 73 64.386 64.553 -0.167 1
1 834 . 14 1 1 A 73 73 SER N N 73 123.640 124.595 -0.955 1
1 835 . 14 1 1 A 74 74 LEU H H 74 8.585 8.719 -0.134 1
1 836 . 14 1 1 A 74 74 LEU HA H 74 5.450 5.243 0.207 1
1 846 . 14 1 1 A 74 74 LEU C C 74 174.061 175.449 -1.388 1
1 847 . 14 1 1 A 74 74 LEU CA C 74 53.101 53.465 -0.364 1
1 848 . 14 1 1 A 74 74 LEU CB C 74 48.268 46.795 1.473 1
1 852 . 14 1 1 A 74 74 LEU N N 74 125.221 124.531 0.690 1
1 853 . 14 1 1 A 75 75 SER H H 75 8.840 8.593 0.247 1
1 854 . 14 1 1 A 75 75 SER HA H 75 5.040 5.261 -0.221 1
1 857 . 14 1 1 A 75 75 SER C C 75 176.552 173.636 2.916 1
1 858 . 14 1 1 A 75 75 SER CA C 75 57.487 56.375 1.112 1
1 859 . 14 1 1 A 75 75 SER CB C 75 64.993 66.363 -1.370 1
1 860 . 14 1 1 A 75 75 SER N N 75 111.252 113.691 -2.439 1
1 861 . 14 1 1 A 76 76 ILE H H 76 7.790 8.701 -0.911 1
1 862 . 14 1 1 A 76 76 ILE HA H 76 4.690 4.234 0.456 1
1 872 . 14 1 1 A 76 76 ILE C C 76 175.780 177.890 -2.110 1
1 873 . 14 1 1 A 76 76 ILE CA C 76 63.631 63.151 0.480 1
1 874 . 14 1 1 A 76 76 ILE CB C 76 39.484 38.955 0.529 1
1 878 . 14 1 1 A 76 76 ILE N N 76 129.205 120.437 8.768 1
1 879 . 14 1 1 A 77 77 ARG H H 77 8.115 8.525 -0.410 1
1 880 . 14 1 1 A 77 77 ARG HA H 77 3.760 4.131 -0.371 1
1 887 . 14 1 1 A 77 77 ARG C C 77 178.704 177.745 0.959 1
1 888 . 14 1 1 A 77 77 ARG CA C 77 58.933 58.528 0.405 1
1 889 . 14 1 1 A 77 77 ARG CB C 77 29.463 29.874 -0.411 1
1 892 . 14 1 1 A 77 77 ARG N N 77 123.257 121.196 2.061 1
1 893 . 14 1 1 A 78 78 ALA H H 78 8.304 7.727 0.577 1
1 894 . 14 1 1 A 78 78 ALA HA H 78 4.296 4.161 0.135 1
1 898 . 14 1 1 A 78 78 ALA C C 78 176.870 177.748 -0.878 1
1 899 . 14 1 1 A 78 78 ALA CA C 78 53.548 54.067 -0.519 1
1 900 . 14 1 1 A 78 78 ALA CB C 78 19.872 18.687 1.185 1
1 901 . 14 1 1 A 78 78 ALA N N 78 118.764 121.901 -3.137 1
1 902 . 14 1 1 A 79 79 THR H H 79 7.931 8.366 -0.435 1
1 903 . 14 1 1 A 79 79 THR HA H 79 4.370 4.671 -0.301 1
1 908 . 14 1 1 A 79 79 THR C C 79 178.356 173.360 4.996 1
1 909 . 14 1 1 A 79 79 THR CA C 79 62.381 61.871 0.510 1
1 910 . 14 1 1 A 79 79 THR CB C 79 69.693 71.919 -2.226 1
1 912 . 14 1 1 A 79 79 THR N N 79 107.360 112.165 -4.805 1
1 913 . 14 1 1 A 80 80 GLN H H 80 7.651 8.003 -0.352 1
1 914 . 14 1 1 A 80 80 GLN HA H 80 4.527 4.789 -0.262 1
1 921 . 14 1 1 A 80 80 GLN C C 80 174.249 174.536 -0.287 1
1 922 . 14 1 1 A 80 80 GLN CA C 80 54.760 54.225 0.535 1
1 923 . 14 1 1 A 80 80 GLN CB C 80 30.565 33.272 -2.707 1
1 925 . 14 1 1 A 80 80 GLN N N 80 121.588 119.472 2.116 1
1 927 . 14 1 1 A 81 81 ALA H H 81 8.498 8.674 -0.176 1
1 928 . 14 1 1 A 81 81 ALA HA H 81 4.252 4.622 -0.370 1
1 932 . 14 1 1 A 81 81 ALA C C 81 175.693 175.669 0.024 1
1 933 . 14 1 1 A 81 81 ALA CA C 81 52.345 50.907 1.438 1
1 934 . 14 1 1 A 81 81 ALA CB C 81 19.062 22.878 -3.816 1
1 935 . 14 1 1 A 81 81 ALA N N 81 126.423 121.769 4.654 1
1 936 . 14 1 1 A 82 82 ALA H H 82 8.324 8.511 -0.187 1
1 937 . 14 1 1 A 82 82 ALA HA H 82 4.000 3.872 0.128 1
1 941 . 14 1 1 A 82 82 ALA C C 82 177.065 175.820 1.245 1
1 942 . 14 1 1 A 82 82 ALA CA C 82 50.240 52.861 -2.621 1
1 943 . 14 1 1 A 82 82 ALA CB C 82 17.650 17.698 -0.048 1
1 944 . 14 1 1 A 82 82 ALA N N 82 125.114 118.753 6.361 1
1 945 . 14 1 1 A 83 83 PRO HA H 83 4.350 4.710 -0.360 1
1 952 . 14 1 1 A 83 83 PRO CA C 83 63.148 62.588 0.560 1
1 953 . 14 1 1 A 83 83 PRO CB C 83 32.054 32.988 -0.934 1
1 956 . 14 1 1 A 84 84 GLU H H 84 8.517 8.835 -0.318 1
1 957 . 14 1 1 A 84 84 GLU HA H 84 4.197 4.844 -0.647 1
1 962 . 14 1 1 A 84 84 GLU C C 84 176.948 174.620 2.328 1
1 963 . 14 1 1 A 84 84 GLU CA C 84 56.674 54.992 1.682 1
1 964 . 14 1 1 A 84 84 GLU CB C 84 30.459 33.643 -3.184 1
1 966 . 14 1 1 A 84 84 GLU N N 84 121.479 120.585 0.894 1
1 967 . 14 1 1 A 85 85 LYS H H 85 8.381 8.650 -0.269 1
1 968 . 14 1 1 A 85 85 LYS HA H 85 4.309 5.539 -1.230 1
1 977 . 14 1 1 A 85 85 LYS C C 85 176.457 174.601 1.856 1
1 978 . 14 1 1 A 85 85 LYS CA C 85 56.272 53.838 2.434 1
1 979 . 14 1 1 A 85 85 LYS CB C 85 32.961 36.810 -3.849 1
1 983 . 14 1 1 A 85 85 LYS N N 85 123.266 121.508 1.758 1
1 984 . 14 1 1 A 86 86 LYS H H 86 8.403 9.109 -0.706 1
1 985 . 14 1 1 A 86 86 LYS HA H 86 4.308 5.197 -0.889 1
1 994 . 14 1 1 A 86 86 LYS C C 86 176.435 174.382 2.053 1
1 995 . 14 1 1 A 86 86 LYS CA C 86 56.272 54.721 1.551 1
1 996 . 14 1 1 A 86 86 LYS CB C 86 32.961 37.083 -4.122 1
1 1000 . 14 1 1 A 86 86 LYS N N 86 123.688 118.865 4.823 1
1 1001 . 14 1 1 A 87 87 GLU H H 87 8.540 8.694 -0.154 1
1 1002 . 14 1 1 A 87 87 GLU HA H 87 4.358 4.669 -0.311 1
1 1007 . 14 1 1 A 87 87 GLU C C 87 176.556 176.132 0.424 1
1 1008 . 14 1 1 A 87 87 GLU CA C 87 56.406 55.804 0.602 1
1 1009 . 14 1 1 A 87 87 GLU CB C 87 30.607 31.698 -1.091 1
1 1011 . 14 1 1 A 87 87 GLU N N 87 122.633 121.134 1.499 1
1 1012 . 14 1 1 A 88 88 SER H H 88 8.520 8.843 -0.323 1
1 1013 . 14 1 1 A 88 88 SER HA H 88 4.490 4.297 0.193 1
1 1016 . 14 1 1 A 88 88 SER C C 88 175.780 175.163 0.617 1
1 1017 . 14 1 1 A 88 88 SER CA C 88 58.431 61.487 -3.056 1
1 1018 . 14 1 1 A 88 88 SER CB C 88 63.858 63.558 0.300 1
1 1019 . 14 1 1 A 88 88 SER N N 88 118.333 120.853 -2.520 1
1 1020 . 14 1 1 A 89 89 LYS H H 89 8.339 7.437 0.902 1
1 1021 . 14 1 1 A 89 89 LYS HA H 89 4.620 4.497 0.123 1
1 1030 . 14 1 1 A 89 89 LYS C C 89 174.160 174.593 -0.433 1
1 1031 . 14 1 1 A 89 89 LYS CA C 89 54.265 55.045 -0.780 1
1 1032 . 14 1 1 A 89 89 LYS CB C 89 32.672 31.619 1.053 1
1 1036 . 14 1 1 A 89 89 LYS N N 89 124.433 121.544 2.889 1
1 1037 . 14 1 1 A 90 90 PRO HA H 90 4.417 4.487 -0.070 1
1 1044 . 14 1 1 A 90 90 PRO CA C 90 63.064 62.508 0.556 1
1 1045 . 14 1 1 A 90 90 PRO CB C 90 32.266 31.994 0.272 1
1 1048 . 14 1 1 A 91 91 ARG H H 91 8.502 8.403 0.099 1
1 1049 . 14 1 1 A 91 91 ARG HA H 91 4.305 4.483 -0.178 1
1 1056 . 14 1 1 A 91 91 ARG C C 91 176.831 175.676 1.155 1
1 1057 . 14 1 1 A 91 91 ARG CA C 91 56.002 56.540 -0.538 1
1 1058 . 14 1 1 A 91 91 ARG CB C 91 30.913 31.315 -0.402 1
1 1061 . 14 1 1 A 91 91 ARG N N 91 122.193 122.852 -0.659 1
1 1062 . 14 1 1 A 92 92 LYS H H 92 8.415 8.334 0.081 1
1 1063 . 14 1 1 A 92 92 LYS HA H 92 4.610 4.783 -0.173 1
1 1072 . 14 1 1 A 92 92 LYS C C 92 176.262 176.282 -0.020 1
1 1073 . 14 1 1 A 92 92 LYS CA C 92 54.258 53.200 1.058 1
1 1074 . 14 1 1 A 92 92 LYS CB C 92 32.672 34.192 -1.520 1
1 1078 . 14 1 1 A 92 92 LYS N N 92 124.243 120.342 3.901 1
1 1079 . 14 1 1 A 93 93 PRO HA H 93 4.415 4.458 -0.043 1
1 1086 . 14 1 1 A 93 93 PRO CA C 93 62.899 64.038 -1.139 1
1 1087 . 14 1 1 A 93 93 PRO CB C 93 32.323 32.088 0.235 1
1 1090 . 14 1 1 A 94 94 LYS H H 94 8.420 7.327 1.093 1
1 1091 . 14 1 1 A 94 94 LYS HA H 94 4.290 4.686 -0.396 1
1 1100 . 14 1 1 A 94 94 LYS C C 94 176.714 174.893 1.821 1
1 1101 . 14 1 1 A 94 94 LYS CA C 94 56.585 54.894 1.691 1
1 1102 . 14 1 1 A 94 94 LYS CB C 94 33.161 35.592 -2.431 1
1 1106 . 14 1 1 A 94 94 LYS N N 94 122.121 111.830 10.291 1
1 1107 . 14 1 1 A 95 95 ALA H H 95 8.348 8.523 -0.175 1
1 1108 . 14 1 1 A 95 95 ALA HA H 95 4.250 4.302 -0.052 1
1 1112 . 14 1 1 A 95 95 ALA C C 95 176.453 177.450 -0.997 1
1 1113 . 14 1 1 A 95 95 ALA CA C 95 52.471 52.104 0.367 1
1 1114 . 14 1 1 A 95 95 ALA CB C 95 19.347 19.060 0.287 1
1 1115 . 14 1 1 A 95 95 ALA N N 95 125.624 124.191 1.433 1
1 1116 . 14 1 1 A 96 96 ALA H H 96 8.348 8.277 0.071 1
1 1117 . 14 1 1 A 96 96 ALA HA H 96 4.254 4.267 -0.013 1
1 1121 . 14 1 1 A 96 96 ALA C C 96 176.462 176.867 -0.405 1
1 1122 . 14 1 1 A 96 96 ALA CA C 96 52.471 52.080 0.391 1
1 1123 . 14 1 1 A 96 96 ALA CB C 96 19.347 19.525 -0.178 1
1 1124 . 14 1 1 A 96 96 ALA N N 96 125.624 123.484 2.140 1
1 1125 . 14 1 1 A 97 97 GLN H H 97 8.333 8.377 -0.044 1
1 1126 . 14 1 1 A 97 97 GLN HA H 97 4.362 4.716 -0.354 1
1 1133 . 14 1 1 A 97 97 GLN C C 97 177.684 175.898 1.786 1
1 1134 . 14 1 1 A 97 97 GLN CA C 97 55.848 54.648 1.200 1
1 1135 . 14 1 1 A 97 97 GLN CB C 97 29.643 32.257 -2.614 1
1 1137 . 14 1 1 A 97 97 GLN N N 97 120.049 119.207 0.842 1
1 1139 . 14 1 1 A 98 98 VAL H H 98 8.230 8.499 -0.269 1
1 1140 . 14 1 1 A 98 98 VAL HA H 98 4.145 3.963 0.182 1
1 1148 . 14 1 1 A 98 98 VAL C C 98 176.033 175.088 0.945 1
1 1149 . 14 1 1 A 98 98 VAL CA C 98 62.444 64.855 -2.411 1
1 1150 . 14 1 1 A 98 98 VAL CB C 98 32.942 32.317 0.625 1
1 1153 . 14 1 1 A 98 98 VAL N N 98 121.607 124.183 -2.576 1
1 1154 . 14 1 1 A 99 99 SER H H 99 8.375 7.652 0.723 1
1 1155 . 14 1 1 A 99 99 SER HA H 99 4.473 4.842 -0.369 1
1 1158 . 14 1 1 A 99 99 SER C C 99 176.204 173.761 2.443 1
1 1159 . 14 1 1 A 99 99 SER CA C 99 58.379 57.718 0.661 1
1 1160 . 14 1 1 A 99 99 SER CB C 99 63.914 67.046 -3.132 1
1 1161 . 14 1 1 A 99 99 SER N N 99 119.455 113.800 5.655 1
1 1162 . 14 1 1 A 100 100 GLU H H 100 8.547 8.694 -0.147 1
1 1163 . 14 1 1 A 100 100 GLU HA H 100 4.304 4.382 -0.078 1
1 1168 . 14 1 1 A 100 100 GLU C C 100 174.620 176.574 -1.954 1
1 1169 . 14 1 1 A 100 100 GLU CA C 100 56.835 57.414 -0.579 1
1 1170 . 14 1 1 A 100 100 GLU CB C 100 30.365 29.856 0.509 1
1 1172 . 14 1 1 A 100 100 GLU N N 100 123.419 121.949 1.470 1
1 1173 . 14 1 1 A 101 101 GLU H H 101 8.432 7.661 0.771 1
1 1174 . 14 1 1 A 101 101 GLU HA H 101 4.252 4.140 0.112 1
1 1179 . 14 1 1 A 101 101 GLU C C 101 176.693 176.020 0.673 1
1 1180 . 14 1 1 A 101 101 GLU CA C 101 56.835 57.354 -0.519 1
1 1181 . 14 1 1 A 101 101 GLU CB C 101 30.365 30.407 -0.042 1
1 1183 . 14 1 1 A 101 101 GLU N N 101 122.025 122.524 -0.499 1
1 1184 . 14 1 1 A 102 102 ALA H H 102 8.324 8.943 -0.619 1
1 1185 . 14 1 1 A 102 102 ALA HA H 102 4.361 4.749 -0.388 1
1 1189 . 14 1 1 A 102 102 ALA C C 102 177.065 176.157 0.908 1
1 1190 . 14 1 1 A 102 102 ALA CA C 102 52.647 51.264 1.383 1
1 1191 . 14 1 1 A 102 102 ALA CB C 102 19.227 23.094 -3.867 1
1 1192 . 14 1 1 A 102 102 ALA N N 102 125.114 128.308 -3.194 1
1 1193 . 14 1 1 A 103 103 SER H H 103 8.259 8.511 -0.252 1
1 1194 . 14 1 1 A 103 103 SER HA H 103 4.473 4.448 0.025 1
1 1197 . 14 1 1 A 103 103 SER C C 103 177.772 175.087 2.685 1
1 1198 . 14 1 1 A 103 103 SER CA C 103 58.301 58.984 -0.683 1
1 1199 . 14 1 1 A 103 103 SER CB C 103 63.961 63.507 0.454 1
1 1200 . 14 1 1 A 103 103 SER N N 103 115.109 115.981 -0.872 1
1 1201 . 14 1 1 A 104 104 THR H H 104 8.127 8.479 -0.352 1
1 1202 . 14 1 1 A 104 104 THR HA H 104 4.600 4.351 0.249 1
1 1207 . 14 1 1 A 104 104 THR C C 104 174.427 172.911 1.516 1
1 1208 . 14 1 1 A 104 104 THR CA C 104 59.954 61.371 -1.417 1
1 1209 . 14 1 1 A 104 104 THR CB C 104 69.868 69.539 0.329 1
1 1211 . 14 1 1 A 104 104 THR N N 104 117.882 119.011 -1.129 1
1 1212 . 14 1 1 A 105 105 PRO HA H 105 4.414 4.586 -0.172 1
1 1219 . 14 1 1 A 105 105 PRO CA C 105 63.300 62.749 0.551 1
1 1220 . 14 1 1 A 105 105 PRO CB C 105 32.227 32.655 -0.428 1
1 1223 . 14 1 1 A 106 106 GLN H H 106 8.524 8.780 -0.256 1
1 1224 . 14 1 1 A 106 106 GLN HA H 106 4.276 4.465 -0.189 1
1 1229 . 14 1 1 A 106 106 GLN C C 106 177.083 174.760 2.323 1
1 1230 . 14 1 1 A 106 106 GLN CA C 106 56.209 55.344 0.865 1
1 1231 . 14 1 1 A 106 106 GLN CB C 106 29.490 30.030 -0.540 1
1 1233 . 14 1 1 A 106 106 GLN N N 106 120.754 118.808 1.946 1
1 1234 . 14 1 1 A 107 107 GLY H H 107 8.394 7.074 1.320 1
1 1235 . 14 1 1 A 107 107 GLY HA2 H 107 3.895 3.927 -0.032 1
1 1236 . 14 1 1 A 107 107 GLY HA3 H 107 3.895 3.930 -0.035 1
1 1237 . 14 1 1 A 107 107 GLY C C 107 176.651 170.964 5.687 1
1 1238 . 14 1 1 A 107 107 GLY CA C 107 45.330 45.330 0.000 1
1 1239 . 14 1 1 A 107 107 GLY N N 107 110.026 106.506 3.520 1
1 1240 . 14 1 1 A 108 108 PHE H H 108 8.099 8.453 -0.354 1
1 1241 . 14 1 1 A 108 108 PHE HA H 108 4.582 5.399 -0.817 1
1 1245 . 14 1 1 A 108 108 PHE C C 108 173.944 174.157 -0.213 1
1 1246 . 14 1 1 A 108 108 PHE CA C 108 58.054 56.404 1.650 1
1 1247 . 14 1 1 A 108 108 PHE CB C 108 39.708 43.631 -3.923 1
1 1248 . 14 1 1 A 108 108 PHE N N 108 120.180 118.689 1.491 1
1 1249 . 14 1 1 A 109 109 ASN H H 109 8.482 8.804 -0.322 1
1 1250 . 14 1 1 A 109 109 ASN HA H 109 4.691 5.125 -0.434 1
1 1255 . 14 1 1 A 109 109 ASN C C 109 175.627 173.937 1.690 1
1 1256 . 14 1 1 A 109 109 ASN CA C 109 53.402 52.004 1.398 1
1 1257 . 14 1 1 A 109 109 ASN CB C 109 38.883 42.252 -3.369 1
1 1258 . 14 1 1 A 109 109 ASN N N 109 120.752 118.162 2.590 1
1 1260 . 14 1 1 A 110 110 THR H H 110 8.112 8.519 -0.407 1
1 1261 . 14 1 1 A 110 110 THR HA H 110 4.251 4.283 -0.032 1
1 1266 . 14 1 1 A 110 110 THR C C 110 175.275 175.331 -0.056 1
1 1267 . 14 1 1 A 110 110 THR CA C 110 62.460 61.205 1.255 1
1 1268 . 14 1 1 A 110 110 THR CB C 110 69.726 70.588 -0.862 1
1 1270 . 14 1 1 A 110 110 THR N N 110 114.601 114.019 0.582 1
1 1271 . 14 1 1 A 111 111 LEU H H 111 8.168 8.549 -0.381 1
1 1272 . 14 1 1 A 111 111 LEU HA H 111 4.308 4.106 0.202 1
1 1282 . 14 1 1 A 111 111 LEU CA C 111 55.704 57.993 -2.289 1
1 1283 . 14 1 1 A 111 111 LEU CB C 111 42.071 42.215 -0.144 1
1 1287 . 14 1 1 A 111 111 LEU N N 111 123.756 122.850 0.906 1
1 1288 . 14 1 1 A 112 112 LYS H H 112 8.123 7.614 0.509 1
1 1289 . 14 1 1 A 112 112 LYS HA H 112 4.242 4.650 -0.408 1
1 1298 . 14 1 1 A 112 112 LYS C C 112 177.547 173.999 3.548 1
1 1299 . 14 1 1 A 112 112 LYS CA C 112 56.928 54.766 2.162 1
1 1300 . 14 1 1 A 112 112 LYS CB C 112 33.055 34.996 -1.941 1
1 1304 . 14 1 1 A 112 112 LYS N N 112 121.442 114.058 7.384 1
1 1305 . 14 1 1 A 113 113 ASP H H 113 8.230 8.671 -0.441 1
1 1306 . 14 1 1 A 113 113 ASP HA H 113 4.526 4.739 -0.213 1
1 1309 . 14 1 1 A 113 113 ASP C C 113 176.532 175.331 1.201 1
1 1310 . 14 1 1 A 113 113 ASP CA C 113 54.896 54.808 0.088 1
1 1311 . 14 1 1 A 113 113 ASP CB C 113 41.362 41.760 -0.398 1
1 1312 . 14 1 1 A 113 113 ASP N N 113 120.598 121.599 -1.001 1
1 1313 . 14 1 1 A 114 114 LYS H H 114 8.127 8.526 -0.399 1
1 1314 . 14 1 1 A 114 114 LYS HA H 114 4.300 4.730 -0.430 1
1 1323 . 14 1 1 A 114 114 LYS C C 114 176.303 174.953 1.350 1
1 1324 . 14 1 1 A 114 114 LYS CA C 114 56.633 55.794 0.839 1
1 1325 . 14 1 1 A 114 114 LYS CB C 114 32.818 36.189 -3.371 1
1 1329 . 14 1 1 A 114 114 LYS N N 114 120.897 125.870 -4.973 1
1 1330 . 14 1 1 A 115 115 LEU H H 115 8.244 8.591 -0.347 1
1 1331 . 14 1 1 A 115 115 LEU HA H 115 4.254 4.589 -0.335 1
1 1341 . 14 1 1 A 115 115 LEU C C 115 176.909 175.185 1.724 1
1 1342 . 14 1 1 A 115 115 LEU CA C 115 56.282 55.873 0.409 1
1 1343 . 14 1 1 A 115 115 LEU CB C 115 42.188 42.180 0.008 1
1 1347 . 14 1 1 A 115 115 LEU N N 115 123.251 127.594 -4.343 1
1 1348 . 14 1 1 A 116 116 GLU H H 116 8.421 8.386 0.035 1
1 1349 . 14 1 1 A 116 116 GLU HA H 116 4.190 4.376 -0.186 1
1 1352 . 14 1 1 A 116 116 GLU C C 116 177.828 175.993 1.835 1
1 1353 . 14 1 1 A 116 116 GLU CA C 116 57.466 55.043 2.423 1
1 1354 . 14 1 1 A 116 116 GLU CB C 116 30.124 32.336 -2.212 1
1 1355 . 14 1 1 A 116 116 GLU N N 116 120.575 126.843 -6.268 1
1 1356 . 14 1 1 A 117 117 GLU H H 117 8.255 8.462 -0.207 1
1 1357 . 14 1 1 A 117 117 GLU HA H 117 4.192 3.917 0.275 1
1 1362 . 14 1 1 A 117 117 GLU CA C 117 57.491 59.144 -1.653 1
1 1363 . 14 1 1 A 117 117 GLU CB C 117 30.365 29.012 1.353 1
1 1365 . 14 1 1 A 117 117 GLU N N 117 120.933 123.448 -2.515 1
1 1366 . 14 1 1 A 118 118 TRP H H 118 8.143 7.740 0.403 1
1 1367 . 14 1 1 A 118 118 TRP HA H 118 4.581 4.496 0.085 1
1 1372 . 14 1 1 A 118 118 TRP C C 118 176.794 178.133 -1.339 1
1 1373 . 14 1 1 A 118 118 TRP CA C 118 58.363 59.455 -1.092 1
1 1374 . 14 1 1 A 118 118 TRP CB C 118 29.333 27.991 1.342 1
1 1375 . 14 1 1 A 118 118 TRP N N 118 121.592 119.256 2.336 1
1 1376 . 14 1 1 A 119 119 ILE H H 119 7.908 8.212 -0.304 1
1 1377 . 14 1 1 A 119 119 ILE HA H 119 3.828 4.123 -0.295 1
1 1387 . 14 1 1 A 119 119 ILE C C 119 176.984 177.922 -0.938 1
1 1388 . 14 1 1 A 119 119 ILE CA C 119 62.335 63.421 -1.086 1
1 1389 . 14 1 1 A 119 119 ILE CB C 119 38.649 37.666 0.983 1
1 1393 . 14 1 1 A 119 119 ILE N N 119 122.744 123.449 -0.705 1
1 1394 . 14 1 1 A 120 120 GLU H H 120 8.143 8.116 0.027 1
1 1395 . 14 1 1 A 120 120 GLU HA H 120 4.093 4.082 0.011 1
1 1400 . 14 1 1 A 120 120 GLU C C 120 176.565 177.532 -0.967 1
1 1401 . 14 1 1 A 120 120 GLU CA C 120 57.613 59.084 -1.471 1
1 1402 . 14 1 1 A 120 120 GLU CB C 120 29.834 29.576 0.258 1
1 1404 . 14 1 1 A 120 120 GLU N N 120 123.139 121.429 1.710 1
1 1405 . 14 1 1 A 121 121 MET H H 121 8.254 7.857 0.397 1
1 1406 . 14 1 1 A 121 121 MET HA H 121 4.357 4.749 -0.392 1
1 1411 . 14 1 1 A 121 121 MET CA C 121 56.625 54.375 2.250 1
1 1412 . 14 1 1 A 121 121 MET CB C 121 32.664 34.743 -2.079 1
1 1414 . 14 1 1 A 121 121 MET N N 121 120.449 113.690 6.759 1
1 1415 . 14 1 1 A 122 122 SER H H 122 8.199 8.015 0.184 1
1 1416 . 14 1 1 A 122 122 SER HA H 122 4.280 5.178 -0.898 1
1 1419 . 14 1 1 A 122 122 SER C C 122 177.224 172.616 4.608 1
1 1420 . 14 1 1 A 122 122 SER CA C 122 59.635 57.215 2.420 1
1 1421 . 14 1 1 A 122 122 SER CB C 122 63.560 66.305 -2.745 1
1 1422 . 14 1 1 A 122 122 SER N N 122 115.857 115.696 0.161 1
1 1423 . 14 1 1 A 123 123 ASN H H 123 8.211 8.832 -0.621 1
1 1424 . 14 1 1 A 123 123 ASN HA H 123 4.737 5.308 -0.571 1
1 1429 . 14 1 1 A 123 123 ASN C C 123 174.709 173.387 1.322 1
1 1430 . 14 1 1 A 123 123 ASN CA C 123 53.507 52.575 0.932 1
1 1431 . 14 1 1 A 123 123 ASN CB C 123 38.800 42.975 -4.175 1
1 1432 . 14 1 1 A 123 123 ASN N N 123 119.923 122.387 -2.464 1
1 1434 . 14 1 1 A 124 124 ARG H H 124 7.997 8.668 -0.671 1
1 1435 . 14 1 1 A 124 124 ARG HA H 124 4.305 4.963 -0.658 1
1 1442 . 14 1 1 A 124 124 ARG C C 124 175.477 174.212 1.265 1
1 1443 . 14 1 1 A 124 124 ARG CA C 124 56.709 54.852 1.857 1
1 1444 . 14 1 1 A 124 124 ARG CB C 124 30.584 34.168 -3.584 1
1 1447 . 14 1 1 A 124 124 ARG N N 124 120.821 124.419 -3.598 1
1 1448 . 14 1 1 A 125 125 LYS H H 125 8.327 8.627 -0.300 1
1 1449 . 14 1 1 A 125 125 LYS HA H 125 4.254 4.724 -0.470 1
1 1458 . 14 1 1 A 125 125 LYS C C 125 176.777 175.465 1.312 1
1 1459 . 14 1 1 A 125 125 LYS CA C 125 56.860 55.688 1.172 1
1 1460 . 14 1 1 A 125 125 LYS CB C 125 32.879 33.353 -0.474 1
1 1464 . 14 1 1 A 125 125 LYS N N 125 121.891 122.378 -0.487 1
1 1465 . 14 1 1 A 126 126 ASP H H 126 8.343 7.659 0.684 1
1 1466 . 14 1 1 A 126 126 ASP HA H 126 4.581 5.052 -0.471 1
1 1469 . 14 1 1 A 126 126 ASP C C 126 176.538 174.690 1.848 1
1 1470 . 14 1 1 A 126 126 ASP CA C 126 54.540 53.127 1.413 1
1 1471 . 14 1 1 A 126 126 ASP CB C 126 40.907 44.827 -3.920 1
1 1472 . 14 1 1 A 126 126 ASP N N 126 119.814 118.715 1.099 1
1 1473 . 14 1 1 A 127 127 LEU H H 127 7.946 8.676 -0.730 1
1 1474 . 14 1 1 A 127 127 LEU HA H 127 4.309 4.376 -0.067 1
1 1484 . 14 1 1 A 127 127 LEU C C 127 176.043 177.588 -1.545 1
1 1485 . 14 1 1 A 127 127 LEU CA C 127 55.427 55.128 0.299 1
1 1486 . 14 1 1 A 127 127 LEU CB C 127 42.394 41.537 0.857 1
1 1490 . 14 1 1 A 127 127 LEU N N 127 121.432 124.046 -2.614 1
1 1491 . 14 1 1 A 128 128 ILE H H 128 7.967 8.796 -0.829 1
1 1492 . 14 1 1 A 128 128 ILE HA H 128 4.141 3.920 0.221 1
1 1502 . 14 1 1 A 128 128 ILE C C 128 177.200 177.387 -0.187 1
1 1503 . 14 1 1 A 128 128 ILE CA C 128 61.150 63.909 -2.759 1
1 1504 . 14 1 1 A 128 128 ILE CB C 128 38.489 38.015 0.474 1
1 1508 . 14 1 1 A 128 128 ILE N N 128 121.579 126.519 -4.940 1
1 1509 . 14 1 1 A 129 129 LYS H H 129 8.331 8.468 -0.137 1
1 1510 . 14 1 1 A 129 129 LYS HA H 129 4.328 4.040 0.288 1
1 1519 . 14 1 1 A 129 129 LYS C C 129 175.952 177.859 -1.907 1
1 1520 . 14 1 1 A 129 129 LYS CA C 129 56.330 58.712 -2.382 1
1 1521 . 14 1 1 A 129 129 LYS CB C 129 33.010 31.341 1.669 1
1 1525 . 14 1 1 A 129 129 LYS N N 129 126.955 120.403 6.552 1
1 1 . 15 1 1 A 2 2 ALA HA H 2 4.070 5.068 -0.998 1
1 5 . 15 1 1 A 2 2 ALA CA C 2 52.067 51.176 0.891 1
1 6 . 15 1 1 A 2 2 ALA CB C 2 19.577 24.341 -4.764 1
1 7 . 15 1 1 A 3 3 ALA H H 3 8.714 8.421 0.293 1
1 8 . 15 1 1 A 3 3 ALA HA H 3 4.253 4.604 -0.351 1
1 12 . 15 1 1 A 3 3 ALA C C 3 173.672 176.936 -3.264 1
1 13 . 15 1 1 A 3 3 ALA CA C 3 52.067 51.112 0.955 1
1 14 . 15 1 1 A 3 3 ALA CB C 3 19.577 22.581 -3.004 1
1 15 . 15 1 1 A 3 3 ALA N N 3 124.480 119.662 4.818 1
1 16 . 15 1 1 A 4 4 LYS H H 4 8.227 8.487 -0.260 1
1 17 . 15 1 1 A 4 4 LYS HA H 4 3.976 4.002 -0.026 1
1 26 . 15 1 1 A 4 4 LYS C C 4 176.672 177.348 -0.676 1
1 27 . 15 1 1 A 4 4 LYS CA C 4 57.274 59.169 -1.895 1
1 28 . 15 1 1 A 4 4 LYS CB C 4 33.209 31.861 1.348 1
1 32 . 15 1 1 A 4 4 LYS N N 4 120.988 119.686 1.302 1
1 33 . 15 1 1 A 5 5 PHE H H 5 7.719 7.248 0.471 1
1 34 . 15 1 1 A 5 5 PHE HA H 5 4.384 4.633 -0.249 1
1 38 . 15 1 1 A 5 5 PHE C C 5 175.364 175.488 -0.124 1
1 39 . 15 1 1 A 5 5 PHE CA C 5 57.074 59.358 -2.284 1
1 40 . 15 1 1 A 5 5 PHE CB C 5 39.669 40.013 -0.344 1
1 41 . 15 1 1 A 5 5 PHE N N 5 119.246 119.569 -0.323 1
1 42 . 15 1 1 A 6 6 GLU H H 6 8.515 9.154 -0.639 1
1 43 . 15 1 1 A 6 6 GLU HA H 6 4.370 5.051 -0.681 1
1 48 . 15 1 1 A 6 6 GLU CA C 6 55.669 54.835 0.834 1
1 49 . 15 1 1 A 6 6 GLU CB C 6 32.094 33.571 -1.477 1
1 51 . 15 1 1 A 6 6 GLU N N 6 122.193 119.790 2.403 1
1 52 . 15 1 1 A 7 7 VAL H H 7 8.636 8.636 0.000 1
1 53 . 15 1 1 A 7 7 VAL HA H 7 3.406 3.529 -0.123 1
1 61 . 15 1 1 A 7 7 VAL C C 7 176.611 177.097 -0.486 1
1 62 . 15 1 1 A 7 7 VAL CA C 7 65.358 65.658 -0.300 1
1 63 . 15 1 1 A 7 7 VAL CB C 7 31.391 31.442 -0.051 1
1 66 . 15 1 1 A 7 7 VAL N N 7 122.949 121.778 1.171 1
1 67 . 15 1 1 A 8 8 GLY H H 8 9.394 9.102 0.292 1
1 68 . 15 1 1 A 8 8 GLY HA2 H 8 3.600 4.051 -0.451 1
1 69 . 15 1 1 A 8 8 GLY HA3 H 8 4.546 4.052 0.494 1
1 70 . 15 1 1 A 8 8 GLY C C 8 178.074 174.488 3.586 1
1 71 . 15 1 1 A 8 8 GLY CA C 8 45.121 44.855 0.266 1
1 72 . 15 1 1 A 8 8 GLY N N 8 116.837 116.004 0.833 1
1 73 . 15 1 1 A 9 9 SER H H 9 8.021 8.033 -0.012 1
1 74 . 15 1 1 A 9 9 SER HA H 9 4.680 4.474 0.206 1
1 77 . 15 1 1 A 9 9 SER C C 9 174.234 173.194 1.040 1
1 78 . 15 1 1 A 9 9 SER CA C 9 59.387 59.481 -0.094 1
1 79 . 15 1 1 A 9 9 SER CB C 9 65.584 64.589 0.995 1
1 80 . 15 1 1 A 9 9 SER N N 9 118.208 117.773 0.435 1
1 81 . 15 1 1 A 10 10 VAL H H 10 7.945 8.193 -0.248 1
1 82 . 15 1 1 A 10 10 VAL HA H 10 4.980 5.129 -0.149 1
1 90 . 15 1 1 A 10 10 VAL C C 10 171.388 174.329 -2.941 1
1 91 . 15 1 1 A 10 10 VAL CA C 10 61.021 61.009 0.012 1
1 92 . 15 1 1 A 10 10 VAL CB C 10 33.400 34.995 -1.595 1
1 95 . 15 1 1 A 10 10 VAL N N 10 121.118 122.477 -1.359 1
1 96 . 15 1 1 A 11 11 TYR H H 11 9.008 9.204 -0.196 1
1 97 . 15 1 1 A 11 11 TYR HA H 11 4.850 5.312 -0.462 1
1 101 . 15 1 1 A 11 11 TYR C C 11 174.926 174.678 0.248 1
1 102 . 15 1 1 A 11 11 TYR CA C 11 56.803 56.292 0.511 1
1 103 . 15 1 1 A 11 11 TYR CB C 11 43.676 43.888 -0.212 1
1 104 . 15 1 1 A 11 11 TYR N N 11 125.043 125.370 -0.327 1
1 105 . 15 1 1 A 12 12 THR H H 12 8.809 8.665 0.144 1
1 106 . 15 1 1 A 12 12 THR HA H 12 5.020 5.466 -0.446 1
1 111 . 15 1 1 A 12 12 THR C C 12 174.195 174.732 -0.537 1
1 112 . 15 1 1 A 12 12 THR CA C 12 62.487 60.022 2.465 1
1 113 . 15 1 1 A 12 12 THR CB C 12 69.743 71.992 -2.249 1
1 115 . 15 1 1 A 12 12 THR N N 12 116.850 114.990 1.860 1
1 116 . 15 1 1 A 13 13 GLY H H 13 9.179 8.406 0.773 1
1 117 . 15 1 1 A 13 13 GLY HA2 H 13 3.250 4.336 -1.086 1
1 118 . 15 1 1 A 13 13 GLY HA3 H 13 4.801 4.355 0.446 1
1 119 . 15 1 1 A 13 13 GLY C C 13 174.654 171.810 2.844 1
1 120 . 15 1 1 A 13 13 GLY CA C 13 44.377 45.317 -0.940 1
1 121 . 15 1 1 A 13 13 GLY N N 13 113.654 111.948 1.706 1
1 122 . 15 1 1 A 14 14 LYS H H 14 7.770 8.564 -0.794 1
1 123 . 15 1 1 A 14 14 LYS HA H 14 5.426 5.140 0.286 1
1 132 . 15 1 1 A 14 14 LYS C C 14 171.343 175.984 -4.641 1
1 133 . 15 1 1 A 14 14 LYS CA C 14 53.879 54.593 -0.714 1
1 134 . 15 1 1 A 14 14 LYS CB C 14 36.032 35.597 0.435 1
1 138 . 15 1 1 A 14 14 LYS N N 14 118.322 120.347 -2.025 1
1 139 . 15 1 1 A 15 15 VAL H H 15 9.206 9.293 -0.087 1
1 140 . 15 1 1 A 15 15 VAL HA H 15 4.400 4.302 0.098 1
1 148 . 15 1 1 A 15 15 VAL C C 15 176.306 177.275 -0.969 1
1 149 . 15 1 1 A 15 15 VAL CA C 15 63.648 63.440 0.208 1
1 150 . 15 1 1 A 15 15 VAL CB C 15 31.769 31.718 0.051 1
1 153 . 15 1 1 A 15 15 VAL N N 15 125.308 123.605 1.703 1
1 154 . 15 1 1 A 16 16 THR H H 16 9.403 9.333 0.070 1
1 155 . 15 1 1 A 16 16 THR HA H 16 4.562 4.714 -0.152 1
1 160 . 15 1 1 A 16 16 THR C C 16 178.098 174.554 3.544 1
1 161 . 15 1 1 A 16 16 THR CA C 16 62.018 61.467 0.551 1
1 162 . 15 1 1 A 16 16 THR CB C 16 69.720 69.912 -0.192 1
1 164 . 15 1 1 A 16 16 THR N N 16 121.753 117.554 4.199 1
1 165 . 15 1 1 A 17 17 GLY H H 17 7.600 7.074 0.526 1
1 166 . 15 1 1 A 17 17 GLY HA2 H 17 4.110 4.127 -0.017 1
1 167 . 15 1 1 A 17 17 GLY HA3 H 17 4.250 4.229 0.021 1
1 168 . 15 1 1 A 17 17 GLY C C 17 175.551 171.477 4.074 1
1 169 . 15 1 1 A 17 17 GLY CA C 17 46.258 45.558 0.700 1
1 170 . 15 1 1 A 17 17 GLY N N 17 109.407 108.817 0.590 1
1 171 . 15 1 1 A 18 18 LEU H H 18 8.820 8.528 0.292 1
1 172 . 15 1 1 A 18 18 LEU HA H 18 4.852 5.118 -0.266 1
1 182 . 15 1 1 A 18 18 LEU CA C 18 54.245 53.273 0.972 1
1 183 . 15 1 1 A 18 18 LEU CB C 18 44.906 45.879 -0.973 1
1 187 . 15 1 1 A 18 18 LEU N N 18 123.419 121.688 1.731 1
1 188 . 15 1 1 A 19 19 GLN H H 19 8.537 8.306 0.231 1
1 189 . 15 1 1 A 19 19 GLN HA H 19 4.520 4.746 -0.226 1
1 196 . 15 1 1 A 19 19 GLN C C 19 175.258 175.785 -0.527 1
1 197 . 15 1 1 A 19 19 GLN CA C 19 53.269 53.845 -0.576 1
1 198 . 15 1 1 A 19 19 GLN CB C 19 31.522 32.569 -1.047 1
1 200 . 15 1 1 A 19 19 GLN N N 19 120.187 121.323 -1.136 1
1 202 . 15 1 1 A 20 20 ALA H H 20 8.798 8.726 0.072 1
1 203 . 15 1 1 A 20 20 ALA HA H 20 4.010 4.098 -0.088 1
1 207 . 15 1 1 A 20 20 ALA C C 20 175.698 177.268 -1.570 1
1 208 . 15 1 1 A 20 20 ALA CA C 20 55.084 54.230 0.854 1
1 209 . 15 1 1 A 20 20 ALA CB C 20 18.277 18.700 -0.423 1
1 210 . 15 1 1 A 20 20 ALA N N 20 120.606 123.958 -3.352 1
1 211 . 15 1 1 A 21 21 TYR H H 21 6.618 7.723 -1.105 1
1 212 . 15 1 1 A 21 21 TYR HA H 21 4.540 4.856 -0.316 1
1 216 . 15 1 1 A 21 21 TYR C C 21 178.437 175.161 3.276 1
1 217 . 15 1 1 A 21 21 TYR CA C 21 55.120 56.942 -1.822 1
1 218 . 15 1 1 A 21 21 TYR CB C 21 37.891 40.280 -2.389 1
1 219 . 15 1 1 A 21 21 TYR N N 21 105.570 113.460 -7.890 1
1 220 . 15 1 1 A 22 22 GLY H H 22 7.203 7.084 0.119 1
1 221 . 15 1 1 A 22 22 GLY HA2 H 22 3.460 3.852 -0.392 1
1 222 . 15 1 1 A 22 22 GLY HA3 H 22 4.360 3.960 0.400 1
1 223 . 15 1 1 A 22 22 GLY C C 22 175.833 171.214 4.619 1
1 224 . 15 1 1 A 22 22 GLY CA C 22 46.356 45.568 0.788 1
1 225 . 15 1 1 A 22 22 GLY N N 22 109.854 108.669 1.185 1
1 226 . 15 1 1 A 23 23 ALA H H 23 8.549 8.526 0.023 1
1 227 . 15 1 1 A 23 23 ALA HA H 23 4.981 5.157 -0.176 1
1 231 . 15 1 1 A 23 23 ALA C C 23 168.810 175.882 -7.072 1
1 232 . 15 1 1 A 23 23 ALA CA C 23 49.178 50.740 -1.562 1
1 233 . 15 1 1 A 23 23 ALA CB C 23 22.797 21.871 0.926 1
1 234 . 15 1 1 A 23 23 ALA N N 23 118.749 122.287 -3.538 1
1 235 . 15 1 1 A 24 24 PHE H H 24 8.812 8.603 0.209 1
1 236 . 15 1 1 A 24 24 PHE HA H 24 5.125 4.898 0.227 1
1 240 . 15 1 1 A 24 24 PHE CA C 24 58.017 58.096 -0.079 1
1 241 . 15 1 1 A 24 24 PHE CB C 24 40.475 40.500 -0.025 1
1 242 . 15 1 1 A 24 24 PHE N N 24 122.891 122.107 0.784 1
1 243 . 15 1 1 A 25 25 VAL H H 25 8.880 9.019 -0.139 1
1 244 . 15 1 1 A 25 25 VAL HA H 25 4.660 4.722 -0.062 1
1 252 . 15 1 1 A 25 25 VAL CA C 25 60.379 61.135 -0.756 1
1 253 . 15 1 1 A 25 25 VAL CB C 25 35.654 35.034 0.620 1
1 256 . 15 1 1 A 25 25 VAL N N 25 122.908 121.290 1.618 1
1 257 . 15 1 1 A 26 26 ALA H H 26 9.403 8.812 0.591 1
1 258 . 15 1 1 A 26 26 ALA HA H 26 4.750 4.346 0.404 1
1 262 . 15 1 1 A 26 26 ALA C C 26 174.445 176.730 -2.285 1
1 263 . 15 1 1 A 26 26 ALA CA C 26 51.711 52.422 -0.711 1
1 264 . 15 1 1 A 26 26 ALA CB C 26 19.319 19.195 0.124 1
1 265 . 15 1 1 A 26 26 ALA N N 26 129.425 130.394 -0.969 1
1 266 . 15 1 1 A 27 27 LEU H H 27 8.601 9.279 -0.678 1
1 267 . 15 1 1 A 27 27 LEU HA H 27 4.158 4.589 -0.431 1
1 277 . 15 1 1 A 27 27 LEU C C 27 177.814 176.347 1.467 1
1 278 . 15 1 1 A 27 27 LEU CA C 27 55.869 55.701 0.168 1
1 279 . 15 1 1 A 27 27 LEU CB C 27 42.251 43.637 -1.386 1
1 283 . 15 1 1 A 27 27 LEU N N 27 127.169 121.821 5.348 1
1 284 . 15 1 1 A 28 28 ASP H H 28 8.172 7.952 0.220 1
1 285 . 15 1 1 A 28 28 ASP HA H 28 4.420 4.822 -0.402 1
1 288 . 15 1 1 A 28 28 ASP C C 28 177.116 175.804 1.312 1
1 289 . 15 1 1 A 28 28 ASP CA C 28 53.755 53.625 0.130 1
1 290 . 15 1 1 A 28 28 ASP CB C 28 39.833 43.770 -3.937 1
1 291 . 15 1 1 A 28 28 ASP N N 28 115.657 117.400 -1.743 1
1 292 . 15 1 1 A 29 29 GLU H H 29 8.857 9.137 -0.280 1
1 293 . 15 1 1 A 29 29 GLU HA H 29 4.090 4.111 -0.021 1
1 298 . 15 1 1 A 29 29 GLU C C 29 175.965 176.595 -0.630 1
1 299 . 15 1 1 A 29 29 GLU CA C 29 59.470 58.558 0.912 1
1 300 . 15 1 1 A 29 29 GLU CB C 29 29.409 28.925 0.484 1
1 302 . 15 1 1 A 29 29 GLU N N 29 114.738 121.384 -6.646 1
1 303 . 15 1 1 A 30 30 GLU H H 30 8.326 8.210 0.116 1
1 304 . 15 1 1 A 30 30 GLU HA H 30 4.640 4.545 0.095 1
1 309 . 15 1 1 A 30 30 GLU C C 30 176.817 174.895 1.922 1
1 310 . 15 1 1 A 30 30 GLU CA C 30 56.073 55.942 0.131 1
1 311 . 15 1 1 A 30 30 GLU CB C 30 32.453 31.286 1.167 1
1 313 . 15 1 1 A 30 30 GLU N N 30 115.753 117.817 -2.064 1
1 314 . 15 1 1 A 31 31 THR H H 31 7.819 7.579 0.240 1
1 315 . 15 1 1 A 31 31 THR HA H 31 4.484 5.102 -0.618 1
1 320 . 15 1 1 A 31 31 THR C C 31 176.330 173.015 3.315 1
1 321 . 15 1 1 A 31 31 THR CA C 31 63.398 61.077 2.321 1
1 322 . 15 1 1 A 31 31 THR CB C 31 69.367 72.136 -2.769 1
1 324 . 15 1 1 A 31 31 THR N N 31 118.750 115.496 3.254 1
1 325 . 15 1 1 A 32 32 GLN H H 32 8.913 8.655 0.258 1
1 326 . 15 1 1 A 32 32 GLN HA H 32 5.337 4.739 0.598 1
1 333 . 15 1 1 A 32 32 GLN C C 32 173.087 174.450 -1.363 1
1 334 . 15 1 1 A 32 32 GLN CA C 32 54.051 54.956 -0.905 1
1 335 . 15 1 1 A 32 32 GLN CB C 32 32.672 32.945 -0.273 1
1 337 . 15 1 1 A 32 32 GLN N N 32 127.294 125.258 2.036 1
1 339 . 15 1 1 A 33 33 GLY H H 33 8.900 8.513 0.387 1
1 340 . 15 1 1 A 33 33 GLY HA2 H 33 3.290 4.382 -1.092 1
1 341 . 15 1 1 A 33 33 GLY HA3 H 33 4.530 4.442 0.088 1
1 342 . 15 1 1 A 33 33 GLY C C 33 174.918 172.222 2.696 1
1 343 . 15 1 1 A 33 33 GLY CA C 33 44.534 44.718 -0.184 1
1 344 . 15 1 1 A 33 33 GLY N N 33 107.639 110.550 -2.911 1
1 345 . 15 1 1 A 34 34 LEU H H 34 8.127 8.482 -0.355 1
1 346 . 15 1 1 A 34 34 LEU HA H 34 4.950 4.922 0.028 1
1 356 . 15 1 1 A 34 34 LEU CA C 34 53.755 53.764 -0.009 1
1 357 . 15 1 1 A 34 34 LEU CB C 34 45.493 45.198 0.295 1
1 361 . 15 1 1 A 34 34 LEU N N 34 120.897 121.504 -0.607 1
1 362 . 15 1 1 A 35 35 VAL H H 35 9.386 8.851 0.535 1
1 363 . 15 1 1 A 35 35 VAL HA H 35 4.479 4.336 0.143 1
1 371 . 15 1 1 A 35 35 VAL C C 35 176.402 175.733 0.669 1
1 372 . 15 1 1 A 35 35 VAL CA C 35 59.594 62.936 -3.342 1
1 373 . 15 1 1 A 35 35 VAL CB C 35 32.590 31.556 1.034 1
1 376 . 15 1 1 A 35 35 VAL N N 35 128.897 128.049 0.848 1
1 377 . 15 1 1 A 36 36 HIS H H 36 9.194 8.869 0.325 1
1 378 . 15 1 1 A 36 36 HIS HA H 36 4.487 4.567 -0.080 1
1 381 . 15 1 1 A 36 36 HIS C C 36 174.864 176.399 -1.535 1
1 382 . 15 1 1 A 36 36 HIS CA C 36 59.426 56.744 2.682 1
1 383 . 15 1 1 A 36 36 HIS CB C 36 31.542 30.752 0.790 1
1 384 . 15 1 1 A 36 36 HIS N N 36 127.751 126.993 0.758 1
1 385 . 15 1 1 A 37 37 ILE H H 37 7.454 8.805 -1.351 1
1 386 . 15 1 1 A 37 37 ILE HA H 37 3.810 3.593 0.217 1
1 396 . 15 1 1 A 37 37 ILE C C 37 176.948 177.708 -0.760 1
1 397 . 15 1 1 A 37 37 ILE CA C 37 63.773 64.713 -0.940 1
1 398 . 15 1 1 A 37 37 ILE CB C 37 38.993 37.427 1.566 1
1 402 . 15 1 1 A 37 37 ILE N N 37 126.266 127.096 -0.830 1
1 403 . 15 1 1 A 38 38 SER H H 38 8.343 7.478 0.865 1
1 404 . 15 1 1 A 38 38 SER HA H 38 4.370 4.123 0.247 1
1 407 . 15 1 1 A 38 38 SER C C 38 174.792 174.996 -0.204 1
1 408 . 15 1 1 A 38 38 SER CA C 38 60.567 60.347 0.220 1
1 409 . 15 1 1 A 38 38 SER CB C 38 63.632 62.714 0.918 1
1 410 . 15 1 1 A 38 38 SER N N 38 118.079 117.624 0.455 1
1 411 . 15 1 1 A 39 39 GLU H H 39 8.536 8.051 0.485 1
1 412 . 15 1 1 A 39 39 GLU HA H 39 4.503 4.535 -0.032 1
1 417 . 15 1 1 A 39 39 GLU C C 39 175.131 176.881 -1.750 1
1 418 . 15 1 1 A 39 39 GLU CA C 39 54.928 56.366 -1.438 1
1 419 . 15 1 1 A 39 39 GLU CB C 39 29.621 30.648 -1.027 1
1 421 . 15 1 1 A 39 39 GLU N N 39 118.349 118.643 -0.294 1
1 422 . 15 1 1 A 40 40 VAL H H 40 7.776 7.650 0.126 1
1 423 . 15 1 1 A 40 40 VAL HA H 40 3.616 3.928 -0.312 1
1 431 . 15 1 1 A 40 40 VAL C C 40 177.277 176.121 1.156 1
1 432 . 15 1 1 A 40 40 VAL CA C 40 66.245 64.178 2.067 1
1 433 . 15 1 1 A 40 40 VAL CB C 40 32.590 32.331 0.259 1
1 436 . 15 1 1 A 40 40 VAL N N 40 125.443 117.351 8.092 1
1 437 . 15 1 1 A 41 41 THR H H 41 7.888 7.616 0.272 1
1 438 . 15 1 1 A 41 41 THR HA H 41 4.345 4.935 -0.590 1
1 443 . 15 1 1 A 41 41 THR C C 41 173.492 173.591 -0.099 1
1 444 . 15 1 1 A 41 41 THR CA C 41 59.047 61.551 -2.504 1
1 445 . 15 1 1 A 41 41 THR CB C 41 68.992 73.011 -4.019 1
1 447 . 15 1 1 A 41 41 THR N N 41 109.905 113.180 -3.275 1
1 448 . 15 1 1 A 42 42 HIS H H 42 8.063 8.784 -0.721 1
1 449 . 15 1 1 A 42 42 HIS HA H 42 4.510 4.602 -0.092 1
1 452 . 15 1 1 A 42 42 HIS C C 42 172.139 174.325 -2.186 1
1 453 . 15 1 1 A 42 42 HIS CA C 42 57.735 55.006 2.729 1
1 454 . 15 1 1 A 42 42 HIS CB C 42 31.144 28.548 2.596 1
1 455 . 15 1 1 A 42 42 HIS N N 42 121.760 125.649 -3.889 1
1 456 . 15 1 1 A 43 43 GLY H H 43 8.286 7.379 0.907 1
1 457 . 15 1 1 A 43 43 GLY HA2 H 43 3.980 3.847 0.133 1
1 458 . 15 1 1 A 43 43 GLY HA3 H 43 3.980 4.004 -0.024 1
1 459 . 15 1 1 A 43 43 GLY C C 43 176.307 171.688 4.619 1
1 460 . 15 1 1 A 43 43 GLY CA C 43 44.336 45.873 -1.537 1
1 461 . 15 1 1 A 43 43 GLY N N 43 110.133 107.851 2.282 1
1 462 . 15 1 1 A 44 44 PHE H H 44 8.327 8.346 -0.019 1
1 463 . 15 1 1 A 44 44 PHE HA H 44 4.489 4.514 -0.025 1
1 467 . 15 1 1 A 44 44 PHE C C 44 171.877 176.349 -4.472 1
1 468 . 15 1 1 A 44 44 PHE CA C 44 58.027 58.400 -0.373 1
1 469 . 15 1 1 A 44 44 PHE CB C 44 39.850 39.666 0.184 1
1 470 . 15 1 1 A 44 44 PHE N N 44 120.049 120.118 -0.069 1
1 471 . 15 1 1 A 45 45 VAL H H 45 7.939 8.660 -0.721 1
1 472 . 15 1 1 A 45 45 VAL HA H 45 3.865 4.153 -0.288 1
1 480 . 15 1 1 A 45 45 VAL C C 45 175.523 176.074 -0.551 1
1 481 . 15 1 1 A 45 45 VAL CA C 45 61.536 60.264 1.272 1
1 482 . 15 1 1 A 45 45 VAL CB C 45 33.127 34.481 -1.354 1
1 485 . 15 1 1 A 45 45 VAL N N 45 127.882 120.472 7.410 1
1 486 . 15 1 1 A 46 46 LYS H H 46 8.868 9.074 -0.206 1
1 487 . 15 1 1 A 46 46 LYS HA H 46 4.170 4.122 0.048 1
1 496 . 15 1 1 A 46 46 LYS C C 46 175.728 176.222 -0.494 1
1 497 . 15 1 1 A 46 46 LYS CA C 46 57.198 58.618 -1.420 1
1 498 . 15 1 1 A 46 46 LYS CB C 46 33.299 32.999 0.300 1
1 502 . 15 1 1 A 46 46 LYS N N 46 127.308 127.040 0.268 1
1 503 . 15 1 1 A 47 47 ASP H H 47 7.652 7.993 -0.341 1
1 504 . 15 1 1 A 47 47 ASP HA H 47 4.710 4.848 -0.138 1
1 507 . 15 1 1 A 47 47 ASP C C 47 176.411 175.976 0.435 1
1 508 . 15 1 1 A 47 47 ASP CA C 47 53.390 54.010 -0.620 1
1 509 . 15 1 1 A 47 47 ASP CB C 47 42.635 44.391 -1.756 1
1 510 . 15 1 1 A 47 47 ASP N N 47 117.932 114.605 3.327 1
1 511 . 15 1 1 A 48 48 ILE H H 48 9.230 8.658 0.572 1
1 512 . 15 1 1 A 48 48 ILE HA H 48 3.579 3.882 -0.303 1
1 522 . 15 1 1 A 48 48 ILE C C 48 177.249 177.553 -0.304 1
1 523 . 15 1 1 A 48 48 ILE CA C 48 65.525 63.609 1.916 1
1 524 . 15 1 1 A 48 48 ILE CB C 48 38.797 37.894 0.903 1
1 528 . 15 1 1 A 48 48 ILE N N 48 129.049 125.532 3.517 1
1 529 . 15 1 1 A 49 49 ASN H H 49 8.468 9.022 -0.554 1
1 530 . 15 1 1 A 49 49 ASN HA H 49 4.690 4.655 0.035 1
1 535 . 15 1 1 A 49 49 ASN C C 49 175.779 176.495 -0.716 1
1 536 . 15 1 1 A 49 49 ASN CA C 49 55.587 54.990 0.597 1
1 537 . 15 1 1 A 49 49 ASN CB C 49 38.587 36.736 1.851 1
1 538 . 15 1 1 A 49 49 ASN N N 49 118.835 117.678 1.157 1
1 540 . 15 1 1 A 50 50 GLU H H 50 7.853 8.295 -0.442 1
1 541 . 15 1 1 A 50 50 GLU HA H 50 4.040 4.269 -0.229 1
1 546 . 15 1 1 A 50 50 GLU C C 50 176.148 177.297 -1.149 1
1 547 . 15 1 1 A 50 50 GLU CA C 50 57.404 57.395 0.009 1
1 548 . 15 1 1 A 50 50 GLU CB C 50 29.491 29.582 -0.091 1
1 550 . 15 1 1 A 50 50 GLU N N 50 116.358 118.151 -1.793 1
1 551 . 15 1 1 A 51 51 HIS H H 51 7.575 7.942 -0.367 1
1 552 . 15 1 1 A 51 51 HIS HA H 51 4.431 4.742 -0.311 1
1 555 . 15 1 1 A 51 51 HIS C C 51 176.383 174.773 1.610 1
1 556 . 15 1 1 A 51 51 HIS CA C 51 57.089 56.754 0.335 1
1 557 . 15 1 1 A 51 51 HIS CB C 51 33.168 32.197 0.971 1
1 558 . 15 1 1 A 51 51 HIS N N 51 115.828 115.593 0.235 1
1 559 . 15 1 1 A 52 52 LEU H H 52 7.640 7.785 -0.145 1
1 560 . 15 1 1 A 52 52 LEU HA H 52 4.796 4.907 -0.111 1
1 570 . 15 1 1 A 52 52 LEU C C 52 174.452 175.215 -0.763 1
1 571 . 15 1 1 A 52 52 LEU CA C 52 53.398 53.544 -0.146 1
1 572 . 15 1 1 A 52 52 LEU CB C 52 48.805 47.456 1.349 1
1 576 . 15 1 1 A 52 52 LEU N N 52 117.932 118.606 -0.674 1
1 577 . 15 1 1 A 53 53 SER H H 53 8.151 8.848 -0.697 1
1 578 . 15 1 1 A 53 53 SER HA H 53 4.680 5.010 -0.330 1
1 581 . 15 1 1 A 53 53 SER C C 53 174.304 173.785 0.519 1
1 582 . 15 1 1 A 53 53 SER CA C 53 56.714 57.663 -0.949 1
1 583 . 15 1 1 A 53 53 SER CB C 53 65.431 66.002 -0.571 1
1 584 . 15 1 1 A 53 53 SER N N 53 113.496 118.141 -4.645 1
1 585 . 15 1 1 A 54 54 VAL H H 54 8.782 8.547 0.235 1
1 586 . 15 1 1 A 54 54 VAL HA H 54 3.230 3.630 -0.400 1
1 594 . 15 1 1 A 54 54 VAL C C 54 173.745 177.547 -3.802 1
1 595 . 15 1 1 A 54 54 VAL CA C 54 66.232 65.281 0.951 1
1 596 . 15 1 1 A 54 54 VAL CB C 54 31.067 31.568 -0.501 1
1 599 . 15 1 1 A 54 54 VAL N N 54 124.401 125.842 -1.441 1
1 600 . 15 1 1 A 55 55 GLY H H 55 9.079 9.041 0.038 1
1 601 . 15 1 1 A 55 55 GLY HA2 H 55 3.530 3.860 -0.330 1
1 602 . 15 1 1 A 55 55 GLY HA3 H 55 4.553 3.861 0.692 1
1 603 . 15 1 1 A 55 55 GLY C C 55 177.219 173.222 3.997 1
1 604 . 15 1 1 A 55 55 GLY CA C 55 44.647 46.271 -1.624 1
1 605 . 15 1 1 A 55 55 GLY N N 55 117.320 114.863 2.457 1
1 606 . 15 1 1 A 56 56 ASP H H 56 7.943 7.745 0.198 1
1 607 . 15 1 1 A 56 56 ASP HA H 56 4.460 5.095 -0.635 1
1 610 . 15 1 1 A 56 56 ASP C C 56 176.055 173.709 2.346 1
1 611 . 15 1 1 A 56 56 ASP CA C 56 55.456 52.318 3.138 1
1 612 . 15 1 1 A 56 56 ASP CB C 56 40.914 44.502 -3.588 1
1 613 . 15 1 1 A 56 56 ASP N N 56 121.782 119.723 2.059 1
1 614 . 15 1 1 A 57 57 GLU H H 57 8.649 8.852 -0.203 1
1 615 . 15 1 1 A 57 57 GLU HA H 57 5.100 5.239 -0.139 1
1 620 . 15 1 1 A 57 57 GLU C C 57 175.635 175.745 -0.110 1
1 621 . 15 1 1 A 57 57 GLU CA C 57 55.805 55.460 0.345 1
1 622 . 15 1 1 A 57 57 GLU CB C 57 30.915 31.761 -0.846 1
1 624 . 15 1 1 A 57 57 GLU N N 57 122.513 123.855 -1.342 1
1 625 . 15 1 1 A 58 58 VAL H H 58 8.809 9.115 -0.306 1
1 626 . 15 1 1 A 58 58 VAL HA H 58 4.817 4.818 -0.001 1
1 634 . 15 1 1 A 58 58 VAL C C 58 176.528 174.014 2.514 1
1 635 . 15 1 1 A 58 58 VAL CA C 58 58.719 59.271 -0.552 1
1 636 . 15 1 1 A 58 58 VAL CB C 58 35.523 35.997 -0.474 1
1 639 . 15 1 1 A 58 58 VAL N N 58 118.382 119.547 -1.165 1
1 640 . 15 1 1 A 59 59 GLN H H 59 8.255 8.365 -0.110 1
1 641 . 15 1 1 A 59 59 GLN HA H 59 5.030 4.987 0.043 1
1 646 . 15 1 1 A 59 59 GLN CA C 59 54.843 55.809 -0.966 1
1 647 . 15 1 1 A 59 59 GLN CB C 59 30.111 29.832 0.279 1
1 649 . 15 1 1 A 59 59 GLN N N 59 120.933 122.421 -1.488 1
1 650 . 15 1 1 A 60 60 VAL H H 60 8.970 9.276 -0.306 1
1 651 . 15 1 1 A 60 60 VAL HA H 60 4.990 4.942 0.048 1
1 659 . 15 1 1 A 60 60 VAL C C 60 175.203 173.979 1.224 1
1 660 . 15 1 1 A 60 60 VAL CA C 60 57.404 59.155 -1.751 1
1 661 . 15 1 1 A 60 60 VAL CB C 60 35.771 35.622 0.149 1
1 664 . 15 1 1 A 60 60 VAL N N 60 111.046 118.503 -7.457 1
1 665 . 15 1 1 A 61 61 LYS H H 61 8.937 8.678 0.259 1
1 666 . 15 1 1 A 61 61 LYS HA H 61 5.100 4.922 0.178 1
1 675 . 15 1 1 A 61 61 LYS C C 61 173.610 176.357 -2.747 1
1 676 . 15 1 1 A 61 61 LYS CA C 61 53.762 54.846 -1.084 1
1 677 . 15 1 1 A 61 61 LYS CB C 61 36.273 34.525 1.748 1
1 681 . 15 1 1 A 61 61 LYS N N 61 121.930 123.966 -2.036 1
1 682 . 15 1 1 A 62 62 VAL H H 62 8.429 9.318 -0.889 1
1 683 . 15 1 1 A 62 62 VAL HA H 62 4.074 4.089 -0.015 1
1 691 . 15 1 1 A 62 62 VAL C C 62 176.912 175.896 1.016 1
1 692 . 15 1 1 A 62 62 VAL CA C 62 63.188 63.720 -0.532 1
1 693 . 15 1 1 A 62 62 VAL CB C 62 30.813 31.597 -0.784 1
1 696 . 15 1 1 A 62 62 VAL N N 62 126.329 127.168 -0.839 1
1 697 . 15 1 1 A 63 63 LEU H H 63 9.109 9.393 -0.284 1
1 698 . 15 1 1 A 63 63 LEU HA H 63 4.423 4.532 -0.109 1
1 708 . 15 1 1 A 63 63 LEU C C 63 176.091 176.086 0.005 1
1 709 . 15 1 1 A 63 63 LEU CA C 63 55.876 55.892 -0.016 1
1 710 . 15 1 1 A 63 63 LEU CB C 63 42.800 44.497 -1.697 1
1 714 . 15 1 1 A 63 63 LEU N N 63 129.436 129.505 -0.069 1
1 715 . 15 1 1 A 64 64 ALA H H 64 7.594 7.376 0.218 1
1 716 . 15 1 1 A 64 64 ALA HA H 64 4.455 4.774 -0.319 1
1 720 . 15 1 1 A 64 64 ALA C C 64 177.314 175.202 2.112 1
1 721 . 15 1 1 A 64 64 ALA CA C 64 52.557 51.673 0.884 1
1 722 . 15 1 1 A 64 64 ALA CB C 64 21.458 22.633 -1.175 1
1 723 . 15 1 1 A 64 64 ALA N N 64 117.791 118.916 -1.125 1
1 724 . 15 1 1 A 65 65 VAL H H 65 8.583 8.621 -0.038 1
1 725 . 15 1 1 A 65 65 VAL HA H 65 4.470 4.900 -0.430 1
1 733 . 15 1 1 A 65 65 VAL C C 65 174.697 174.861 -0.164 1
1 734 . 15 1 1 A 65 65 VAL CA C 65 61.936 60.608 1.328 1
1 735 . 15 1 1 A 65 65 VAL CB C 65 35.288 35.851 -0.563 1
1 738 . 15 1 1 A 65 65 VAL N N 65 120.009 119.734 0.275 1
1 739 . 15 1 1 A 66 66 ASP H H 66 8.567 8.953 -0.386 1
1 740 . 15 1 1 A 66 66 ASP HA H 66 4.880 4.973 -0.093 1
1 743 . 15 1 1 A 66 66 ASP C C 66 174.355 175.881 -1.526 1
1 744 . 15 1 1 A 66 66 ASP CA C 66 52.681 52.884 -0.203 1
1 745 . 15 1 1 A 66 66 ASP CB C 66 41.775 40.682 1.093 1
1 746 . 15 1 1 A 66 66 ASP N N 66 126.262 125.073 1.189 1
1 747 . 15 1 1 A 67 67 GLU H H 67 9.148 8.697 0.451 1
1 748 . 15 1 1 A 67 67 GLU HA H 67 4.110 4.112 -0.002 1
1 753 . 15 1 1 A 67 67 GLU C C 67 177.052 178.394 -1.342 1
1 754 . 15 1 1 A 67 67 GLU CA C 67 59.044 58.531 0.513 1
1 755 . 15 1 1 A 67 67 GLU CB C 67 29.919 29.029 0.890 1
1 757 . 15 1 1 A 67 67 GLU N N 67 125.480 124.437 1.043 1
1 758 . 15 1 1 A 68 68 GLU H H 68 8.384 8.007 0.377 1
1 759 . 15 1 1 A 68 68 GLU HA H 68 4.140 4.128 0.012 1
1 764 . 15 1 1 A 68 68 GLU C C 68 178.383 177.412 0.971 1
1 765 . 15 1 1 A 68 68 GLU CA C 68 59.044 59.074 -0.030 1
1 766 . 15 1 1 A 68 68 GLU CB C 68 29.919 29.393 0.526 1
1 768 . 15 1 1 A 68 68 GLU N N 68 119.760 119.068 0.692 1
1 769 . 15 1 1 A 69 69 LYS H H 69 7.799 7.725 0.074 1
1 770 . 15 1 1 A 69 69 LYS HA H 69 4.375 4.525 -0.150 1
1 779 . 15 1 1 A 69 69 LYS C C 69 178.297 176.913 1.384 1
1 780 . 15 1 1 A 69 69 LYS CA C 69 55.704 55.547 0.157 1
1 781 . 15 1 1 A 69 69 LYS CB C 69 33.622 34.314 -0.692 1
1 785 . 15 1 1 A 69 69 LYS N N 69 115.476 117.114 -1.638 1
1 786 . 15 1 1 A 70 70 GLY H H 70 7.994 7.842 0.152 1
1 787 . 15 1 1 A 70 70 GLY HA2 H 70 3.940 3.932 0.008 1
1 788 . 15 1 1 A 70 70 GLY HA3 H 70 3.960 3.939 0.021 1
1 789 . 15 1 1 A 70 70 GLY C C 70 177.215 174.437 2.778 1
1 790 . 15 1 1 A 70 70 GLY CA C 70 46.773 46.502 0.271 1
1 791 . 15 1 1 A 70 70 GLY N N 70 110.245 109.616 0.629 1
1 792 . 15 1 1 A 71 71 LYS H H 71 7.560 7.806 -0.246 1
1 793 . 15 1 1 A 71 71 LYS HA H 71 4.690 4.713 -0.023 1
1 802 . 15 1 1 A 71 71 LYS C C 71 174.607 175.885 -1.278 1
1 803 . 15 1 1 A 71 71 LYS CA C 71 55.332 54.461 0.871 1
1 804 . 15 1 1 A 71 71 LYS CB C 71 34.903 34.564 0.339 1
1 808 . 15 1 1 A 71 71 LYS N N 71 118.201 118.472 -0.271 1
1 809 . 15 1 1 A 72 72 ILE H H 72 8.867 8.639 0.228 1
1 810 . 15 1 1 A 72 72 ILE HA H 72 4.630 4.903 -0.273 1
1 820 . 15 1 1 A 72 72 ILE C C 72 175.708 174.643 1.065 1
1 821 . 15 1 1 A 72 72 ILE CA C 72 61.494 60.005 1.489 1
1 822 . 15 1 1 A 72 72 ILE CB C 72 40.652 42.383 -1.731 1
1 826 . 15 1 1 A 72 72 ILE N N 72 126.827 121.357 5.470 1
1 827 . 15 1 1 A 73 73 SER H H 73 8.815 8.900 -0.085 1
1 828 . 15 1 1 A 73 73 SER HA H 73 5.110 5.356 -0.246 1
1 831 . 15 1 1 A 73 73 SER C C 73 175.122 173.026 2.096 1
1 832 . 15 1 1 A 73 73 SER CA C 73 57.487 57.411 0.076 1
1 833 . 15 1 1 A 73 73 SER CB C 73 64.386 65.550 -1.164 1
1 834 . 15 1 1 A 73 73 SER N N 73 123.640 124.478 -0.838 1
1 835 . 15 1 1 A 74 74 LEU H H 74 8.585 8.923 -0.338 1
1 836 . 15 1 1 A 74 74 LEU HA H 74 5.450 5.319 0.131 1
1 846 . 15 1 1 A 74 74 LEU C C 74 174.061 175.502 -1.441 1
1 847 . 15 1 1 A 74 74 LEU CA C 74 53.101 53.480 -0.379 1
1 848 . 15 1 1 A 74 74 LEU CB C 74 48.268 46.724 1.544 1
1 852 . 15 1 1 A 74 74 LEU N N 74 125.221 124.157 1.064 1
1 853 . 15 1 1 A 75 75 SER H H 75 8.840 8.877 -0.037 1
1 854 . 15 1 1 A 75 75 SER HA H 75 5.040 5.231 -0.191 1
1 857 . 15 1 1 A 75 75 SER C C 75 176.552 173.134 3.418 1
1 858 . 15 1 1 A 75 75 SER CA C 75 57.487 56.505 0.982 1
1 859 . 15 1 1 A 75 75 SER CB C 75 64.993 65.579 -0.586 1
1 860 . 15 1 1 A 75 75 SER N N 75 111.252 114.272 -3.020 1
1 861 . 15 1 1 A 76 76 ILE H H 76 7.790 8.869 -1.079 1
1 862 . 15 1 1 A 76 76 ILE HA H 76 4.690 4.599 0.091 1
1 872 . 15 1 1 A 76 76 ILE C C 76 175.780 177.183 -1.403 1
1 873 . 15 1 1 A 76 76 ILE CA C 76 63.631 62.047 1.584 1
1 874 . 15 1 1 A 76 76 ILE CB C 76 39.484 39.697 -0.213 1
1 878 . 15 1 1 A 76 76 ILE N N 76 129.205 126.262 2.943 1
1 879 . 15 1 1 A 77 77 ARG H H 77 8.115 8.566 -0.451 1
1 880 . 15 1 1 A 77 77 ARG HA H 77 3.760 4.123 -0.363 1
1 887 . 15 1 1 A 77 77 ARG C C 77 178.704 177.933 0.771 1
1 888 . 15 1 1 A 77 77 ARG CA C 77 58.933 58.655 0.278 1
1 889 . 15 1 1 A 77 77 ARG CB C 77 29.463 29.781 -0.318 1
1 892 . 15 1 1 A 77 77 ARG N N 77 123.257 121.725 1.532 1
1 893 . 15 1 1 A 78 78 ALA H H 78 8.304 7.336 0.968 1
1 894 . 15 1 1 A 78 78 ALA HA H 78 4.296 4.169 0.127 1
1 898 . 15 1 1 A 78 78 ALA C C 78 176.870 178.050 -1.180 1
1 899 . 15 1 1 A 78 78 ALA CA C 78 53.548 54.209 -0.661 1
1 900 . 15 1 1 A 78 78 ALA CB C 78 19.872 18.451 1.421 1
1 901 . 15 1 1 A 78 78 ALA N N 78 118.764 121.611 -2.847 1
1 902 . 15 1 1 A 79 79 THR H H 79 7.931 7.673 0.258 1
1 903 . 15 1 1 A 79 79 THR HA H 79 4.370 4.554 -0.184 1
1 908 . 15 1 1 A 79 79 THR C C 79 178.356 175.340 3.016 1
1 909 . 15 1 1 A 79 79 THR CA C 79 62.381 62.338 0.043 1
1 910 . 15 1 1 A 79 79 THR CB C 79 69.693 70.530 -0.837 1
1 912 . 15 1 1 A 79 79 THR N N 79 107.360 105.257 2.103 1
1 913 . 15 1 1 A 80 80 GLN H H 80 7.651 8.016 -0.365 1
1 914 . 15 1 1 A 80 80 GLN HA H 80 4.527 4.681 -0.154 1
1 921 . 15 1 1 A 80 80 GLN C C 80 174.249 176.115 -1.866 1
1 922 . 15 1 1 A 80 80 GLN CA C 80 54.760 54.725 0.035 1
1 923 . 15 1 1 A 80 80 GLN CB C 80 30.565 29.313 1.252 1
1 925 . 15 1 1 A 80 80 GLN N N 80 121.588 119.654 1.934 1
1 927 . 15 1 1 A 81 81 ALA H H 81 8.498 8.176 0.322 1
1 928 . 15 1 1 A 81 81 ALA HA H 81 4.252 4.223 0.029 1
1 932 . 15 1 1 A 81 81 ALA C C 81 175.693 178.089 -2.396 1
1 933 . 15 1 1 A 81 81 ALA CA C 81 52.345 54.352 -2.007 1
1 934 . 15 1 1 A 81 81 ALA CB C 81 19.062 18.886 0.176 1
1 935 . 15 1 1 A 81 81 ALA N N 81 126.423 122.229 4.194 1
1 936 . 15 1 1 A 82 82 ALA H H 82 8.324 7.620 0.704 1
1 937 . 15 1 1 A 82 82 ALA HA H 82 4.000 4.388 -0.388 1
1 941 . 15 1 1 A 82 82 ALA C C 82 177.065 175.834 1.231 1
1 942 . 15 1 1 A 82 82 ALA CA C 82 50.240 51.012 -0.772 1
1 943 . 15 1 1 A 82 82 ALA CB C 82 17.650 18.585 -0.935 1
1 944 . 15 1 1 A 82 82 ALA N N 82 125.114 122.472 2.642 1
1 945 . 15 1 1 A 83 83 PRO HA H 83 4.350 4.510 -0.160 1
1 952 . 15 1 1 A 83 83 PRO CA C 83 63.148 62.616 0.532 1
1 953 . 15 1 1 A 83 83 PRO CB C 83 32.054 32.650 -0.596 1
1 956 . 15 1 1 A 84 84 GLU H H 84 8.517 9.098 -0.581 1
1 957 . 15 1 1 A 84 84 GLU HA H 84 4.197 4.072 0.125 1
1 962 . 15 1 1 A 84 84 GLU C C 84 176.948 176.535 0.413 1
1 963 . 15 1 1 A 84 84 GLU CA C 84 56.674 58.462 -1.788 1
1 964 . 15 1 1 A 84 84 GLU CB C 84 30.459 30.536 -0.077 1
1 966 . 15 1 1 A 84 84 GLU N N 84 121.479 120.000 1.479 1
1 967 . 15 1 1 A 85 85 LYS H H 85 8.381 7.559 0.822 1
1 968 . 15 1 1 A 85 85 LYS HA H 85 4.309 4.631 -0.322 1
1 977 . 15 1 1 A 85 85 LYS C C 85 176.457 175.407 1.050 1
1 978 . 15 1 1 A 85 85 LYS CA C 85 56.272 54.611 1.661 1
1 979 . 15 1 1 A 85 85 LYS CB C 85 32.961 35.295 -2.334 1
1 983 . 15 1 1 A 85 85 LYS N N 85 123.266 115.663 7.603 1
1 984 . 15 1 1 A 86 86 LYS H H 86 8.403 8.589 -0.186 1
1 985 . 15 1 1 A 86 86 LYS HA H 86 4.308 4.256 0.052 1
1 994 . 15 1 1 A 86 86 LYS C C 86 176.435 177.059 -0.624 1
1 995 . 15 1 1 A 86 86 LYS CA C 86 56.272 56.890 -0.618 1
1 996 . 15 1 1 A 86 86 LYS CB C 86 32.961 32.408 0.553 1
1 1000 . 15 1 1 A 86 86 LYS N N 86 123.688 120.793 2.895 1
1 1001 . 15 1 1 A 87 87 GLU H H 87 8.540 8.836 -0.296 1
1 1002 . 15 1 1 A 87 87 GLU HA H 87 4.358 4.361 -0.003 1
1 1007 . 15 1 1 A 87 87 GLU C C 87 176.556 177.010 -0.454 1
1 1008 . 15 1 1 A 87 87 GLU CA C 87 56.406 57.564 -1.158 1
1 1009 . 15 1 1 A 87 87 GLU CB C 87 30.607 30.168 0.439 1
1 1011 . 15 1 1 A 87 87 GLU N N 87 122.633 124.959 -2.326 1
1 1012 . 15 1 1 A 88 88 SER H H 88 8.520 7.753 0.767 1
1 1013 . 15 1 1 A 88 88 SER HA H 88 4.490 4.408 0.082 1
1 1016 . 15 1 1 A 88 88 SER C C 88 175.780 174.871 0.909 1
1 1017 . 15 1 1 A 88 88 SER CA C 88 58.431 59.343 -0.912 1
1 1018 . 15 1 1 A 88 88 SER CB C 88 63.858 64.152 -0.294 1
1 1019 . 15 1 1 A 88 88 SER N N 88 118.333 117.392 0.941 1
1 1020 . 15 1 1 A 89 89 LYS H H 89 8.339 8.528 -0.189 1
1 1021 . 15 1 1 A 89 89 LYS HA H 89 4.620 4.434 0.186 1
1 1030 . 15 1 1 A 89 89 LYS C C 89 174.160 174.546 -0.386 1
1 1031 . 15 1 1 A 89 89 LYS CA C 89 54.265 55.091 -0.826 1
1 1032 . 15 1 1 A 89 89 LYS CB C 89 32.672 31.531 1.141 1
1 1036 . 15 1 1 A 89 89 LYS N N 89 124.433 123.455 0.978 1
1 1037 . 15 1 1 A 90 90 PRO HA H 90 4.417 4.539 -0.122 1
1 1044 . 15 1 1 A 90 90 PRO CA C 90 63.064 62.280 0.784 1
1 1045 . 15 1 1 A 90 90 PRO CB C 90 32.266 32.288 -0.022 1
1 1048 . 15 1 1 A 91 91 ARG H H 91 8.502 8.343 0.159 1
1 1049 . 15 1 1 A 91 91 ARG HA H 91 4.305 4.273 0.032 1
1 1056 . 15 1 1 A 91 91 ARG C C 91 176.831 175.743 1.088 1
1 1057 . 15 1 1 A 91 91 ARG CA C 91 56.002 55.927 0.075 1
1 1058 . 15 1 1 A 91 91 ARG CB C 91 30.913 30.468 0.445 1
1 1061 . 15 1 1 A 91 91 ARG N N 91 122.193 119.663 2.530 1
1 1062 . 15 1 1 A 92 92 LYS H H 92 8.415 8.484 -0.069 1
1 1063 . 15 1 1 A 92 92 LYS HA H 92 4.610 4.424 0.186 1
1 1072 . 15 1 1 A 92 92 LYS C C 92 176.262 174.569 1.693 1
1 1073 . 15 1 1 A 92 92 LYS CA C 92 54.258 55.067 -0.809 1
1 1074 . 15 1 1 A 92 92 LYS CB C 92 32.672 31.697 0.975 1
1 1078 . 15 1 1 A 92 92 LYS N N 92 124.243 120.979 3.264 1
1 1079 . 15 1 1 A 93 93 PRO HA H 93 4.415 4.689 -0.274 1
1 1086 . 15 1 1 A 93 93 PRO CA C 93 62.899 62.604 0.295 1
1 1087 . 15 1 1 A 93 93 PRO CB C 93 32.323 32.916 -0.593 1
1 1090 . 15 1 1 A 94 94 LYS H H 94 8.420 8.713 -0.293 1
1 1091 . 15 1 1 A 94 94 LYS HA H 94 4.290 4.966 -0.676 1
1 1100 . 15 1 1 A 94 94 LYS C C 94 176.714 174.637 2.077 1
1 1101 . 15 1 1 A 94 94 LYS CA C 94 56.585 55.359 1.226 1
1 1102 . 15 1 1 A 94 94 LYS CB C 94 33.161 36.233 -3.072 1
1 1106 . 15 1 1 A 94 94 LYS N N 94 122.121 121.208 0.913 1
1 1107 . 15 1 1 A 95 95 ALA H H 95 8.348 8.282 0.066 1
1 1108 . 15 1 1 A 95 95 ALA HA H 95 4.250 4.646 -0.396 1
1 1112 . 15 1 1 A 95 95 ALA C C 95 176.453 177.251 -0.798 1
1 1113 . 15 1 1 A 95 95 ALA CA C 95 52.471 50.849 1.622 1
1 1114 . 15 1 1 A 95 95 ALA CB C 95 19.347 22.480 -3.133 1
1 1115 . 15 1 1 A 95 95 ALA N N 95 125.624 127.081 -1.457 1
1 1116 . 15 1 1 A 96 96 ALA H H 96 8.348 8.815 -0.467 1
1 1117 . 15 1 1 A 96 96 ALA HA H 96 4.254 4.130 0.124 1
1 1121 . 15 1 1 A 96 96 ALA C C 96 176.462 179.481 -3.019 1
1 1122 . 15 1 1 A 96 96 ALA CA C 96 52.471 55.515 -3.044 1
1 1123 . 15 1 1 A 96 96 ALA CB C 96 19.347 18.235 1.112 1
1 1124 . 15 1 1 A 96 96 ALA N N 96 125.624 121.320 4.304 1
1 1125 . 15 1 1 A 97 97 GLN H H 97 8.333 8.635 -0.302 1
1 1126 . 15 1 1 A 97 97 GLN HA H 97 4.362 4.181 0.181 1
1 1133 . 15 1 1 A 97 97 GLN C C 97 177.684 176.391 1.293 1
1 1134 . 15 1 1 A 97 97 GLN CA C 97 55.848 57.593 -1.745 1
1 1135 . 15 1 1 A 97 97 GLN CB C 97 29.643 27.405 2.238 1
1 1137 . 15 1 1 A 97 97 GLN N N 97 120.049 115.224 4.825 1
1 1139 . 15 1 1 A 98 98 VAL H H 98 8.230 7.595 0.635 1
1 1140 . 15 1 1 A 98 98 VAL HA H 98 4.145 4.623 -0.478 1
1 1148 . 15 1 1 A 98 98 VAL C C 98 176.033 176.539 -0.506 1
1 1149 . 15 1 1 A 98 98 VAL CA C 98 62.444 60.987 1.457 1
1 1150 . 15 1 1 A 98 98 VAL CB C 98 32.942 31.703 1.239 1
1 1153 . 15 1 1 A 98 98 VAL N N 98 121.607 115.018 6.589 1
1 1154 . 15 1 1 A 99 99 SER H H 99 8.375 7.778 0.597 1
1 1155 . 15 1 1 A 99 99 SER HA H 99 4.473 4.378 0.095 1
1 1158 . 15 1 1 A 99 99 SER C C 99 176.204 174.980 1.224 1
1 1159 . 15 1 1 A 99 99 SER CA C 99 58.379 61.075 -2.696 1
1 1160 . 15 1 1 A 99 99 SER CB C 99 63.914 63.453 0.461 1
1 1161 . 15 1 1 A 99 99 SER N N 99 119.455 117.588 1.867 1
1 1162 . 15 1 1 A 100 100 GLU H H 100 8.547 7.735 0.812 1
1 1163 . 15 1 1 A 100 100 GLU HA H 100 4.304 4.228 0.076 1
1 1168 . 15 1 1 A 100 100 GLU C C 100 174.620 175.854 -1.234 1
1 1169 . 15 1 1 A 100 100 GLU CA C 100 56.835 56.542 0.293 1
1 1170 . 15 1 1 A 100 100 GLU CB C 100 30.365 30.577 -0.212 1
1 1172 . 15 1 1 A 100 100 GLU N N 100 123.419 120.897 2.522 1
1 1173 . 15 1 1 A 101 101 GLU H H 101 8.432 8.893 -0.461 1
1 1174 . 15 1 1 A 101 101 GLU HA H 101 4.252 5.106 -0.854 1
1 1179 . 15 1 1 A 101 101 GLU C C 101 176.693 174.890 1.803 1
1 1180 . 15 1 1 A 101 101 GLU CA C 101 56.835 54.858 1.977 1
1 1181 . 15 1 1 A 101 101 GLU CB C 101 30.365 33.782 -3.417 1
1 1183 . 15 1 1 A 101 101 GLU N N 101 122.025 122.683 -0.658 1
1 1184 . 15 1 1 A 102 102 ALA H H 102 8.324 8.342 -0.018 1
1 1185 . 15 1 1 A 102 102 ALA HA H 102 4.361 4.741 -0.380 1
1 1189 . 15 1 1 A 102 102 ALA C C 102 177.065 176.590 0.475 1
1 1190 . 15 1 1 A 102 102 ALA CA C 102 52.647 51.178 1.469 1
1 1191 . 15 1 1 A 102 102 ALA CB C 102 19.227 21.053 -1.826 1
1 1192 . 15 1 1 A 102 102 ALA N N 102 125.114 122.450 2.664 1
1 1193 . 15 1 1 A 103 103 SER H H 103 8.259 8.557 -0.298 1
1 1194 . 15 1 1 A 103 103 SER HA H 103 4.473 4.469 0.004 1
1 1197 . 15 1 1 A 103 103 SER C C 103 177.772 174.698 3.074 1
1 1198 . 15 1 1 A 103 103 SER CA C 103 58.301 59.952 -1.651 1
1 1199 . 15 1 1 A 103 103 SER CB C 103 63.961 63.888 0.073 1
1 1200 . 15 1 1 A 103 103 SER N N 103 115.109 113.717 1.392 1
1 1201 . 15 1 1 A 104 104 THR H H 104 8.127 8.701 -0.574 1
1 1202 . 15 1 1 A 104 104 THR HA H 104 4.600 4.677 -0.077 1
1 1207 . 15 1 1 A 104 104 THR C C 104 174.427 174.884 -0.457 1
1 1208 . 15 1 1 A 104 104 THR CA C 104 59.954 60.637 -0.683 1
1 1209 . 15 1 1 A 104 104 THR CB C 104 69.868 68.841 1.027 1
1 1211 . 15 1 1 A 104 104 THR N N 104 117.882 116.488 1.394 1
1 1212 . 15 1 1 A 105 105 PRO HA H 105 4.414 4.435 -0.021 1
1 1219 . 15 1 1 A 105 105 PRO CA C 105 63.300 64.836 -1.536 1
1 1220 . 15 1 1 A 105 105 PRO CB C 105 32.227 32.074 0.153 1
1 1223 . 15 1 1 A 106 106 GLN H H 106 8.524 7.916 0.608 1
1 1224 . 15 1 1 A 106 106 GLN HA H 106 4.276 4.527 -0.251 1
1 1229 . 15 1 1 A 106 106 GLN C C 106 177.083 177.351 -0.268 1
1 1230 . 15 1 1 A 106 106 GLN CA C 106 56.209 55.146 1.063 1
1 1231 . 15 1 1 A 106 106 GLN CB C 106 29.490 29.491 -0.001 1
1 1233 . 15 1 1 A 106 106 GLN N N 106 120.754 118.620 2.134 1
1 1234 . 15 1 1 A 107 107 GLY H H 107 8.394 8.913 -0.519 1
1 1235 . 15 1 1 A 107 107 GLY HA2 H 107 3.895 3.941 -0.046 1
1 1236 . 15 1 1 A 107 107 GLY HA3 H 107 3.895 3.947 -0.052 1
1 1237 . 15 1 1 A 107 107 GLY C C 107 176.651 175.213 1.438 1
1 1238 . 15 1 1 A 107 107 GLY CA C 107 45.330 46.142 -0.812 1
1 1239 . 15 1 1 A 107 107 GLY N N 107 110.026 111.001 -0.975 1
1 1240 . 15 1 1 A 108 108 PHE H H 108 8.099 7.934 0.165 1
1 1241 . 15 1 1 A 108 108 PHE HA H 108 4.582 4.120 0.462 1
1 1245 . 15 1 1 A 108 108 PHE C C 108 173.944 176.539 -2.595 1
1 1246 . 15 1 1 A 108 108 PHE CA C 108 58.054 60.807 -2.753 1
1 1247 . 15 1 1 A 108 108 PHE CB C 108 39.708 39.310 0.398 1
1 1248 . 15 1 1 A 108 108 PHE N N 108 120.180 119.882 0.298 1
1 1249 . 15 1 1 A 109 109 ASN H H 109 8.482 7.933 0.549 1
1 1250 . 15 1 1 A 109 109 ASN HA H 109 4.691 4.465 0.226 1
1 1255 . 15 1 1 A 109 109 ASN C C 109 175.627 175.526 0.101 1
1 1256 . 15 1 1 A 109 109 ASN CA C 109 53.402 53.514 -0.112 1
1 1257 . 15 1 1 A 109 109 ASN CB C 109 38.883 39.351 -0.468 1
1 1258 . 15 1 1 A 109 109 ASN N N 109 120.752 117.506 3.246 1
1 1260 . 15 1 1 A 110 110 THR H H 110 8.112 8.591 -0.479 1
1 1261 . 15 1 1 A 110 110 THR HA H 110 4.251 4.519 -0.268 1
1 1266 . 15 1 1 A 110 110 THR C C 110 175.275 174.805 0.470 1
1 1267 . 15 1 1 A 110 110 THR CA C 110 62.460 61.281 1.179 1
1 1268 . 15 1 1 A 110 110 THR CB C 110 69.726 70.066 -0.340 1
1 1270 . 15 1 1 A 110 110 THR N N 110 114.601 115.723 -1.122 1
1 1271 . 15 1 1 A 111 111 LEU H H 111 8.168 7.255 0.913 1
1 1272 . 15 1 1 A 111 111 LEU HA H 111 4.308 4.095 0.213 1
1 1282 . 15 1 1 A 111 111 LEU CA C 111 55.704 55.194 0.510 1
1 1283 . 15 1 1 A 111 111 LEU CB C 111 42.071 41.935 0.136 1
1 1287 . 15 1 1 A 111 111 LEU N N 111 123.756 124.555 -0.799 1
1 1288 . 15 1 1 A 112 112 LYS H H 112 8.123 8.410 -0.287 1
1 1289 . 15 1 1 A 112 112 LYS HA H 112 4.242 4.167 0.075 1
1 1298 . 15 1 1 A 112 112 LYS C C 112 177.547 175.309 2.238 1
1 1299 . 15 1 1 A 112 112 LYS CA C 112 56.928 56.182 0.746 1
1 1300 . 15 1 1 A 112 112 LYS CB C 112 33.055 33.186 -0.131 1
1 1304 . 15 1 1 A 112 112 LYS N N 112 121.442 123.717 -2.275 1
1 1305 . 15 1 1 A 113 113 ASP H H 113 8.230 8.591 -0.361 1
1 1306 . 15 1 1 A 113 113 ASP HA H 113 4.526 5.047 -0.521 1
1 1309 . 15 1 1 A 113 113 ASP C C 113 176.532 175.115 1.417 1
1 1310 . 15 1 1 A 113 113 ASP CA C 113 54.896 52.937 1.959 1
1 1311 . 15 1 1 A 113 113 ASP CB C 113 41.362 45.166 -3.804 1
1 1312 . 15 1 1 A 113 113 ASP N N 113 120.598 118.864 1.734 1
1 1313 . 15 1 1 A 114 114 LYS H H 114 8.127 8.504 -0.377 1
1 1314 . 15 1 1 A 114 114 LYS HA H 114 4.300 4.384 -0.084 1
1 1323 . 15 1 1 A 114 114 LYS C C 114 176.303 176.672 -0.369 1
1 1324 . 15 1 1 A 114 114 LYS CA C 114 56.633 57.326 -0.693 1
1 1325 . 15 1 1 A 114 114 LYS CB C 114 32.818 33.207 -0.389 1
1 1329 . 15 1 1 A 114 114 LYS N N 114 120.897 122.717 -1.820 1
1 1330 . 15 1 1 A 115 115 LEU H H 115 8.244 8.258 -0.014 1
1 1331 . 15 1 1 A 115 115 LEU HA H 115 4.254 4.330 -0.076 1
1 1341 . 15 1 1 A 115 115 LEU C C 115 176.909 177.665 -0.756 1
1 1342 . 15 1 1 A 115 115 LEU CA C 115 56.282 55.955 0.327 1
1 1343 . 15 1 1 A 115 115 LEU CB C 115 42.188 43.286 -1.098 1
1 1347 . 15 1 1 A 115 115 LEU N N 115 123.251 124.073 -0.822 1
1 1348 . 15 1 1 A 116 116 GLU H H 116 8.421 9.129 -0.708 1
1 1349 . 15 1 1 A 116 116 GLU HA H 116 4.190 4.748 -0.558 1
1 1352 . 15 1 1 A 116 116 GLU C C 116 177.828 176.727 1.101 1
1 1353 . 15 1 1 A 116 116 GLU CA C 116 57.466 56.128 1.338 1
1 1354 . 15 1 1 A 116 116 GLU CB C 116 30.124 27.781 2.343 1
1 1355 . 15 1 1 A 116 116 GLU N N 116 120.575 126.310 -5.735 1
1 1356 . 15 1 1 A 117 117 GLU H H 117 8.255 8.718 -0.463 1
1 1357 . 15 1 1 A 117 117 GLU HA H 117 4.192 4.706 -0.514 1
1 1362 . 15 1 1 A 117 117 GLU CA C 117 57.491 58.029 -0.538 1
1 1363 . 15 1 1 A 117 117 GLU CB C 117 30.365 32.740 -2.375 1
1 1365 . 15 1 1 A 117 117 GLU N N 117 120.933 120.130 0.803 1
1 1366 . 15 1 1 A 118 118 TRP H H 118 8.143 7.981 0.162 1
1 1367 . 15 1 1 A 118 118 TRP HA H 118 4.581 4.295 0.286 1
1 1372 . 15 1 1 A 118 118 TRP C C 118 176.794 175.687 1.107 1
1 1373 . 15 1 1 A 118 118 TRP CA C 118 58.363 60.587 -2.224 1
1 1374 . 15 1 1 A 118 118 TRP CB C 118 29.333 29.721 -0.388 1
1 1375 . 15 1 1 A 118 118 TRP N N 118 121.592 121.783 -0.191 1
1 1376 . 15 1 1 A 119 119 ILE H H 119 7.908 7.722 0.186 1
1 1377 . 15 1 1 A 119 119 ILE HA H 119 3.828 4.621 -0.793 1
1 1387 . 15 1 1 A 119 119 ILE C C 119 176.984 174.395 2.589 1
1 1388 . 15 1 1 A 119 119 ILE CA C 119 62.335 58.421 3.914 1
1 1389 . 15 1 1 A 119 119 ILE CB C 119 38.649 41.627 -2.978 1
1 1393 . 15 1 1 A 119 119 ILE N N 119 122.744 114.740 8.004 1
1 1394 . 15 1 1 A 120 120 GLU H H 120 8.143 8.895 -0.752 1
1 1395 . 15 1 1 A 120 120 GLU HA H 120 4.093 5.032 -0.939 1
1 1400 . 15 1 1 A 120 120 GLU C C 120 176.565 175.388 1.177 1
1 1401 . 15 1 1 A 120 120 GLU CA C 120 57.613 54.768 2.845 1
1 1402 . 15 1 1 A 120 120 GLU CB C 120 29.834 34.009 -4.175 1
1 1404 . 15 1 1 A 120 120 GLU N N 120 123.139 117.401 5.738 1
1 1405 . 15 1 1 A 121 121 MET H H 121 8.254 8.947 -0.693 1
1 1406 . 15 1 1 A 121 121 MET HA H 121 4.357 4.675 -0.318 1
1 1411 . 15 1 1 A 121 121 MET CA C 121 56.625 56.492 0.133 1
1 1412 . 15 1 1 A 121 121 MET CB C 121 32.664 35.835 -3.171 1
1 1414 . 15 1 1 A 121 121 MET N N 121 120.449 120.847 -0.398 1
1 1415 . 15 1 1 A 122 122 SER H H 122 8.199 9.074 -0.875 1
1 1416 . 15 1 1 A 122 122 SER HA H 122 4.280 4.213 0.067 1
1 1419 . 15 1 1 A 122 122 SER C C 122 177.224 176.323 0.901 1
1 1420 . 15 1 1 A 122 122 SER CA C 122 59.635 61.343 -1.708 1
1 1421 . 15 1 1 A 122 122 SER CB C 122 63.560 62.528 1.032 1
1 1422 . 15 1 1 A 122 122 SER N N 122 115.857 115.708 0.149 1
1 1423 . 15 1 1 A 123 123 ASN H H 123 8.211 8.392 -0.181 1
1 1424 . 15 1 1 A 123 123 ASN HA H 123 4.737 4.420 0.317 1
1 1429 . 15 1 1 A 123 123 ASN C C 123 174.709 177.949 -3.240 1
1 1430 . 15 1 1 A 123 123 ASN CA C 123 53.507 56.772 -3.265 1
1 1431 . 15 1 1 A 123 123 ASN CB C 123 38.800 39.555 -0.755 1
1 1432 . 15 1 1 A 123 123 ASN N N 123 119.923 119.412 0.511 1
1 1434 . 15 1 1 A 124 124 ARG H H 124 7.997 8.011 -0.014 1
1 1435 . 15 1 1 A 124 124 ARG HA H 124 4.305 4.155 0.150 1
1 1442 . 15 1 1 A 124 124 ARG C C 124 175.477 179.257 -3.780 1
1 1443 . 15 1 1 A 124 124 ARG CA C 124 56.709 59.764 -3.055 1
1 1444 . 15 1 1 A 124 124 ARG CB C 124 30.584 29.665 0.919 1
1 1447 . 15 1 1 A 124 124 ARG N N 124 120.821 119.276 1.545 1
1 1448 . 15 1 1 A 125 125 LYS H H 125 8.327 8.146 0.181 1
1 1449 . 15 1 1 A 125 125 LYS HA H 125 4.254 4.233 0.021 1
1 1458 . 15 1 1 A 125 125 LYS C C 125 176.777 175.906 0.871 1
1 1459 . 15 1 1 A 125 125 LYS CA C 125 56.860 58.006 -1.146 1
1 1460 . 15 1 1 A 125 125 LYS CB C 125 32.879 32.928 -0.049 1
1 1464 . 15 1 1 A 125 125 LYS N N 125 121.891 119.501 2.390 1
1 1465 . 15 1 1 A 126 126 ASP H H 126 8.343 8.033 0.310 1
1 1466 . 15 1 1 A 126 126 ASP HA H 126 4.581 4.277 0.304 1
1 1469 . 15 1 1 A 126 126 ASP C C 126 176.538 175.163 1.375 1
1 1470 . 15 1 1 A 126 126 ASP CA C 126 54.540 54.951 -0.411 1
1 1471 . 15 1 1 A 126 126 ASP CB C 126 40.907 39.486 1.421 1
1 1472 . 15 1 1 A 126 126 ASP N N 126 119.814 119.777 0.037 1
1 1473 . 15 1 1 A 127 127 LEU H H 127 7.946 7.908 0.038 1
1 1474 . 15 1 1 A 127 127 LEU HA H 127 4.309 5.121 -0.812 1
1 1484 . 15 1 1 A 127 127 LEU C C 127 176.043 174.467 1.576 1
1 1485 . 15 1 1 A 127 127 LEU CA C 127 55.427 53.871 1.556 1
1 1486 . 15 1 1 A 127 127 LEU CB C 127 42.394 46.393 -3.999 1
1 1490 . 15 1 1 A 127 127 LEU N N 127 121.432 119.381 2.051 1
1 1491 . 15 1 1 A 128 128 ILE H H 128 7.967 8.638 -0.671 1
1 1492 . 15 1 1 A 128 128 ILE HA H 128 4.141 5.011 -0.870 1
1 1502 . 15 1 1 A 128 128 ILE C C 128 177.200 174.473 2.727 1
1 1503 . 15 1 1 A 128 128 ILE CA C 128 61.150 59.185 1.965 1
1 1504 . 15 1 1 A 128 128 ILE CB C 128 38.489 42.340 -3.851 1
1 1508 . 15 1 1 A 128 128 ILE N N 128 121.579 124.510 -2.931 1
1 1509 . 15 1 1 A 129 129 LYS H H 129 8.331 8.992 -0.661 1
1 1510 . 15 1 1 A 129 129 LYS HA H 129 4.328 4.678 -0.350 1
1 1519 . 15 1 1 A 129 129 LYS C C 129 175.952 176.759 -0.807 1
1 1520 . 15 1 1 A 129 129 LYS CA C 129 56.330 55.459 0.871 1
1 1521 . 15 1 1 A 129 129 LYS CB C 129 33.010 33.293 -0.283 1
1 1525 . 15 1 1 A 129 129 LYS N N 129 126.955 126.192 0.763 1
1 1 . 16 1 1 A 2 2 ALA HA H 2 4.070 4.872 -0.802 1
1 5 . 16 1 1 A 2 2 ALA CA C 2 52.067 51.195 0.872 1
1 6 . 16 1 1 A 2 2 ALA CB C 2 19.577 24.070 -4.493 1
1 7 . 16 1 1 A 3 3 ALA H H 3 8.714 8.659 0.055 1
1 8 . 16 1 1 A 3 3 ALA HA H 3 4.253 5.256 -1.003 1
1 12 . 16 1 1 A 3 3 ALA C C 3 173.672 176.291 -2.619 1
1 13 . 16 1 1 A 3 3 ALA CA C 3 52.067 50.911 1.156 1
1 14 . 16 1 1 A 3 3 ALA CB C 3 19.577 24.142 -4.565 1
1 15 . 16 1 1 A 3 3 ALA N N 3 124.480 120.223 4.257 1
1 16 . 16 1 1 A 4 4 LYS H H 4 8.227 8.851 -0.624 1
1 17 . 16 1 1 A 4 4 LYS HA H 4 3.976 4.575 -0.599 1
1 26 . 16 1 1 A 4 4 LYS C C 4 176.672 175.419 1.253 1
1 27 . 16 1 1 A 4 4 LYS CA C 4 57.274 55.892 1.382 1
1 28 . 16 1 1 A 4 4 LYS CB C 4 33.209 33.383 -0.174 1
1 32 . 16 1 1 A 4 4 LYS N N 4 120.988 117.719 3.269 1
1 33 . 16 1 1 A 5 5 PHE H H 5 7.719 7.759 -0.040 1
1 34 . 16 1 1 A 5 5 PHE HA H 5 4.384 5.139 -0.755 1
1 38 . 16 1 1 A 5 5 PHE C C 5 175.364 174.432 0.932 1
1 39 . 16 1 1 A 5 5 PHE CA C 5 57.074 56.344 0.730 1
1 40 . 16 1 1 A 5 5 PHE CB C 5 39.669 43.646 -3.977 1
1 41 . 16 1 1 A 5 5 PHE N N 5 119.246 118.631 0.615 1
1 42 . 16 1 1 A 6 6 GLU H H 6 8.515 8.941 -0.426 1
1 43 . 16 1 1 A 6 6 GLU HA H 6 4.370 5.022 -0.652 1
1 48 . 16 1 1 A 6 6 GLU CA C 6 55.669 54.850 0.819 1
1 49 . 16 1 1 A 6 6 GLU CB C 6 32.094 33.848 -1.754 1
1 51 . 16 1 1 A 6 6 GLU N N 6 122.193 118.397 3.796 1
1 52 . 16 1 1 A 7 7 VAL H H 7 8.636 8.506 0.130 1
1 53 . 16 1 1 A 7 7 VAL HA H 7 3.406 3.963 -0.557 1
1 61 . 16 1 1 A 7 7 VAL C C 7 176.611 176.363 0.248 1
1 62 . 16 1 1 A 7 7 VAL CA C 7 65.358 63.252 2.106 1
1 63 . 16 1 1 A 7 7 VAL CB C 7 31.391 31.516 -0.125 1
1 66 . 16 1 1 A 7 7 VAL N N 7 122.949 122.293 0.656 1
1 67 . 16 1 1 A 8 8 GLY H H 8 9.394 9.152 0.242 1
1 68 . 16 1 1 A 8 8 GLY HA2 H 8 3.600 4.034 -0.434 1
1 69 . 16 1 1 A 8 8 GLY HA3 H 8 4.546 4.035 0.511 1
1 70 . 16 1 1 A 8 8 GLY C C 8 178.074 174.243 3.831 1
1 71 . 16 1 1 A 8 8 GLY CA C 8 45.121 44.981 0.140 1
1 72 . 16 1 1 A 8 8 GLY N N 8 116.837 115.095 1.742 1
1 73 . 16 1 1 A 9 9 SER H H 9 8.021 7.862 0.159 1
1 74 . 16 1 1 A 9 9 SER HA H 9 4.680 4.468 0.212 1
1 77 . 16 1 1 A 9 9 SER C C 9 174.234 173.084 1.150 1
1 78 . 16 1 1 A 9 9 SER CA C 9 59.387 59.377 0.010 1
1 79 . 16 1 1 A 9 9 SER CB C 9 65.584 64.660 0.924 1
1 80 . 16 1 1 A 9 9 SER N N 9 118.208 118.131 0.077 1
1 81 . 16 1 1 A 10 10 VAL H H 10 7.945 8.230 -0.285 1
1 82 . 16 1 1 A 10 10 VAL HA H 10 4.980 5.106 -0.126 1
1 90 . 16 1 1 A 10 10 VAL C C 10 171.388 174.341 -2.953 1
1 91 . 16 1 1 A 10 10 VAL CA C 10 61.021 61.098 -0.077 1
1 92 . 16 1 1 A 10 10 VAL CB C 10 33.400 34.963 -1.563 1
1 95 . 16 1 1 A 10 10 VAL N N 10 121.118 122.479 -1.361 1
1 96 . 16 1 1 A 11 11 TYR H H 11 9.008 9.151 -0.143 1
1 97 . 16 1 1 A 11 11 TYR HA H 11 4.850 5.342 -0.492 1
1 101 . 16 1 1 A 11 11 TYR C C 11 174.926 174.834 0.092 1
1 102 . 16 1 1 A 11 11 TYR CA C 11 56.803 56.240 0.563 1
1 103 . 16 1 1 A 11 11 TYR CB C 11 43.676 43.601 0.075 1
1 104 . 16 1 1 A 11 11 TYR N N 11 125.043 125.349 -0.306 1
1 105 . 16 1 1 A 12 12 THR H H 12 8.809 8.656 0.153 1
1 106 . 16 1 1 A 12 12 THR HA H 12 5.020 5.403 -0.383 1
1 111 . 16 1 1 A 12 12 THR C C 12 174.195 174.785 -0.590 1
1 112 . 16 1 1 A 12 12 THR CA C 12 62.487 60.050 2.437 1
1 113 . 16 1 1 A 12 12 THR CB C 12 69.743 71.599 -1.856 1
1 115 . 16 1 1 A 12 12 THR N N 12 116.850 115.117 1.733 1
1 116 . 16 1 1 A 13 13 GLY H H 13 9.179 8.644 0.535 1
1 117 . 16 1 1 A 13 13 GLY HA2 H 13 3.250 4.342 -1.092 1
1 118 . 16 1 1 A 13 13 GLY HA3 H 13 4.801 4.357 0.444 1
1 119 . 16 1 1 A 13 13 GLY C C 13 174.654 171.965 2.689 1
1 120 . 16 1 1 A 13 13 GLY CA C 13 44.377 45.365 -0.988 1
1 121 . 16 1 1 A 13 13 GLY N N 13 113.654 112.003 1.651 1
1 122 . 16 1 1 A 14 14 LYS H H 14 7.770 8.637 -0.867 1
1 123 . 16 1 1 A 14 14 LYS HA H 14 5.426 5.146 0.280 1
1 132 . 16 1 1 A 14 14 LYS C C 14 171.343 175.852 -4.509 1
1 133 . 16 1 1 A 14 14 LYS CA C 14 53.879 54.604 -0.725 1
1 134 . 16 1 1 A 14 14 LYS CB C 14 36.032 35.597 0.435 1
1 138 . 16 1 1 A 14 14 LYS N N 14 118.322 120.324 -2.002 1
1 139 . 16 1 1 A 15 15 VAL H H 15 9.206 9.284 -0.078 1
1 140 . 16 1 1 A 15 15 VAL HA H 15 4.400 4.286 0.114 1
1 148 . 16 1 1 A 15 15 VAL C C 15 176.306 177.150 -0.844 1
1 149 . 16 1 1 A 15 15 VAL CA C 15 63.648 63.378 0.270 1
1 150 . 16 1 1 A 15 15 VAL CB C 15 31.769 31.534 0.235 1
1 153 . 16 1 1 A 15 15 VAL N N 15 125.308 123.598 1.710 1
1 154 . 16 1 1 A 16 16 THR H H 16 9.403 9.287 0.116 1
1 155 . 16 1 1 A 16 16 THR HA H 16 4.562 4.687 -0.125 1
1 160 . 16 1 1 A 16 16 THR C C 16 178.098 174.576 3.522 1
1 161 . 16 1 1 A 16 16 THR CA C 16 62.018 61.483 0.535 1
1 162 . 16 1 1 A 16 16 THR CB C 16 69.720 69.821 -0.101 1
1 164 . 16 1 1 A 16 16 THR N N 16 121.753 117.601 4.152 1
1 165 . 16 1 1 A 17 17 GLY H H 17 7.600 7.123 0.477 1
1 166 . 16 1 1 A 17 17 GLY HA2 H 17 4.110 4.099 0.011 1
1 167 . 16 1 1 A 17 17 GLY HA3 H 17 4.250 4.208 0.042 1
1 168 . 16 1 1 A 17 17 GLY C C 17 175.551 171.309 4.242 1
1 169 . 16 1 1 A 17 17 GLY CA C 17 46.258 45.585 0.673 1
1 170 . 16 1 1 A 17 17 GLY N N 17 109.407 108.792 0.615 1
1 171 . 16 1 1 A 18 18 LEU H H 18 8.820 8.497 0.323 1
1 172 . 16 1 1 A 18 18 LEU HA H 18 4.852 4.987 -0.135 1
1 182 . 16 1 1 A 18 18 LEU CA C 18 54.245 53.190 1.055 1
1 183 . 16 1 1 A 18 18 LEU CB C 18 44.906 46.332 -1.426 1
1 187 . 16 1 1 A 18 18 LEU N N 18 123.419 121.386 2.033 1
1 188 . 16 1 1 A 19 19 GLN H H 19 8.537 8.213 0.324 1
1 189 . 16 1 1 A 19 19 GLN HA H 19 4.520 4.699 -0.179 1
1 196 . 16 1 1 A 19 19 GLN C C 19 175.258 175.682 -0.424 1
1 197 . 16 1 1 A 19 19 GLN CA C 19 53.269 53.854 -0.585 1
1 198 . 16 1 1 A 19 19 GLN CB C 19 31.522 32.544 -1.022 1
1 200 . 16 1 1 A 19 19 GLN N N 19 120.187 121.462 -1.275 1
1 202 . 16 1 1 A 20 20 ALA H H 20 8.798 8.689 0.109 1
1 203 . 16 1 1 A 20 20 ALA HA H 20 4.010 4.057 -0.047 1
1 207 . 16 1 1 A 20 20 ALA C C 20 175.698 177.148 -1.450 1
1 208 . 16 1 1 A 20 20 ALA CA C 20 55.084 54.034 1.050 1
1 209 . 16 1 1 A 20 20 ALA CB C 20 18.277 18.495 -0.218 1
1 210 . 16 1 1 A 20 20 ALA N N 20 120.606 124.033 -3.427 1
1 211 . 16 1 1 A 21 21 TYR H H 21 6.618 7.605 -0.987 1
1 212 . 16 1 1 A 21 21 TYR HA H 21 4.540 4.614 -0.074 1
1 216 . 16 1 1 A 21 21 TYR C C 21 178.437 174.844 3.593 1
1 217 . 16 1 1 A 21 21 TYR CA C 21 55.120 56.706 -1.586 1
1 218 . 16 1 1 A 21 21 TYR CB C 21 37.891 40.169 -2.278 1
1 219 . 16 1 1 A 21 21 TYR N N 21 105.570 113.320 -7.750 1
1 220 . 16 1 1 A 22 22 GLY H H 22 7.203 7.015 0.188 1
1 221 . 16 1 1 A 22 22 GLY HA2 H 22 3.460 3.699 -0.239 1
1 222 . 16 1 1 A 22 22 GLY HA3 H 22 4.360 3.810 0.550 1
1 223 . 16 1 1 A 22 22 GLY C C 22 175.833 171.159 4.674 1
1 224 . 16 1 1 A 22 22 GLY CA C 22 46.356 45.273 1.083 1
1 225 . 16 1 1 A 22 22 GLY N N 22 109.854 108.457 1.397 1
1 226 . 16 1 1 A 23 23 ALA H H 23 8.549 8.450 0.099 1
1 227 . 16 1 1 A 23 23 ALA HA H 23 4.981 5.103 -0.122 1
1 231 . 16 1 1 A 23 23 ALA C C 23 168.810 175.966 -7.156 1
1 232 . 16 1 1 A 23 23 ALA CA C 23 49.178 50.661 -1.483 1
1 233 . 16 1 1 A 23 23 ALA CB C 23 22.797 21.706 1.091 1
1 234 . 16 1 1 A 23 23 ALA N N 23 118.749 122.219 -3.470 1
1 235 . 16 1 1 A 24 24 PHE H H 24 8.812 8.483 0.329 1
1 236 . 16 1 1 A 24 24 PHE HA H 24 5.125 4.862 0.263 1
1 240 . 16 1 1 A 24 24 PHE CA C 24 58.017 58.097 -0.080 1
1 241 . 16 1 1 A 24 24 PHE CB C 24 40.475 40.532 -0.057 1
1 242 . 16 1 1 A 24 24 PHE N N 24 122.891 122.244 0.647 1
1 243 . 16 1 1 A 25 25 VAL H H 25 8.880 8.991 -0.111 1
1 244 . 16 1 1 A 25 25 VAL HA H 25 4.660 4.686 -0.026 1
1 252 . 16 1 1 A 25 25 VAL CA C 25 60.379 61.122 -0.743 1
1 253 . 16 1 1 A 25 25 VAL CB C 25 35.654 34.898 0.756 1
1 256 . 16 1 1 A 25 25 VAL N N 25 122.908 121.116 1.792 1
1 257 . 16 1 1 A 26 26 ALA H H 26 9.403 8.785 0.618 1
1 258 . 16 1 1 A 26 26 ALA HA H 26 4.750 4.351 0.399 1
1 262 . 16 1 1 A 26 26 ALA C C 26 174.445 176.868 -2.423 1
1 263 . 16 1 1 A 26 26 ALA CA C 26 51.711 52.701 -0.990 1
1 264 . 16 1 1 A 26 26 ALA CB C 26 19.319 19.058 0.261 1
1 265 . 16 1 1 A 26 26 ALA N N 26 129.425 130.747 -1.322 1
1 266 . 16 1 1 A 27 27 LEU H H 27 8.601 9.164 -0.563 1
1 267 . 16 1 1 A 27 27 LEU HA H 27 4.158 4.585 -0.427 1
1 277 . 16 1 1 A 27 27 LEU C C 27 177.814 176.413 1.401 1
1 278 . 16 1 1 A 27 27 LEU CA C 27 55.869 55.729 0.140 1
1 279 . 16 1 1 A 27 27 LEU CB C 27 42.251 43.705 -1.454 1
1 283 . 16 1 1 A 27 27 LEU N N 27 127.169 122.736 4.433 1
1 284 . 16 1 1 A 28 28 ASP H H 28 8.172 7.836 0.336 1
1 285 . 16 1 1 A 28 28 ASP HA H 28 4.420 4.899 -0.479 1
1 288 . 16 1 1 A 28 28 ASP C C 28 177.116 175.399 1.717 1
1 289 . 16 1 1 A 28 28 ASP CA C 28 53.755 53.642 0.113 1
1 290 . 16 1 1 A 28 28 ASP CB C 28 39.833 43.886 -4.053 1
1 291 . 16 1 1 A 28 28 ASP N N 28 115.657 116.369 -0.712 1
1 292 . 16 1 1 A 29 29 GLU H H 29 8.857 8.638 0.219 1
1 293 . 16 1 1 A 29 29 GLU HA H 29 4.090 4.121 -0.031 1
1 298 . 16 1 1 A 29 29 GLU C C 29 175.965 176.673 -0.708 1
1 299 . 16 1 1 A 29 29 GLU CA C 29 59.470 58.945 0.525 1
1 300 . 16 1 1 A 29 29 GLU CB C 29 29.409 29.346 0.063 1
1 302 . 16 1 1 A 29 29 GLU N N 29 114.738 123.141 -8.403 1
1 303 . 16 1 1 A 30 30 GLU H H 30 8.326 8.135 0.191 1
1 304 . 16 1 1 A 30 30 GLU HA H 30 4.640 4.564 0.076 1
1 309 . 16 1 1 A 30 30 GLU C C 30 176.817 175.480 1.337 1
1 310 . 16 1 1 A 30 30 GLU CA C 30 56.073 56.126 -0.053 1
1 311 . 16 1 1 A 30 30 GLU CB C 30 32.453 31.656 0.797 1
1 313 . 16 1 1 A 30 30 GLU N N 30 115.753 117.557 -1.804 1
1 314 . 16 1 1 A 31 31 THR H H 31 7.819 7.617 0.202 1
1 315 . 16 1 1 A 31 31 THR HA H 31 4.484 5.090 -0.606 1
1 320 . 16 1 1 A 31 31 THR C C 31 176.330 173.013 3.317 1
1 321 . 16 1 1 A 31 31 THR CA C 31 63.398 61.085 2.313 1
1 322 . 16 1 1 A 31 31 THR CB C 31 69.367 72.970 -3.603 1
1 324 . 16 1 1 A 31 31 THR N N 31 118.750 115.164 3.586 1
1 325 . 16 1 1 A 32 32 GLN H H 32 8.913 8.714 0.199 1
1 326 . 16 1 1 A 32 32 GLN HA H 32 5.337 4.895 0.442 1
1 333 . 16 1 1 A 32 32 GLN C C 32 173.087 174.499 -1.412 1
1 334 . 16 1 1 A 32 32 GLN CA C 32 54.051 54.693 -0.642 1
1 335 . 16 1 1 A 32 32 GLN CB C 32 32.672 32.783 -0.111 1
1 337 . 16 1 1 A 32 32 GLN N N 32 127.294 124.912 2.382 1
1 339 . 16 1 1 A 33 33 GLY H H 33 8.900 8.568 0.332 1
1 340 . 16 1 1 A 33 33 GLY HA2 H 33 3.290 4.330 -1.040 1
1 341 . 16 1 1 A 33 33 GLY HA3 H 33 4.530 4.394 0.136 1
1 342 . 16 1 1 A 33 33 GLY C C 33 174.918 172.299 2.619 1
1 343 . 16 1 1 A 33 33 GLY CA C 33 44.534 45.005 -0.471 1
1 344 . 16 1 1 A 33 33 GLY N N 33 107.639 110.768 -3.129 1
1 345 . 16 1 1 A 34 34 LEU H H 34 8.127 8.503 -0.376 1
1 346 . 16 1 1 A 34 34 LEU HA H 34 4.950 4.846 0.104 1
1 356 . 16 1 1 A 34 34 LEU CA C 34 53.755 53.941 -0.186 1
1 357 . 16 1 1 A 34 34 LEU CB C 34 45.493 45.248 0.245 1
1 361 . 16 1 1 A 34 34 LEU N N 34 120.897 121.034 -0.137 1
1 362 . 16 1 1 A 35 35 VAL H H 35 9.386 8.869 0.517 1
1 363 . 16 1 1 A 35 35 VAL HA H 35 4.479 4.369 0.110 1
1 371 . 16 1 1 A 35 35 VAL C C 35 176.402 175.788 0.614 1
1 372 . 16 1 1 A 35 35 VAL CA C 35 59.594 62.905 -3.311 1
1 373 . 16 1 1 A 35 35 VAL CB C 35 32.590 31.462 1.128 1
1 376 . 16 1 1 A 35 35 VAL N N 35 128.897 127.750 1.147 1
1 377 . 16 1 1 A 36 36 HIS H H 36 9.194 8.877 0.317 1
1 378 . 16 1 1 A 36 36 HIS HA H 36 4.487 4.540 -0.053 1
1 381 . 16 1 1 A 36 36 HIS C C 36 174.864 176.122 -1.258 1
1 382 . 16 1 1 A 36 36 HIS CA C 36 59.426 56.836 2.590 1
1 383 . 16 1 1 A 36 36 HIS CB C 36 31.542 30.724 0.818 1
1 384 . 16 1 1 A 36 36 HIS N N 36 127.751 126.867 0.884 1
1 385 . 16 1 1 A 37 37 ILE H H 37 7.454 8.420 -0.966 1
1 386 . 16 1 1 A 37 37 ILE HA H 37 3.810 3.543 0.267 1
1 396 . 16 1 1 A 37 37 ILE C C 37 176.948 177.823 -0.875 1
1 397 . 16 1 1 A 37 37 ILE CA C 37 63.773 64.726 -0.953 1
1 398 . 16 1 1 A 37 37 ILE CB C 37 38.993 37.316 1.677 1
1 402 . 16 1 1 A 37 37 ILE N N 37 126.266 126.680 -0.414 1
1 403 . 16 1 1 A 38 38 SER H H 38 8.343 8.165 0.178 1
1 404 . 16 1 1 A 38 38 SER HA H 38 4.370 4.277 0.093 1
1 407 . 16 1 1 A 38 38 SER C C 38 174.792 175.001 -0.209 1
1 408 . 16 1 1 A 38 38 SER CA C 38 60.567 61.294 -0.727 1
1 409 . 16 1 1 A 38 38 SER CB C 38 63.632 62.979 0.653 1
1 410 . 16 1 1 A 38 38 SER N N 38 118.079 118.411 -0.332 1
1 411 . 16 1 1 A 39 39 GLU H H 39 8.536 8.014 0.522 1
1 412 . 16 1 1 A 39 39 GLU HA H 39 4.503 4.516 -0.013 1
1 417 . 16 1 1 A 39 39 GLU C C 39 175.131 176.944 -1.813 1
1 418 . 16 1 1 A 39 39 GLU CA C 39 54.928 56.193 -1.265 1
1 419 . 16 1 1 A 39 39 GLU CB C 39 29.621 30.706 -1.085 1
1 421 . 16 1 1 A 39 39 GLU N N 39 118.349 117.726 0.623 1
1 422 . 16 1 1 A 40 40 VAL H H 40 7.776 7.559 0.217 1
1 423 . 16 1 1 A 40 40 VAL HA H 40 3.616 3.830 -0.214 1
1 431 . 16 1 1 A 40 40 VAL C C 40 177.277 175.683 1.594 1
1 432 . 16 1 1 A 40 40 VAL CA C 40 66.245 64.401 1.844 1
1 433 . 16 1 1 A 40 40 VAL CB C 40 32.590 31.896 0.694 1
1 436 . 16 1 1 A 40 40 VAL N N 40 125.443 117.987 7.456 1
1 437 . 16 1 1 A 41 41 THR H H 41 7.888 7.357 0.531 1
1 438 . 16 1 1 A 41 41 THR HA H 41 4.345 4.514 -0.169 1
1 443 . 16 1 1 A 41 41 THR C C 41 173.492 172.405 1.087 1
1 444 . 16 1 1 A 41 41 THR CA C 41 59.047 60.386 -1.339 1
1 445 . 16 1 1 A 41 41 THR CB C 41 68.992 70.235 -1.243 1
1 447 . 16 1 1 A 41 41 THR N N 41 109.905 111.496 -1.591 1
1 448 . 16 1 1 A 42 42 HIS H H 42 8.063 8.573 -0.510 1
1 449 . 16 1 1 A 42 42 HIS HA H 42 4.510 4.768 -0.258 1
1 452 . 16 1 1 A 42 42 HIS C C 42 172.139 174.516 -2.377 1
1 453 . 16 1 1 A 42 42 HIS CA C 42 57.735 54.605 3.130 1
1 454 . 16 1 1 A 42 42 HIS CB C 42 31.144 27.398 3.746 1
1 455 . 16 1 1 A 42 42 HIS N N 42 121.760 121.675 0.085 1
1 456 . 16 1 1 A 43 43 GLY H H 43 8.286 7.454 0.832 1
1 457 . 16 1 1 A 43 43 GLY HA2 H 43 3.980 4.124 -0.144 1
1 458 . 16 1 1 A 43 43 GLY HA3 H 43 3.980 4.130 -0.150 1
1 459 . 16 1 1 A 43 43 GLY C C 43 176.307 172.679 3.628 1
1 460 . 16 1 1 A 43 43 GLY CA C 43 44.336 45.832 -1.496 1
1 461 . 16 1 1 A 43 43 GLY N N 43 110.133 107.566 2.567 1
1 462 . 16 1 1 A 44 44 PHE H H 44 8.327 8.566 -0.239 1
1 463 . 16 1 1 A 44 44 PHE HA H 44 4.489 4.588 -0.099 1
1 467 . 16 1 1 A 44 44 PHE C C 44 171.877 174.565 -2.688 1
1 468 . 16 1 1 A 44 44 PHE CA C 44 58.027 58.844 -0.817 1
1 469 . 16 1 1 A 44 44 PHE CB C 44 39.850 39.908 -0.058 1
1 470 . 16 1 1 A 44 44 PHE N N 44 120.049 120.797 -0.748 1
1 471 . 16 1 1 A 45 45 VAL H H 45 7.939 7.463 0.476 1
1 472 . 16 1 1 A 45 45 VAL HA H 45 3.865 3.871 -0.006 1
1 480 . 16 1 1 A 45 45 VAL C C 45 175.523 175.696 -0.173 1
1 481 . 16 1 1 A 45 45 VAL CA C 45 61.536 60.641 0.895 1
1 482 . 16 1 1 A 45 45 VAL CB C 45 33.127 32.854 0.273 1
1 485 . 16 1 1 A 45 45 VAL N N 45 127.882 125.565 2.317 1
1 486 . 16 1 1 A 46 46 LYS H H 46 8.868 8.797 0.071 1
1 487 . 16 1 1 A 46 46 LYS HA H 46 4.170 4.175 -0.005 1
1 496 . 16 1 1 A 46 46 LYS C C 46 175.728 176.170 -0.442 1
1 497 . 16 1 1 A 46 46 LYS CA C 46 57.198 58.789 -1.591 1
1 498 . 16 1 1 A 46 46 LYS CB C 46 33.299 32.910 0.389 1
1 502 . 16 1 1 A 46 46 LYS N N 46 127.308 127.349 -0.041 1
1 503 . 16 1 1 A 47 47 ASP H H 47 7.652 7.946 -0.294 1
1 504 . 16 1 1 A 47 47 ASP HA H 47 4.710 4.842 -0.132 1
1 507 . 16 1 1 A 47 47 ASP C C 47 176.411 175.991 0.420 1
1 508 . 16 1 1 A 47 47 ASP CA C 47 53.390 53.841 -0.451 1
1 509 . 16 1 1 A 47 47 ASP CB C 47 42.635 44.183 -1.548 1
1 510 . 16 1 1 A 47 47 ASP N N 47 117.932 115.198 2.734 1
1 511 . 16 1 1 A 48 48 ILE H H 48 9.230 8.615 0.615 1
1 512 . 16 1 1 A 48 48 ILE HA H 48 3.579 3.832 -0.253 1
1 522 . 16 1 1 A 48 48 ILE C C 48 177.249 177.559 -0.310 1
1 523 . 16 1 1 A 48 48 ILE CA C 48 65.525 63.635 1.890 1
1 524 . 16 1 1 A 48 48 ILE CB C 48 38.797 37.949 0.848 1
1 528 . 16 1 1 A 48 48 ILE N N 48 129.049 125.353 3.696 1
1 529 . 16 1 1 A 49 49 ASN H H 49 8.468 8.833 -0.365 1
1 530 . 16 1 1 A 49 49 ASN HA H 49 4.690 4.770 -0.080 1
1 535 . 16 1 1 A 49 49 ASN C C 49 175.779 176.672 -0.893 1
1 536 . 16 1 1 A 49 49 ASN CA C 49 55.587 54.794 0.793 1
1 537 . 16 1 1 A 49 49 ASN CB C 49 38.587 36.590 1.997 1
1 538 . 16 1 1 A 49 49 ASN N N 49 118.835 118.263 0.572 1
1 540 . 16 1 1 A 50 50 GLU H H 50 7.853 8.150 -0.297 1
1 541 . 16 1 1 A 50 50 GLU HA H 50 4.040 4.189 -0.149 1
1 546 . 16 1 1 A 50 50 GLU C C 50 176.148 177.419 -1.271 1
1 547 . 16 1 1 A 50 50 GLU CA C 50 57.404 58.332 -0.928 1
1 548 . 16 1 1 A 50 50 GLU CB C 50 29.491 29.878 -0.387 1
1 550 . 16 1 1 A 50 50 GLU N N 50 116.358 118.471 -2.113 1
1 551 . 16 1 1 A 51 51 HIS H H 51 7.575 8.104 -0.529 1
1 552 . 16 1 1 A 51 51 HIS HA H 51 4.431 4.760 -0.329 1
1 555 . 16 1 1 A 51 51 HIS C C 51 176.383 175.050 1.333 1
1 556 . 16 1 1 A 51 51 HIS CA C 51 57.089 56.733 0.356 1
1 557 . 16 1 1 A 51 51 HIS CB C 51 33.168 32.264 0.904 1
1 558 . 16 1 1 A 51 51 HIS N N 51 115.828 113.631 2.197 1
1 559 . 16 1 1 A 52 52 LEU H H 52 7.640 7.617 0.023 1
1 560 . 16 1 1 A 52 52 LEU HA H 52 4.796 4.895 -0.099 1
1 570 . 16 1 1 A 52 52 LEU C C 52 174.452 175.194 -0.742 1
1 571 . 16 1 1 A 52 52 LEU CA C 52 53.398 53.534 -0.136 1
1 572 . 16 1 1 A 52 52 LEU CB C 52 48.805 47.374 1.431 1
1 576 . 16 1 1 A 52 52 LEU N N 52 117.932 118.774 -0.842 1
1 577 . 16 1 1 A 53 53 SER H H 53 8.151 8.827 -0.676 1
1 578 . 16 1 1 A 53 53 SER HA H 53 4.680 4.981 -0.301 1
1 581 . 16 1 1 A 53 53 SER C C 53 174.304 172.924 1.380 1
1 582 . 16 1 1 A 53 53 SER CA C 53 56.714 57.642 -0.928 1
1 583 . 16 1 1 A 53 53 SER CB C 53 65.431 66.079 -0.648 1
1 584 . 16 1 1 A 53 53 SER N N 53 113.496 117.275 -3.779 1
1 585 . 16 1 1 A 54 54 VAL H H 54 8.782 8.561 0.221 1
1 586 . 16 1 1 A 54 54 VAL HA H 54 3.230 3.788 -0.558 1
1 594 . 16 1 1 A 54 54 VAL C C 54 173.745 177.234 -3.489 1
1 595 . 16 1 1 A 54 54 VAL CA C 54 66.232 63.652 2.580 1
1 596 . 16 1 1 A 54 54 VAL CB C 54 31.067 31.577 -0.510 1
1 599 . 16 1 1 A 54 54 VAL N N 54 124.401 126.647 -2.246 1
1 600 . 16 1 1 A 55 55 GLY H H 55 9.079 9.057 0.022 1
1 601 . 16 1 1 A 55 55 GLY HA2 H 55 3.530 3.861 -0.331 1
1 602 . 16 1 1 A 55 55 GLY HA3 H 55 4.553 3.862 0.691 1
1 603 . 16 1 1 A 55 55 GLY C C 55 177.219 173.229 3.990 1
1 604 . 16 1 1 A 55 55 GLY CA C 55 44.647 46.257 -1.610 1
1 605 . 16 1 1 A 55 55 GLY N N 55 117.320 116.128 1.192 1
1 606 . 16 1 1 A 56 56 ASP H H 56 7.943 7.751 0.192 1
1 607 . 16 1 1 A 56 56 ASP HA H 56 4.460 5.158 -0.698 1
1 610 . 16 1 1 A 56 56 ASP C C 56 176.055 173.733 2.322 1
1 611 . 16 1 1 A 56 56 ASP CA C 56 55.456 52.353 3.103 1
1 612 . 16 1 1 A 56 56 ASP CB C 56 40.914 44.592 -3.678 1
1 613 . 16 1 1 A 56 56 ASP N N 56 121.782 119.685 2.097 1
1 614 . 16 1 1 A 57 57 GLU H H 57 8.649 8.825 -0.176 1
1 615 . 16 1 1 A 57 57 GLU HA H 57 5.100 5.217 -0.117 1
1 620 . 16 1 1 A 57 57 GLU C C 57 175.635 175.756 -0.121 1
1 621 . 16 1 1 A 57 57 GLU CA C 57 55.805 55.479 0.326 1
1 622 . 16 1 1 A 57 57 GLU CB C 57 30.915 31.533 -0.618 1
1 624 . 16 1 1 A 57 57 GLU N N 57 122.513 123.770 -1.257 1
1 625 . 16 1 1 A 58 58 VAL H H 58 8.809 9.105 -0.296 1
1 626 . 16 1 1 A 58 58 VAL HA H 58 4.817 4.792 0.025 1
1 634 . 16 1 1 A 58 58 VAL C C 58 176.528 174.101 2.427 1
1 635 . 16 1 1 A 58 58 VAL CA C 58 58.719 59.397 -0.678 1
1 636 . 16 1 1 A 58 58 VAL CB C 58 35.523 35.921 -0.398 1
1 639 . 16 1 1 A 58 58 VAL N N 58 118.382 119.636 -1.254 1
1 640 . 16 1 1 A 59 59 GLN H H 59 8.255 8.712 -0.457 1
1 641 . 16 1 1 A 59 59 GLN HA H 59 5.030 4.842 0.188 1
1 646 . 16 1 1 A 59 59 GLN CA C 59 54.843 55.582 -0.739 1
1 647 . 16 1 1 A 59 59 GLN CB C 59 30.111 30.092 0.019 1
1 649 . 16 1 1 A 59 59 GLN N N 59 120.933 124.395 -3.462 1
1 650 . 16 1 1 A 60 60 VAL H H 60 8.970 9.275 -0.305 1
1 651 . 16 1 1 A 60 60 VAL HA H 60 4.990 4.899 0.091 1
1 659 . 16 1 1 A 60 60 VAL C C 60 175.203 173.907 1.296 1
1 660 . 16 1 1 A 60 60 VAL CA C 60 57.404 59.057 -1.653 1
1 661 . 16 1 1 A 60 60 VAL CB C 60 35.771 35.714 0.057 1
1 664 . 16 1 1 A 60 60 VAL N N 60 111.046 119.931 -8.885 1
1 665 . 16 1 1 A 61 61 LYS H H 61 8.937 8.653 0.284 1
1 666 . 16 1 1 A 61 61 LYS HA H 61 5.100 4.806 0.294 1
1 675 . 16 1 1 A 61 61 LYS C C 61 173.610 176.372 -2.762 1
1 676 . 16 1 1 A 61 61 LYS CA C 61 53.762 54.877 -1.115 1
1 677 . 16 1 1 A 61 61 LYS CB C 61 36.273 34.297 1.976 1
1 681 . 16 1 1 A 61 61 LYS N N 61 121.930 123.570 -1.640 1
1 682 . 16 1 1 A 62 62 VAL H H 62 8.429 9.318 -0.889 1
1 683 . 16 1 1 A 62 62 VAL HA H 62 4.074 4.024 0.050 1
1 691 . 16 1 1 A 62 62 VAL C C 62 176.912 175.939 0.973 1
1 692 . 16 1 1 A 62 62 VAL CA C 62 63.188 63.486 -0.298 1
1 693 . 16 1 1 A 62 62 VAL CB C 62 30.813 31.195 -0.382 1
1 696 . 16 1 1 A 62 62 VAL N N 62 126.329 127.120 -0.791 1
1 697 . 16 1 1 A 63 63 LEU H H 63 9.109 9.082 0.027 1
1 698 . 16 1 1 A 63 63 LEU HA H 63 4.423 4.425 -0.002 1
1 708 . 16 1 1 A 63 63 LEU C C 63 176.091 176.171 -0.080 1
1 709 . 16 1 1 A 63 63 LEU CA C 63 55.876 56.430 -0.554 1
1 710 . 16 1 1 A 63 63 LEU CB C 63 42.800 43.229 -0.429 1
1 714 . 16 1 1 A 63 63 LEU N N 63 129.436 129.931 -0.495 1
1 715 . 16 1 1 A 64 64 ALA H H 64 7.594 7.220 0.374 1
1 716 . 16 1 1 A 64 64 ALA HA H 64 4.455 4.703 -0.248 1
1 720 . 16 1 1 A 64 64 ALA C C 64 177.314 175.187 2.127 1
1 721 . 16 1 1 A 64 64 ALA CA C 64 52.557 51.807 0.750 1
1 722 . 16 1 1 A 64 64 ALA CB C 64 21.458 22.699 -1.241 1
1 723 . 16 1 1 A 64 64 ALA N N 64 117.791 118.164 -0.373 1
1 724 . 16 1 1 A 65 65 VAL H H 65 8.583 8.612 -0.029 1
1 725 . 16 1 1 A 65 65 VAL HA H 65 4.470 4.944 -0.474 1
1 733 . 16 1 1 A 65 65 VAL C C 65 174.697 172.836 1.861 1
1 734 . 16 1 1 A 65 65 VAL CA C 65 61.936 60.017 1.919 1
1 735 . 16 1 1 A 65 65 VAL CB C 65 35.288 35.713 -0.425 1
1 738 . 16 1 1 A 65 65 VAL N N 65 120.009 118.340 1.669 1
1 739 . 16 1 1 A 66 66 ASP H H 66 8.567 8.935 -0.368 1
1 740 . 16 1 1 A 66 66 ASP HA H 66 4.880 4.979 -0.099 1
1 743 . 16 1 1 A 66 66 ASP C C 66 174.355 175.946 -1.591 1
1 744 . 16 1 1 A 66 66 ASP CA C 66 52.681 53.105 -0.424 1
1 745 . 16 1 1 A 66 66 ASP CB C 66 41.775 42.423 -0.648 1
1 746 . 16 1 1 A 66 66 ASP N N 66 126.262 127.845 -1.583 1
1 747 . 16 1 1 A 67 67 GLU H H 67 9.148 9.026 0.122 1
1 748 . 16 1 1 A 67 67 GLU HA H 67 4.110 4.194 -0.084 1
1 753 . 16 1 1 A 67 67 GLU C C 67 177.052 178.478 -1.426 1
1 754 . 16 1 1 A 67 67 GLU CA C 67 59.044 58.300 0.744 1
1 755 . 16 1 1 A 67 67 GLU CB C 67 29.919 28.757 1.162 1
1 757 . 16 1 1 A 67 67 GLU N N 67 125.480 125.503 -0.023 1
1 758 . 16 1 1 A 68 68 GLU H H 68 8.384 7.939 0.445 1
1 759 . 16 1 1 A 68 68 GLU HA H 68 4.140 4.165 -0.025 1
1 764 . 16 1 1 A 68 68 GLU C C 68 178.383 179.264 -0.881 1
1 765 . 16 1 1 A 68 68 GLU CA C 68 59.044 59.004 0.040 1
1 766 . 16 1 1 A 68 68 GLU CB C 68 29.919 29.938 -0.019 1
1 768 . 16 1 1 A 68 68 GLU N N 68 119.760 119.485 0.275 1
1 769 . 16 1 1 A 69 69 LYS H H 69 7.799 8.029 -0.230 1
1 770 . 16 1 1 A 69 69 LYS HA H 69 4.375 4.147 0.228 1
1 779 . 16 1 1 A 69 69 LYS C C 69 178.297 177.359 0.938 1
1 780 . 16 1 1 A 69 69 LYS CA C 69 55.704 56.460 -0.756 1
1 781 . 16 1 1 A 69 69 LYS CB C 69 33.622 32.801 0.821 1
1 785 . 16 1 1 A 69 69 LYS N N 69 115.476 116.951 -1.475 1
1 786 . 16 1 1 A 70 70 GLY H H 70 7.994 8.274 -0.280 1
1 787 . 16 1 1 A 70 70 GLY HA2 H 70 3.940 3.954 -0.014 1
1 788 . 16 1 1 A 70 70 GLY HA3 H 70 3.960 3.960 0.000 1
1 789 . 16 1 1 A 70 70 GLY C C 70 177.215 173.749 3.466 1
1 790 . 16 1 1 A 70 70 GLY CA C 70 46.773 46.616 0.157 1
1 791 . 16 1 1 A 70 70 GLY N N 70 110.245 108.549 1.696 1
1 792 . 16 1 1 A 71 71 LYS H H 71 7.560 7.753 -0.193 1
1 793 . 16 1 1 A 71 71 LYS HA H 71 4.690 4.966 -0.276 1
1 802 . 16 1 1 A 71 71 LYS C C 71 174.607 174.701 -0.094 1
1 803 . 16 1 1 A 71 71 LYS CA C 71 55.332 54.214 1.118 1
1 804 . 16 1 1 A 71 71 LYS CB C 71 34.903 36.654 -1.751 1
1 808 . 16 1 1 A 71 71 LYS N N 71 118.201 114.859 3.342 1
1 809 . 16 1 1 A 72 72 ILE H H 72 8.867 8.717 0.150 1
1 810 . 16 1 1 A 72 72 ILE HA H 72 4.630 4.910 -0.280 1
1 820 . 16 1 1 A 72 72 ILE C C 72 175.708 174.611 1.097 1
1 821 . 16 1 1 A 72 72 ILE CA C 72 61.494 59.714 1.780 1
1 822 . 16 1 1 A 72 72 ILE CB C 72 40.652 42.259 -1.607 1
1 826 . 16 1 1 A 72 72 ILE N N 72 126.827 121.440 5.387 1
1 827 . 16 1 1 A 73 73 SER H H 73 8.815 9.141 -0.326 1
1 828 . 16 1 1 A 73 73 SER HA H 73 5.110 5.228 -0.118 1
1 831 . 16 1 1 A 73 73 SER C C 73 175.122 173.302 1.820 1
1 832 . 16 1 1 A 73 73 SER CA C 73 57.487 58.224 -0.737 1
1 833 . 16 1 1 A 73 73 SER CB C 73 64.386 64.646 -0.260 1
1 834 . 16 1 1 A 73 73 SER N N 73 123.640 124.210 -0.570 1
1 835 . 16 1 1 A 74 74 LEU H H 74 8.585 8.762 -0.177 1
1 836 . 16 1 1 A 74 74 LEU HA H 74 5.450 5.319 0.131 1
1 846 . 16 1 1 A 74 74 LEU C C 74 174.061 175.990 -1.929 1
1 847 . 16 1 1 A 74 74 LEU CA C 74 53.101 53.487 -0.386 1
1 848 . 16 1 1 A 74 74 LEU CB C 74 48.268 46.797 1.471 1
1 852 . 16 1 1 A 74 74 LEU N N 74 125.221 124.670 0.551 1
1 853 . 16 1 1 A 75 75 SER H H 75 8.840 8.738 0.102 1
1 854 . 16 1 1 A 75 75 SER HA H 75 5.040 5.113 -0.073 1
1 857 . 16 1 1 A 75 75 SER C C 75 176.552 173.419 3.133 1
1 858 . 16 1 1 A 75 75 SER CA C 75 57.487 57.188 0.299 1
1 859 . 16 1 1 A 75 75 SER CB C 75 64.993 66.566 -1.573 1
1 860 . 16 1 1 A 75 75 SER N N 75 111.252 116.347 -5.095 1
1 861 . 16 1 1 A 76 76 ILE H H 76 7.790 8.818 -1.028 1
1 862 . 16 1 1 A 76 76 ILE HA H 76 4.690 4.516 0.174 1
1 872 . 16 1 1 A 76 76 ILE C C 76 175.780 177.167 -1.387 1
1 873 . 16 1 1 A 76 76 ILE CA C 76 63.631 61.677 1.954 1
1 874 . 16 1 1 A 76 76 ILE CB C 76 39.484 39.229 0.255 1
1 878 . 16 1 1 A 76 76 ILE N N 76 129.205 124.308 4.897 1
1 879 . 16 1 1 A 77 77 ARG H H 77 8.115 8.335 -0.220 1
1 880 . 16 1 1 A 77 77 ARG HA H 77 3.760 4.004 -0.244 1
1 887 . 16 1 1 A 77 77 ARG C C 77 178.704 177.778 0.926 1
1 888 . 16 1 1 A 77 77 ARG CA C 77 58.933 58.332 0.601 1
1 889 . 16 1 1 A 77 77 ARG CB C 77 29.463 29.499 -0.036 1
1 892 . 16 1 1 A 77 77 ARG N N 77 123.257 121.681 1.576 1
1 893 . 16 1 1 A 78 78 ALA H H 78 8.304 7.641 0.663 1
1 894 . 16 1 1 A 78 78 ALA HA H 78 4.296 4.219 0.077 1
1 898 . 16 1 1 A 78 78 ALA C C 78 176.870 178.195 -1.325 1
1 899 . 16 1 1 A 78 78 ALA CA C 78 53.548 53.987 -0.439 1
1 900 . 16 1 1 A 78 78 ALA CB C 78 19.872 18.391 1.481 1
1 901 . 16 1 1 A 78 78 ALA N N 78 118.764 121.220 -2.456 1
1 902 . 16 1 1 A 79 79 THR H H 79 7.931 7.821 0.110 1
1 903 . 16 1 1 A 79 79 THR HA H 79 4.370 4.611 -0.241 1
1 908 . 16 1 1 A 79 79 THR C C 79 178.356 174.543 3.813 1
1 909 . 16 1 1 A 79 79 THR CA C 79 62.381 61.906 0.475 1
1 910 . 16 1 1 A 79 79 THR CB C 79 69.693 70.791 -1.098 1
1 912 . 16 1 1 A 79 79 THR N N 79 107.360 103.557 3.803 1
1 913 . 16 1 1 A 80 80 GLN H H 80 7.651 7.816 -0.165 1
1 914 . 16 1 1 A 80 80 GLN HA H 80 4.527 4.708 -0.181 1
1 921 . 16 1 1 A 80 80 GLN C C 80 174.249 175.954 -1.705 1
1 922 . 16 1 1 A 80 80 GLN CA C 80 54.760 54.112 0.648 1
1 923 . 16 1 1 A 80 80 GLN CB C 80 30.565 32.645 -2.080 1
1 925 . 16 1 1 A 80 80 GLN N N 80 121.588 119.817 1.771 1
1 927 . 16 1 1 A 81 81 ALA H H 81 8.498 8.785 -0.287 1
1 928 . 16 1 1 A 81 81 ALA HA H 81 4.252 4.080 0.172 1
1 932 . 16 1 1 A 81 81 ALA C C 81 175.693 177.397 -1.704 1
1 933 . 16 1 1 A 81 81 ALA CA C 81 52.345 55.139 -2.794 1
1 934 . 16 1 1 A 81 81 ALA CB C 81 19.062 18.259 0.803 1
1 935 . 16 1 1 A 81 81 ALA N N 81 126.423 124.419 2.004 1
1 936 . 16 1 1 A 82 82 ALA H H 82 8.324 7.892 0.432 1
1 937 . 16 1 1 A 82 82 ALA HA H 82 4.000 3.989 0.011 1
1 941 . 16 1 1 A 82 82 ALA C C 82 177.065 175.645 1.420 1
1 942 . 16 1 1 A 82 82 ALA CA C 82 50.240 52.897 -2.657 1
1 943 . 16 1 1 A 82 82 ALA CB C 82 17.650 17.582 0.068 1
1 944 . 16 1 1 A 82 82 ALA N N 82 125.114 118.613 6.501 1
1 945 . 16 1 1 A 83 83 PRO HA H 83 4.350 4.619 -0.269 1
1 952 . 16 1 1 A 83 83 PRO CA C 83 63.148 62.404 0.744 1
1 953 . 16 1 1 A 83 83 PRO CB C 83 32.054 32.431 -0.377 1
1 956 . 16 1 1 A 84 84 GLU H H 84 8.517 8.520 -0.003 1
1 957 . 16 1 1 A 84 84 GLU HA H 84 4.197 4.227 -0.030 1
1 962 . 16 1 1 A 84 84 GLU C C 84 176.948 176.750 0.198 1
1 963 . 16 1 1 A 84 84 GLU CA C 84 56.674 57.090 -0.416 1
1 964 . 16 1 1 A 84 84 GLU CB C 84 30.459 30.279 0.180 1
1 966 . 16 1 1 A 84 84 GLU N N 84 121.479 121.483 -0.004 1
1 967 . 16 1 1 A 85 85 LYS H H 85 8.381 8.624 -0.243 1
1 968 . 16 1 1 A 85 85 LYS HA H 85 4.309 5.068 -0.759 1
1 977 . 16 1 1 A 85 85 LYS C C 85 176.457 173.823 2.634 1
1 978 . 16 1 1 A 85 85 LYS CA C 85 56.272 54.717 1.555 1
1 979 . 16 1 1 A 85 85 LYS CB C 85 32.961 36.551 -3.590 1
1 983 . 16 1 1 A 85 85 LYS N N 85 123.266 120.350 2.916 1
1 984 . 16 1 1 A 86 86 LYS H H 86 8.403 8.473 -0.070 1
1 985 . 16 1 1 A 86 86 LYS HA H 86 4.308 5.120 -0.812 1
1 994 . 16 1 1 A 86 86 LYS C C 86 176.435 175.572 0.863 1
1 995 . 16 1 1 A 86 86 LYS CA C 86 56.272 55.038 1.234 1
1 996 . 16 1 1 A 86 86 LYS CB C 86 32.961 33.459 -0.498 1
1 1000 . 16 1 1 A 86 86 LYS N N 86 123.688 119.794 3.894 1
1 1001 . 16 1 1 A 87 87 GLU H H 87 8.540 8.744 -0.204 1
1 1002 . 16 1 1 A 87 87 GLU HA H 87 4.358 4.640 -0.282 1
1 1007 . 16 1 1 A 87 87 GLU C C 87 176.556 177.053 -0.497 1
1 1008 . 16 1 1 A 87 87 GLU CA C 87 56.406 56.260 0.146 1
1 1009 . 16 1 1 A 87 87 GLU CB C 87 30.607 32.684 -2.077 1
1 1011 . 16 1 1 A 87 87 GLU N N 87 122.633 126.095 -3.462 1
1 1012 . 16 1 1 A 88 88 SER H H 88 8.520 8.334 0.186 1
1 1013 . 16 1 1 A 88 88 SER HA H 88 4.490 4.757 -0.267 1
1 1016 . 16 1 1 A 88 88 SER C C 88 175.780 173.781 1.999 1
1 1017 . 16 1 1 A 88 88 SER CA C 88 58.431 57.719 0.712 1
1 1018 . 16 1 1 A 88 88 SER CB C 88 63.858 64.770 -0.912 1
1 1019 . 16 1 1 A 88 88 SER N N 88 118.333 115.130 3.203 1
1 1020 . 16 1 1 A 89 89 LYS H H 89 8.339 7.342 0.997 1
1 1021 . 16 1 1 A 89 89 LYS HA H 89 4.620 4.552 0.068 1
1 1030 . 16 1 1 A 89 89 LYS C C 89 174.160 175.890 -1.730 1
1 1031 . 16 1 1 A 89 89 LYS CA C 89 54.265 55.269 -1.004 1
1 1032 . 16 1 1 A 89 89 LYS CB C 89 32.672 32.307 0.365 1
1 1036 . 16 1 1 A 89 89 LYS N N 89 124.433 119.901 4.532 1
1 1037 . 16 1 1 A 90 90 PRO HA H 90 4.417 4.693 -0.276 1
1 1044 . 16 1 1 A 90 90 PRO CA C 90 63.064 62.993 0.071 1
1 1045 . 16 1 1 A 90 90 PRO CB C 90 32.266 32.961 -0.695 1
1 1048 . 16 1 1 A 91 91 ARG H H 91 8.502 8.831 -0.329 1
1 1049 . 16 1 1 A 91 91 ARG HA H 91 4.305 4.551 -0.246 1
1 1056 . 16 1 1 A 91 91 ARG C C 91 176.831 175.363 1.468 1
1 1057 . 16 1 1 A 91 91 ARG CA C 91 56.002 55.271 0.731 1
1 1058 . 16 1 1 A 91 91 ARG CB C 91 30.913 31.728 -0.815 1
1 1061 . 16 1 1 A 91 91 ARG N N 91 122.193 121.373 0.820 1
1 1062 . 16 1 1 A 92 92 LYS H H 92 8.415 7.869 0.546 1
1 1063 . 16 1 1 A 92 92 LYS HA H 92 4.610 3.963 0.647 1
1 1072 . 16 1 1 A 92 92 LYS C C 92 176.262 174.251 2.011 1
1 1073 . 16 1 1 A 92 92 LYS CA C 92 54.258 56.809 -2.551 1
1 1074 . 16 1 1 A 92 92 LYS CB C 92 32.672 31.126 1.546 1
1 1078 . 16 1 1 A 92 92 LYS N N 92 124.243 116.208 8.035 1
1 1079 . 16 1 1 A 93 93 PRO HA H 93 4.415 4.568 -0.153 1
1 1086 . 16 1 1 A 93 93 PRO CA C 93 62.899 62.508 0.391 1
1 1087 . 16 1 1 A 93 93 PRO CB C 93 32.323 32.177 0.146 1
1 1090 . 16 1 1 A 94 94 LYS H H 94 8.420 8.416 0.004 1
1 1091 . 16 1 1 A 94 94 LYS HA H 94 4.290 4.312 -0.022 1
1 1100 . 16 1 1 A 94 94 LYS C C 94 176.714 175.501 1.213 1
1 1101 . 16 1 1 A 94 94 LYS CA C 94 56.585 56.615 -0.030 1
1 1102 . 16 1 1 A 94 94 LYS CB C 94 33.161 33.286 -0.125 1
1 1106 . 16 1 1 A 94 94 LYS N N 94 122.121 122.271 -0.150 1
1 1107 . 16 1 1 A 95 95 ALA H H 95 8.348 8.374 -0.026 1
1 1108 . 16 1 1 A 95 95 ALA HA H 95 4.250 5.107 -0.857 1
1 1112 . 16 1 1 A 95 95 ALA C C 95 176.453 175.204 1.249 1
1 1113 . 16 1 1 A 95 95 ALA CA C 95 52.471 50.978 1.493 1
1 1114 . 16 1 1 A 95 95 ALA CB C 95 19.347 23.680 -4.333 1
1 1115 . 16 1 1 A 95 95 ALA N N 95 125.624 127.781 -2.157 1
1 1116 . 16 1 1 A 96 96 ALA H H 96 8.348 8.219 0.129 1
1 1117 . 16 1 1 A 96 96 ALA HA H 96 4.254 4.815 -0.561 1
1 1121 . 16 1 1 A 96 96 ALA C C 96 176.462 176.170 0.292 1
1 1122 . 16 1 1 A 96 96 ALA CA C 96 52.471 50.922 1.549 1
1 1123 . 16 1 1 A 96 96 ALA CB C 96 19.347 23.302 -3.955 1
1 1124 . 16 1 1 A 96 96 ALA N N 96 125.624 120.423 5.201 1
1 1125 . 16 1 1 A 97 97 GLN H H 97 8.333 8.377 -0.044 1
1 1126 . 16 1 1 A 97 97 GLN HA H 97 4.362 4.660 -0.298 1
1 1133 . 16 1 1 A 97 97 GLN C C 97 177.684 175.948 1.736 1
1 1134 . 16 1 1 A 97 97 GLN CA C 97 55.848 56.981 -1.133 1
1 1135 . 16 1 1 A 97 97 GLN CB C 97 29.643 29.364 0.279 1
1 1137 . 16 1 1 A 97 97 GLN N N 97 120.049 119.310 0.739 1
1 1139 . 16 1 1 A 98 98 VAL H H 98 8.230 8.840 -0.610 1
1 1140 . 16 1 1 A 98 98 VAL HA H 98 4.145 4.728 -0.583 1
1 1148 . 16 1 1 A 98 98 VAL C C 98 176.033 174.705 1.328 1
1 1149 . 16 1 1 A 98 98 VAL CA C 98 62.444 59.020 3.424 1
1 1150 . 16 1 1 A 98 98 VAL CB C 98 32.942 36.045 -3.103 1
1 1153 . 16 1 1 A 98 98 VAL N N 98 121.607 119.257 2.350 1
1 1154 . 16 1 1 A 99 99 SER H H 99 8.375 8.471 -0.096 1
1 1155 . 16 1 1 A 99 99 SER HA H 99 4.473 4.438 0.035 1
1 1158 . 16 1 1 A 99 99 SER C C 99 176.204 174.544 1.660 1
1 1159 . 16 1 1 A 99 99 SER CA C 99 58.379 59.400 -1.021 1
1 1160 . 16 1 1 A 99 99 SER CB C 99 63.914 63.836 0.078 1
1 1161 . 16 1 1 A 99 99 SER N N 99 119.455 118.989 0.466 1
1 1162 . 16 1 1 A 100 100 GLU H H 100 8.547 8.588 -0.041 1
1 1163 . 16 1 1 A 100 100 GLU HA H 100 4.304 4.778 -0.474 1
1 1168 . 16 1 1 A 100 100 GLU C C 100 174.620 174.612 0.008 1
1 1169 . 16 1 1 A 100 100 GLU CA C 100 56.835 55.630 1.205 1
1 1170 . 16 1 1 A 100 100 GLU CB C 100 30.365 33.762 -3.397 1
1 1172 . 16 1 1 A 100 100 GLU N N 100 123.419 124.315 -0.896 1
1 1173 . 16 1 1 A 101 101 GLU H H 101 8.432 8.997 -0.565 1
1 1174 . 16 1 1 A 101 101 GLU HA H 101 4.252 4.845 -0.593 1
1 1179 . 16 1 1 A 101 101 GLU C C 101 176.693 176.623 0.070 1
1 1180 . 16 1 1 A 101 101 GLU CA C 101 56.835 56.661 0.174 1
1 1181 . 16 1 1 A 101 101 GLU CB C 101 30.365 31.875 -1.510 1
1 1183 . 16 1 1 A 101 101 GLU N N 101 122.025 121.106 0.919 1
1 1184 . 16 1 1 A 102 102 ALA H H 102 8.324 7.818 0.506 1
1 1185 . 16 1 1 A 102 102 ALA HA H 102 4.361 4.310 0.051 1
1 1189 . 16 1 1 A 102 102 ALA C C 102 177.065 177.217 -0.152 1
1 1190 . 16 1 1 A 102 102 ALA CA C 102 52.647 52.949 -0.302 1
1 1191 . 16 1 1 A 102 102 ALA CB C 102 19.227 19.453 -0.226 1
1 1192 . 16 1 1 A 102 102 ALA N N 102 125.114 123.684 1.430 1
1 1193 . 16 1 1 A 103 103 SER H H 103 8.259 8.662 -0.403 1
1 1194 . 16 1 1 A 103 103 SER HA H 103 4.473 5.043 -0.570 1
1 1197 . 16 1 1 A 103 103 SER C C 103 177.772 173.516 4.256 1
1 1198 . 16 1 1 A 103 103 SER CA C 103 58.301 57.461 0.840 1
1 1199 . 16 1 1 A 103 103 SER CB C 103 63.961 66.987 -3.026 1
1 1200 . 16 1 1 A 103 103 SER N N 103 115.109 116.336 -1.227 1
1 1201 . 16 1 1 A 104 104 THR H H 104 8.127 8.424 -0.297 1
1 1202 . 16 1 1 A 104 104 THR HA H 104 4.600 4.390 0.210 1
1 1207 . 16 1 1 A 104 104 THR C C 104 174.427 174.900 -0.473 1
1 1208 . 16 1 1 A 104 104 THR CA C 104 59.954 60.684 -0.730 1
1 1209 . 16 1 1 A 104 104 THR CB C 104 69.868 68.806 1.062 1
1 1211 . 16 1 1 A 104 104 THR N N 104 117.882 114.810 3.072 1
1 1212 . 16 1 1 A 105 105 PRO HA H 105 4.414 4.459 -0.045 1
1 1219 . 16 1 1 A 105 105 PRO CA C 105 63.300 64.335 -1.035 1
1 1220 . 16 1 1 A 105 105 PRO CB C 105 32.227 31.881 0.346 1
1 1223 . 16 1 1 A 106 106 GLN H H 106 8.524 7.700 0.824 1
1 1224 . 16 1 1 A 106 106 GLN HA H 106 4.276 3.561 0.715 1
1 1229 . 16 1 1 A 106 106 GLN C C 106 177.083 175.872 1.211 1
1 1230 . 16 1 1 A 106 106 GLN CA C 106 56.209 57.279 -1.070 1
1 1231 . 16 1 1 A 106 106 GLN CB C 106 29.490 28.743 0.747 1
1 1233 . 16 1 1 A 106 106 GLN N N 106 120.754 118.958 1.796 1
1 1234 . 16 1 1 A 107 107 GLY H H 107 8.394 7.205 1.189 1
1 1235 . 16 1 1 A 107 107 GLY HA2 H 107 3.895 4.025 -0.130 1
1 1236 . 16 1 1 A 107 107 GLY HA3 H 107 3.895 4.039 -0.144 1
1 1237 . 16 1 1 A 107 107 GLY C C 107 176.651 175.303 1.348 1
1 1238 . 16 1 1 A 107 107 GLY CA C 107 45.330 45.313 0.017 1
1 1239 . 16 1 1 A 107 107 GLY N N 107 110.026 111.504 -1.478 1
1 1240 . 16 1 1 A 108 108 PHE H H 108 8.099 7.722 0.377 1
1 1241 . 16 1 1 A 108 108 PHE HA H 108 4.582 4.277 0.305 1
1 1245 . 16 1 1 A 108 108 PHE C C 108 173.944 175.813 -1.869 1
1 1246 . 16 1 1 A 108 108 PHE CA C 108 58.054 59.452 -1.398 1
1 1247 . 16 1 1 A 108 108 PHE CB C 108 39.708 38.899 0.809 1
1 1248 . 16 1 1 A 108 108 PHE N N 108 120.180 118.060 2.120 1
1 1249 . 16 1 1 A 109 109 ASN H H 109 8.482 7.781 0.701 1
1 1250 . 16 1 1 A 109 109 ASN HA H 109 4.691 5.077 -0.386 1
1 1255 . 16 1 1 A 109 109 ASN C C 109 175.627 173.446 2.181 1
1 1256 . 16 1 1 A 109 109 ASN CA C 109 53.402 52.414 0.988 1
1 1257 . 16 1 1 A 109 109 ASN CB C 109 38.883 42.247 -3.364 1
1 1258 . 16 1 1 A 109 109 ASN N N 109 120.752 115.440 5.312 1
1 1260 . 16 1 1 A 110 110 THR H H 110 8.112 8.457 -0.345 1
1 1261 . 16 1 1 A 110 110 THR HA H 110 4.251 4.271 -0.020 1
1 1266 . 16 1 1 A 110 110 THR C C 110 175.275 173.710 1.565 1
1 1267 . 16 1 1 A 110 110 THR CA C 110 62.460 62.418 0.042 1
1 1268 . 16 1 1 A 110 110 THR CB C 110 69.726 69.925 -0.199 1
1 1270 . 16 1 1 A 110 110 THR N N 110 114.601 115.515 -0.914 1
1 1271 . 16 1 1 A 111 111 LEU H H 111 8.168 8.415 -0.247 1
1 1272 . 16 1 1 A 111 111 LEU HA H 111 4.308 4.783 -0.475 1
1 1282 . 16 1 1 A 111 111 LEU CA C 111 55.704 54.135 1.569 1
1 1283 . 16 1 1 A 111 111 LEU CB C 111 42.071 45.297 -3.226 1
1 1287 . 16 1 1 A 111 111 LEU N N 111 123.756 123.652 0.104 1
1 1288 . 16 1 1 A 112 112 LYS H H 112 8.123 8.816 -0.693 1
1 1289 . 16 1 1 A 112 112 LYS HA H 112 4.242 4.063 0.179 1
1 1298 . 16 1 1 A 112 112 LYS C C 112 177.547 176.854 0.693 1
1 1299 . 16 1 1 A 112 112 LYS CA C 112 56.928 59.244 -2.316 1
1 1300 . 16 1 1 A 112 112 LYS CB C 112 33.055 32.464 0.591 1
1 1304 . 16 1 1 A 112 112 LYS N N 112 121.442 125.647 -4.205 1
1 1305 . 16 1 1 A 113 113 ASP H H 113 8.230 7.665 0.565 1
1 1306 . 16 1 1 A 113 113 ASP HA H 113 4.526 4.456 0.070 1
1 1309 . 16 1 1 A 113 113 ASP C C 113 176.532 175.399 1.133 1
1 1310 . 16 1 1 A 113 113 ASP CA C 113 54.896 54.692 0.204 1
1 1311 . 16 1 1 A 113 113 ASP CB C 113 41.362 41.192 0.170 1
1 1312 . 16 1 1 A 113 113 ASP N N 113 120.598 119.809 0.789 1
1 1313 . 16 1 1 A 114 114 LYS H H 114 8.127 8.350 -0.223 1
1 1314 . 16 1 1 A 114 114 LYS HA H 114 4.300 5.049 -0.749 1
1 1323 . 16 1 1 A 114 114 LYS C C 114 176.303 175.085 1.218 1
1 1324 . 16 1 1 A 114 114 LYS CA C 114 56.633 55.407 1.226 1
1 1325 . 16 1 1 A 114 114 LYS CB C 114 32.818 36.379 -3.561 1
1 1329 . 16 1 1 A 114 114 LYS N N 114 120.897 125.730 -4.833 1
1 1330 . 16 1 1 A 115 115 LEU H H 115 8.244 8.726 -0.482 1
1 1331 . 16 1 1 A 115 115 LEU HA H 115 4.254 4.484 -0.230 1
1 1341 . 16 1 1 A 115 115 LEU C C 115 176.909 175.939 0.970 1
1 1342 . 16 1 1 A 115 115 LEU CA C 115 56.282 56.172 0.110 1
1 1343 . 16 1 1 A 115 115 LEU CB C 115 42.188 45.406 -3.218 1
1 1347 . 16 1 1 A 115 115 LEU N N 115 123.251 125.625 -2.374 1
1 1348 . 16 1 1 A 116 116 GLU H H 116 8.421 7.906 0.515 1
1 1349 . 16 1 1 A 116 116 GLU HA H 116 4.190 4.665 -0.475 1
1 1352 . 16 1 1 A 116 116 GLU C C 116 177.828 175.462 2.366 1
1 1353 . 16 1 1 A 116 116 GLU CA C 116 57.466 55.303 2.163 1
1 1354 . 16 1 1 A 116 116 GLU CB C 116 30.124 32.834 -2.710 1
1 1355 . 16 1 1 A 116 116 GLU N N 116 120.575 114.356 6.219 1
1 1356 . 16 1 1 A 117 117 GLU H H 117 8.255 7.911 0.344 1
1 1357 . 16 1 1 A 117 117 GLU HA H 117 4.192 4.514 -0.322 1
1 1362 . 16 1 1 A 117 117 GLU CA C 117 57.491 55.237 2.254 1
1 1363 . 16 1 1 A 117 117 GLU CB C 117 30.365 29.529 0.836 1
1 1365 . 16 1 1 A 117 117 GLU N N 117 120.933 117.636 3.297 1
1 1366 . 16 1 1 A 118 118 TRP H H 118 8.143 7.594 0.549 1
1 1367 . 16 1 1 A 118 118 TRP HA H 118 4.581 5.555 -0.974 1
1 1372 . 16 1 1 A 118 118 TRP C C 118 176.794 174.834 1.960 1
1 1373 . 16 1 1 A 118 118 TRP CA C 118 58.363 56.037 2.326 1
1 1374 . 16 1 1 A 118 118 TRP CB C 118 29.333 34.244 -4.911 1
1 1375 . 16 1 1 A 118 118 TRP N N 118 121.592 121.022 0.570 1
1 1376 . 16 1 1 A 119 119 ILE H H 119 7.908 8.677 -0.769 1
1 1377 . 16 1 1 A 119 119 ILE HA H 119 3.828 4.998 -1.170 1
1 1387 . 16 1 1 A 119 119 ILE C C 119 176.984 173.939 3.045 1
1 1388 . 16 1 1 A 119 119 ILE CA C 119 62.335 59.329 3.006 1
1 1389 . 16 1 1 A 119 119 ILE CB C 119 38.649 42.125 -3.476 1
1 1393 . 16 1 1 A 119 119 ILE N N 119 122.744 120.529 2.215 1
1 1394 . 16 1 1 A 120 120 GLU H H 120 8.143 8.964 -0.821 1
1 1395 . 16 1 1 A 120 120 GLU HA H 120 4.093 5.055 -0.962 1
1 1400 . 16 1 1 A 120 120 GLU C C 120 176.565 173.845 2.720 1
1 1401 . 16 1 1 A 120 120 GLU CA C 120 57.613 55.053 2.560 1
1 1402 . 16 1 1 A 120 120 GLU CB C 120 29.834 33.418 -3.584 1
1 1404 . 16 1 1 A 120 120 GLU N N 120 123.139 126.634 -3.495 1
1 1405 . 16 1 1 A 121 121 MET H H 121 8.254 8.698 -0.444 1
1 1406 . 16 1 1 A 121 121 MET HA H 121 4.357 5.195 -0.838 1
1 1411 . 16 1 1 A 121 121 MET CA C 121 56.625 53.991 2.634 1
1 1412 . 16 1 1 A 121 121 MET CB C 121 32.664 37.917 -5.253 1
1 1414 . 16 1 1 A 121 121 MET N N 121 120.449 119.558 0.891 1
1 1415 . 16 1 1 A 122 122 SER H H 122 8.199 8.651 -0.452 1
1 1416 . 16 1 1 A 122 122 SER HA H 122 4.280 5.376 -1.096 1
1 1419 . 16 1 1 A 122 122 SER C C 122 177.224 173.360 3.864 1
1 1420 . 16 1 1 A 122 122 SER CA C 122 59.635 57.495 2.140 1
1 1421 . 16 1 1 A 122 122 SER CB C 122 63.560 66.143 -2.583 1
1 1422 . 16 1 1 A 122 122 SER N N 122 115.857 115.961 -0.104 1
1 1423 . 16 1 1 A 123 123 ASN H H 123 8.211 8.938 -0.727 1
1 1424 . 16 1 1 A 123 123 ASN HA H 123 4.737 5.043 -0.306 1
1 1429 . 16 1 1 A 123 123 ASN C C 123 174.709 173.580 1.129 1
1 1430 . 16 1 1 A 123 123 ASN CA C 123 53.507 52.881 0.626 1
1 1431 . 16 1 1 A 123 123 ASN CB C 123 38.800 42.521 -3.721 1
1 1432 . 16 1 1 A 123 123 ASN N N 123 119.923 121.126 -1.203 1
1 1434 . 16 1 1 A 124 124 ARG H H 124 7.997 8.455 -0.458 1
1 1435 . 16 1 1 A 124 124 ARG HA H 124 4.305 4.309 -0.004 1
1 1442 . 16 1 1 A 124 124 ARG C C 124 175.477 175.745 -0.268 1
1 1443 . 16 1 1 A 124 124 ARG CA C 124 56.709 56.585 0.124 1
1 1444 . 16 1 1 A 124 124 ARG CB C 124 30.584 30.588 -0.004 1
1 1447 . 16 1 1 A 124 124 ARG N N 124 120.821 127.535 -6.714 1
1 1448 . 16 1 1 A 125 125 LYS H H 125 8.327 8.421 -0.094 1
1 1449 . 16 1 1 A 125 125 LYS HA H 125 4.254 4.428 -0.174 1
1 1458 . 16 1 1 A 125 125 LYS C C 125 176.777 175.817 0.960 1
1 1459 . 16 1 1 A 125 125 LYS CA C 125 56.860 56.309 0.551 1
1 1460 . 16 1 1 A 125 125 LYS CB C 125 32.879 32.756 0.123 1
1 1464 . 16 1 1 A 125 125 LYS N N 125 121.891 123.788 -1.897 1
1 1465 . 16 1 1 A 126 126 ASP H H 126 8.343 8.073 0.270 1
1 1466 . 16 1 1 A 126 126 ASP HA H 126 4.581 4.620 -0.039 1
1 1469 . 16 1 1 A 126 126 ASP C C 126 176.538 177.657 -1.119 1
1 1470 . 16 1 1 A 126 126 ASP CA C 126 54.540 53.831 0.709 1
1 1471 . 16 1 1 A 126 126 ASP CB C 126 40.907 41.949 -1.042 1
1 1472 . 16 1 1 A 126 126 ASP N N 126 119.814 122.368 -2.554 1
1 1473 . 16 1 1 A 127 127 LEU H H 127 7.946 8.641 -0.695 1
1 1474 . 16 1 1 A 127 127 LEU HA H 127 4.309 4.139 0.170 1
1 1484 . 16 1 1 A 127 127 LEU C C 127 176.043 177.056 -1.013 1
1 1485 . 16 1 1 A 127 127 LEU CA C 127 55.427 56.515 -1.088 1
1 1486 . 16 1 1 A 127 127 LEU CB C 127 42.394 41.862 0.532 1
1 1490 . 16 1 1 A 127 127 LEU N N 127 121.432 121.547 -0.115 1
1 1491 . 16 1 1 A 128 128 ILE H H 128 7.967 7.203 0.764 1
1 1492 . 16 1 1 A 128 128 ILE HA H 128 4.141 3.940 0.201 1
1 1502 . 16 1 1 A 128 128 ILE C C 128 177.200 176.983 0.217 1
1 1503 . 16 1 1 A 128 128 ILE CA C 128 61.150 62.252 -1.102 1
1 1504 . 16 1 1 A 128 128 ILE CB C 128 38.489 39.644 -1.155 1
1 1508 . 16 1 1 A 128 128 ILE N N 128 121.579 121.641 -0.062 1
1 1509 . 16 1 1 A 129 129 LYS H H 129 8.331 8.721 -0.390 1
1 1510 . 16 1 1 A 129 129 LYS HA H 129 4.328 4.073 0.255 1
1 1519 . 16 1 1 A 129 129 LYS C C 129 175.952 178.364 -2.412 1
1 1520 . 16 1 1 A 129 129 LYS CA C 129 56.330 58.724 -2.394 1
1 1521 . 16 1 1 A 129 129 LYS CB C 129 33.010 31.991 1.019 1
1 1525 . 16 1 1 A 129 129 LYS N N 129 126.955 126.173 0.782 1
1 1 . 17 1 1 A 2 2 ALA HA H 2 4.070 5.253 -1.183 1
1 5 . 17 1 1 A 2 2 ALA CA C 2 52.067 51.258 0.809 1
1 6 . 17 1 1 A 2 2 ALA CB C 2 19.577 24.258 -4.681 1
1 7 . 17 1 1 A 3 3 ALA H H 3 8.714 8.941 -0.227 1
1 8 . 17 1 1 A 3 3 ALA HA H 3 4.253 5.162 -0.909 1
1 12 . 17 1 1 A 3 3 ALA C C 3 173.672 176.175 -2.503 1
1 13 . 17 1 1 A 3 3 ALA CA C 3 52.067 50.774 1.293 1
1 14 . 17 1 1 A 3 3 ALA CB C 3 19.577 24.348 -4.771 1
1 15 . 17 1 1 A 3 3 ALA N N 3 124.480 120.720 3.760 1
1 16 . 17 1 1 A 4 4 LYS H H 4 8.227 8.766 -0.539 1
1 17 . 17 1 1 A 4 4 LYS HA H 4 3.976 4.461 -0.485 1
1 26 . 17 1 1 A 4 4 LYS C C 4 176.672 175.129 1.543 1
1 27 . 17 1 1 A 4 4 LYS CA C 4 57.274 55.790 1.484 1
1 28 . 17 1 1 A 4 4 LYS CB C 4 33.209 33.204 0.005 1
1 32 . 17 1 1 A 4 4 LYS N N 4 120.988 117.265 3.723 1
1 33 . 17 1 1 A 5 5 PHE H H 5 7.719 7.673 0.046 1
1 34 . 17 1 1 A 5 5 PHE HA H 5 4.384 5.136 -0.752 1
1 38 . 17 1 1 A 5 5 PHE C C 5 175.364 174.421 0.943 1
1 39 . 17 1 1 A 5 5 PHE CA C 5 57.074 56.359 0.715 1
1 40 . 17 1 1 A 5 5 PHE CB C 5 39.669 43.553 -3.884 1
1 41 . 17 1 1 A 5 5 PHE N N 5 119.246 118.560 0.686 1
1 42 . 17 1 1 A 6 6 GLU H H 6 8.515 8.949 -0.434 1
1 43 . 17 1 1 A 6 6 GLU HA H 6 4.370 5.023 -0.653 1
1 48 . 17 1 1 A 6 6 GLU CA C 6 55.669 54.791 0.878 1
1 49 . 17 1 1 A 6 6 GLU CB C 6 32.094 33.871 -1.777 1
1 51 . 17 1 1 A 6 6 GLU N N 6 122.193 118.651 3.542 1
1 52 . 17 1 1 A 7 7 VAL H H 7 8.636 8.536 0.100 1
1 53 . 17 1 1 A 7 7 VAL HA H 7 3.406 3.967 -0.561 1
1 61 . 17 1 1 A 7 7 VAL C C 7 176.611 176.354 0.257 1
1 62 . 17 1 1 A 7 7 VAL CA C 7 65.358 63.318 2.040 1
1 63 . 17 1 1 A 7 7 VAL CB C 7 31.391 31.469 -0.078 1
1 66 . 17 1 1 A 7 7 VAL N N 7 122.949 122.224 0.725 1
1 67 . 17 1 1 A 8 8 GLY H H 8 9.394 9.172 0.222 1
1 68 . 17 1 1 A 8 8 GLY HA2 H 8 3.600 4.043 -0.443 1
1 69 . 17 1 1 A 8 8 GLY HA3 H 8 4.546 4.046 0.500 1
1 70 . 17 1 1 A 8 8 GLY C C 8 178.074 174.222 3.852 1
1 71 . 17 1 1 A 8 8 GLY CA C 8 45.121 44.955 0.166 1
1 72 . 17 1 1 A 8 8 GLY N N 8 116.837 115.189 1.648 1
1 73 . 17 1 1 A 9 9 SER H H 9 8.021 7.796 0.225 1
1 74 . 17 1 1 A 9 9 SER HA H 9 4.680 4.459 0.221 1
1 77 . 17 1 1 A 9 9 SER C C 9 174.234 173.169 1.065 1
1 78 . 17 1 1 A 9 9 SER CA C 9 59.387 59.241 0.146 1
1 79 . 17 1 1 A 9 9 SER CB C 9 65.584 64.588 0.996 1
1 80 . 17 1 1 A 9 9 SER N N 9 118.208 117.639 0.569 1
1 81 . 17 1 1 A 10 10 VAL H H 10 7.945 8.182 -0.237 1
1 82 . 17 1 1 A 10 10 VAL HA H 10 4.980 5.055 -0.075 1
1 90 . 17 1 1 A 10 10 VAL C C 10 171.388 174.277 -2.889 1
1 91 . 17 1 1 A 10 10 VAL CA C 10 61.021 60.985 0.036 1
1 92 . 17 1 1 A 10 10 VAL CB C 10 33.400 35.091 -1.691 1
1 95 . 17 1 1 A 10 10 VAL N N 10 121.118 122.411 -1.293 1
1 96 . 17 1 1 A 11 11 TYR H H 11 9.008 9.198 -0.190 1
1 97 . 17 1 1 A 11 11 TYR HA H 11 4.850 5.338 -0.488 1
1 101 . 17 1 1 A 11 11 TYR C C 11 174.926 174.713 0.213 1
1 102 . 17 1 1 A 11 11 TYR CA C 11 56.803 56.270 0.533 1
1 103 . 17 1 1 A 11 11 TYR CB C 11 43.676 43.705 -0.029 1
1 104 . 17 1 1 A 11 11 TYR N N 11 125.043 125.417 -0.374 1
1 105 . 17 1 1 A 12 12 THR H H 12 8.809 8.678 0.131 1
1 106 . 17 1 1 A 12 12 THR HA H 12 5.020 5.387 -0.367 1
1 111 . 17 1 1 A 12 12 THR C C 12 174.195 174.511 -0.316 1
1 112 . 17 1 1 A 12 12 THR CA C 12 62.487 60.007 2.480 1
1 113 . 17 1 1 A 12 12 THR CB C 12 69.743 71.744 -2.001 1
1 115 . 17 1 1 A 12 12 THR N N 12 116.850 115.113 1.737 1
1 116 . 17 1 1 A 13 13 GLY H H 13 9.179 8.546 0.633 1
1 117 . 17 1 1 A 13 13 GLY HA2 H 13 3.250 4.344 -1.094 1
1 118 . 17 1 1 A 13 13 GLY HA3 H 13 4.801 4.365 0.436 1
1 119 . 17 1 1 A 13 13 GLY C C 13 174.654 171.907 2.747 1
1 120 . 17 1 1 A 13 13 GLY CA C 13 44.377 45.358 -0.981 1
1 121 . 17 1 1 A 13 13 GLY N N 13 113.654 111.844 1.810 1
1 122 . 17 1 1 A 14 14 LYS H H 14 7.770 8.559 -0.789 1
1 123 . 17 1 1 A 14 14 LYS HA H 14 5.426 5.065 0.361 1
1 132 . 17 1 1 A 14 14 LYS C C 14 171.343 175.743 -4.400 1
1 133 . 17 1 1 A 14 14 LYS CA C 14 53.879 54.615 -0.736 1
1 134 . 17 1 1 A 14 14 LYS CB C 14 36.032 35.642 0.390 1
1 138 . 17 1 1 A 14 14 LYS N N 14 118.322 120.499 -2.177 1
1 139 . 17 1 1 A 15 15 VAL H H 15 9.206 9.205 0.001 1
1 140 . 17 1 1 A 15 15 VAL HA H 15 4.400 4.253 0.147 1
1 148 . 17 1 1 A 15 15 VAL C C 15 176.306 177.035 -0.729 1
1 149 . 17 1 1 A 15 15 VAL CA C 15 63.648 63.394 0.254 1
1 150 . 17 1 1 A 15 15 VAL CB C 15 31.769 31.513 0.256 1
1 153 . 17 1 1 A 15 15 VAL N N 15 125.308 123.607 1.701 1
1 154 . 17 1 1 A 16 16 THR H H 16 9.403 9.253 0.150 1
1 155 . 17 1 1 A 16 16 THR HA H 16 4.562 4.673 -0.111 1
1 160 . 17 1 1 A 16 16 THR C C 16 178.098 174.672 3.426 1
1 161 . 17 1 1 A 16 16 THR CA C 16 62.018 61.545 0.473 1
1 162 . 17 1 1 A 16 16 THR CB C 16 69.720 69.892 -0.172 1
1 164 . 17 1 1 A 16 16 THR N N 16 121.753 117.748 4.005 1
1 165 . 17 1 1 A 17 17 GLY H H 17 7.600 7.070 0.530 1
1 166 . 17 1 1 A 17 17 GLY HA2 H 17 4.110 4.115 -0.005 1
1 167 . 17 1 1 A 17 17 GLY HA3 H 17 4.250 4.201 0.049 1
1 168 . 17 1 1 A 17 17 GLY C C 17 175.551 171.496 4.055 1
1 169 . 17 1 1 A 17 17 GLY CA C 17 46.258 45.505 0.753 1
1 170 . 17 1 1 A 17 17 GLY N N 17 109.407 108.751 0.656 1
1 171 . 17 1 1 A 18 18 LEU H H 18 8.820 8.501 0.319 1
1 172 . 17 1 1 A 18 18 LEU HA H 18 4.852 5.100 -0.248 1
1 182 . 17 1 1 A 18 18 LEU CA C 18 54.245 53.249 0.996 1
1 183 . 17 1 1 A 18 18 LEU CB C 18 44.906 45.702 -0.796 1
1 187 . 17 1 1 A 18 18 LEU N N 18 123.419 121.663 1.756 1
1 188 . 17 1 1 A 19 19 GLN H H 19 8.537 8.352 0.185 1
1 189 . 17 1 1 A 19 19 GLN HA H 19 4.520 4.580 -0.060 1
1 196 . 17 1 1 A 19 19 GLN C C 19 175.258 175.650 -0.392 1
1 197 . 17 1 1 A 19 19 GLN CA C 19 53.269 53.649 -0.380 1
1 198 . 17 1 1 A 19 19 GLN CB C 19 31.522 31.948 -0.426 1
1 200 . 17 1 1 A 19 19 GLN N N 19 120.187 121.175 -0.988 1
1 202 . 17 1 1 A 20 20 ALA H H 20 8.798 8.593 0.205 1
1 203 . 17 1 1 A 20 20 ALA HA H 20 4.010 3.979 0.031 1
1 207 . 17 1 1 A 20 20 ALA C C 20 175.698 177.278 -1.580 1
1 208 . 17 1 1 A 20 20 ALA CA C 20 55.084 54.210 0.874 1
1 209 . 17 1 1 A 20 20 ALA CB C 20 18.277 18.572 -0.295 1
1 210 . 17 1 1 A 20 20 ALA N N 20 120.606 123.738 -3.132 1
1 211 . 17 1 1 A 21 21 TYR H H 21 6.618 7.190 -0.572 1
1 212 . 17 1 1 A 21 21 TYR HA H 21 4.540 4.720 -0.180 1
1 216 . 17 1 1 A 21 21 TYR C C 21 178.437 175.152 3.285 1
1 217 . 17 1 1 A 21 21 TYR CA C 21 55.120 56.998 -1.878 1
1 218 . 17 1 1 A 21 21 TYR CB C 21 37.891 39.948 -2.057 1
1 219 . 17 1 1 A 21 21 TYR N N 21 105.570 113.784 -8.214 1
1 220 . 17 1 1 A 22 22 GLY H H 22 7.203 7.053 0.150 1
1 221 . 17 1 1 A 22 22 GLY HA2 H 22 3.460 3.944 -0.484 1
1 222 . 17 1 1 A 22 22 GLY HA3 H 22 4.360 3.986 0.374 1
1 223 . 17 1 1 A 22 22 GLY C C 22 175.833 171.257 4.576 1
1 224 . 17 1 1 A 22 22 GLY CA C 22 46.356 45.440 0.916 1
1 225 . 17 1 1 A 22 22 GLY N N 22 109.854 108.507 1.347 1
1 226 . 17 1 1 A 23 23 ALA H H 23 8.549 8.452 0.097 1
1 227 . 17 1 1 A 23 23 ALA HA H 23 4.981 5.182 -0.201 1
1 231 . 17 1 1 A 23 23 ALA C C 23 168.810 176.103 -7.293 1
1 232 . 17 1 1 A 23 23 ALA CA C 23 49.178 50.803 -1.625 1
1 233 . 17 1 1 A 23 23 ALA CB C 23 22.797 21.357 1.440 1
1 234 . 17 1 1 A 23 23 ALA N N 23 118.749 122.362 -3.613 1
1 235 . 17 1 1 A 24 24 PHE H H 24 8.812 8.737 0.075 1
1 236 . 17 1 1 A 24 24 PHE HA H 24 5.125 4.816 0.309 1
1 240 . 17 1 1 A 24 24 PHE CA C 24 58.017 58.320 -0.303 1
1 241 . 17 1 1 A 24 24 PHE CB C 24 40.475 40.579 -0.104 1
1 242 . 17 1 1 A 24 24 PHE N N 24 122.891 122.038 0.853 1
1 243 . 17 1 1 A 25 25 VAL H H 25 8.880 8.948 -0.068 1
1 244 . 17 1 1 A 25 25 VAL HA H 25 4.660 4.683 -0.023 1
1 252 . 17 1 1 A 25 25 VAL CA C 25 60.379 61.119 -0.740 1
1 253 . 17 1 1 A 25 25 VAL CB C 25 35.654 34.757 0.897 1
1 256 . 17 1 1 A 25 25 VAL N N 25 122.908 121.525 1.383 1
1 257 . 17 1 1 A 26 26 ALA H H 26 9.403 8.806 0.597 1
1 258 . 17 1 1 A 26 26 ALA HA H 26 4.750 4.360 0.390 1
1 262 . 17 1 1 A 26 26 ALA C C 26 174.445 176.843 -2.398 1
1 263 . 17 1 1 A 26 26 ALA CA C 26 51.711 52.725 -1.014 1
1 264 . 17 1 1 A 26 26 ALA CB C 26 19.319 19.060 0.259 1
1 265 . 17 1 1 A 26 26 ALA N N 26 129.425 130.780 -1.355 1
1 266 . 17 1 1 A 27 27 LEU H H 27 8.601 9.259 -0.658 1
1 267 . 17 1 1 A 27 27 LEU HA H 27 4.158 4.514 -0.356 1
1 277 . 17 1 1 A 27 27 LEU C C 27 177.814 176.370 1.444 1
1 278 . 17 1 1 A 27 27 LEU CA C 27 55.869 55.694 0.175 1
1 279 . 17 1 1 A 27 27 LEU CB C 27 42.251 43.575 -1.324 1
1 283 . 17 1 1 A 27 27 LEU N N 27 127.169 122.970 4.199 1
1 284 . 17 1 1 A 28 28 ASP H H 28 8.172 7.863 0.309 1
1 285 . 17 1 1 A 28 28 ASP HA H 28 4.420 4.871 -0.451 1
1 288 . 17 1 1 A 28 28 ASP C C 28 177.116 175.323 1.793 1
1 289 . 17 1 1 A 28 28 ASP CA C 28 53.755 53.126 0.629 1
1 290 . 17 1 1 A 28 28 ASP CB C 28 39.833 43.977 -4.144 1
1 291 . 17 1 1 A 28 28 ASP N N 28 115.657 116.424 -0.767 1
1 292 . 17 1 1 A 29 29 GLU H H 29 8.857 8.562 0.295 1
1 293 . 17 1 1 A 29 29 GLU HA H 29 4.090 4.142 -0.052 1
1 298 . 17 1 1 A 29 29 GLU C C 29 175.965 176.983 -1.018 1
1 299 . 17 1 1 A 29 29 GLU CA C 29 59.470 58.984 0.486 1
1 300 . 17 1 1 A 29 29 GLU CB C 29 29.409 29.263 0.146 1
1 302 . 17 1 1 A 29 29 GLU N N 29 114.738 122.424 -7.686 1
1 303 . 17 1 1 A 30 30 GLU H H 30 8.326 8.198 0.128 1
1 304 . 17 1 1 A 30 30 GLU HA H 30 4.640 4.563 0.077 1
1 309 . 17 1 1 A 30 30 GLU C C 30 176.817 175.945 0.872 1
1 310 . 17 1 1 A 30 30 GLU CA C 30 56.073 55.875 0.198 1
1 311 . 17 1 1 A 30 30 GLU CB C 30 32.453 30.920 1.533 1
1 313 . 17 1 1 A 30 30 GLU N N 30 115.753 114.923 0.830 1
1 314 . 17 1 1 A 31 31 THR H H 31 7.819 7.537 0.282 1
1 315 . 17 1 1 A 31 31 THR HA H 31 4.484 5.097 -0.613 1
1 320 . 17 1 1 A 31 31 THR C C 31 176.330 172.995 3.335 1
1 321 . 17 1 1 A 31 31 THR CA C 31 63.398 61.118 2.280 1
1 322 . 17 1 1 A 31 31 THR CB C 31 69.367 72.863 -3.496 1
1 324 . 17 1 1 A 31 31 THR N N 31 118.750 115.699 3.051 1
1 325 . 17 1 1 A 32 32 GLN H H 32 8.913 8.784 0.129 1
1 326 . 17 1 1 A 32 32 GLN HA H 32 5.337 4.827 0.510 1
1 333 . 17 1 1 A 32 32 GLN C C 32 173.087 174.451 -1.364 1
1 334 . 17 1 1 A 32 32 GLN CA C 32 54.051 54.855 -0.804 1
1 335 . 17 1 1 A 32 32 GLN CB C 32 32.672 32.872 -0.200 1
1 337 . 17 1 1 A 32 32 GLN N N 32 127.294 124.923 2.371 1
1 339 . 17 1 1 A 33 33 GLY H H 33 8.900 8.586 0.314 1
1 340 . 17 1 1 A 33 33 GLY HA2 H 33 3.290 4.387 -1.097 1
1 341 . 17 1 1 A 33 33 GLY HA3 H 33 4.530 4.456 0.074 1
1 342 . 17 1 1 A 33 33 GLY C C 33 174.918 172.305 2.613 1
1 343 . 17 1 1 A 33 33 GLY CA C 33 44.534 44.829 -0.295 1
1 344 . 17 1 1 A 33 33 GLY N N 33 107.639 110.797 -3.158 1
1 345 . 17 1 1 A 34 34 LEU H H 34 8.127 8.732 -0.605 1
1 346 . 17 1 1 A 34 34 LEU HA H 34 4.950 4.808 0.142 1
1 356 . 17 1 1 A 34 34 LEU CA C 34 53.755 54.028 -0.273 1
1 357 . 17 1 1 A 34 34 LEU CB C 34 45.493 44.538 0.955 1
1 361 . 17 1 1 A 34 34 LEU N N 34 120.897 121.877 -0.980 1
1 362 . 17 1 1 A 35 35 VAL H H 35 9.386 8.778 0.608 1
1 363 . 17 1 1 A 35 35 VAL HA H 35 4.479 4.255 0.224 1
1 371 . 17 1 1 A 35 35 VAL C C 35 176.402 176.157 0.245 1
1 372 . 17 1 1 A 35 35 VAL CA C 35 59.594 63.042 -3.448 1
1 373 . 17 1 1 A 35 35 VAL CB C 35 32.590 31.331 1.259 1
1 376 . 17 1 1 A 35 35 VAL N N 35 128.897 127.655 1.242 1
1 377 . 17 1 1 A 36 36 HIS H H 36 9.194 8.932 0.262 1
1 378 . 17 1 1 A 36 36 HIS HA H 36 4.487 4.583 -0.096 1
1 381 . 17 1 1 A 36 36 HIS C C 36 174.864 176.606 -1.742 1
1 382 . 17 1 1 A 36 36 HIS CA C 36 59.426 56.758 2.668 1
1 383 . 17 1 1 A 36 36 HIS CB C 36 31.542 30.266 1.276 1
1 384 . 17 1 1 A 36 36 HIS N N 36 127.751 126.464 1.287 1
1 385 . 17 1 1 A 37 37 ILE H H 37 7.454 8.862 -1.408 1
1 386 . 17 1 1 A 37 37 ILE HA H 37 3.810 3.667 0.143 1
1 396 . 17 1 1 A 37 37 ILE C C 37 176.948 177.879 -0.931 1
1 397 . 17 1 1 A 37 37 ILE CA C 37 63.773 64.871 -1.098 1
1 398 . 17 1 1 A 37 37 ILE CB C 37 38.993 37.502 1.491 1
1 402 . 17 1 1 A 37 37 ILE N N 37 126.266 126.022 0.244 1
1 403 . 17 1 1 A 38 38 SER H H 38 8.343 8.204 0.139 1
1 404 . 17 1 1 A 38 38 SER HA H 38 4.370 4.285 0.085 1
1 407 . 17 1 1 A 38 38 SER C C 38 174.792 174.847 -0.055 1
1 408 . 17 1 1 A 38 38 SER CA C 38 60.567 60.986 -0.419 1
1 409 . 17 1 1 A 38 38 SER CB C 38 63.632 62.886 0.746 1
1 410 . 17 1 1 A 38 38 SER N N 38 118.079 118.431 -0.352 1
1 411 . 17 1 1 A 39 39 GLU H H 39 8.536 8.044 0.492 1
1 412 . 17 1 1 A 39 39 GLU HA H 39 4.503 4.516 -0.013 1
1 417 . 17 1 1 A 39 39 GLU C C 39 175.131 176.948 -1.817 1
1 418 . 17 1 1 A 39 39 GLU CA C 39 54.928 56.306 -1.378 1
1 419 . 17 1 1 A 39 39 GLU CB C 39 29.621 30.436 -0.815 1
1 421 . 17 1 1 A 39 39 GLU N N 39 118.349 118.255 0.094 1
1 422 . 17 1 1 A 40 40 VAL H H 40 7.776 7.576 0.200 1
1 423 . 17 1 1 A 40 40 VAL HA H 40 3.616 3.893 -0.277 1
1 431 . 17 1 1 A 40 40 VAL C C 40 177.277 176.198 1.079 1
1 432 . 17 1 1 A 40 40 VAL CA C 40 66.245 64.308 1.937 1
1 433 . 17 1 1 A 40 40 VAL CB C 40 32.590 32.066 0.524 1
1 436 . 17 1 1 A 40 40 VAL N N 40 125.443 117.711 7.732 1
1 437 . 17 1 1 A 41 41 THR H H 41 7.888 7.657 0.231 1
1 438 . 17 1 1 A 41 41 THR HA H 41 4.345 4.790 -0.445 1
1 443 . 17 1 1 A 41 41 THR C C 41 173.492 174.072 -0.580 1
1 444 . 17 1 1 A 41 41 THR CA C 41 59.047 61.264 -2.217 1
1 445 . 17 1 1 A 41 41 THR CB C 41 68.992 72.811 -3.819 1
1 447 . 17 1 1 A 41 41 THR N N 41 109.905 112.858 -2.953 1
1 448 . 17 1 1 A 42 42 HIS H H 42 8.063 9.251 -1.188 1
1 449 . 17 1 1 A 42 42 HIS HA H 42 4.510 4.290 0.220 1
1 452 . 17 1 1 A 42 42 HIS C C 42 172.139 176.656 -4.517 1
1 453 . 17 1 1 A 42 42 HIS CA C 42 57.735 58.569 -0.834 1
1 454 . 17 1 1 A 42 42 HIS CB C 42 31.144 29.519 1.625 1
1 455 . 17 1 1 A 42 42 HIS N N 42 121.760 121.759 0.001 1
1 456 . 17 1 1 A 43 43 GLY H H 43 8.286 7.811 0.475 1
1 457 . 17 1 1 A 43 43 GLY HA2 H 43 3.980 4.040 -0.060 1
1 458 . 17 1 1 A 43 43 GLY HA3 H 43 3.980 4.043 -0.063 1
1 459 . 17 1 1 A 43 43 GLY C C 43 176.307 173.091 3.216 1
1 460 . 17 1 1 A 43 43 GLY CA C 43 44.336 45.528 -1.192 1
1 461 . 17 1 1 A 43 43 GLY N N 43 110.133 106.783 3.350 1
1 462 . 17 1 1 A 44 44 PHE H H 44 8.327 8.623 -0.296 1
1 463 . 17 1 1 A 44 44 PHE HA H 44 4.489 4.533 -0.044 1
1 467 . 17 1 1 A 44 44 PHE C C 44 171.877 174.714 -2.837 1
1 468 . 17 1 1 A 44 44 PHE CA C 44 58.027 58.804 -0.777 1
1 469 . 17 1 1 A 44 44 PHE CB C 44 39.850 39.743 0.107 1
1 470 . 17 1 1 A 44 44 PHE N N 44 120.049 122.518 -2.469 1
1 471 . 17 1 1 A 45 45 VAL H H 45 7.939 8.418 -0.479 1
1 472 . 17 1 1 A 45 45 VAL HA H 45 3.865 3.214 0.651 1
1 480 . 17 1 1 A 45 45 VAL C C 45 175.523 176.339 -0.816 1
1 481 . 17 1 1 A 45 45 VAL CA C 45 61.536 61.769 -0.233 1
1 482 . 17 1 1 A 45 45 VAL CB C 45 33.127 28.924 4.203 1
1 485 . 17 1 1 A 45 45 VAL N N 45 127.882 126.841 1.041 1
1 486 . 17 1 1 A 46 46 LYS H H 46 8.868 7.698 1.170 1
1 487 . 17 1 1 A 46 46 LYS HA H 46 4.170 3.563 0.607 1
1 496 . 17 1 1 A 46 46 LYS C C 46 175.728 175.783 -0.055 1
1 497 . 17 1 1 A 46 46 LYS CA C 46 57.198 58.279 -1.081 1
1 498 . 17 1 1 A 46 46 LYS CB C 46 33.299 32.201 1.098 1
1 502 . 17 1 1 A 46 46 LYS N N 46 127.308 122.870 4.438 1
1 503 . 17 1 1 A 47 47 ASP H H 47 7.652 7.775 -0.123 1
1 504 . 17 1 1 A 47 47 ASP HA H 47 4.710 4.872 -0.162 1
1 507 . 17 1 1 A 47 47 ASP C C 47 176.411 176.233 0.178 1
1 508 . 17 1 1 A 47 47 ASP CA C 47 53.390 53.710 -0.320 1
1 509 . 17 1 1 A 47 47 ASP CB C 47 42.635 43.298 -0.663 1
1 510 . 17 1 1 A 47 47 ASP N N 47 117.932 118.008 -0.076 1
1 511 . 17 1 1 A 48 48 ILE H H 48 9.230 8.617 0.613 1
1 512 . 17 1 1 A 48 48 ILE HA H 48 3.579 3.987 -0.408 1
1 522 . 17 1 1 A 48 48 ILE C C 48 177.249 177.484 -0.235 1
1 523 . 17 1 1 A 48 48 ILE CA C 48 65.525 63.347 2.178 1
1 524 . 17 1 1 A 48 48 ILE CB C 48 38.797 37.784 1.013 1
1 528 . 17 1 1 A 48 48 ILE N N 48 129.049 126.633 2.416 1
1 529 . 17 1 1 A 49 49 ASN H H 49 8.468 8.888 -0.420 1
1 530 . 17 1 1 A 49 49 ASN HA H 49 4.690 4.541 0.149 1
1 535 . 17 1 1 A 49 49 ASN C C 49 175.779 176.320 -0.541 1
1 536 . 17 1 1 A 49 49 ASN CA C 49 55.587 54.892 0.695 1
1 537 . 17 1 1 A 49 49 ASN CB C 49 38.587 36.690 1.897 1
1 538 . 17 1 1 A 49 49 ASN N N 49 118.835 118.201 0.634 1
1 540 . 17 1 1 A 50 50 GLU H H 50 7.853 7.637 0.216 1
1 541 . 17 1 1 A 50 50 GLU HA H 50 4.040 4.137 -0.097 1
1 546 . 17 1 1 A 50 50 GLU C C 50 176.148 177.301 -1.153 1
1 547 . 17 1 1 A 50 50 GLU CA C 50 57.404 57.606 -0.202 1
1 548 . 17 1 1 A 50 50 GLU CB C 50 29.491 29.287 0.204 1
1 550 . 17 1 1 A 50 50 GLU N N 50 116.358 118.338 -1.980 1
1 551 . 17 1 1 A 51 51 HIS H H 51 7.575 7.938 -0.363 1
1 552 . 17 1 1 A 51 51 HIS HA H 51 4.431 4.762 -0.331 1
1 555 . 17 1 1 A 51 51 HIS C C 51 176.383 174.603 1.780 1
1 556 . 17 1 1 A 51 51 HIS CA C 51 57.089 56.300 0.789 1
1 557 . 17 1 1 A 51 51 HIS CB C 51 33.168 31.851 1.317 1
1 558 . 17 1 1 A 51 51 HIS N N 51 115.828 115.225 0.603 1
1 559 . 17 1 1 A 52 52 LEU H H 52 7.640 7.282 0.358 1
1 560 . 17 1 1 A 52 52 LEU HA H 52 4.796 4.615 0.181 1
1 570 . 17 1 1 A 52 52 LEU C C 52 174.452 174.342 0.110 1
1 571 . 17 1 1 A 52 52 LEU CA C 52 53.398 53.711 -0.313 1
1 572 . 17 1 1 A 52 52 LEU CB C 52 48.805 43.560 5.245 1
1 576 . 17 1 1 A 52 52 LEU N N 52 117.932 119.512 -1.580 1
1 577 . 17 1 1 A 53 53 SER H H 53 8.151 8.678 -0.527 1
1 578 . 17 1 1 A 53 53 SER HA H 53 4.680 4.915 -0.235 1
1 581 . 17 1 1 A 53 53 SER C C 53 174.304 173.407 0.897 1
1 582 . 17 1 1 A 53 53 SER CA C 53 56.714 57.570 -0.856 1
1 583 . 17 1 1 A 53 53 SER CB C 53 65.431 66.393 -0.962 1
1 584 . 17 1 1 A 53 53 SER N N 53 113.496 117.499 -4.003 1
1 585 . 17 1 1 A 54 54 VAL H H 54 8.782 8.528 0.254 1
1 586 . 17 1 1 A 54 54 VAL HA H 54 3.230 3.631 -0.401 1
1 594 . 17 1 1 A 54 54 VAL C C 54 173.745 177.430 -3.685 1
1 595 . 17 1 1 A 54 54 VAL CA C 54 66.232 65.123 1.109 1
1 596 . 17 1 1 A 54 54 VAL CB C 54 31.067 31.692 -0.625 1
1 599 . 17 1 1 A 54 54 VAL N N 54 124.401 125.573 -1.172 1
1 600 . 17 1 1 A 55 55 GLY H H 55 9.079 9.072 0.007 1
1 601 . 17 1 1 A 55 55 GLY HA2 H 55 3.530 3.848 -0.318 1
1 602 . 17 1 1 A 55 55 GLY HA3 H 55 4.553 3.848 0.705 1
1 603 . 17 1 1 A 55 55 GLY C C 55 177.219 173.189 4.030 1
1 604 . 17 1 1 A 55 55 GLY CA C 55 44.647 46.246 -1.599 1
1 605 . 17 1 1 A 55 55 GLY N N 55 117.320 114.716 2.604 1
1 606 . 17 1 1 A 56 56 ASP H H 56 7.943 7.742 0.201 1
1 607 . 17 1 1 A 56 56 ASP HA H 56 4.460 5.067 -0.607 1
1 610 . 17 1 1 A 56 56 ASP C C 56 176.055 173.875 2.180 1
1 611 . 17 1 1 A 56 56 ASP CA C 56 55.456 52.300 3.156 1
1 612 . 17 1 1 A 56 56 ASP CB C 56 40.914 44.453 -3.539 1
1 613 . 17 1 1 A 56 56 ASP N N 56 121.782 119.730 2.052 1
1 614 . 17 1 1 A 57 57 GLU H H 57 8.649 8.664 -0.015 1
1 615 . 17 1 1 A 57 57 GLU HA H 57 5.100 5.138 -0.038 1
1 620 . 17 1 1 A 57 57 GLU C C 57 175.635 175.898 -0.263 1
1 621 . 17 1 1 A 57 57 GLU CA C 57 55.805 55.437 0.368 1
1 622 . 17 1 1 A 57 57 GLU CB C 57 30.915 31.298 -0.383 1
1 624 . 17 1 1 A 57 57 GLU N N 57 122.513 123.634 -1.121 1
1 625 . 17 1 1 A 58 58 VAL H H 58 8.809 9.043 -0.234 1
1 626 . 17 1 1 A 58 58 VAL HA H 58 4.817 4.767 0.050 1
1 634 . 17 1 1 A 58 58 VAL C C 58 176.528 174.417 2.111 1
1 635 . 17 1 1 A 58 58 VAL CA C 58 58.719 59.189 -0.470 1
1 636 . 17 1 1 A 58 58 VAL CB C 58 35.523 35.806 -0.283 1
1 639 . 17 1 1 A 58 58 VAL N N 58 118.382 119.713 -1.331 1
1 640 . 17 1 1 A 59 59 GLN H H 59 8.255 8.361 -0.106 1
1 641 . 17 1 1 A 59 59 GLN HA H 59 5.030 4.754 0.276 1
1 646 . 17 1 1 A 59 59 GLN CA C 59 54.843 56.446 -1.603 1
1 647 . 17 1 1 A 59 59 GLN CB C 59 30.111 29.091 1.020 1
1 649 . 17 1 1 A 59 59 GLN N N 59 120.933 122.796 -1.863 1
1 650 . 17 1 1 A 60 60 VAL H H 60 8.970 9.208 -0.238 1
1 651 . 17 1 1 A 60 60 VAL HA H 60 4.990 4.978 0.012 1
1 659 . 17 1 1 A 60 60 VAL C C 60 175.203 174.000 1.203 1
1 660 . 17 1 1 A 60 60 VAL CA C 60 57.404 59.465 -2.061 1
1 661 . 17 1 1 A 60 60 VAL CB C 60 35.771 35.542 0.229 1
1 664 . 17 1 1 A 60 60 VAL N N 60 111.046 118.479 -7.433 1
1 665 . 17 1 1 A 61 61 LYS H H 61 8.937 8.607 0.330 1
1 666 . 17 1 1 A 61 61 LYS HA H 61 5.100 4.695 0.405 1
1 675 . 17 1 1 A 61 61 LYS C C 61 173.610 176.545 -2.935 1
1 676 . 17 1 1 A 61 61 LYS CA C 61 53.762 55.589 -1.827 1
1 677 . 17 1 1 A 61 61 LYS CB C 61 36.273 33.622 2.651 1
1 681 . 17 1 1 A 61 61 LYS N N 61 121.930 124.679 -2.749 1
1 682 . 17 1 1 A 62 62 VAL H H 62 8.429 9.288 -0.859 1
1 683 . 17 1 1 A 62 62 VAL HA H 62 4.074 4.058 0.016 1
1 691 . 17 1 1 A 62 62 VAL C C 62 176.912 175.983 0.929 1
1 692 . 17 1 1 A 62 62 VAL CA C 62 63.188 63.540 -0.352 1
1 693 . 17 1 1 A 62 62 VAL CB C 62 30.813 31.309 -0.496 1
1 696 . 17 1 1 A 62 62 VAL N N 62 126.329 127.066 -0.737 1
1 697 . 17 1 1 A 63 63 LEU H H 63 9.109 9.215 -0.106 1
1 698 . 17 1 1 A 63 63 LEU HA H 63 4.423 4.487 -0.064 1
1 708 . 17 1 1 A 63 63 LEU C C 63 176.091 176.139 -0.048 1
1 709 . 17 1 1 A 63 63 LEU CA C 63 55.876 56.212 -0.336 1
1 710 . 17 1 1 A 63 63 LEU CB C 63 42.800 44.024 -1.224 1
1 714 . 17 1 1 A 63 63 LEU N N 63 129.436 129.906 -0.470 1
1 715 . 17 1 1 A 64 64 ALA H H 64 7.594 7.350 0.244 1
1 716 . 17 1 1 A 64 64 ALA HA H 64 4.455 4.716 -0.261 1
1 720 . 17 1 1 A 64 64 ALA C C 64 177.314 175.103 2.211 1
1 721 . 17 1 1 A 64 64 ALA CA C 64 52.557 51.699 0.858 1
1 722 . 17 1 1 A 64 64 ALA CB C 64 21.458 22.641 -1.183 1
1 723 . 17 1 1 A 64 64 ALA N N 64 117.791 118.657 -0.866 1
1 724 . 17 1 1 A 65 65 VAL H H 65 8.583 8.623 -0.040 1
1 725 . 17 1 1 A 65 65 VAL HA H 65 4.470 4.921 -0.451 1
1 733 . 17 1 1 A 65 65 VAL C C 65 174.697 172.910 1.787 1
1 734 . 17 1 1 A 65 65 VAL CA C 65 61.936 60.250 1.686 1
1 735 . 17 1 1 A 65 65 VAL CB C 65 35.288 35.583 -0.295 1
1 738 . 17 1 1 A 65 65 VAL N N 65 120.009 118.350 1.659 1
1 739 . 17 1 1 A 66 66 ASP H H 66 8.567 8.872 -0.305 1
1 740 . 17 1 1 A 66 66 ASP HA H 66 4.880 4.982 -0.102 1
1 743 . 17 1 1 A 66 66 ASP C C 66 174.355 175.693 -1.338 1
1 744 . 17 1 1 A 66 66 ASP CA C 66 52.681 53.459 -0.778 1
1 745 . 17 1 1 A 66 66 ASP CB C 66 41.775 42.368 -0.593 1
1 746 . 17 1 1 A 66 66 ASP N N 66 126.262 127.933 -1.671 1
1 747 . 17 1 1 A 67 67 GLU H H 67 9.148 8.938 0.210 1
1 748 . 17 1 1 A 67 67 GLU HA H 67 4.110 4.233 -0.123 1
1 753 . 17 1 1 A 67 67 GLU C C 67 177.052 178.746 -1.694 1
1 754 . 17 1 1 A 67 67 GLU CA C 67 59.044 58.829 0.215 1
1 755 . 17 1 1 A 67 67 GLU CB C 67 29.919 29.795 0.124 1
1 757 . 17 1 1 A 67 67 GLU N N 67 125.480 124.818 0.662 1
1 758 . 17 1 1 A 68 68 GLU H H 68 8.384 7.979 0.405 1
1 759 . 17 1 1 A 68 68 GLU HA H 68 4.140 4.138 0.002 1
1 764 . 17 1 1 A 68 68 GLU C C 68 178.383 179.763 -1.380 1
1 765 . 17 1 1 A 68 68 GLU CA C 68 59.044 59.049 -0.005 1
1 766 . 17 1 1 A 68 68 GLU CB C 68 29.919 29.901 0.018 1
1 768 . 17 1 1 A 68 68 GLU N N 68 119.760 120.419 -0.659 1
1 769 . 17 1 1 A 69 69 LYS H H 69 7.799 8.244 -0.445 1
1 770 . 17 1 1 A 69 69 LYS HA H 69 4.375 4.308 0.067 1
1 779 . 17 1 1 A 69 69 LYS C C 69 178.297 176.656 1.641 1
1 780 . 17 1 1 A 69 69 LYS CA C 69 55.704 57.698 -1.994 1
1 781 . 17 1 1 A 69 69 LYS CB C 69 33.622 33.285 0.337 1
1 785 . 17 1 1 A 69 69 LYS N N 69 115.476 119.642 -4.166 1
1 786 . 17 1 1 A 70 70 GLY H H 70 7.994 8.270 -0.276 1
1 787 . 17 1 1 A 70 70 GLY HA2 H 70 3.940 3.943 -0.003 1
1 788 . 17 1 1 A 70 70 GLY HA3 H 70 3.960 3.948 0.012 1
1 789 . 17 1 1 A 70 70 GLY C C 70 177.215 174.135 3.080 1
1 790 . 17 1 1 A 70 70 GLY CA C 70 46.773 46.680 0.093 1
1 791 . 17 1 1 A 70 70 GLY N N 70 110.245 108.506 1.739 1
1 792 . 17 1 1 A 71 71 LYS H H 71 7.560 7.985 -0.425 1
1 793 . 17 1 1 A 71 71 LYS HA H 71 4.690 4.990 -0.300 1
1 802 . 17 1 1 A 71 71 LYS C C 71 174.607 174.802 -0.195 1
1 803 . 17 1 1 A 71 71 LYS CA C 71 55.332 54.561 0.771 1
1 804 . 17 1 1 A 71 71 LYS CB C 71 34.903 36.201 -1.298 1
1 808 . 17 1 1 A 71 71 LYS N N 71 118.201 118.555 -0.354 1
1 809 . 17 1 1 A 72 72 ILE H H 72 8.867 8.696 0.171 1
1 810 . 17 1 1 A 72 72 ILE HA H 72 4.630 5.020 -0.390 1
1 820 . 17 1 1 A 72 72 ILE C C 72 175.708 174.683 1.025 1
1 821 . 17 1 1 A 72 72 ILE CA C 72 61.494 60.148 1.346 1
1 822 . 17 1 1 A 72 72 ILE CB C 72 40.652 42.137 -1.485 1
1 826 . 17 1 1 A 72 72 ILE N N 72 126.827 121.809 5.018 1
1 827 . 17 1 1 A 73 73 SER H H 73 8.815 9.083 -0.268 1
1 828 . 17 1 1 A 73 73 SER HA H 73 5.110 5.393 -0.283 1
1 831 . 17 1 1 A 73 73 SER C C 73 175.122 173.048 2.074 1
1 832 . 17 1 1 A 73 73 SER CA C 73 57.487 57.779 -0.292 1
1 833 . 17 1 1 A 73 73 SER CB C 73 64.386 64.819 -0.433 1
1 834 . 17 1 1 A 73 73 SER N N 73 123.640 124.930 -1.290 1
1 835 . 17 1 1 A 74 74 LEU H H 74 8.585 8.751 -0.166 1
1 836 . 17 1 1 A 74 74 LEU HA H 74 5.450 5.310 0.140 1
1 846 . 17 1 1 A 74 74 LEU C C 74 174.061 175.583 -1.522 1
1 847 . 17 1 1 A 74 74 LEU CA C 74 53.101 53.497 -0.396 1
1 848 . 17 1 1 A 74 74 LEU CB C 74 48.268 46.653 1.615 1
1 852 . 17 1 1 A 74 74 LEU N N 74 125.221 124.403 0.818 1
1 853 . 17 1 1 A 75 75 SER H H 75 8.840 8.829 0.011 1
1 854 . 17 1 1 A 75 75 SER HA H 75 5.040 5.162 -0.122 1
1 857 . 17 1 1 A 75 75 SER C C 75 176.552 173.514 3.038 1
1 858 . 17 1 1 A 75 75 SER CA C 75 57.487 56.404 1.083 1
1 859 . 17 1 1 A 75 75 SER CB C 75 64.993 65.484 -0.491 1
1 860 . 17 1 1 A 75 75 SER N N 75 111.252 114.524 -3.272 1
1 861 . 17 1 1 A 76 76 ILE H H 76 7.790 8.664 -0.874 1
1 862 . 17 1 1 A 76 76 ILE HA H 76 4.690 4.131 0.559 1
1 872 . 17 1 1 A 76 76 ILE C C 76 175.780 177.864 -2.084 1
1 873 . 17 1 1 A 76 76 ILE CA C 76 63.631 63.221 0.410 1
1 874 . 17 1 1 A 76 76 ILE CB C 76 39.484 38.439 1.045 1
1 878 . 17 1 1 A 76 76 ILE N N 76 129.205 128.818 0.387 1
1 879 . 17 1 1 A 77 77 ARG H H 77 8.115 8.409 -0.294 1
1 880 . 17 1 1 A 77 77 ARG HA H 77 3.760 4.256 -0.496 1
1 887 . 17 1 1 A 77 77 ARG C C 77 178.704 177.512 1.192 1
1 888 . 17 1 1 A 77 77 ARG CA C 77 58.933 58.493 0.440 1
1 889 . 17 1 1 A 77 77 ARG CB C 77 29.463 29.552 -0.089 1
1 892 . 17 1 1 A 77 77 ARG N N 77 123.257 120.706 2.551 1
1 893 . 17 1 1 A 78 78 ALA H H 78 8.304 7.486 0.818 1
1 894 . 17 1 1 A 78 78 ALA HA H 78 4.296 4.241 0.055 1
1 898 . 17 1 1 A 78 78 ALA C C 78 176.870 177.624 -0.754 1
1 899 . 17 1 1 A 78 78 ALA CA C 78 53.548 54.044 -0.496 1
1 900 . 17 1 1 A 78 78 ALA CB C 78 19.872 18.554 1.318 1
1 901 . 17 1 1 A 78 78 ALA N N 78 118.764 121.551 -2.787 1
1 902 . 17 1 1 A 79 79 THR H H 79 7.931 8.238 -0.307 1
1 903 . 17 1 1 A 79 79 THR HA H 79 4.370 4.668 -0.298 1
1 908 . 17 1 1 A 79 79 THR C C 79 178.356 173.796 4.560 1
1 909 . 17 1 1 A 79 79 THR CA C 79 62.381 62.668 -0.287 1
1 910 . 17 1 1 A 79 79 THR CB C 79 69.693 72.191 -2.498 1
1 912 . 17 1 1 A 79 79 THR N N 79 107.360 111.943 -4.583 1
1 913 . 17 1 1 A 80 80 GLN H H 80 7.651 8.301 -0.650 1
1 914 . 17 1 1 A 80 80 GLN HA H 80 4.527 4.636 -0.109 1
1 921 . 17 1 1 A 80 80 GLN C C 80 174.249 173.987 0.262 1
1 922 . 17 1 1 A 80 80 GLN CA C 80 54.760 54.345 0.415 1
1 923 . 17 1 1 A 80 80 GLN CB C 80 30.565 29.770 0.795 1
1 925 . 17 1 1 A 80 80 GLN N N 80 121.588 117.288 4.300 1
1 927 . 17 1 1 A 81 81 ALA H H 81 8.498 8.566 -0.068 1
1 928 . 17 1 1 A 81 81 ALA HA H 81 4.252 4.962 -0.710 1
1 932 . 17 1 1 A 81 81 ALA C C 81 175.693 176.440 -0.747 1
1 933 . 17 1 1 A 81 81 ALA CA C 81 52.345 50.566 1.779 1
1 934 . 17 1 1 A 81 81 ALA CB C 81 19.062 22.712 -3.650 1
1 935 . 17 1 1 A 81 81 ALA N N 81 126.423 121.617 4.806 1
1 936 . 17 1 1 A 82 82 ALA H H 82 8.324 8.533 -0.209 1
1 937 . 17 1 1 A 82 82 ALA HA H 82 4.000 4.588 -0.588 1
1 941 . 17 1 1 A 82 82 ALA C C 82 177.065 177.795 -0.730 1
1 942 . 17 1 1 A 82 82 ALA CA C 82 50.240 50.895 -0.655 1
1 943 . 17 1 1 A 82 82 ALA CB C 82 17.650 18.025 -0.375 1
1 944 . 17 1 1 A 82 82 ALA N N 82 125.114 121.514 3.600 1
1 945 . 17 1 1 A 83 83 PRO HA H 83 4.350 4.431 -0.081 1
1 952 . 17 1 1 A 83 83 PRO CA C 83 63.148 65.442 -2.294 1
1 953 . 17 1 1 A 83 83 PRO CB C 83 32.054 31.992 0.062 1
1 956 . 17 1 1 A 84 84 GLU H H 84 8.517 8.036 0.481 1
1 957 . 17 1 1 A 84 84 GLU HA H 84 4.197 3.914 0.283 1
1 962 . 17 1 1 A 84 84 GLU C C 84 176.948 175.239 1.709 1
1 963 . 17 1 1 A 84 84 GLU CA C 84 56.674 57.678 -1.004 1
1 964 . 17 1 1 A 84 84 GLU CB C 84 30.459 27.492 2.967 1
1 966 . 17 1 1 A 84 84 GLU N N 84 121.479 116.319 5.160 1
1 967 . 17 1 1 A 85 85 LYS H H 85 8.381 7.883 0.498 1
1 968 . 17 1 1 A 85 85 LYS HA H 85 4.309 4.150 0.159 1
1 977 . 17 1 1 A 85 85 LYS C C 85 176.457 175.590 0.867 1
1 978 . 17 1 1 A 85 85 LYS CA C 85 56.272 56.419 -0.147 1
1 979 . 17 1 1 A 85 85 LYS CB C 85 32.961 33.787 -0.826 1
1 983 . 17 1 1 A 85 85 LYS N N 85 123.266 121.151 2.115 1
1 984 . 17 1 1 A 86 86 LYS H H 86 8.403 8.519 -0.116 1
1 985 . 17 1 1 A 86 86 LYS HA H 86 4.308 4.780 -0.472 1
1 994 . 17 1 1 A 86 86 LYS C C 86 176.435 176.255 0.180 1
1 995 . 17 1 1 A 86 86 LYS CA C 86 56.272 54.177 2.095 1
1 996 . 17 1 1 A 86 86 LYS CB C 86 32.961 36.166 -3.205 1
1 1000 . 17 1 1 A 86 86 LYS N N 86 123.688 124.256 -0.568 1
1 1001 . 17 1 1 A 87 87 GLU H H 87 8.540 8.623 -0.083 1
1 1002 . 17 1 1 A 87 87 GLU HA H 87 4.358 4.254 0.104 1
1 1007 . 17 1 1 A 87 87 GLU C C 87 176.556 177.809 -1.253 1
1 1008 . 17 1 1 A 87 87 GLU CA C 87 56.406 57.196 -0.790 1
1 1009 . 17 1 1 A 87 87 GLU CB C 87 30.607 29.715 0.892 1
1 1011 . 17 1 1 A 87 87 GLU N N 87 122.633 119.705 2.928 1
1 1012 . 17 1 1 A 88 88 SER H H 88 8.520 8.604 -0.084 1
1 1013 . 17 1 1 A 88 88 SER HA H 88 4.490 4.393 0.097 1
1 1016 . 17 1 1 A 88 88 SER C C 88 175.780 174.088 1.692 1
1 1017 . 17 1 1 A 88 88 SER CA C 88 58.431 60.331 -1.900 1
1 1018 . 17 1 1 A 88 88 SER CB C 88 63.858 64.021 -0.163 1
1 1019 . 17 1 1 A 88 88 SER N N 88 118.333 118.906 -0.573 1
1 1020 . 17 1 1 A 89 89 LYS H H 89 8.339 7.646 0.693 1
1 1021 . 17 1 1 A 89 89 LYS HA H 89 4.620 4.731 -0.111 1
1 1030 . 17 1 1 A 89 89 LYS C C 89 174.160 173.847 0.313 1
1 1031 . 17 1 1 A 89 89 LYS CA C 89 54.265 53.109 1.156 1
1 1032 . 17 1 1 A 89 89 LYS CB C 89 32.672 35.300 -2.628 1
1 1036 . 17 1 1 A 89 89 LYS N N 89 124.433 118.815 5.618 1
1 1037 . 17 1 1 A 90 90 PRO HA H 90 4.417 4.493 -0.076 1
1 1044 . 17 1 1 A 90 90 PRO CA C 90 63.064 62.475 0.589 1
1 1045 . 17 1 1 A 90 90 PRO CB C 90 32.266 32.247 0.019 1
1 1048 . 17 1 1 A 91 91 ARG H H 91 8.502 8.349 0.153 1
1 1049 . 17 1 1 A 91 91 ARG HA H 91 4.305 4.263 0.042 1
1 1056 . 17 1 1 A 91 91 ARG C C 91 176.831 175.100 1.731 1
1 1057 . 17 1 1 A 91 91 ARG CA C 91 56.002 56.892 -0.890 1
1 1058 . 17 1 1 A 91 91 ARG CB C 91 30.913 31.056 -0.143 1
1 1061 . 17 1 1 A 91 91 ARG N N 91 122.193 122.312 -0.119 1
1 1062 . 17 1 1 A 92 92 LYS H H 92 8.415 8.455 -0.040 1
1 1063 . 17 1 1 A 92 92 LYS HA H 92 4.610 4.598 0.012 1
1 1072 . 17 1 1 A 92 92 LYS C C 92 176.262 175.901 0.361 1
1 1073 . 17 1 1 A 92 92 LYS CA C 92 54.258 53.133 1.125 1
1 1074 . 17 1 1 A 92 92 LYS CB C 92 32.672 36.764 -4.092 1
1 1078 . 17 1 1 A 92 92 LYS N N 92 124.243 126.478 -2.235 1
1 1079 . 17 1 1 A 93 93 PRO HA H 93 4.415 4.420 -0.005 1
1 1086 . 17 1 1 A 93 93 PRO CA C 93 62.899 64.856 -1.957 1
1 1087 . 17 1 1 A 93 93 PRO CB C 93 32.323 31.900 0.423 1
1 1090 . 17 1 1 A 94 94 LYS H H 94 8.420 7.737 0.683 1
1 1091 . 17 1 1 A 94 94 LYS HA H 94 4.290 4.868 -0.578 1
1 1100 . 17 1 1 A 94 94 LYS C C 94 176.714 174.705 2.009 1
1 1101 . 17 1 1 A 94 94 LYS CA C 94 56.585 54.795 1.790 1
1 1102 . 17 1 1 A 94 94 LYS CB C 94 33.161 36.787 -3.626 1
1 1106 . 17 1 1 A 94 94 LYS N N 94 122.121 118.009 4.112 1
1 1107 . 17 1 1 A 95 95 ALA H H 95 8.348 8.676 -0.328 1
1 1108 . 17 1 1 A 95 95 ALA HA H 95 4.250 4.890 -0.640 1
1 1112 . 17 1 1 A 95 95 ALA C C 95 176.453 175.338 1.115 1
1 1113 . 17 1 1 A 95 95 ALA CA C 95 52.471 51.416 1.055 1
1 1114 . 17 1 1 A 95 95 ALA CB C 95 19.347 23.843 -4.496 1
1 1115 . 17 1 1 A 95 95 ALA N N 95 125.624 122.728 2.896 1
1 1116 . 17 1 1 A 96 96 ALA H H 96 8.348 8.410 -0.062 1
1 1117 . 17 1 1 A 96 96 ALA HA H 96 4.254 4.868 -0.614 1
1 1121 . 17 1 1 A 96 96 ALA C C 96 176.462 176.971 -0.509 1
1 1122 . 17 1 1 A 96 96 ALA CA C 96 52.471 51.156 1.315 1
1 1123 . 17 1 1 A 96 96 ALA CB C 96 19.347 23.243 -3.896 1
1 1124 . 17 1 1 A 96 96 ALA N N 96 125.624 119.877 5.747 1
1 1125 . 17 1 1 A 97 97 GLN H H 97 8.333 8.931 -0.598 1
1 1126 . 17 1 1 A 97 97 GLN HA H 97 4.362 4.217 0.145 1
1 1133 . 17 1 1 A 97 97 GLN C C 97 177.684 176.159 1.525 1
1 1134 . 17 1 1 A 97 97 GLN CA C 97 55.848 56.102 -0.254 1
1 1135 . 17 1 1 A 97 97 GLN CB C 97 29.643 27.596 2.047 1
1 1137 . 17 1 1 A 97 97 GLN N N 97 120.049 119.631 0.418 1
1 1139 . 17 1 1 A 98 98 VAL H H 98 8.230 7.662 0.568 1
1 1140 . 17 1 1 A 98 98 VAL HA H 98 4.145 4.143 0.002 1
1 1148 . 17 1 1 A 98 98 VAL C C 98 176.033 176.269 -0.236 1
1 1149 . 17 1 1 A 98 98 VAL CA C 98 62.444 62.646 -0.202 1
1 1150 . 17 1 1 A 98 98 VAL CB C 98 32.942 31.881 1.061 1
1 1153 . 17 1 1 A 98 98 VAL N N 98 121.607 119.210 2.397 1
1 1154 . 17 1 1 A 99 99 SER H H 99 8.375 7.528 0.847 1
1 1155 . 17 1 1 A 99 99 SER HA H 99 4.473 4.268 0.205 1
1 1158 . 17 1 1 A 99 99 SER C C 99 176.204 174.727 1.477 1
1 1159 . 17 1 1 A 99 99 SER CA C 99 58.379 60.358 -1.979 1
1 1160 . 17 1 1 A 99 99 SER CB C 99 63.914 63.870 0.044 1
1 1161 . 17 1 1 A 99 99 SER N N 99 119.455 120.075 -0.620 1
1 1162 . 17 1 1 A 100 100 GLU H H 100 8.547 8.874 -0.327 1
1 1163 . 17 1 1 A 100 100 GLU HA H 100 4.304 3.992 0.312 1
1 1168 . 17 1 1 A 100 100 GLU C C 100 174.620 178.323 -3.703 1
1 1169 . 17 1 1 A 100 100 GLU CA C 100 56.835 59.814 -2.979 1
1 1170 . 17 1 1 A 100 100 GLU CB C 100 30.365 29.378 0.987 1
1 1172 . 17 1 1 A 100 100 GLU N N 100 123.419 125.291 -1.872 1
1 1173 . 17 1 1 A 101 101 GLU H H 101 8.432 7.857 0.575 1
1 1174 . 17 1 1 A 101 101 GLU HA H 101 4.252 4.163 0.089 1
1 1179 . 17 1 1 A 101 101 GLU C C 101 176.693 176.033 0.660 1
1 1180 . 17 1 1 A 101 101 GLU CA C 101 56.835 57.864 -1.029 1
1 1181 . 17 1 1 A 101 101 GLU CB C 101 30.365 29.618 0.747 1
1 1183 . 17 1 1 A 101 101 GLU N N 101 122.025 118.795 3.230 1
1 1184 . 17 1 1 A 102 102 ALA H H 102 8.324 7.924 0.400 1
1 1185 . 17 1 1 A 102 102 ALA HA H 102 4.361 3.937 0.424 1
1 1189 . 17 1 1 A 102 102 ALA C C 102 177.065 176.521 0.544 1
1 1190 . 17 1 1 A 102 102 ALA CA C 102 52.647 53.118 -0.471 1
1 1191 . 17 1 1 A 102 102 ALA CB C 102 19.227 16.997 2.230 1
1 1192 . 17 1 1 A 102 102 ALA N N 102 125.114 122.228 2.886 1
1 1193 . 17 1 1 A 103 103 SER H H 103 8.259 7.684 0.575 1
1 1194 . 17 1 1 A 103 103 SER HA H 103 4.473 4.401 0.072 1
1 1197 . 17 1 1 A 103 103 SER C C 103 177.772 174.761 3.011 1
1 1198 . 17 1 1 A 103 103 SER CA C 103 58.301 59.672 -1.371 1
1 1199 . 17 1 1 A 103 103 SER CB C 103 63.961 63.969 -0.008 1
1 1200 . 17 1 1 A 103 103 SER N N 103 115.109 112.391 2.718 1
1 1201 . 17 1 1 A 104 104 THR H H 104 8.127 8.162 -0.035 1
1 1202 . 17 1 1 A 104 104 THR HA H 104 4.600 4.482 0.118 1
1 1207 . 17 1 1 A 104 104 THR C C 104 174.427 173.715 0.712 1
1 1208 . 17 1 1 A 104 104 THR CA C 104 59.954 60.646 -0.692 1
1 1209 . 17 1 1 A 104 104 THR CB C 104 69.868 68.916 0.952 1
1 1211 . 17 1 1 A 104 104 THR N N 104 117.882 116.067 1.815 1
1 1212 . 17 1 1 A 105 105 PRO HA H 105 4.414 4.416 -0.002 1
1 1219 . 17 1 1 A 105 105 PRO CA C 105 63.300 62.072 1.228 1
1 1220 . 17 1 1 A 105 105 PRO CB C 105 32.227 32.045 0.182 1
1 1223 . 17 1 1 A 106 106 GLN H H 106 8.524 8.177 0.347 1
1 1224 . 17 1 1 A 106 106 GLN HA H 106 4.276 4.185 0.091 1
1 1229 . 17 1 1 A 106 106 GLN C C 106 177.083 176.059 1.024 1
1 1230 . 17 1 1 A 106 106 GLN CA C 106 56.209 55.417 0.792 1
1 1231 . 17 1 1 A 106 106 GLN CB C 106 29.490 29.308 0.182 1
1 1233 . 17 1 1 A 106 106 GLN N N 106 120.754 119.595 1.159 1
1 1234 . 17 1 1 A 107 107 GLY H H 107 8.394 8.641 -0.247 1
1 1235 . 17 1 1 A 107 107 GLY HA2 H 107 3.895 3.951 -0.056 1
1 1236 . 17 1 1 A 107 107 GLY HA3 H 107 3.895 3.972 -0.077 1
1 1237 . 17 1 1 A 107 107 GLY C C 107 176.651 173.560 3.091 1
1 1238 . 17 1 1 A 107 107 GLY CA C 107 45.330 45.351 -0.021 1
1 1239 . 17 1 1 A 107 107 GLY N N 107 110.026 110.537 -0.511 1
1 1240 . 17 1 1 A 108 108 PHE H H 108 8.099 7.164 0.935 1
1 1241 . 17 1 1 A 108 108 PHE HA H 108 4.582 5.123 -0.541 1
1 1245 . 17 1 1 A 108 108 PHE C C 108 173.944 172.757 1.187 1
1 1246 . 17 1 1 A 108 108 PHE CA C 108 58.054 55.986 2.068 1
1 1247 . 17 1 1 A 108 108 PHE CB C 108 39.708 41.522 -1.814 1
1 1248 . 17 1 1 A 108 108 PHE N N 108 120.180 115.080 5.100 1
1 1249 . 17 1 1 A 109 109 ASN H H 109 8.482 9.087 -0.605 1
1 1250 . 17 1 1 A 109 109 ASN HA H 109 4.691 4.992 -0.301 1
1 1255 . 17 1 1 A 109 109 ASN C C 109 175.627 175.918 -0.291 1
1 1256 . 17 1 1 A 109 109 ASN CA C 109 53.402 53.243 0.159 1
1 1257 . 17 1 1 A 109 109 ASN CB C 109 38.883 40.047 -1.164 1
1 1258 . 17 1 1 A 109 109 ASN N N 109 120.752 119.907 0.845 1
1 1260 . 17 1 1 A 110 110 THR H H 110 8.112 8.680 -0.568 1
1 1261 . 17 1 1 A 110 110 THR HA H 110 4.251 4.737 -0.486 1
1 1266 . 17 1 1 A 110 110 THR C C 110 175.275 174.843 0.432 1
1 1267 . 17 1 1 A 110 110 THR CA C 110 62.460 61.327 1.133 1
1 1268 . 17 1 1 A 110 110 THR CB C 110 69.726 70.561 -0.835 1
1 1270 . 17 1 1 A 110 110 THR N N 110 114.601 115.829 -1.228 1
1 1271 . 17 1 1 A 111 111 LEU H H 111 8.168 7.647 0.521 1
1 1272 . 17 1 1 A 111 111 LEU HA H 111 4.308 4.121 0.187 1
1 1282 . 17 1 1 A 111 111 LEU CA C 111 55.704 55.908 -0.204 1
1 1283 . 17 1 1 A 111 111 LEU CB C 111 42.071 43.964 -1.893 1
1 1287 . 17 1 1 A 111 111 LEU N N 111 123.756 123.421 0.335 1
1 1288 . 17 1 1 A 112 112 LYS H H 112 8.123 8.763 -0.640 1
1 1289 . 17 1 1 A 112 112 LYS HA H 112 4.242 4.050 0.192 1
1 1298 . 17 1 1 A 112 112 LYS C C 112 177.547 176.958 0.589 1
1 1299 . 17 1 1 A 112 112 LYS CA C 112 56.928 59.963 -3.035 1
1 1300 . 17 1 1 A 112 112 LYS CB C 112 33.055 32.301 0.754 1
1 1304 . 17 1 1 A 112 112 LYS N N 112 121.442 126.130 -4.688 1
1 1305 . 17 1 1 A 113 113 ASP H H 113 8.230 7.735 0.495 1
1 1306 . 17 1 1 A 113 113 ASP HA H 113 4.526 4.593 -0.067 1
1 1309 . 17 1 1 A 113 113 ASP C C 113 176.532 176.334 0.198 1
1 1310 . 17 1 1 A 113 113 ASP CA C 113 54.896 54.005 0.891 1
1 1311 . 17 1 1 A 113 113 ASP CB C 113 41.362 41.299 0.063 1
1 1312 . 17 1 1 A 113 113 ASP N N 113 120.598 119.960 0.638 1
1 1313 . 17 1 1 A 114 114 LYS H H 114 8.127 8.462 -0.335 1
1 1314 . 17 1 1 A 114 114 LYS HA H 114 4.300 4.254 0.046 1
1 1323 . 17 1 1 A 114 114 LYS C C 114 176.303 176.597 -0.294 1
1 1324 . 17 1 1 A 114 114 LYS CA C 114 56.633 56.794 -0.161 1
1 1325 . 17 1 1 A 114 114 LYS CB C 114 32.818 32.169 0.649 1
1 1329 . 17 1 1 A 114 114 LYS N N 114 120.897 123.015 -2.118 1
1 1330 . 17 1 1 A 115 115 LEU H H 115 8.244 8.527 -0.283 1
1 1331 . 17 1 1 A 115 115 LEU HA H 115 4.254 4.319 -0.065 1
1 1341 . 17 1 1 A 115 115 LEU C C 115 176.909 175.475 1.434 1
1 1342 . 17 1 1 A 115 115 LEU CA C 115 56.282 55.711 0.571 1
1 1343 . 17 1 1 A 115 115 LEU CB C 115 42.188 42.677 -0.489 1
1 1347 . 17 1 1 A 115 115 LEU N N 115 123.251 128.303 -5.052 1
1 1348 . 17 1 1 A 116 116 GLU H H 116 8.421 9.058 -0.637 1
1 1349 . 17 1 1 A 116 116 GLU HA H 116 4.190 4.934 -0.744 1
1 1352 . 17 1 1 A 116 116 GLU C C 116 177.828 176.714 1.114 1
1 1353 . 17 1 1 A 116 116 GLU CA C 116 57.466 54.619 2.847 1
1 1354 . 17 1 1 A 116 116 GLU CB C 116 30.124 33.416 -3.292 1
1 1355 . 17 1 1 A 116 116 GLU N N 116 120.575 124.543 -3.968 1
1 1356 . 17 1 1 A 117 117 GLU H H 117 8.255 8.513 -0.258 1
1 1357 . 17 1 1 A 117 117 GLU HA H 117 4.192 4.172 0.020 1
1 1362 . 17 1 1 A 117 117 GLU CA C 117 57.491 57.483 0.008 1
1 1363 . 17 1 1 A 117 117 GLU CB C 117 30.365 29.217 1.148 1
1 1365 . 17 1 1 A 117 117 GLU N N 117 120.933 122.224 -1.291 1
1 1366 . 17 1 1 A 118 118 TRP H H 118 8.143 7.745 0.398 1
1 1367 . 17 1 1 A 118 118 TRP HA H 118 4.581 4.919 -0.338 1
1 1372 . 17 1 1 A 118 118 TRP C C 118 176.794 175.900 0.894 1
1 1373 . 17 1 1 A 118 118 TRP CA C 118 58.363 57.175 1.188 1
1 1374 . 17 1 1 A 118 118 TRP CB C 118 29.333 30.800 -1.467 1
1 1375 . 17 1 1 A 118 118 TRP N N 118 121.592 118.018 3.574 1
1 1376 . 17 1 1 A 119 119 ILE H H 119 7.908 6.885 1.023 1
1 1377 . 17 1 1 A 119 119 ILE HA H 119 3.828 4.717 -0.889 1
1 1387 . 17 1 1 A 119 119 ILE C C 119 176.984 176.337 0.647 1
1 1388 . 17 1 1 A 119 119 ILE CA C 119 62.335 58.771 3.564 1
1 1389 . 17 1 1 A 119 119 ILE CB C 119 38.649 40.887 -2.238 1
1 1393 . 17 1 1 A 119 119 ILE N N 119 122.744 115.426 7.318 1
1 1394 . 17 1 1 A 120 120 GLU H H 120 8.143 8.952 -0.809 1
1 1395 . 17 1 1 A 120 120 GLU HA H 120 4.093 3.958 0.135 1
1 1400 . 17 1 1 A 120 120 GLU C C 120 176.565 177.631 -1.066 1
1 1401 . 17 1 1 A 120 120 GLU CA C 120 57.613 59.434 -1.821 1
1 1402 . 17 1 1 A 120 120 GLU CB C 120 29.834 29.150 0.684 1
1 1404 . 17 1 1 A 120 120 GLU N N 120 123.139 123.109 0.030 1
1 1405 . 17 1 1 A 121 121 MET H H 121 8.254 7.972 0.282 1
1 1406 . 17 1 1 A 121 121 MET HA H 121 4.357 4.147 0.210 1
1 1411 . 17 1 1 A 121 121 MET CA C 121 56.625 58.286 -1.661 1
1 1412 . 17 1 1 A 121 121 MET CB C 121 32.664 32.057 0.607 1
1 1414 . 17 1 1 A 121 121 MET N N 121 120.449 119.931 0.518 1
1 1415 . 17 1 1 A 122 122 SER H H 122 8.199 7.876 0.323 1
1 1416 . 17 1 1 A 122 122 SER HA H 122 4.280 4.180 0.100 1
1 1419 . 17 1 1 A 122 122 SER C C 122 177.224 174.770 2.454 1
1 1420 . 17 1 1 A 122 122 SER CA C 122 59.635 60.852 -1.217 1
1 1421 . 17 1 1 A 122 122 SER CB C 122 63.560 64.100 -0.540 1
1 1422 . 17 1 1 A 122 122 SER N N 122 115.857 114.066 1.791 1
1 1423 . 17 1 1 A 123 123 ASN H H 123 8.211 8.167 0.044 1
1 1424 . 17 1 1 A 123 123 ASN HA H 123 4.737 4.310 0.427 1
1 1429 . 17 1 1 A 123 123 ASN C C 123 174.709 175.137 -0.428 1
1 1430 . 17 1 1 A 123 123 ASN CA C 123 53.507 54.148 -0.641 1
1 1431 . 17 1 1 A 123 123 ASN CB C 123 38.800 37.153 1.647 1
1 1432 . 17 1 1 A 123 123 ASN N N 123 119.923 119.135 0.788 1
1 1434 . 17 1 1 A 124 124 ARG H H 124 7.997 7.377 0.620 1
1 1435 . 17 1 1 A 124 124 ARG HA H 124 4.305 4.157 0.148 1
1 1442 . 17 1 1 A 124 124 ARG C C 124 175.477 176.167 -0.690 1
1 1443 . 17 1 1 A 124 124 ARG CA C 124 56.709 55.719 0.990 1
1 1444 . 17 1 1 A 124 124 ARG CB C 124 30.584 31.098 -0.514 1
1 1447 . 17 1 1 A 124 124 ARG N N 124 120.821 120.657 0.164 1
1 1448 . 17 1 1 A 125 125 LYS H H 125 8.327 8.438 -0.111 1
1 1449 . 17 1 1 A 125 125 LYS HA H 125 4.254 4.222 0.032 1
1 1458 . 17 1 1 A 125 125 LYS C C 125 176.777 177.534 -0.757 1
1 1459 . 17 1 1 A 125 125 LYS CA C 125 56.860 56.973 -0.113 1
1 1460 . 17 1 1 A 125 125 LYS CB C 125 32.879 33.270 -0.391 1
1 1464 . 17 1 1 A 125 125 LYS N N 125 121.891 124.044 -2.153 1
1 1465 . 17 1 1 A 126 126 ASP H H 126 8.343 9.083 -0.740 1
1 1466 . 17 1 1 A 126 126 ASP HA H 126 4.581 4.336 0.245 1
1 1469 . 17 1 1 A 126 126 ASP C C 126 176.538 176.994 -0.456 1
1 1470 . 17 1 1 A 126 126 ASP CA C 126 54.540 56.587 -2.047 1
1 1471 . 17 1 1 A 126 126 ASP CB C 126 40.907 40.510 0.397 1
1 1472 . 17 1 1 A 126 126 ASP N N 126 119.814 123.064 -3.250 1
1 1473 . 17 1 1 A 127 127 LEU H H 127 7.946 7.519 0.427 1
1 1474 . 17 1 1 A 127 127 LEU HA H 127 4.309 4.309 0.000 1
1 1484 . 17 1 1 A 127 127 LEU C C 127 176.043 177.440 -1.397 1
1 1485 . 17 1 1 A 127 127 LEU CA C 127 55.427 53.814 1.613 1
1 1486 . 17 1 1 A 127 127 LEU CB C 127 42.394 40.349 2.045 1
1 1490 . 17 1 1 A 127 127 LEU N N 127 121.432 118.869 2.563 1
1 1491 . 17 1 1 A 128 128 ILE H H 128 7.967 8.302 -0.335 1
1 1492 . 17 1 1 A 128 128 ILE HA H 128 4.141 3.638 0.503 1
1 1502 . 17 1 1 A 128 128 ILE C C 128 177.200 177.546 -0.346 1
1 1503 . 17 1 1 A 128 128 ILE CA C 128 61.150 63.383 -2.233 1
1 1504 . 17 1 1 A 128 128 ILE CB C 128 38.489 37.643 0.846 1
1 1508 . 17 1 1 A 128 128 ILE N N 128 121.579 124.458 -2.879 1
1 1509 . 17 1 1 A 129 129 LYS H H 129 8.331 7.916 0.415 1
1 1510 . 17 1 1 A 129 129 LYS HA H 129 4.328 4.090 0.238 1
1 1519 . 17 1 1 A 129 129 LYS C C 129 175.952 176.430 -0.478 1
1 1520 . 17 1 1 A 129 129 LYS CA C 129 56.330 59.179 -2.849 1
1 1521 . 17 1 1 A 129 129 LYS CB C 129 33.010 32.459 0.551 1
1 1525 . 17 1 1 A 129 129 LYS N N 129 126.955 121.799 5.156 1
1 1 . 18 1 1 A 2 2 ALA HA H 2 4.070 4.851 -0.781 1
1 5 . 18 1 1 A 2 2 ALA CA C 2 52.067 50.886 1.181 1
1 6 . 18 1 1 A 2 2 ALA CB C 2 19.577 23.375 -3.798 1
1 7 . 18 1 1 A 3 3 ALA H H 3 8.714 8.344 0.370 1
1 8 . 18 1 1 A 3 3 ALA HA H 3 4.253 4.221 0.032 1
1 12 . 18 1 1 A 3 3 ALA C C 3 173.672 178.584 -4.912 1
1 13 . 18 1 1 A 3 3 ALA CA C 3 52.067 52.186 -0.119 1
1 14 . 18 1 1 A 3 3 ALA CB C 3 19.577 18.932 0.645 1
1 15 . 18 1 1 A 3 3 ALA N N 3 124.480 122.351 2.129 1
1 16 . 18 1 1 A 4 4 LYS H H 4 8.227 8.464 -0.237 1
1 17 . 18 1 1 A 4 4 LYS HA H 4 3.976 4.109 -0.133 1
1 26 . 18 1 1 A 4 4 LYS C C 4 176.672 176.231 0.441 1
1 27 . 18 1 1 A 4 4 LYS CA C 4 57.274 58.903 -1.629 1
1 28 . 18 1 1 A 4 4 LYS CB C 4 33.209 32.340 0.869 1
1 32 . 18 1 1 A 4 4 LYS N N 4 120.988 120.501 0.487 1
1 33 . 18 1 1 A 5 5 PHE H H 5 7.719 7.844 -0.125 1
1 34 . 18 1 1 A 5 5 PHE HA H 5 4.384 4.571 -0.187 1
1 38 . 18 1 1 A 5 5 PHE C C 5 175.364 173.563 1.801 1
1 39 . 18 1 1 A 5 5 PHE CA C 5 57.074 59.368 -2.294 1
1 40 . 18 1 1 A 5 5 PHE CB C 5 39.669 37.781 1.888 1
1 41 . 18 1 1 A 5 5 PHE N N 5 119.246 115.426 3.820 1
1 42 . 18 1 1 A 6 6 GLU H H 6 8.515 8.753 -0.238 1
1 43 . 18 1 1 A 6 6 GLU HA H 6 4.370 4.748 -0.378 1
1 48 . 18 1 1 A 6 6 GLU CA C 6 55.669 55.628 0.041 1
1 49 . 18 1 1 A 6 6 GLU CB C 6 32.094 33.601 -1.507 1
1 51 . 18 1 1 A 6 6 GLU N N 6 122.193 121.250 0.943 1
1 52 . 18 1 1 A 7 7 VAL H H 7 8.636 8.513 0.123 1
1 53 . 18 1 1 A 7 7 VAL HA H 7 3.406 3.950 -0.544 1
1 61 . 18 1 1 A 7 7 VAL C C 7 176.611 176.333 0.278 1
1 62 . 18 1 1 A 7 7 VAL CA C 7 65.358 63.312 2.046 1
1 63 . 18 1 1 A 7 7 VAL CB C 7 31.391 31.438 -0.047 1
1 66 . 18 1 1 A 7 7 VAL N N 7 122.949 123.317 -0.368 1
1 67 . 18 1 1 A 8 8 GLY H H 8 9.394 9.151 0.243 1
1 68 . 18 1 1 A 8 8 GLY HA2 H 8 3.600 4.025 -0.425 1
1 69 . 18 1 1 A 8 8 GLY HA3 H 8 4.546 4.027 0.519 1
1 70 . 18 1 1 A 8 8 GLY C C 8 178.074 174.166 3.908 1
1 71 . 18 1 1 A 8 8 GLY CA C 8 45.121 45.031 0.090 1
1 72 . 18 1 1 A 8 8 GLY N N 8 116.837 115.192 1.645 1
1 73 . 18 1 1 A 9 9 SER H H 9 8.021 7.991 0.030 1
1 74 . 18 1 1 A 9 9 SER HA H 9 4.680 4.461 0.219 1
1 77 . 18 1 1 A 9 9 SER C C 9 174.234 173.041 1.193 1
1 78 . 18 1 1 A 9 9 SER CA C 9 59.387 59.470 -0.083 1
1 79 . 18 1 1 A 9 9 SER CB C 9 65.584 64.617 0.967 1
1 80 . 18 1 1 A 9 9 SER N N 9 118.208 118.271 -0.063 1
1 81 . 18 1 1 A 10 10 VAL H H 10 7.945 8.216 -0.271 1
1 82 . 18 1 1 A 10 10 VAL HA H 10 4.980 5.117 -0.137 1
1 90 . 18 1 1 A 10 10 VAL C C 10 171.388 174.339 -2.951 1
1 91 . 18 1 1 A 10 10 VAL CA C 10 61.021 61.052 -0.031 1
1 92 . 18 1 1 A 10 10 VAL CB C 10 33.400 35.023 -1.623 1
1 95 . 18 1 1 A 10 10 VAL N N 10 121.118 122.519 -1.401 1
1 96 . 18 1 1 A 11 11 TYR H H 11 9.008 9.199 -0.191 1
1 97 . 18 1 1 A 11 11 TYR HA H 11 4.850 5.343 -0.493 1
1 101 . 18 1 1 A 11 11 TYR C C 11 174.926 174.742 0.184 1
1 102 . 18 1 1 A 11 11 TYR CA C 11 56.803 56.291 0.512 1
1 103 . 18 1 1 A 11 11 TYR CB C 11 43.676 43.739 -0.063 1
1 104 . 18 1 1 A 11 11 TYR N N 11 125.043 125.415 -0.372 1
1 105 . 18 1 1 A 12 12 THR H H 12 8.809 8.696 0.113 1
1 106 . 18 1 1 A 12 12 THR HA H 12 5.020 5.441 -0.421 1
1 111 . 18 1 1 A 12 12 THR C C 12 174.195 174.450 -0.255 1
1 112 . 18 1 1 A 12 12 THR CA C 12 62.487 59.999 2.488 1
1 113 . 18 1 1 A 12 12 THR CB C 12 69.743 71.811 -2.068 1
1 115 . 18 1 1 A 12 12 THR N N 12 116.850 115.154 1.696 1
1 116 . 18 1 1 A 13 13 GLY H H 13 9.179 8.490 0.689 1
1 117 . 18 1 1 A 13 13 GLY HA2 H 13 3.250 4.351 -1.101 1
1 118 . 18 1 1 A 13 13 GLY HA3 H 13 4.801 4.367 0.434 1
1 119 . 18 1 1 A 13 13 GLY C C 13 174.654 172.009 2.645 1
1 120 . 18 1 1 A 13 13 GLY CA C 13 44.377 45.327 -0.950 1
1 121 . 18 1 1 A 13 13 GLY N N 13 113.654 111.431 2.223 1
1 122 . 18 1 1 A 14 14 LYS H H 14 7.770 8.601 -0.831 1
1 123 . 18 1 1 A 14 14 LYS HA H 14 5.426 5.114 0.312 1
1 132 . 18 1 1 A 14 14 LYS C C 14 171.343 175.849 -4.506 1
1 133 . 18 1 1 A 14 14 LYS CA C 14 53.879 54.598 -0.719 1
1 134 . 18 1 1 A 14 14 LYS CB C 14 36.032 35.594 0.438 1
1 138 . 18 1 1 A 14 14 LYS N N 14 118.322 120.482 -2.160 1
1 139 . 18 1 1 A 15 15 VAL H H 15 9.206 9.295 -0.089 1
1 140 . 18 1 1 A 15 15 VAL HA H 15 4.400 4.275 0.125 1
1 148 . 18 1 1 A 15 15 VAL C C 15 176.306 177.052 -0.746 1
1 149 . 18 1 1 A 15 15 VAL CA C 15 63.648 63.396 0.252 1
1 150 . 18 1 1 A 15 15 VAL CB C 15 31.769 31.462 0.307 1
1 153 . 18 1 1 A 15 15 VAL N N 15 125.308 123.587 1.721 1
1 154 . 18 1 1 A 16 16 THR H H 16 9.403 9.272 0.131 1
1 155 . 18 1 1 A 16 16 THR HA H 16 4.562 4.670 -0.108 1
1 160 . 18 1 1 A 16 16 THR C C 16 178.098 174.663 3.435 1
1 161 . 18 1 1 A 16 16 THR CA C 16 62.018 61.579 0.439 1
1 162 . 18 1 1 A 16 16 THR CB C 16 69.720 69.837 -0.117 1
1 164 . 18 1 1 A 16 16 THR N N 16 121.753 117.752 4.001 1
1 165 . 18 1 1 A 17 17 GLY H H 17 7.600 7.080 0.520 1
1 166 . 18 1 1 A 17 17 GLY HA2 H 17 4.110 4.110 0.000 1
1 167 . 18 1 1 A 17 17 GLY HA3 H 17 4.250 4.241 0.009 1
1 168 . 18 1 1 A 17 17 GLY C C 17 175.551 171.423 4.128 1
1 169 . 18 1 1 A 17 17 GLY CA C 17 46.258 45.538 0.720 1
1 170 . 18 1 1 A 17 17 GLY N N 17 109.407 108.756 0.651 1
1 171 . 18 1 1 A 18 18 LEU H H 18 8.820 8.480 0.340 1
1 172 . 18 1 1 A 18 18 LEU HA H 18 4.852 5.109 -0.257 1
1 182 . 18 1 1 A 18 18 LEU CA C 18 54.245 53.356 0.889 1
1 183 . 18 1 1 A 18 18 LEU CB C 18 44.906 46.145 -1.239 1
1 187 . 18 1 1 A 18 18 LEU N N 18 123.419 121.145 2.274 1
1 188 . 18 1 1 A 19 19 GLN H H 19 8.537 8.148 0.389 1
1 189 . 18 1 1 A 19 19 GLN HA H 19 4.520 4.770 -0.250 1
1 196 . 18 1 1 A 19 19 GLN C C 19 175.258 175.721 -0.463 1
1 197 . 18 1 1 A 19 19 GLN CA C 19 53.269 53.817 -0.548 1
1 198 . 18 1 1 A 19 19 GLN CB C 19 31.522 32.364 -0.842 1
1 200 . 18 1 1 A 19 19 GLN N N 19 120.187 120.500 -0.313 1
1 202 . 18 1 1 A 20 20 ALA H H 20 8.798 8.839 -0.041 1
1 203 . 18 1 1 A 20 20 ALA HA H 20 4.010 4.078 -0.068 1
1 207 . 18 1 1 A 20 20 ALA C C 20 175.698 177.234 -1.536 1
1 208 . 18 1 1 A 20 20 ALA CA C 20 55.084 54.273 0.811 1
1 209 . 18 1 1 A 20 20 ALA CB C 20 18.277 18.646 -0.369 1
1 210 . 18 1 1 A 20 20 ALA N N 20 120.606 124.008 -3.402 1
1 211 . 18 1 1 A 21 21 TYR H H 21 6.618 7.631 -1.013 1
1 212 . 18 1 1 A 21 21 TYR HA H 21 4.540 4.830 -0.290 1
1 216 . 18 1 1 A 21 21 TYR C C 21 178.437 175.114 3.323 1
1 217 . 18 1 1 A 21 21 TYR CA C 21 55.120 56.853 -1.733 1
1 218 . 18 1 1 A 21 21 TYR CB C 21 37.891 40.520 -2.629 1
1 219 . 18 1 1 A 21 21 TYR N N 21 105.570 113.426 -7.856 1
1 220 . 18 1 1 A 22 22 GLY H H 22 7.203 7.058 0.145 1
1 221 . 18 1 1 A 22 22 GLY HA2 H 22 3.460 3.845 -0.385 1
1 222 . 18 1 1 A 22 22 GLY HA3 H 22 4.360 3.942 0.418 1
1 223 . 18 1 1 A 22 22 GLY C C 22 175.833 171.166 4.667 1
1 224 . 18 1 1 A 22 22 GLY CA C 22 46.356 45.395 0.961 1
1 225 . 18 1 1 A 22 22 GLY N N 22 109.854 108.605 1.249 1
1 226 . 18 1 1 A 23 23 ALA H H 23 8.549 8.457 0.092 1
1 227 . 18 1 1 A 23 23 ALA HA H 23 4.981 5.018 -0.037 1
1 231 . 18 1 1 A 23 23 ALA C C 23 168.810 175.603 -6.793 1
1 232 . 18 1 1 A 23 23 ALA CA C 23 49.178 50.513 -1.335 1
1 233 . 18 1 1 A 23 23 ALA CB C 23 22.797 22.542 0.255 1
1 234 . 18 1 1 A 23 23 ALA N N 23 118.749 122.169 -3.420 1
1 235 . 18 1 1 A 24 24 PHE H H 24 8.812 8.639 0.173 1
1 236 . 18 1 1 A 24 24 PHE HA H 24 5.125 5.007 0.118 1
1 240 . 18 1 1 A 24 24 PHE CA C 24 58.017 57.528 0.489 1
1 241 . 18 1 1 A 24 24 PHE CB C 24 40.475 40.726 -0.251 1
1 242 . 18 1 1 A 24 24 PHE N N 24 122.891 120.649 2.242 1
1 243 . 18 1 1 A 25 25 VAL H H 25 8.880 8.850 0.030 1
1 244 . 18 1 1 A 25 25 VAL HA H 25 4.660 4.834 -0.174 1
1 252 . 18 1 1 A 25 25 VAL CA C 25 60.379 60.851 -0.472 1
1 253 . 18 1 1 A 25 25 VAL CB C 25 35.654 35.265 0.389 1
1 256 . 18 1 1 A 25 25 VAL N N 25 122.908 121.238 1.670 1
1 257 . 18 1 1 A 26 26 ALA H H 26 9.403 8.937 0.466 1
1 258 . 18 1 1 A 26 26 ALA HA H 26 4.750 4.346 0.404 1
1 262 . 18 1 1 A 26 26 ALA C C 26 174.445 176.789 -2.344 1
1 263 . 18 1 1 A 26 26 ALA CA C 26 51.711 51.833 -0.122 1
1 264 . 18 1 1 A 26 26 ALA CB C 26 19.319 19.782 -0.463 1
1 265 . 18 1 1 A 26 26 ALA N N 26 129.425 129.803 -0.378 1
1 266 . 18 1 1 A 27 27 LEU H H 27 8.601 9.319 -0.718 1
1 267 . 18 1 1 A 27 27 LEU HA H 27 4.158 4.536 -0.378 1
1 277 . 18 1 1 A 27 27 LEU C C 27 177.814 176.266 1.548 1
1 278 . 18 1 1 A 27 27 LEU CA C 27 55.869 55.699 0.170 1
1 279 . 18 1 1 A 27 27 LEU CB C 27 42.251 43.590 -1.339 1
1 283 . 18 1 1 A 27 27 LEU N N 27 127.169 121.746 5.423 1
1 284 . 18 1 1 A 28 28 ASP H H 28 8.172 7.812 0.360 1
1 285 . 18 1 1 A 28 28 ASP HA H 28 4.420 4.857 -0.437 1
1 288 . 18 1 1 A 28 28 ASP C C 28 177.116 175.511 1.605 1
1 289 . 18 1 1 A 28 28 ASP CA C 28 53.755 53.488 0.267 1
1 290 . 18 1 1 A 28 28 ASP CB C 28 39.833 43.867 -4.034 1
1 291 . 18 1 1 A 28 28 ASP N N 28 115.657 116.606 -0.949 1
1 292 . 18 1 1 A 29 29 GLU H H 29 8.857 8.725 0.132 1
1 293 . 18 1 1 A 29 29 GLU HA H 29 4.090 4.047 0.043 1
1 298 . 18 1 1 A 29 29 GLU C C 29 175.965 176.858 -0.893 1
1 299 . 18 1 1 A 29 29 GLU CA C 29 59.470 59.067 0.403 1
1 300 . 18 1 1 A 29 29 GLU CB C 29 29.409 29.463 -0.054 1
1 302 . 18 1 1 A 29 29 GLU N N 29 114.738 122.885 -8.147 1
1 303 . 18 1 1 A 30 30 GLU H H 30 8.326 8.223 0.103 1
1 304 . 18 1 1 A 30 30 GLU HA H 30 4.640 4.533 0.107 1
1 309 . 18 1 1 A 30 30 GLU C C 30 176.817 175.026 1.791 1
1 310 . 18 1 1 A 30 30 GLU CA C 30 56.073 56.006 0.067 1
1 311 . 18 1 1 A 30 30 GLU CB C 30 32.453 31.842 0.611 1
1 313 . 18 1 1 A 30 30 GLU N N 30 115.753 117.432 -1.679 1
1 314 . 18 1 1 A 31 31 THR H H 31 7.819 7.411 0.408 1
1 315 . 18 1 1 A 31 31 THR HA H 31 4.484 5.022 -0.538 1
1 320 . 18 1 1 A 31 31 THR C C 31 176.330 173.046 3.284 1
1 321 . 18 1 1 A 31 31 THR CA C 31 63.398 61.111 2.287 1
1 322 . 18 1 1 A 31 31 THR CB C 31 69.367 71.921 -2.554 1
1 324 . 18 1 1 A 31 31 THR N N 31 118.750 115.201 3.549 1
1 325 . 18 1 1 A 32 32 GLN H H 32 8.913 8.616 0.297 1
1 326 . 18 1 1 A 32 32 GLN HA H 32 5.337 4.684 0.653 1
1 333 . 18 1 1 A 32 32 GLN C C 32 173.087 174.360 -1.273 1
1 334 . 18 1 1 A 32 32 GLN CA C 32 54.051 55.149 -1.098 1
1 335 . 18 1 1 A 32 32 GLN CB C 32 32.672 32.717 -0.045 1
1 337 . 18 1 1 A 32 32 GLN N N 32 127.294 124.949 2.345 1
1 339 . 18 1 1 A 33 33 GLY H H 33 8.900 8.480 0.420 1
1 340 . 18 1 1 A 33 33 GLY HA2 H 33 3.290 4.346 -1.056 1
1 341 . 18 1 1 A 33 33 GLY HA3 H 33 4.530 4.390 0.140 1
1 342 . 18 1 1 A 33 33 GLY C C 33 174.918 172.145 2.773 1
1 343 . 18 1 1 A 33 33 GLY CA C 33 44.534 45.348 -0.814 1
1 344 . 18 1 1 A 33 33 GLY N N 33 107.639 110.818 -3.179 1
1 345 . 18 1 1 A 34 34 LEU H H 34 8.127 8.162 -0.035 1
1 346 . 18 1 1 A 34 34 LEU HA H 34 4.950 5.105 -0.155 1
1 356 . 18 1 1 A 34 34 LEU CA C 34 53.755 54.041 -0.286 1
1 357 . 18 1 1 A 34 34 LEU CB C 34 45.493 45.808 -0.315 1
1 361 . 18 1 1 A 34 34 LEU N N 34 120.897 120.674 0.223 1
1 362 . 18 1 1 A 35 35 VAL H H 35 9.386 9.051 0.335 1
1 363 . 18 1 1 A 35 35 VAL HA H 35 4.479 4.709 -0.230 1
1 371 . 18 1 1 A 35 35 VAL C C 35 176.402 175.469 0.933 1
1 372 . 18 1 1 A 35 35 VAL CA C 35 59.594 60.061 -0.467 1
1 373 . 18 1 1 A 35 35 VAL CB C 35 32.590 33.569 -0.979 1
1 376 . 18 1 1 A 35 35 VAL N N 35 128.897 126.155 2.742 1
1 377 . 18 1 1 A 36 36 HIS H H 36 9.194 8.322 0.872 1
1 378 . 18 1 1 A 36 36 HIS HA H 36 4.487 4.621 -0.134 1
1 381 . 18 1 1 A 36 36 HIS C C 36 174.864 176.571 -1.707 1
1 382 . 18 1 1 A 36 36 HIS CA C 36 59.426 56.849 2.577 1
1 383 . 18 1 1 A 36 36 HIS CB C 36 31.542 30.697 0.845 1
1 384 . 18 1 1 A 36 36 HIS N N 36 127.751 126.093 1.658 1
1 385 . 18 1 1 A 37 37 ILE H H 37 7.454 8.978 -1.524 1
1 386 . 18 1 1 A 37 37 ILE HA H 37 3.810 3.656 0.154 1
1 396 . 18 1 1 A 37 37 ILE C C 37 176.948 177.465 -0.517 1
1 397 . 18 1 1 A 37 37 ILE CA C 37 63.773 64.945 -1.172 1
1 398 . 18 1 1 A 37 37 ILE CB C 37 38.993 37.498 1.495 1
1 402 . 18 1 1 A 37 37 ILE N N 37 126.266 126.037 0.229 1
1 403 . 18 1 1 A 38 38 SER H H 38 8.343 8.245 0.098 1
1 404 . 18 1 1 A 38 38 SER HA H 38 4.370 4.199 0.171 1
1 407 . 18 1 1 A 38 38 SER C C 38 174.792 175.478 -0.686 1
1 408 . 18 1 1 A 38 38 SER CA C 38 60.567 61.085 -0.518 1
1 409 . 18 1 1 A 38 38 SER CB C 38 63.632 62.929 0.703 1
1 410 . 18 1 1 A 38 38 SER N N 38 118.079 117.228 0.851 1
1 411 . 18 1 1 A 39 39 GLU H H 39 8.536 8.030 0.506 1
1 412 . 18 1 1 A 39 39 GLU HA H 39 4.503 4.498 0.005 1
1 417 . 18 1 1 A 39 39 GLU C C 39 175.131 177.527 -2.396 1
1 418 . 18 1 1 A 39 39 GLU CA C 39 54.928 56.504 -1.576 1
1 419 . 18 1 1 A 39 39 GLU CB C 39 29.621 30.220 -0.599 1
1 421 . 18 1 1 A 39 39 GLU N N 39 118.349 119.329 -0.980 1
1 422 . 18 1 1 A 40 40 VAL H H 40 7.776 7.452 0.324 1
1 423 . 18 1 1 A 40 40 VAL HA H 40 3.616 3.888 -0.272 1
1 431 . 18 1 1 A 40 40 VAL C C 40 177.277 176.283 0.994 1
1 432 . 18 1 1 A 40 40 VAL CA C 40 66.245 64.476 1.769 1
1 433 . 18 1 1 A 40 40 VAL CB C 40 32.590 32.194 0.396 1
1 436 . 18 1 1 A 40 40 VAL N N 40 125.443 117.507 7.936 1
1 437 . 18 1 1 A 41 41 THR H H 41 7.888 7.603 0.285 1
1 438 . 18 1 1 A 41 41 THR HA H 41 4.345 4.757 -0.412 1
1 443 . 18 1 1 A 41 41 THR C C 41 173.492 174.580 -1.088 1
1 444 . 18 1 1 A 41 41 THR CA C 41 59.047 61.315 -2.268 1
1 445 . 18 1 1 A 41 41 THR CB C 41 68.992 72.919 -3.927 1
1 447 . 18 1 1 A 41 41 THR N N 41 109.905 113.046 -3.141 1
1 448 . 18 1 1 A 42 42 HIS H H 42 8.063 8.337 -0.274 1
1 449 . 18 1 1 A 42 42 HIS HA H 42 4.510 4.648 -0.138 1
1 452 . 18 1 1 A 42 42 HIS C C 42 172.139 174.670 -2.531 1
1 453 . 18 1 1 A 42 42 HIS CA C 42 57.735 55.332 2.403 1
1 454 . 18 1 1 A 42 42 HIS CB C 42 31.144 29.748 1.396 1
1 455 . 18 1 1 A 42 42 HIS N N 42 121.760 121.034 0.726 1
1 456 . 18 1 1 A 43 43 GLY H H 43 8.286 7.410 0.876 1
1 457 . 18 1 1 A 43 43 GLY HA2 H 43 3.980 4.029 -0.049 1
1 458 . 18 1 1 A 43 43 GLY HA3 H 43 3.980 4.067 -0.087 1
1 459 . 18 1 1 A 43 43 GLY C C 43 176.307 172.545 3.762 1
1 460 . 18 1 1 A 43 43 GLY CA C 43 44.336 45.868 -1.532 1
1 461 . 18 1 1 A 43 43 GLY N N 43 110.133 108.158 1.975 1
1 462 . 18 1 1 A 44 44 PHE H H 44 8.327 8.577 -0.250 1
1 463 . 18 1 1 A 44 44 PHE HA H 44 4.489 4.561 -0.072 1
1 467 . 18 1 1 A 44 44 PHE C C 44 171.877 174.660 -2.783 1
1 468 . 18 1 1 A 44 44 PHE CA C 44 58.027 58.707 -0.680 1
1 469 . 18 1 1 A 44 44 PHE CB C 44 39.850 39.887 -0.037 1
1 470 . 18 1 1 A 44 44 PHE N N 44 120.049 121.007 -0.958 1
1 471 . 18 1 1 A 45 45 VAL H H 45 7.939 7.843 0.096 1
1 472 . 18 1 1 A 45 45 VAL HA H 45 3.865 3.718 0.147 1
1 480 . 18 1 1 A 45 45 VAL C C 45 175.523 175.433 0.090 1
1 481 . 18 1 1 A 45 45 VAL CA C 45 61.536 60.736 0.800 1
1 482 . 18 1 1 A 45 45 VAL CB C 45 33.127 31.644 1.483 1
1 485 . 18 1 1 A 45 45 VAL N N 45 127.882 127.008 0.874 1
1 486 . 18 1 1 A 46 46 LYS H H 46 8.868 8.005 0.863 1
1 487 . 18 1 1 A 46 46 LYS HA H 46 4.170 3.692 0.478 1
1 496 . 18 1 1 A 46 46 LYS C C 46 175.728 175.829 -0.101 1
1 497 . 18 1 1 A 46 46 LYS CA C 46 57.198 58.393 -1.195 1
1 498 . 18 1 1 A 46 46 LYS CB C 46 33.299 32.344 0.955 1
1 502 . 18 1 1 A 46 46 LYS N N 46 127.308 123.888 3.420 1
1 503 . 18 1 1 A 47 47 ASP H H 47 7.652 7.792 -0.140 1
1 504 . 18 1 1 A 47 47 ASP HA H 47 4.710 4.887 -0.177 1
1 507 . 18 1 1 A 47 47 ASP C C 47 176.411 176.166 0.245 1
1 508 . 18 1 1 A 47 47 ASP CA C 47 53.390 53.830 -0.440 1
1 509 . 18 1 1 A 47 47 ASP CB C 47 42.635 43.337 -0.702 1
1 510 . 18 1 1 A 47 47 ASP N N 47 117.932 118.217 -0.285 1
1 511 . 18 1 1 A 48 48 ILE H H 48 9.230 8.645 0.585 1
1 512 . 18 1 1 A 48 48 ILE HA H 48 3.579 3.928 -0.349 1
1 522 . 18 1 1 A 48 48 ILE C C 48 177.249 177.515 -0.266 1
1 523 . 18 1 1 A 48 48 ILE CA C 48 65.525 63.547 1.978 1
1 524 . 18 1 1 A 48 48 ILE CB C 48 38.797 37.650 1.147 1
1 528 . 18 1 1 A 48 48 ILE N N 48 129.049 125.598 3.451 1
1 529 . 18 1 1 A 49 49 ASN H H 49 8.468 9.114 -0.646 1
1 530 . 18 1 1 A 49 49 ASN HA H 49 4.690 4.587 0.103 1
1 535 . 18 1 1 A 49 49 ASN C C 49 175.779 176.274 -0.495 1
1 536 . 18 1 1 A 49 49 ASN CA C 49 55.587 55.012 0.575 1
1 537 . 18 1 1 A 49 49 ASN CB C 49 38.587 36.728 1.859 1
1 538 . 18 1 1 A 49 49 ASN N N 49 118.835 117.718 1.117 1
1 540 . 18 1 1 A 50 50 GLU H H 50 7.853 7.555 0.298 1
1 541 . 18 1 1 A 50 50 GLU HA H 50 4.040 4.120 -0.080 1
1 546 . 18 1 1 A 50 50 GLU C C 50 176.148 177.209 -1.061 1
1 547 . 18 1 1 A 50 50 GLU CA C 50 57.404 58.029 -0.625 1
1 548 . 18 1 1 A 50 50 GLU CB C 50 29.491 29.546 -0.055 1
1 550 . 18 1 1 A 50 50 GLU N N 50 116.358 118.253 -1.895 1
1 551 . 18 1 1 A 51 51 HIS H H 51 7.575 8.038 -0.463 1
1 552 . 18 1 1 A 51 51 HIS HA H 51 4.431 4.710 -0.279 1
1 555 . 18 1 1 A 51 51 HIS C C 51 176.383 174.572 1.811 1
1 556 . 18 1 1 A 51 51 HIS CA C 51 57.089 56.342 0.747 1
1 557 . 18 1 1 A 51 51 HIS CB C 51 33.168 31.811 1.357 1
1 558 . 18 1 1 A 51 51 HIS N N 51 115.828 114.523 1.305 1
1 559 . 18 1 1 A 52 52 LEU H H 52 7.640 7.629 0.011 1
1 560 . 18 1 1 A 52 52 LEU HA H 52 4.796 4.652 0.144 1
1 570 . 18 1 1 A 52 52 LEU C C 52 174.452 174.255 0.197 1
1 571 . 18 1 1 A 52 52 LEU CA C 52 53.398 53.735 -0.337 1
1 572 . 18 1 1 A 52 52 LEU CB C 52 48.805 44.412 4.393 1
1 576 . 18 1 1 A 52 52 LEU N N 52 117.932 119.878 -1.946 1
1 577 . 18 1 1 A 53 53 SER H H 53 8.151 8.653 -0.502 1
1 578 . 18 1 1 A 53 53 SER HA H 53 4.680 5.004 -0.324 1
1 581 . 18 1 1 A 53 53 SER C C 53 174.304 173.022 1.282 1
1 582 . 18 1 1 A 53 53 SER CA C 53 56.714 57.591 -0.877 1
1 583 . 18 1 1 A 53 53 SER CB C 53 65.431 66.195 -0.764 1
1 584 . 18 1 1 A 53 53 SER N N 53 113.496 117.428 -3.932 1
1 585 . 18 1 1 A 54 54 VAL H H 54 8.782 8.550 0.232 1
1 586 . 18 1 1 A 54 54 VAL HA H 54 3.230 3.783 -0.553 1
1 594 . 18 1 1 A 54 54 VAL C C 54 173.745 177.224 -3.479 1
1 595 . 18 1 1 A 54 54 VAL CA C 54 66.232 63.654 2.578 1
1 596 . 18 1 1 A 54 54 VAL CB C 54 31.067 31.544 -0.477 1
1 599 . 18 1 1 A 54 54 VAL N N 54 124.401 126.409 -2.008 1
1 600 . 18 1 1 A 55 55 GLY H H 55 9.079 9.029 0.050 1
1 601 . 18 1 1 A 55 55 GLY HA2 H 55 3.530 3.851 -0.321 1
1 602 . 18 1 1 A 55 55 GLY HA3 H 55 4.553 3.852 0.701 1
1 603 . 18 1 1 A 55 55 GLY C C 55 177.219 173.219 4.000 1
1 604 . 18 1 1 A 55 55 GLY CA C 55 44.647 46.257 -1.610 1
1 605 . 18 1 1 A 55 55 GLY N N 55 117.320 115.972 1.348 1
1 606 . 18 1 1 A 56 56 ASP H H 56 7.943 7.747 0.196 1
1 607 . 18 1 1 A 56 56 ASP HA H 56 4.460 5.145 -0.685 1
1 610 . 18 1 1 A 56 56 ASP C C 56 176.055 173.719 2.336 1
1 611 . 18 1 1 A 56 56 ASP CA C 56 55.456 52.429 3.027 1
1 612 . 18 1 1 A 56 56 ASP CB C 56 40.914 44.592 -3.678 1
1 613 . 18 1 1 A 56 56 ASP N N 56 121.782 119.677 2.105 1
1 614 . 18 1 1 A 57 57 GLU H H 57 8.649 8.847 -0.198 1
1 615 . 18 1 1 A 57 57 GLU HA H 57 5.100 5.218 -0.118 1
1 620 . 18 1 1 A 57 57 GLU C C 57 175.635 175.603 0.032 1
1 621 . 18 1 1 A 57 57 GLU CA C 57 55.805 55.399 0.406 1
1 622 . 18 1 1 A 57 57 GLU CB C 57 30.915 31.875 -0.960 1
1 624 . 18 1 1 A 57 57 GLU N N 57 122.513 123.756 -1.243 1
1 625 . 18 1 1 A 58 58 VAL H H 58 8.809 9.029 -0.220 1
1 626 . 18 1 1 A 58 58 VAL HA H 58 4.817 4.763 0.054 1
1 634 . 18 1 1 A 58 58 VAL C C 58 176.528 174.539 1.989 1
1 635 . 18 1 1 A 58 58 VAL CA C 58 58.719 59.414 -0.695 1
1 636 . 18 1 1 A 58 58 VAL CB C 58 35.523 35.815 -0.292 1
1 639 . 18 1 1 A 58 58 VAL N N 58 118.382 119.661 -1.279 1
1 640 . 18 1 1 A 59 59 GLN H H 59 8.255 8.597 -0.342 1
1 641 . 18 1 1 A 59 59 GLN HA H 59 5.030 4.709 0.321 1
1 646 . 18 1 1 A 59 59 GLN CA C 59 54.843 56.575 -1.732 1
1 647 . 18 1 1 A 59 59 GLN CB C 59 30.111 29.163 0.948 1
1 649 . 18 1 1 A 59 59 GLN N N 59 120.933 123.236 -2.303 1
1 650 . 18 1 1 A 60 60 VAL H H 60 8.970 9.181 -0.211 1
1 651 . 18 1 1 A 60 60 VAL HA H 60 4.990 4.892 0.098 1
1 659 . 18 1 1 A 60 60 VAL C C 60 175.203 174.101 1.102 1
1 660 . 18 1 1 A 60 60 VAL CA C 60 57.404 59.558 -2.154 1
1 661 . 18 1 1 A 60 60 VAL CB C 60 35.771 35.334 0.437 1
1 664 . 18 1 1 A 60 60 VAL N N 60 111.046 118.825 -7.779 1
1 665 . 18 1 1 A 61 61 LYS H H 61 8.937 8.353 0.584 1
1 666 . 18 1 1 A 61 61 LYS HA H 61 5.100 4.721 0.379 1
1 675 . 18 1 1 A 61 61 LYS C C 61 173.610 176.580 -2.970 1
1 676 . 18 1 1 A 61 61 LYS CA C 61 53.762 55.613 -1.851 1
1 677 . 18 1 1 A 61 61 LYS CB C 61 36.273 33.805 2.468 1
1 681 . 18 1 1 A 61 61 LYS N N 61 121.930 124.671 -2.741 1
1 682 . 18 1 1 A 62 62 VAL H H 62 8.429 9.281 -0.852 1
1 683 . 18 1 1 A 62 62 VAL HA H 62 4.074 4.051 0.023 1
1 691 . 18 1 1 A 62 62 VAL C C 62 176.912 175.884 1.028 1
1 692 . 18 1 1 A 62 62 VAL CA C 62 63.188 63.612 -0.424 1
1 693 . 18 1 1 A 62 62 VAL CB C 62 30.813 31.259 -0.446 1
1 696 . 18 1 1 A 62 62 VAL N N 62 126.329 127.153 -0.824 1
1 697 . 18 1 1 A 63 63 LEU H H 63 9.109 9.152 -0.043 1
1 698 . 18 1 1 A 63 63 LEU HA H 63 4.423 4.450 -0.027 1
1 708 . 18 1 1 A 63 63 LEU C C 63 176.091 176.216 -0.125 1
1 709 . 18 1 1 A 63 63 LEU CA C 63 55.876 56.311 -0.435 1
1 710 . 18 1 1 A 63 63 LEU CB C 63 42.800 43.493 -0.693 1
1 714 . 18 1 1 A 63 63 LEU N N 63 129.436 129.938 -0.502 1
1 715 . 18 1 1 A 64 64 ALA H H 64 7.594 7.380 0.214 1
1 716 . 18 1 1 A 64 64 ALA HA H 64 4.455 4.762 -0.307 1
1 720 . 18 1 1 A 64 64 ALA C C 64 177.314 175.200 2.114 1
1 721 . 18 1 1 A 64 64 ALA CA C 64 52.557 51.688 0.869 1
1 722 . 18 1 1 A 64 64 ALA CB C 64 21.458 22.686 -1.228 1
1 723 . 18 1 1 A 64 64 ALA N N 64 117.791 118.573 -0.782 1
1 724 . 18 1 1 A 65 65 VAL H H 65 8.583 8.623 -0.040 1
1 725 . 18 1 1 A 65 65 VAL HA H 65 4.470 4.825 -0.355 1
1 733 . 18 1 1 A 65 65 VAL C C 65 174.697 174.610 0.087 1
1 734 . 18 1 1 A 65 65 VAL CA C 65 61.936 60.889 1.047 1
1 735 . 18 1 1 A 65 65 VAL CB C 65 35.288 35.706 -0.418 1
1 738 . 18 1 1 A 65 65 VAL N N 65 120.009 120.041 -0.032 1
1 739 . 18 1 1 A 66 66 ASP H H 66 8.567 8.890 -0.323 1
1 740 . 18 1 1 A 66 66 ASP HA H 66 4.880 4.953 -0.073 1
1 743 . 18 1 1 A 66 66 ASP C C 66 174.355 175.820 -1.465 1
1 744 . 18 1 1 A 66 66 ASP CA C 66 52.681 53.411 -0.730 1
1 745 . 18 1 1 A 66 66 ASP CB C 66 41.775 41.934 -0.159 1
1 746 . 18 1 1 A 66 66 ASP N N 66 126.262 125.070 1.192 1
1 747 . 18 1 1 A 67 67 GLU H H 67 9.148 8.876 0.272 1
1 748 . 18 1 1 A 67 67 GLU HA H 67 4.110 4.236 -0.126 1
1 753 . 18 1 1 A 67 67 GLU C C 67 177.052 178.524 -1.472 1
1 754 . 18 1 1 A 67 67 GLU CA C 67 59.044 58.437 0.607 1
1 755 . 18 1 1 A 67 67 GLU CB C 67 29.919 29.558 0.361 1
1 757 . 18 1 1 A 67 67 GLU N N 67 125.480 124.725 0.755 1
1 758 . 18 1 1 A 68 68 GLU H H 68 8.384 7.913 0.471 1
1 759 . 18 1 1 A 68 68 GLU HA H 68 4.140 4.177 -0.037 1
1 764 . 18 1 1 A 68 68 GLU C C 68 178.383 179.267 -0.884 1
1 765 . 18 1 1 A 68 68 GLU CA C 68 59.044 59.001 0.043 1
1 766 . 18 1 1 A 68 68 GLU CB C 68 29.919 29.942 -0.023 1
1 768 . 18 1 1 A 68 68 GLU N N 68 119.760 120.060 -0.300 1
1 769 . 18 1 1 A 69 69 LYS H H 69 7.799 7.964 -0.165 1
1 770 . 18 1 1 A 69 69 LYS HA H 69 4.375 4.154 0.221 1
1 779 . 18 1 1 A 69 69 LYS C C 69 178.297 177.358 0.939 1
1 780 . 18 1 1 A 69 69 LYS CA C 69 55.704 56.532 -0.828 1
1 781 . 18 1 1 A 69 69 LYS CB C 69 33.622 32.761 0.861 1
1 785 . 18 1 1 A 69 69 LYS N N 69 115.476 116.966 -1.490 1
1 786 . 18 1 1 A 70 70 GLY H H 70 7.994 8.305 -0.311 1
1 787 . 18 1 1 A 70 70 GLY HA2 H 70 3.940 3.950 -0.010 1
1 788 . 18 1 1 A 70 70 GLY HA3 H 70 3.960 3.954 0.006 1
1 789 . 18 1 1 A 70 70 GLY C C 70 177.215 174.006 3.209 1
1 790 . 18 1 1 A 70 70 GLY CA C 70 46.773 46.599 0.174 1
1 791 . 18 1 1 A 70 70 GLY N N 70 110.245 108.433 1.812 1
1 792 . 18 1 1 A 71 71 LYS H H 71 7.560 8.053 -0.493 1
1 793 . 18 1 1 A 71 71 LYS HA H 71 4.690 4.931 -0.241 1
1 802 . 18 1 1 A 71 71 LYS C C 71 174.607 174.854 -0.247 1
1 803 . 18 1 1 A 71 71 LYS CA C 71 55.332 54.427 0.905 1
1 804 . 18 1 1 A 71 71 LYS CB C 71 34.903 36.135 -1.232 1
1 808 . 18 1 1 A 71 71 LYS N N 71 118.201 118.817 -0.616 1
1 809 . 18 1 1 A 72 72 ILE H H 72 8.867 8.675 0.192 1
1 810 . 18 1 1 A 72 72 ILE HA H 72 4.630 4.999 -0.369 1
1 820 . 18 1 1 A 72 72 ILE C C 72 175.708 174.689 1.019 1
1 821 . 18 1 1 A 72 72 ILE CA C 72 61.494 59.880 1.614 1
1 822 . 18 1 1 A 72 72 ILE CB C 72 40.652 42.152 -1.500 1
1 826 . 18 1 1 A 72 72 ILE N N 72 126.827 121.654 5.173 1
1 827 . 18 1 1 A 73 73 SER H H 73 8.815 9.021 -0.206 1
1 828 . 18 1 1 A 73 73 SER HA H 73 5.110 5.296 -0.186 1
1 831 . 18 1 1 A 73 73 SER C C 73 175.122 172.966 2.156 1
1 832 . 18 1 1 A 73 73 SER CA C 73 57.487 57.566 -0.079 1
1 833 . 18 1 1 A 73 73 SER CB C 73 64.386 65.272 -0.886 1
1 834 . 18 1 1 A 73 73 SER N N 73 123.640 124.532 -0.892 1
1 835 . 18 1 1 A 74 74 LEU H H 74 8.585 8.875 -0.290 1
1 836 . 18 1 1 A 74 74 LEU HA H 74 5.450 5.296 0.154 1
1 846 . 18 1 1 A 74 74 LEU C C 74 174.061 175.149 -1.088 1
1 847 . 18 1 1 A 74 74 LEU CA C 74 53.101 53.424 -0.323 1
1 848 . 18 1 1 A 74 74 LEU CB C 74 48.268 46.840 1.428 1
1 852 . 18 1 1 A 74 74 LEU N N 74 125.221 124.021 1.200 1
1 853 . 18 1 1 A 75 75 SER H H 75 8.840 8.548 0.292 1
1 854 . 18 1 1 A 75 75 SER HA H 75 5.040 5.203 -0.163 1
1 857 . 18 1 1 A 75 75 SER C C 75 176.552 173.649 2.903 1
1 858 . 18 1 1 A 75 75 SER CA C 75 57.487 56.494 0.993 1
1 859 . 18 1 1 A 75 75 SER CB C 75 64.993 66.458 -1.465 1
1 860 . 18 1 1 A 75 75 SER N N 75 111.252 112.839 -1.587 1
1 861 . 18 1 1 A 76 76 ILE H H 76 7.790 8.882 -1.092 1
1 862 . 18 1 1 A 76 76 ILE HA H 76 4.690 4.590 0.100 1
1 872 . 18 1 1 A 76 76 ILE C C 76 175.780 177.041 -1.261 1
1 873 . 18 1 1 A 76 76 ILE CA C 76 63.631 61.968 1.663 1
1 874 . 18 1 1 A 76 76 ILE CB C 76 39.484 39.722 -0.238 1
1 878 . 18 1 1 A 76 76 ILE N N 76 129.205 120.054 9.151 1
1 879 . 18 1 1 A 77 77 ARG H H 77 8.115 8.592 -0.477 1
1 880 . 18 1 1 A 77 77 ARG HA H 77 3.760 4.150 -0.390 1
1 887 . 18 1 1 A 77 77 ARG C C 77 178.704 177.665 1.039 1
1 888 . 18 1 1 A 77 77 ARG CA C 77 58.933 58.279 0.654 1
1 889 . 18 1 1 A 77 77 ARG CB C 77 29.463 29.711 -0.248 1
1 892 . 18 1 1 A 77 77 ARG N N 77 123.257 121.766 1.491 1
1 893 . 18 1 1 A 78 78 ALA H H 78 8.304 7.686 0.618 1
1 894 . 18 1 1 A 78 78 ALA HA H 78 4.296 4.181 0.115 1
1 898 . 18 1 1 A 78 78 ALA C C 78 176.870 178.082 -1.212 1
1 899 . 18 1 1 A 78 78 ALA CA C 78 53.548 53.984 -0.436 1
1 900 . 18 1 1 A 78 78 ALA CB C 78 19.872 18.432 1.440 1
1 901 . 18 1 1 A 78 78 ALA N N 78 118.764 121.672 -2.908 1
1 902 . 18 1 1 A 79 79 THR H H 79 7.931 7.850 0.081 1
1 903 . 18 1 1 A 79 79 THR HA H 79 4.370 4.612 -0.242 1
1 908 . 18 1 1 A 79 79 THR C C 79 178.356 174.404 3.952 1
1 909 . 18 1 1 A 79 79 THR CA C 79 62.381 61.971 0.410 1
1 910 . 18 1 1 A 79 79 THR CB C 79 69.693 70.838 -1.145 1
1 912 . 18 1 1 A 79 79 THR N N 79 107.360 103.585 3.775 1
1 913 . 18 1 1 A 80 80 GLN H H 80 7.651 7.833 -0.182 1
1 914 . 18 1 1 A 80 80 GLN HA H 80 4.527 4.767 -0.240 1
1 921 . 18 1 1 A 80 80 GLN C C 80 174.249 174.084 0.165 1
1 922 . 18 1 1 A 80 80 GLN CA C 80 54.760 54.052 0.708 1
1 923 . 18 1 1 A 80 80 GLN CB C 80 30.565 32.806 -2.241 1
1 925 . 18 1 1 A 80 80 GLN N N 80 121.588 119.717 1.871 1
1 927 . 18 1 1 A 81 81 ALA H H 81 8.498 8.691 -0.193 1
1 928 . 18 1 1 A 81 81 ALA HA H 81 4.252 5.417 -1.165 1
1 932 . 18 1 1 A 81 81 ALA C C 81 175.693 176.161 -0.468 1
1 933 . 18 1 1 A 81 81 ALA CA C 81 52.345 50.286 2.059 1
1 934 . 18 1 1 A 81 81 ALA CB C 81 19.062 23.556 -4.494 1
1 935 . 18 1 1 A 81 81 ALA N N 81 126.423 122.017 4.406 1
1 936 . 18 1 1 A 82 82 ALA H H 82 8.324 8.227 0.097 1
1 937 . 18 1 1 A 82 82 ALA HA H 82 4.000 4.329 -0.329 1
1 941 . 18 1 1 A 82 82 ALA C C 82 177.065 175.889 1.176 1
1 942 . 18 1 1 A 82 82 ALA CA C 82 50.240 51.038 -0.798 1
1 943 . 18 1 1 A 82 82 ALA CB C 82 17.650 17.603 0.047 1
1 944 . 18 1 1 A 82 82 ALA N N 82 125.114 122.111 3.003 1
1 945 . 18 1 1 A 83 83 PRO HA H 83 4.350 4.535 -0.185 1
1 952 . 18 1 1 A 83 83 PRO CA C 83 63.148 62.575 0.573 1
1 953 . 18 1 1 A 83 83 PRO CB C 83 32.054 32.608 -0.554 1
1 956 . 18 1 1 A 84 84 GLU H H 84 8.517 9.120 -0.603 1
1 957 . 18 1 1 A 84 84 GLU HA H 84 4.197 4.172 0.025 1
1 962 . 18 1 1 A 84 84 GLU C C 84 176.948 176.259 0.689 1
1 963 . 18 1 1 A 84 84 GLU CA C 84 56.674 58.618 -1.944 1
1 964 . 18 1 1 A 84 84 GLU CB C 84 30.459 30.936 -0.477 1
1 966 . 18 1 1 A 84 84 GLU N N 84 121.479 119.821 1.658 1
1 967 . 18 1 1 A 85 85 LYS H H 85 8.381 7.629 0.752 1
1 968 . 18 1 1 A 85 85 LYS HA H 85 4.309 4.863 -0.554 1
1 977 . 18 1 1 A 85 85 LYS C C 85 176.457 174.372 2.085 1
1 978 . 18 1 1 A 85 85 LYS CA C 85 56.272 55.572 0.700 1
1 979 . 18 1 1 A 85 85 LYS CB C 85 32.961 36.153 -3.192 1
1 983 . 18 1 1 A 85 85 LYS N N 85 123.266 118.771 4.495 1
1 984 . 18 1 1 A 86 86 LYS H H 86 8.403 8.545 -0.142 1
1 985 . 18 1 1 A 86 86 LYS HA H 86 4.308 4.961 -0.653 1
1 994 . 18 1 1 A 86 86 LYS C C 86 176.435 175.478 0.957 1
1 995 . 18 1 1 A 86 86 LYS CA C 86 56.272 54.121 2.151 1
1 996 . 18 1 1 A 86 86 LYS CB C 86 32.961 36.780 -3.819 1
1 1000 . 18 1 1 A 86 86 LYS N N 86 123.688 124.441 -0.753 1
1 1001 . 18 1 1 A 87 87 GLU H H 87 8.540 8.500 0.040 1
1 1002 . 18 1 1 A 87 87 GLU HA H 87 4.358 4.795 -0.437 1
1 1007 . 18 1 1 A 87 87 GLU C C 87 176.556 176.741 -0.185 1
1 1008 . 18 1 1 A 87 87 GLU CA C 87 56.406 54.393 2.013 1
1 1009 . 18 1 1 A 87 87 GLU CB C 87 30.607 33.051 -2.444 1
1 1011 . 18 1 1 A 87 87 GLU N N 87 122.633 120.639 1.994 1
1 1012 . 18 1 1 A 88 88 SER H H 88 8.520 8.678 -0.158 1
1 1013 . 18 1 1 A 88 88 SER HA H 88 4.490 4.243 0.247 1
1 1016 . 18 1 1 A 88 88 SER C C 88 175.780 175.140 0.640 1
1 1017 . 18 1 1 A 88 88 SER CA C 88 58.431 62.201 -3.770 1
1 1018 . 18 1 1 A 88 88 SER CB C 88 63.858 63.077 0.781 1
1 1019 . 18 1 1 A 88 88 SER N N 88 118.333 116.416 1.917 1
1 1020 . 18 1 1 A 89 89 LYS H H 89 8.339 7.671 0.668 1
1 1021 . 18 1 1 A 89 89 LYS HA H 89 4.620 4.407 0.213 1
1 1030 . 18 1 1 A 89 89 LYS C C 89 174.160 175.513 -1.353 1
1 1031 . 18 1 1 A 89 89 LYS CA C 89 54.265 54.325 -0.060 1
1 1032 . 18 1 1 A 89 89 LYS CB C 89 32.672 33.487 -0.815 1
1 1036 . 18 1 1 A 89 89 LYS N N 89 124.433 120.844 3.589 1
1 1037 . 18 1 1 A 90 90 PRO HA H 90 4.417 4.534 -0.117 1
1 1044 . 18 1 1 A 90 90 PRO CA C 90 63.064 62.952 0.112 1
1 1045 . 18 1 1 A 90 90 PRO CB C 90 32.266 32.592 -0.326 1
1 1048 . 18 1 1 A 91 91 ARG H H 91 8.502 8.329 0.173 1
1 1049 . 18 1 1 A 91 91 ARG HA H 91 4.305 4.047 0.258 1
1 1056 . 18 1 1 A 91 91 ARG C C 91 176.831 176.960 -0.129 1
1 1057 . 18 1 1 A 91 91 ARG CA C 91 56.002 57.996 -1.994 1
1 1058 . 18 1 1 A 91 91 ARG CB C 91 30.913 29.945 0.968 1
1 1061 . 18 1 1 A 91 91 ARG N N 91 122.193 119.628 2.565 1
1 1062 . 18 1 1 A 92 92 LYS H H 92 8.415 7.342 1.073 1
1 1063 . 18 1 1 A 92 92 LYS HA H 92 4.610 4.436 0.174 1
1 1072 . 18 1 1 A 92 92 LYS C C 92 176.262 176.506 -0.244 1
1 1073 . 18 1 1 A 92 92 LYS CA C 92 54.258 54.883 -0.625 1
1 1074 . 18 1 1 A 92 92 LYS CB C 92 32.672 31.863 0.809 1
1 1078 . 18 1 1 A 92 92 LYS N N 92 124.243 121.930 2.313 1
1 1079 . 18 1 1 A 93 93 PRO HA H 93 4.415 4.458 -0.043 1
1 1086 . 18 1 1 A 93 93 PRO CA C 93 62.899 64.538 -1.639 1
1 1087 . 18 1 1 A 93 93 PRO CB C 93 32.323 31.990 0.333 1
1 1090 . 18 1 1 A 94 94 LYS H H 94 8.420 7.647 0.773 1
1 1091 . 18 1 1 A 94 94 LYS HA H 94 4.290 4.599 -0.309 1
1 1100 . 18 1 1 A 94 94 LYS C C 94 176.714 175.838 0.876 1
1 1101 . 18 1 1 A 94 94 LYS CA C 94 56.585 55.152 1.433 1
1 1102 . 18 1 1 A 94 94 LYS CB C 94 33.161 32.306 0.855 1
1 1106 . 18 1 1 A 94 94 LYS N N 94 122.121 114.630 7.491 1
1 1107 . 18 1 1 A 95 95 ALA H H 95 8.348 7.817 0.531 1
1 1108 . 18 1 1 A 95 95 ALA HA H 95 4.250 3.961 0.289 1
1 1112 . 18 1 1 A 95 95 ALA C C 95 176.453 176.772 -0.319 1
1 1113 . 18 1 1 A 95 95 ALA CA C 95 52.471 53.220 -0.749 1
1 1114 . 18 1 1 A 95 95 ALA CB C 95 19.347 17.245 2.102 1
1 1115 . 18 1 1 A 95 95 ALA N N 95 125.624 119.546 6.078 1
1 1116 . 18 1 1 A 96 96 ALA H H 96 8.348 7.821 0.527 1
1 1117 . 18 1 1 A 96 96 ALA HA H 96 4.254 4.401 -0.147 1
1 1121 . 18 1 1 A 96 96 ALA C C 96 176.462 176.578 -0.116 1
1 1122 . 18 1 1 A 96 96 ALA CA C 96 52.471 51.247 1.224 1
1 1123 . 18 1 1 A 96 96 ALA CB C 96 19.347 17.427 1.920 1
1 1124 . 18 1 1 A 96 96 ALA N N 96 125.624 119.545 6.079 1
1 1125 . 18 1 1 A 97 97 GLN H H 97 8.333 7.795 0.538 1
1 1126 . 18 1 1 A 97 97 GLN HA H 97 4.362 4.330 0.032 1
1 1133 . 18 1 1 A 97 97 GLN C C 97 177.684 175.729 1.955 1
1 1134 . 18 1 1 A 97 97 GLN CA C 97 55.848 55.349 0.499 1
1 1135 . 18 1 1 A 97 97 GLN CB C 97 29.643 29.331 0.312 1
1 1137 . 18 1 1 A 97 97 GLN N N 97 120.049 117.012 3.037 1
1 1139 . 18 1 1 A 98 98 VAL H H 98 8.230 8.501 -0.271 1
1 1140 . 18 1 1 A 98 98 VAL HA H 98 4.145 4.795 -0.650 1
1 1148 . 18 1 1 A 98 98 VAL C C 98 176.033 175.305 0.728 1
1 1149 . 18 1 1 A 98 98 VAL CA C 98 62.444 59.731 2.713 1
1 1150 . 18 1 1 A 98 98 VAL CB C 98 32.942 34.950 -2.008 1
1 1153 . 18 1 1 A 98 98 VAL N N 98 121.607 114.182 7.425 1
1 1154 . 18 1 1 A 99 99 SER H H 99 8.375 8.998 -0.623 1
1 1155 . 18 1 1 A 99 99 SER HA H 99 4.473 4.776 -0.303 1
1 1158 . 18 1 1 A 99 99 SER C C 99 176.204 175.050 1.154 1
1 1159 . 18 1 1 A 99 99 SER CA C 99 58.379 58.819 -0.440 1
1 1160 . 18 1 1 A 99 99 SER CB C 99 63.914 65.141 -1.227 1
1 1161 . 18 1 1 A 99 99 SER N N 99 119.455 117.342 2.113 1
1 1162 . 18 1 1 A 100 100 GLU H H 100 8.547 7.836 0.711 1
1 1163 . 18 1 1 A 100 100 GLU HA H 100 4.304 4.671 -0.367 1
1 1168 . 18 1 1 A 100 100 GLU C C 100 174.620 176.132 -1.512 1
1 1169 . 18 1 1 A 100 100 GLU CA C 100 56.835 57.366 -0.531 1
1 1170 . 18 1 1 A 100 100 GLU CB C 100 30.365 32.706 -2.341 1
1 1172 . 18 1 1 A 100 100 GLU N N 100 123.419 118.118 5.301 1
1 1173 . 18 1 1 A 101 101 GLU H H 101 8.432 7.485 0.947 1
1 1174 . 18 1 1 A 101 101 GLU HA H 101 4.252 4.750 -0.498 1
1 1179 . 18 1 1 A 101 101 GLU C C 101 176.693 176.379 0.314 1
1 1180 . 18 1 1 A 101 101 GLU CA C 101 56.835 54.706 2.129 1
1 1181 . 18 1 1 A 101 101 GLU CB C 101 30.365 32.052 -1.687 1
1 1183 . 18 1 1 A 101 101 GLU N N 101 122.025 117.306 4.719 1
1 1184 . 18 1 1 A 102 102 ALA H H 102 8.324 8.702 -0.378 1
1 1185 . 18 1 1 A 102 102 ALA HA H 102 4.361 4.403 -0.042 1
1 1189 . 18 1 1 A 102 102 ALA C C 102 177.065 178.277 -1.212 1
1 1190 . 18 1 1 A 102 102 ALA CA C 102 52.647 53.034 -0.387 1
1 1191 . 18 1 1 A 102 102 ALA CB C 102 19.227 18.580 0.647 1
1 1192 . 18 1 1 A 102 102 ALA N N 102 125.114 124.041 1.073 1
1 1193 . 18 1 1 A 103 103 SER H H 103 8.259 8.162 0.097 1
1 1194 . 18 1 1 A 103 103 SER HA H 103 4.473 4.222 0.251 1
1 1197 . 18 1 1 A 103 103 SER C C 103 177.772 175.084 2.688 1
1 1198 . 18 1 1 A 103 103 SER CA C 103 58.301 61.708 -3.407 1
1 1199 . 18 1 1 A 103 103 SER CB C 103 63.961 62.307 1.654 1
1 1200 . 18 1 1 A 103 103 SER N N 103 115.109 113.686 1.423 1
1 1201 . 18 1 1 A 104 104 THR H H 104 8.127 7.634 0.493 1
1 1202 . 18 1 1 A 104 104 THR HA H 104 4.600 4.483 0.117 1
1 1207 . 18 1 1 A 104 104 THR C C 104 174.427 174.316 0.111 1
1 1208 . 18 1 1 A 104 104 THR CA C 104 59.954 60.290 -0.336 1
1 1209 . 18 1 1 A 104 104 THR CB C 104 69.868 69.007 0.861 1
1 1211 . 18 1 1 A 104 104 THR N N 104 117.882 113.687 4.195 1
1 1212 . 18 1 1 A 105 105 PRO HA H 105 4.414 4.438 -0.024 1
1 1219 . 18 1 1 A 105 105 PRO CA C 105 63.300 64.686 -1.386 1
1 1220 . 18 1 1 A 105 105 PRO CB C 105 32.227 32.184 0.043 1
1 1223 . 18 1 1 A 106 106 GLN H H 106 8.524 7.689 0.835 1
1 1224 . 18 1 1 A 106 106 GLN HA H 106 4.276 5.039 -0.763 1
1 1229 . 18 1 1 A 106 106 GLN C C 106 177.083 175.715 1.368 1
1 1230 . 18 1 1 A 106 106 GLN CA C 106 56.209 53.842 2.367 1
1 1231 . 18 1 1 A 106 106 GLN CB C 106 29.490 33.400 -3.910 1
1 1233 . 18 1 1 A 106 106 GLN N N 106 120.754 117.668 3.086 1
1 1234 . 18 1 1 A 107 107 GLY H H 107 8.394 8.805 -0.411 1
1 1235 . 18 1 1 A 107 107 GLY HA2 H 107 3.895 4.104 -0.209 1
1 1236 . 18 1 1 A 107 107 GLY HA3 H 107 3.895 4.119 -0.224 1
1 1237 . 18 1 1 A 107 107 GLY C C 107 176.651 172.906 3.745 1
1 1238 . 18 1 1 A 107 107 GLY CA C 107 45.330 44.503 0.827 1
1 1239 . 18 1 1 A 107 107 GLY N N 107 110.026 108.743 1.283 1
1 1240 . 18 1 1 A 108 108 PHE H H 108 8.099 8.809 -0.710 1
1 1241 . 18 1 1 A 108 108 PHE HA H 108 4.582 5.078 -0.496 1
1 1245 . 18 1 1 A 108 108 PHE C C 108 173.944 172.742 1.202 1
1 1246 . 18 1 1 A 108 108 PHE CA C 108 58.054 57.441 0.613 1
1 1247 . 18 1 1 A 108 108 PHE CB C 108 39.708 41.257 -1.549 1
1 1248 . 18 1 1 A 108 108 PHE N N 108 120.180 120.000 0.180 1
1 1249 . 18 1 1 A 109 109 ASN H H 109 8.482 7.213 1.269 1
1 1250 . 18 1 1 A 109 109 ASN HA H 109 4.691 5.130 -0.439 1
1 1255 . 18 1 1 A 109 109 ASN C C 109 175.627 175.405 0.222 1
1 1256 . 18 1 1 A 109 109 ASN CA C 109 53.402 51.777 1.625 1
1 1257 . 18 1 1 A 109 109 ASN CB C 109 38.883 40.669 -1.786 1
1 1258 . 18 1 1 A 109 109 ASN N N 109 120.752 121.662 -0.910 1
1 1260 . 18 1 1 A 110 110 THR H H 110 8.112 8.679 -0.567 1
1 1261 . 18 1 1 A 110 110 THR HA H 110 4.251 4.324 -0.073 1
1 1266 . 18 1 1 A 110 110 THR C C 110 175.275 174.302 0.973 1
1 1267 . 18 1 1 A 110 110 THR CA C 110 62.460 63.850 -1.390 1
1 1268 . 18 1 1 A 110 110 THR CB C 110 69.726 69.294 0.432 1
1 1270 . 18 1 1 A 110 110 THR N N 110 114.601 116.071 -1.470 1
1 1271 . 18 1 1 A 111 111 LEU H H 111 8.168 7.570 0.598 1
1 1272 . 18 1 1 A 111 111 LEU HA H 111 4.308 4.564 -0.256 1
1 1282 . 18 1 1 A 111 111 LEU CA C 111 55.704 53.888 1.816 1
1 1283 . 18 1 1 A 111 111 LEU CB C 111 42.071 45.332 -3.261 1
1 1287 . 18 1 1 A 111 111 LEU N N 111 123.756 120.808 2.948 1
1 1288 . 18 1 1 A 112 112 LYS H H 112 8.123 8.638 -0.515 1
1 1289 . 18 1 1 A 112 112 LYS HA H 112 4.242 4.042 0.200 1
1 1298 . 18 1 1 A 112 112 LYS C C 112 177.547 177.518 0.029 1
1 1299 . 18 1 1 A 112 112 LYS CA C 112 56.928 57.275 -0.347 1
1 1300 . 18 1 1 A 112 112 LYS CB C 112 33.055 32.873 0.182 1
1 1304 . 18 1 1 A 112 112 LYS N N 112 121.442 125.365 -3.923 1
1 1305 . 18 1 1 A 113 113 ASP H H 113 8.230 8.967 -0.737 1
1 1306 . 18 1 1 A 113 113 ASP HA H 113 4.526 4.431 0.095 1
1 1309 . 18 1 1 A 113 113 ASP C C 113 176.532 175.759 0.773 1
1 1310 . 18 1 1 A 113 113 ASP CA C 113 54.896 56.723 -1.827 1
1 1311 . 18 1 1 A 113 113 ASP CB C 113 41.362 40.977 0.385 1
1 1312 . 18 1 1 A 113 113 ASP N N 113 120.598 127.439 -6.841 1
1 1313 . 18 1 1 A 114 114 LYS H H 114 8.127 7.741 0.386 1
1 1314 . 18 1 1 A 114 114 LYS HA H 114 4.300 4.837 -0.537 1
1 1323 . 18 1 1 A 114 114 LYS C C 114 176.303 174.940 1.363 1
1 1324 . 18 1 1 A 114 114 LYS CA C 114 56.633 55.600 1.033 1
1 1325 . 18 1 1 A 114 114 LYS CB C 114 32.818 35.466 -2.648 1
1 1329 . 18 1 1 A 114 114 LYS N N 114 120.897 118.291 2.606 1
1 1330 . 18 1 1 A 115 115 LEU H H 115 8.244 8.607 -0.363 1
1 1331 . 18 1 1 A 115 115 LEU HA H 115 4.254 4.453 -0.199 1
1 1341 . 18 1 1 A 115 115 LEU C C 115 176.909 175.365 1.544 1
1 1342 . 18 1 1 A 115 115 LEU CA C 115 56.282 56.192 0.090 1
1 1343 . 18 1 1 A 115 115 LEU CB C 115 42.188 42.094 0.094 1
1 1347 . 18 1 1 A 115 115 LEU N N 115 123.251 127.574 -4.323 1
1 1348 . 18 1 1 A 116 116 GLU H H 116 8.421 8.823 -0.402 1
1 1349 . 18 1 1 A 116 116 GLU HA H 116 4.190 4.896 -0.706 1
1 1352 . 18 1 1 A 116 116 GLU C C 116 177.828 175.793 2.035 1
1 1353 . 18 1 1 A 116 116 GLU CA C 116 57.466 54.626 2.840 1
1 1354 . 18 1 1 A 116 116 GLU CB C 116 30.124 34.216 -4.092 1
1 1355 . 18 1 1 A 116 116 GLU N N 116 120.575 125.069 -4.494 1
1 1356 . 18 1 1 A 117 117 GLU H H 117 8.255 8.711 -0.456 1
1 1357 . 18 1 1 A 117 117 GLU HA H 117 4.192 4.636 -0.444 1
1 1362 . 18 1 1 A 117 117 GLU CA C 117 57.491 56.380 1.111 1
1 1363 . 18 1 1 A 117 117 GLU CB C 117 30.365 31.322 -0.957 1
1 1365 . 18 1 1 A 117 117 GLU N N 117 120.933 118.655 2.278 1
1 1366 . 18 1 1 A 118 118 TRP H H 118 8.143 7.880 0.263 1
1 1367 . 18 1 1 A 118 118 TRP HA H 118 4.581 4.508 0.073 1
1 1372 . 18 1 1 A 118 118 TRP C C 118 176.794 177.564 -0.770 1
1 1373 . 18 1 1 A 118 118 TRP CA C 118 58.363 56.455 1.908 1
1 1374 . 18 1 1 A 118 118 TRP CB C 118 29.333 31.088 -1.755 1
1 1375 . 18 1 1 A 118 118 TRP N N 118 121.592 119.634 1.958 1
1 1376 . 18 1 1 A 119 119 ILE H H 119 7.908 8.598 -0.690 1
1 1377 . 18 1 1 A 119 119 ILE HA H 119 3.828 3.693 0.135 1
1 1387 . 18 1 1 A 119 119 ILE C C 119 176.984 176.737 0.247 1
1 1388 . 18 1 1 A 119 119 ILE CA C 119 62.335 63.782 -1.447 1
1 1389 . 18 1 1 A 119 119 ILE CB C 119 38.649 38.456 0.193 1
1 1393 . 18 1 1 A 119 119 ILE N N 119 122.744 118.147 4.597 1
1 1394 . 18 1 1 A 120 120 GLU H H 120 8.143 7.339 0.804 1
1 1395 . 18 1 1 A 120 120 GLU HA H 120 4.093 2.627 1.466 1
1 1400 . 18 1 1 A 120 120 GLU C C 120 176.565 174.477 2.088 1
1 1401 . 18 1 1 A 120 120 GLU CA C 120 57.613 57.316 0.297 1
1 1402 . 18 1 1 A 120 120 GLU CB C 120 29.834 29.232 0.602 1
1 1404 . 18 1 1 A 120 120 GLU N N 120 123.139 121.485 1.654 1
1 1405 . 18 1 1 A 121 121 MET H H 121 8.254 7.912 0.342 1
1 1406 . 18 1 1 A 121 121 MET HA H 121 4.357 4.537 -0.180 1
1 1411 . 18 1 1 A 121 121 MET CA C 121 56.625 54.096 2.529 1
1 1412 . 18 1 1 A 121 121 MET CB C 121 32.664 34.645 -1.981 1
1 1414 . 18 1 1 A 121 121 MET N N 121 120.449 118.694 1.755 1
1 1415 . 18 1 1 A 122 122 SER H H 122 8.199 8.797 -0.598 1
1 1416 . 18 1 1 A 122 122 SER HA H 122 4.280 4.197 0.083 1
1 1419 . 18 1 1 A 122 122 SER C C 122 177.224 174.725 2.499 1
1 1420 . 18 1 1 A 122 122 SER CA C 122 59.635 61.295 -1.660 1
1 1421 . 18 1 1 A 122 122 SER CB C 122 63.560 62.778 0.782 1
1 1422 . 18 1 1 A 122 122 SER N N 122 115.857 120.308 -4.451 1
1 1423 . 18 1 1 A 123 123 ASN H H 123 8.211 7.984 0.227 1
1 1424 . 18 1 1 A 123 123 ASN HA H 123 4.737 4.979 -0.242 1
1 1429 . 18 1 1 A 123 123 ASN C C 123 174.709 174.352 0.357 1
1 1430 . 18 1 1 A 123 123 ASN CA C 123 53.507 51.855 1.652 1
1 1431 . 18 1 1 A 123 123 ASN CB C 123 38.800 39.485 -0.685 1
1 1432 . 18 1 1 A 123 123 ASN N N 123 119.923 118.898 1.025 1
1 1434 . 18 1 1 A 124 124 ARG H H 124 7.997 7.413 0.584 1
1 1435 . 18 1 1 A 124 124 ARG HA H 124 4.305 4.099 0.206 1
1 1442 . 18 1 1 A 124 124 ARG C C 124 175.477 176.111 -0.634 1
1 1443 . 18 1 1 A 124 124 ARG CA C 124 56.709 56.217 0.492 1
1 1444 . 18 1 1 A 124 124 ARG CB C 124 30.584 30.493 0.091 1
1 1447 . 18 1 1 A 124 124 ARG N N 124 120.821 122.018 -1.197 1
1 1448 . 18 1 1 A 125 125 LYS H H 125 8.327 8.024 0.303 1
1 1449 . 18 1 1 A 125 125 LYS HA H 125 4.254 4.142 0.112 1
1 1458 . 18 1 1 A 125 125 LYS C C 125 176.777 176.303 0.474 1
1 1459 . 18 1 1 A 125 125 LYS CA C 125 56.860 57.153 -0.293 1
1 1460 . 18 1 1 A 125 125 LYS CB C 125 32.879 32.916 -0.037 1
1 1464 . 18 1 1 A 125 125 LYS N N 125 121.891 126.121 -4.230 1
1 1465 . 18 1 1 A 126 126 ASP H H 126 8.343 8.827 -0.484 1
1 1466 . 18 1 1 A 126 126 ASP HA H 126 4.581 4.735 -0.154 1
1 1469 . 18 1 1 A 126 126 ASP C C 126 176.538 175.130 1.408 1
1 1470 . 18 1 1 A 126 126 ASP CA C 126 54.540 52.889 1.651 1
1 1471 . 18 1 1 A 126 126 ASP CB C 126 40.907 38.952 1.955 1
1 1472 . 18 1 1 A 126 126 ASP N N 126 119.814 125.875 -6.061 1
1 1473 . 18 1 1 A 127 127 LEU H H 127 7.946 7.623 0.323 1
1 1474 . 18 1 1 A 127 127 LEU HA H 127 4.309 4.229 0.080 1
1 1484 . 18 1 1 A 127 127 LEU C C 127 176.043 175.497 0.546 1
1 1485 . 18 1 1 A 127 127 LEU CA C 127 55.427 56.367 -0.940 1
1 1486 . 18 1 1 A 127 127 LEU CB C 127 42.394 42.335 0.059 1
1 1490 . 18 1 1 A 127 127 LEU N N 127 121.432 124.394 -2.962 1
1 1491 . 18 1 1 A 128 128 ILE H H 128 7.967 8.832 -0.865 1
1 1492 . 18 1 1 A 128 128 ILE HA H 128 4.141 4.887 -0.746 1
1 1502 . 18 1 1 A 128 128 ILE C C 128 177.200 174.404 2.796 1
1 1503 . 18 1 1 A 128 128 ILE CA C 128 61.150 58.362 2.788 1
1 1504 . 18 1 1 A 128 128 ILE CB C 128 38.489 42.241 -3.752 1
1 1508 . 18 1 1 A 128 128 ILE N N 128 121.579 121.297 0.282 1
1 1509 . 18 1 1 A 129 129 LYS H H 129 8.331 8.415 -0.084 1
1 1510 . 18 1 1 A 129 129 LYS HA H 129 4.328 4.370 -0.042 1
1 1519 . 18 1 1 A 129 129 LYS C C 129 175.952 176.241 -0.289 1
1 1520 . 18 1 1 A 129 129 LYS CA C 129 56.330 55.474 0.856 1
1 1521 . 18 1 1 A 129 129 LYS CB C 129 33.010 31.127 1.883 1
1 1525 . 18 1 1 A 129 129 LYS N N 129 126.955 124.177 2.778 1
1 1 . 19 1 1 A 2 2 ALA HA H 2 4.070 4.170 -0.100 1
1 5 . 19 1 1 A 2 2 ALA CA C 2 52.067 53.921 -1.854 1
1 6 . 19 1 1 A 2 2 ALA CB C 2 19.577 19.144 0.433 1
1 7 . 19 1 1 A 3 3 ALA H H 3 8.714 7.453 1.261 1
1 8 . 19 1 1 A 3 3 ALA HA H 3 4.253 4.582 -0.329 1
1 12 . 19 1 1 A 3 3 ALA C C 3 173.672 177.199 -3.527 1
1 13 . 19 1 1 A 3 3 ALA CA C 3 52.067 50.654 1.413 1
1 14 . 19 1 1 A 3 3 ALA CB C 3 19.577 21.906 -2.329 1
1 15 . 19 1 1 A 3 3 ALA N N 3 124.480 116.967 7.513 1
1 16 . 19 1 1 A 4 4 LYS H H 4 8.227 8.604 -0.377 1
1 17 . 19 1 1 A 4 4 LYS HA H 4 3.976 3.966 0.010 1
1 26 . 19 1 1 A 4 4 LYS C C 4 176.672 176.788 -0.116 1
1 27 . 19 1 1 A 4 4 LYS CA C 4 57.274 58.297 -1.023 1
1 28 . 19 1 1 A 4 4 LYS CB C 4 33.209 31.786 1.423 1
1 32 . 19 1 1 A 4 4 LYS N N 4 120.988 117.144 3.844 1
1 33 . 19 1 1 A 5 5 PHE H H 5 7.719 7.437 0.282 1
1 34 . 19 1 1 A 5 5 PHE HA H 5 4.384 4.684 -0.300 1
1 38 . 19 1 1 A 5 5 PHE C C 5 175.364 175.431 -0.067 1
1 39 . 19 1 1 A 5 5 PHE CA C 5 57.074 59.045 -1.971 1
1 40 . 19 1 1 A 5 5 PHE CB C 5 39.669 40.206 -0.537 1
1 41 . 19 1 1 A 5 5 PHE N N 5 119.246 120.173 -0.927 1
1 42 . 19 1 1 A 6 6 GLU H H 6 8.515 8.951 -0.436 1
1 43 . 19 1 1 A 6 6 GLU HA H 6 4.370 4.835 -0.465 1
1 48 . 19 1 1 A 6 6 GLU CA C 6 55.669 55.360 0.309 1
1 49 . 19 1 1 A 6 6 GLU CB C 6 32.094 34.006 -1.912 1
1 51 . 19 1 1 A 6 6 GLU N N 6 122.193 121.828 0.365 1
1 52 . 19 1 1 A 7 7 VAL H H 7 8.636 8.479 0.157 1
1 53 . 19 1 1 A 7 7 VAL HA H 7 3.406 3.937 -0.531 1
1 61 . 19 1 1 A 7 7 VAL C C 7 176.611 176.350 0.261 1
1 62 . 19 1 1 A 7 7 VAL CA C 7 65.358 63.382 1.976 1
1 63 . 19 1 1 A 7 7 VAL CB C 7 31.391 31.366 0.025 1
1 66 . 19 1 1 A 7 7 VAL N N 7 122.949 123.407 -0.458 1
1 67 . 19 1 1 A 8 8 GLY H H 8 9.394 9.108 0.286 1
1 68 . 19 1 1 A 8 8 GLY HA2 H 8 3.600 4.052 -0.452 1
1 69 . 19 1 1 A 8 8 GLY HA3 H 8 4.546 4.053 0.493 1
1 70 . 19 1 1 A 8 8 GLY C C 8 178.074 174.386 3.688 1
1 71 . 19 1 1 A 8 8 GLY CA C 8 45.121 44.906 0.215 1
1 72 . 19 1 1 A 8 8 GLY N N 8 116.837 115.297 1.540 1
1 73 . 19 1 1 A 9 9 SER H H 9 8.021 7.991 0.030 1
1 74 . 19 1 1 A 9 9 SER HA H 9 4.680 4.425 0.255 1
1 77 . 19 1 1 A 9 9 SER C C 9 174.234 173.133 1.101 1
1 78 . 19 1 1 A 9 9 SER CA C 9 59.387 59.209 0.178 1
1 79 . 19 1 1 A 9 9 SER CB C 9 65.584 64.558 1.026 1
1 80 . 19 1 1 A 9 9 SER N N 9 118.208 117.869 0.339 1
1 81 . 19 1 1 A 10 10 VAL H H 10 7.945 8.064 -0.119 1
1 82 . 19 1 1 A 10 10 VAL HA H 10 4.980 5.114 -0.134 1
1 90 . 19 1 1 A 10 10 VAL C C 10 171.388 174.131 -2.743 1
1 91 . 19 1 1 A 10 10 VAL CA C 10 61.021 61.037 -0.016 1
1 92 . 19 1 1 A 10 10 VAL CB C 10 33.400 34.871 -1.471 1
1 95 . 19 1 1 A 10 10 VAL N N 10 121.118 122.347 -1.229 1
1 96 . 19 1 1 A 11 11 TYR H H 11 9.008 9.094 -0.086 1
1 97 . 19 1 1 A 11 11 TYR HA H 11 4.850 5.305 -0.455 1
1 101 . 19 1 1 A 11 11 TYR C C 11 174.926 174.697 0.229 1
1 102 . 19 1 1 A 11 11 TYR CA C 11 56.803 56.360 0.443 1
1 103 . 19 1 1 A 11 11 TYR CB C 11 43.676 43.881 -0.205 1
1 104 . 19 1 1 A 11 11 TYR N N 11 125.043 125.316 -0.273 1
1 105 . 19 1 1 A 12 12 THR H H 12 8.809 8.650 0.159 1
1 106 . 19 1 1 A 12 12 THR HA H 12 5.020 5.475 -0.455 1
1 111 . 19 1 1 A 12 12 THR C C 12 174.195 174.870 -0.675 1
1 112 . 19 1 1 A 12 12 THR CA C 12 62.487 59.998 2.489 1
1 113 . 19 1 1 A 12 12 THR CB C 12 69.743 72.050 -2.307 1
1 115 . 19 1 1 A 12 12 THR N N 12 116.850 115.336 1.514 1
1 116 . 19 1 1 A 13 13 GLY H H 13 9.179 8.493 0.686 1
1 117 . 19 1 1 A 13 13 GLY HA2 H 13 3.250 4.345 -1.095 1
1 118 . 19 1 1 A 13 13 GLY HA3 H 13 4.801 4.358 0.443 1
1 119 . 19 1 1 A 13 13 GLY C C 13 174.654 171.846 2.808 1
1 120 . 19 1 1 A 13 13 GLY CA C 13 44.377 45.464 -1.087 1
1 121 . 19 1 1 A 13 13 GLY N N 13 113.654 111.587 2.067 1
1 122 . 19 1 1 A 14 14 LYS H H 14 7.770 8.210 -0.440 1
1 123 . 19 1 1 A 14 14 LYS HA H 14 5.426 5.153 0.273 1
1 132 . 19 1 1 A 14 14 LYS C C 14 171.343 175.773 -4.430 1
1 133 . 19 1 1 A 14 14 LYS CA C 14 53.879 54.636 -0.757 1
1 134 . 19 1 1 A 14 14 LYS CB C 14 36.032 35.759 0.273 1
1 138 . 19 1 1 A 14 14 LYS N N 14 118.322 120.583 -2.261 1
1 139 . 19 1 1 A 15 15 VAL H H 15 9.206 9.293 -0.087 1
1 140 . 19 1 1 A 15 15 VAL HA H 15 4.400 4.258 0.142 1
1 148 . 19 1 1 A 15 15 VAL C C 15 176.306 176.884 -0.578 1
1 149 . 19 1 1 A 15 15 VAL CA C 15 63.648 63.374 0.274 1
1 150 . 19 1 1 A 15 15 VAL CB C 15 31.769 31.451 0.318 1
1 153 . 19 1 1 A 15 15 VAL N N 15 125.308 123.758 1.550 1
1 154 . 19 1 1 A 16 16 THR H H 16 9.403 9.219 0.184 1
1 155 . 19 1 1 A 16 16 THR HA H 16 4.562 4.685 -0.123 1
1 160 . 19 1 1 A 16 16 THR C C 16 178.098 174.757 3.341 1
1 161 . 19 1 1 A 16 16 THR CA C 16 62.018 61.858 0.160 1
1 162 . 19 1 1 A 16 16 THR CB C 16 69.720 69.765 -0.045 1
1 164 . 19 1 1 A 16 16 THR N N 16 121.753 117.974 3.779 1
1 165 . 19 1 1 A 17 17 GLY H H 17 7.600 7.084 0.516 1
1 166 . 19 1 1 A 17 17 GLY HA2 H 17 4.110 4.128 -0.018 1
1 167 . 19 1 1 A 17 17 GLY HA3 H 17 4.250 4.251 -0.001 1
1 168 . 19 1 1 A 17 17 GLY C C 17 175.551 171.362 4.189 1
1 169 . 19 1 1 A 17 17 GLY CA C 17 46.258 45.592 0.666 1
1 170 . 19 1 1 A 17 17 GLY N N 17 109.407 108.754 0.653 1
1 171 . 19 1 1 A 18 18 LEU H H 18 8.820 8.463 0.357 1
1 172 . 19 1 1 A 18 18 LEU HA H 18 4.852 5.048 -0.196 1
1 182 . 19 1 1 A 18 18 LEU CA C 18 54.245 53.254 0.991 1
1 183 . 19 1 1 A 18 18 LEU CB C 18 44.906 46.307 -1.401 1
1 187 . 19 1 1 A 18 18 LEU N N 18 123.419 121.479 1.940 1
1 188 . 19 1 1 A 19 19 GLN H H 19 8.537 8.200 0.337 1
1 189 . 19 1 1 A 19 19 GLN HA H 19 4.520 4.735 -0.215 1
1 196 . 19 1 1 A 19 19 GLN C C 19 175.258 175.732 -0.474 1
1 197 . 19 1 1 A 19 19 GLN CA C 19 53.269 54.067 -0.798 1
1 198 . 19 1 1 A 19 19 GLN CB C 19 31.522 32.686 -1.164 1
1 200 . 19 1 1 A 19 19 GLN N N 19 120.187 121.222 -1.035 1
1 202 . 19 1 1 A 20 20 ALA H H 20 8.798 8.809 -0.011 1
1 203 . 19 1 1 A 20 20 ALA HA H 20 4.010 4.020 -0.010 1
1 207 . 19 1 1 A 20 20 ALA C C 20 175.698 177.942 -2.244 1
1 208 . 19 1 1 A 20 20 ALA CA C 20 55.084 54.868 0.216 1
1 209 . 19 1 1 A 20 20 ALA CB C 20 18.277 18.475 -0.198 1
1 210 . 19 1 1 A 20 20 ALA N N 20 120.606 124.407 -3.801 1
1 211 . 19 1 1 A 21 21 TYR H H 21 6.618 8.171 -1.553 1
1 212 . 19 1 1 A 21 21 TYR HA H 21 4.540 4.574 -0.034 1
1 216 . 19 1 1 A 21 21 TYR C C 21 178.437 175.559 2.878 1
1 217 . 19 1 1 A 21 21 TYR CA C 21 55.120 59.320 -4.200 1
1 218 . 19 1 1 A 21 21 TYR CB C 21 37.891 40.051 -2.160 1
1 219 . 19 1 1 A 21 21 TYR N N 21 105.570 118.888 -13.318 1
1 220 . 19 1 1 A 22 22 GLY H H 22 7.203 7.242 -0.039 1
1 221 . 19 1 1 A 22 22 GLY HA2 H 22 3.460 3.958 -0.498 1
1 222 . 19 1 1 A 22 22 GLY HA3 H 22 4.360 4.007 0.353 1
1 223 . 19 1 1 A 22 22 GLY C C 22 175.833 171.457 4.376 1
1 224 . 19 1 1 A 22 22 GLY CA C 22 46.356 45.267 1.089 1
1 225 . 19 1 1 A 22 22 GLY N N 22 109.854 107.194 2.660 1
1 226 . 19 1 1 A 23 23 ALA H H 23 8.549 8.380 0.169 1
1 227 . 19 1 1 A 23 23 ALA HA H 23 4.981 5.214 -0.233 1
1 231 . 19 1 1 A 23 23 ALA C C 23 168.810 175.923 -7.113 1
1 232 . 19 1 1 A 23 23 ALA CA C 23 49.178 50.583 -1.405 1
1 233 . 19 1 1 A 23 23 ALA CB C 23 22.797 21.426 1.371 1
1 234 . 19 1 1 A 23 23 ALA N N 23 118.749 122.999 -4.250 1
1 235 . 19 1 1 A 24 24 PHE H H 24 8.812 8.562 0.250 1
1 236 . 19 1 1 A 24 24 PHE HA H 24 5.125 4.967 0.158 1
1 240 . 19 1 1 A 24 24 PHE CA C 24 58.017 58.071 -0.054 1
1 241 . 19 1 1 A 24 24 PHE CB C 24 40.475 40.521 -0.046 1
1 242 . 19 1 1 A 24 24 PHE N N 24 122.891 121.656 1.235 1
1 243 . 19 1 1 A 25 25 VAL H H 25 8.880 8.796 0.084 1
1 244 . 19 1 1 A 25 25 VAL HA H 25 4.660 4.776 -0.116 1
1 252 . 19 1 1 A 25 25 VAL CA C 25 60.379 60.978 -0.599 1
1 253 . 19 1 1 A 25 25 VAL CB C 25 35.654 35.325 0.329 1
1 256 . 19 1 1 A 25 25 VAL N N 25 122.908 121.113 1.795 1
1 257 . 19 1 1 A 26 26 ALA H H 26 9.403 9.131 0.272 1
1 258 . 19 1 1 A 26 26 ALA HA H 26 4.750 4.353 0.397 1
1 262 . 19 1 1 A 26 26 ALA C C 26 174.445 176.787 -2.342 1
1 263 . 19 1 1 A 26 26 ALA CA C 26 51.711 52.909 -1.198 1
1 264 . 19 1 1 A 26 26 ALA CB C 26 19.319 19.055 0.264 1
1 265 . 19 1 1 A 26 26 ALA N N 26 129.425 129.982 -0.557 1
1 266 . 19 1 1 A 27 27 LEU H H 27 8.601 9.016 -0.415 1
1 267 . 19 1 1 A 27 27 LEU HA H 27 4.158 4.569 -0.411 1
1 277 . 19 1 1 A 27 27 LEU C C 27 177.814 176.409 1.405 1
1 278 . 19 1 1 A 27 27 LEU CA C 27 55.869 55.684 0.185 1
1 279 . 19 1 1 A 27 27 LEU CB C 27 42.251 43.817 -1.566 1
1 283 . 19 1 1 A 27 27 LEU N N 27 127.169 122.533 4.636 1
1 284 . 19 1 1 A 28 28 ASP H H 28 8.172 8.019 0.153 1
1 285 . 19 1 1 A 28 28 ASP HA H 28 4.420 4.919 -0.499 1
1 288 . 19 1 1 A 28 28 ASP C C 28 177.116 175.734 1.382 1
1 289 . 19 1 1 A 28 28 ASP CA C 28 53.755 53.599 0.156 1
1 290 . 19 1 1 A 28 28 ASP CB C 28 39.833 44.136 -4.303 1
1 291 . 19 1 1 A 28 28 ASP N N 28 115.657 115.644 0.013 1
1 292 . 19 1 1 A 29 29 GLU H H 29 8.857 9.095 -0.238 1
1 293 . 19 1 1 A 29 29 GLU HA H 29 4.090 4.083 0.007 1
1 298 . 19 1 1 A 29 29 GLU C C 29 175.965 176.502 -0.537 1
1 299 . 19 1 1 A 29 29 GLU CA C 29 59.470 58.546 0.924 1
1 300 . 19 1 1 A 29 29 GLU CB C 29 29.409 28.907 0.502 1
1 302 . 19 1 1 A 29 29 GLU N N 29 114.738 122.669 -7.931 1
1 303 . 19 1 1 A 30 30 GLU H H 30 8.326 8.123 0.203 1
1 304 . 19 1 1 A 30 30 GLU HA H 30 4.640 4.577 0.063 1
1 309 . 19 1 1 A 30 30 GLU C C 30 176.817 176.818 -0.001 1
1 310 . 19 1 1 A 30 30 GLU CA C 30 56.073 55.806 0.267 1
1 311 . 19 1 1 A 30 30 GLU CB C 30 32.453 30.748 1.705 1
1 313 . 19 1 1 A 30 30 GLU N N 30 115.753 119.272 -3.519 1
1 314 . 19 1 1 A 31 31 THR H H 31 7.819 7.852 -0.033 1
1 315 . 19 1 1 A 31 31 THR HA H 31 4.484 4.622 -0.138 1
1 320 . 19 1 1 A 31 31 THR C C 31 176.330 174.118 2.212 1
1 321 . 19 1 1 A 31 31 THR CA C 31 63.398 61.423 1.975 1
1 322 . 19 1 1 A 31 31 THR CB C 31 69.367 70.613 -1.246 1
1 324 . 19 1 1 A 31 31 THR N N 31 118.750 111.379 7.371 1
1 325 . 19 1 1 A 32 32 GLN H H 32 8.913 7.332 1.581 1
1 326 . 19 1 1 A 32 32 GLN HA H 32 5.337 4.209 1.128 1
1 333 . 19 1 1 A 32 32 GLN C C 32 173.087 175.989 -2.902 1
1 334 . 19 1 1 A 32 32 GLN CA C 32 54.051 55.446 -1.395 1
1 335 . 19 1 1 A 32 32 GLN CB C 32 32.672 29.225 3.447 1
1 337 . 19 1 1 A 32 32 GLN N N 32 127.294 121.221 6.073 1
1 339 . 19 1 1 A 33 33 GLY H H 33 8.900 8.635 0.265 1
1 340 . 19 1 1 A 33 33 GLY HA2 H 33 3.290 4.326 -1.036 1
1 341 . 19 1 1 A 33 33 GLY HA3 H 33 4.530 4.364 0.166 1
1 342 . 19 1 1 A 33 33 GLY C C 33 174.918 172.283 2.635 1
1 343 . 19 1 1 A 33 33 GLY CA C 33 44.534 45.059 -0.525 1
1 344 . 19 1 1 A 33 33 GLY N N 33 107.639 108.165 -0.526 1
1 345 . 19 1 1 A 34 34 LEU H H 34 8.127 8.498 -0.371 1
1 346 . 19 1 1 A 34 34 LEU HA H 34 4.950 5.146 -0.196 1
1 356 . 19 1 1 A 34 34 LEU CA C 34 53.755 54.176 -0.421 1
1 357 . 19 1 1 A 34 34 LEU CB C 34 45.493 45.445 0.048 1
1 361 . 19 1 1 A 34 34 LEU N N 34 120.897 120.999 -0.102 1
1 362 . 19 1 1 A 35 35 VAL H H 35 9.386 9.014 0.372 1
1 363 . 19 1 1 A 35 35 VAL HA H 35 4.479 4.379 0.100 1
1 371 . 19 1 1 A 35 35 VAL C C 35 176.402 175.419 0.983 1
1 372 . 19 1 1 A 35 35 VAL CA C 35 59.594 62.513 -2.919 1
1 373 . 19 1 1 A 35 35 VAL CB C 35 32.590 31.996 0.594 1
1 376 . 19 1 1 A 35 35 VAL N N 35 128.897 128.597 0.300 1
1 377 . 19 1 1 A 36 36 HIS H H 36 9.194 8.863 0.331 1
1 378 . 19 1 1 A 36 36 HIS HA H 36 4.487 4.504 -0.017 1
1 381 . 19 1 1 A 36 36 HIS C C 36 174.864 176.273 -1.409 1
1 382 . 19 1 1 A 36 36 HIS CA C 36 59.426 56.789 2.637 1
1 383 . 19 1 1 A 36 36 HIS CB C 36 31.542 30.609 0.933 1
1 384 . 19 1 1 A 36 36 HIS N N 36 127.751 126.947 0.804 1
1 385 . 19 1 1 A 37 37 ILE H H 37 7.454 8.424 -0.970 1
1 386 . 19 1 1 A 37 37 ILE HA H 37 3.810 3.478 0.332 1
1 396 . 19 1 1 A 37 37 ILE C C 37 176.948 177.603 -0.655 1
1 397 . 19 1 1 A 37 37 ILE CA C 37 63.773 64.514 -0.741 1
1 398 . 19 1 1 A 37 37 ILE CB C 37 38.993 37.267 1.726 1
1 402 . 19 1 1 A 37 37 ILE N N 37 126.266 126.870 -0.604 1
1 403 . 19 1 1 A 38 38 SER H H 38 8.343 7.249 1.094 1
1 404 . 19 1 1 A 38 38 SER HA H 38 4.370 4.055 0.315 1
1 407 . 19 1 1 A 38 38 SER C C 38 174.792 174.922 -0.130 1
1 408 . 19 1 1 A 38 38 SER CA C 38 60.567 60.080 0.487 1
1 409 . 19 1 1 A 38 38 SER CB C 38 63.632 62.694 0.938 1
1 410 . 19 1 1 A 38 38 SER N N 38 118.079 117.456 0.623 1
1 411 . 19 1 1 A 39 39 GLU H H 39 8.536 7.921 0.615 1
1 412 . 19 1 1 A 39 39 GLU HA H 39 4.503 4.394 0.109 1
1 417 . 19 1 1 A 39 39 GLU C C 39 175.131 176.938 -1.807 1
1 418 . 19 1 1 A 39 39 GLU CA C 39 54.928 56.044 -1.116 1
1 419 . 19 1 1 A 39 39 GLU CB C 39 29.621 30.540 -0.919 1
1 421 . 19 1 1 A 39 39 GLU N N 39 118.349 118.545 -0.196 1
1 422 . 19 1 1 A 40 40 VAL H H 40 7.776 7.595 0.181 1
1 423 . 19 1 1 A 40 40 VAL HA H 40 3.616 3.869 -0.253 1
1 431 . 19 1 1 A 40 40 VAL C C 40 177.277 175.899 1.378 1
1 432 . 19 1 1 A 40 40 VAL CA C 40 66.245 64.106 2.139 1
1 433 . 19 1 1 A 40 40 VAL CB C 40 32.590 32.183 0.407 1
1 436 . 19 1 1 A 40 40 VAL N N 40 125.443 117.279 8.164 1
1 437 . 19 1 1 A 41 41 THR H H 41 7.888 7.491 0.397 1
1 438 . 19 1 1 A 41 41 THR HA H 41 4.345 4.606 -0.261 1
1 443 . 19 1 1 A 41 41 THR C C 41 173.492 173.971 -0.479 1
1 444 . 19 1 1 A 41 41 THR CA C 41 59.047 60.944 -1.897 1
1 445 . 19 1 1 A 41 41 THR CB C 41 68.992 72.407 -3.415 1
1 447 . 19 1 1 A 41 41 THR N N 41 109.905 112.729 -2.824 1
1 448 . 19 1 1 A 42 42 HIS H H 42 8.063 8.626 -0.563 1
1 449 . 19 1 1 A 42 42 HIS HA H 42 4.510 4.249 0.261 1
1 452 . 19 1 1 A 42 42 HIS C C 42 172.139 175.188 -3.049 1
1 453 . 19 1 1 A 42 42 HIS CA C 42 57.735 57.871 -0.136 1
1 454 . 19 1 1 A 42 42 HIS CB C 42 31.144 29.599 1.545 1
1 455 . 19 1 1 A 42 42 HIS N N 42 121.760 121.796 -0.036 1
1 456 . 19 1 1 A 43 43 GLY H H 43 8.286 7.272 1.014 1
1 457 . 19 1 1 A 43 43 GLY HA2 H 43 3.980 3.821 0.159 1
1 458 . 19 1 1 A 43 43 GLY HA3 H 43 3.980 3.933 0.047 1
1 459 . 19 1 1 A 43 43 GLY C C 43 176.307 175.030 1.277 1
1 460 . 19 1 1 A 43 43 GLY CA C 43 44.336 45.477 -1.141 1
1 461 . 19 1 1 A 43 43 GLY N N 43 110.133 105.663 4.470 1
1 462 . 19 1 1 A 44 44 PHE H H 44 8.327 8.190 0.137 1
1 463 . 19 1 1 A 44 44 PHE HA H 44 4.489 4.462 0.027 1
1 467 . 19 1 1 A 44 44 PHE C C 44 171.877 175.597 -3.720 1
1 468 . 19 1 1 A 44 44 PHE CA C 44 58.027 57.953 0.074 1
1 469 . 19 1 1 A 44 44 PHE CB C 44 39.850 38.863 0.987 1
1 470 . 19 1 1 A 44 44 PHE N N 44 120.049 118.119 1.930 1
1 471 . 19 1 1 A 45 45 VAL H H 45 7.939 6.805 1.134 1
1 472 . 19 1 1 A 45 45 VAL HA H 45 3.865 2.774 1.091 1
1 480 . 19 1 1 A 45 45 VAL C C 45 175.523 175.566 -0.043 1
1 481 . 19 1 1 A 45 45 VAL CA C 45 61.536 63.044 -1.508 1
1 482 . 19 1 1 A 45 45 VAL CB C 45 33.127 31.108 2.019 1
1 485 . 19 1 1 A 45 45 VAL N N 45 127.882 121.344 6.538 1
1 486 . 19 1 1 A 46 46 LYS H H 46 8.868 8.961 -0.093 1
1 487 . 19 1 1 A 46 46 LYS HA H 46 4.170 4.103 0.067 1
1 496 . 19 1 1 A 46 46 LYS C C 46 175.728 176.175 -0.447 1
1 497 . 19 1 1 A 46 46 LYS CA C 46 57.198 58.545 -1.347 1
1 498 . 19 1 1 A 46 46 LYS CB C 46 33.299 33.018 0.281 1
1 502 . 19 1 1 A 46 46 LYS N N 46 127.308 128.170 -0.862 1
1 503 . 19 1 1 A 47 47 ASP H H 47 7.652 7.934 -0.282 1
1 504 . 19 1 1 A 47 47 ASP HA H 47 4.710 4.880 -0.170 1
1 507 . 19 1 1 A 47 47 ASP C C 47 176.411 175.997 0.414 1
1 508 . 19 1 1 A 47 47 ASP CA C 47 53.390 53.829 -0.439 1
1 509 . 19 1 1 A 47 47 ASP CB C 47 42.635 44.218 -1.583 1
1 510 . 19 1 1 A 47 47 ASP N N 47 117.932 114.979 2.953 1
1 511 . 19 1 1 A 48 48 ILE H H 48 9.230 8.638 0.592 1
1 512 . 19 1 1 A 48 48 ILE HA H 48 3.579 3.848 -0.269 1
1 522 . 19 1 1 A 48 48 ILE C C 48 177.249 177.831 -0.582 1
1 523 . 19 1 1 A 48 48 ILE CA C 48 65.525 63.699 1.826 1
1 524 . 19 1 1 A 48 48 ILE CB C 48 38.797 37.960 0.837 1
1 528 . 19 1 1 A 48 48 ILE N N 48 129.049 125.423 3.626 1
1 529 . 19 1 1 A 49 49 ASN H H 49 8.468 8.396 0.072 1
1 530 . 19 1 1 A 49 49 ASN HA H 49 4.690 4.679 0.011 1
1 535 . 19 1 1 A 49 49 ASN C C 49 175.779 176.303 -0.524 1
1 536 . 19 1 1 A 49 49 ASN CA C 49 55.587 55.429 0.158 1
1 537 . 19 1 1 A 49 49 ASN CB C 49 38.587 37.898 0.689 1
1 538 . 19 1 1 A 49 49 ASN N N 49 118.835 119.729 -0.894 1
1 540 . 19 1 1 A 50 50 GLU H H 50 7.853 7.993 -0.140 1
1 541 . 19 1 1 A 50 50 GLU HA H 50 4.040 4.438 -0.398 1
1 546 . 19 1 1 A 50 50 GLU C C 50 176.148 178.156 -2.008 1
1 547 . 19 1 1 A 50 50 GLU CA C 50 57.404 57.727 -0.323 1
1 548 . 19 1 1 A 50 50 GLU CB C 50 29.491 30.424 -0.933 1
1 550 . 19 1 1 A 50 50 GLU N N 50 116.358 117.981 -1.623 1
1 551 . 19 1 1 A 51 51 HIS H H 51 7.575 7.938 -0.363 1
1 552 . 19 1 1 A 51 51 HIS HA H 51 4.431 4.514 -0.083 1
1 555 . 19 1 1 A 51 51 HIS C C 51 176.383 175.185 1.198 1
1 556 . 19 1 1 A 51 51 HIS CA C 51 57.089 57.358 -0.269 1
1 557 . 19 1 1 A 51 51 HIS CB C 51 33.168 30.319 2.849 1
1 558 . 19 1 1 A 51 51 HIS N N 51 115.828 115.462 0.366 1
1 559 . 19 1 1 A 52 52 LEU H H 52 7.640 7.514 0.126 1
1 560 . 19 1 1 A 52 52 LEU HA H 52 4.796 4.820 -0.024 1
1 570 . 19 1 1 A 52 52 LEU C C 52 174.452 175.068 -0.616 1
1 571 . 19 1 1 A 52 52 LEU CA C 52 53.398 53.447 -0.049 1
1 572 . 19 1 1 A 52 52 LEU CB C 52 48.805 47.493 1.312 1
1 576 . 19 1 1 A 52 52 LEU N N 52 117.932 119.377 -1.445 1
1 577 . 19 1 1 A 53 53 SER H H 53 8.151 8.848 -0.697 1
1 578 . 19 1 1 A 53 53 SER HA H 53 4.680 4.991 -0.311 1
1 581 . 19 1 1 A 53 53 SER C C 53 174.304 172.846 1.458 1
1 582 . 19 1 1 A 53 53 SER CA C 53 56.714 57.455 -0.741 1
1 583 . 19 1 1 A 53 53 SER CB C 53 65.431 66.387 -0.956 1
1 584 . 19 1 1 A 53 53 SER N N 53 113.496 117.405 -3.909 1
1 585 . 19 1 1 A 54 54 VAL H H 54 8.782 8.570 0.212 1
1 586 . 19 1 1 A 54 54 VAL HA H 54 3.230 3.802 -0.572 1
1 594 . 19 1 1 A 54 54 VAL C C 54 173.745 177.176 -3.431 1
1 595 . 19 1 1 A 54 54 VAL CA C 54 66.232 63.659 2.573 1
1 596 . 19 1 1 A 54 54 VAL CB C 54 31.067 31.753 -0.686 1
1 599 . 19 1 1 A 54 54 VAL N N 54 124.401 126.250 -1.849 1
1 600 . 19 1 1 A 55 55 GLY H H 55 9.079 9.042 0.037 1
1 601 . 19 1 1 A 55 55 GLY HA2 H 55 3.530 3.869 -0.339 1
1 602 . 19 1 1 A 55 55 GLY HA3 H 55 4.553 3.871 0.682 1
1 603 . 19 1 1 A 55 55 GLY C C 55 177.219 173.327 3.892 1
1 604 . 19 1 1 A 55 55 GLY CA C 55 44.647 46.361 -1.714 1
1 605 . 19 1 1 A 55 55 GLY N N 55 117.320 115.945 1.375 1
1 606 . 19 1 1 A 56 56 ASP H H 56 7.943 7.762 0.181 1
1 607 . 19 1 1 A 56 56 ASP HA H 56 4.460 5.157 -0.697 1
1 610 . 19 1 1 A 56 56 ASP C C 56 176.055 173.836 2.219 1
1 611 . 19 1 1 A 56 56 ASP CA C 56 55.456 52.399 3.057 1
1 612 . 19 1 1 A 56 56 ASP CB C 56 40.914 44.528 -3.614 1
1 613 . 19 1 1 A 56 56 ASP N N 56 121.782 119.732 2.050 1
1 614 . 19 1 1 A 57 57 GLU H H 57 8.649 8.849 -0.200 1
1 615 . 19 1 1 A 57 57 GLU HA H 57 5.100 5.238 -0.138 1
1 620 . 19 1 1 A 57 57 GLU C C 57 175.635 175.687 -0.052 1
1 621 . 19 1 1 A 57 57 GLU CA C 57 55.805 55.505 0.300 1
1 622 . 19 1 1 A 57 57 GLU CB C 57 30.915 31.769 -0.854 1
1 624 . 19 1 1 A 57 57 GLU N N 57 122.513 123.902 -1.389 1
1 625 . 19 1 1 A 58 58 VAL H H 58 8.809 9.085 -0.276 1
1 626 . 19 1 1 A 58 58 VAL HA H 58 4.817 4.795 0.022 1
1 634 . 19 1 1 A 58 58 VAL C C 58 176.528 174.115 2.413 1
1 635 . 19 1 1 A 58 58 VAL CA C 58 58.719 59.335 -0.616 1
1 636 . 19 1 1 A 58 58 VAL CB C 58 35.523 35.842 -0.319 1
1 639 . 19 1 1 A 58 58 VAL N N 58 118.382 119.754 -1.372 1
1 640 . 19 1 1 A 59 59 GLN H H 59 8.255 8.716 -0.461 1
1 641 . 19 1 1 A 59 59 GLN HA H 59 5.030 4.846 0.184 1
1 646 . 19 1 1 A 59 59 GLN CA C 59 54.843 55.581 -0.738 1
1 647 . 19 1 1 A 59 59 GLN CB C 59 30.111 30.053 0.058 1
1 649 . 19 1 1 A 59 59 GLN N N 59 120.933 124.406 -3.473 1
1 650 . 19 1 1 A 60 60 VAL H H 60 8.970 9.255 -0.285 1
1 651 . 19 1 1 A 60 60 VAL HA H 60 4.990 4.940 0.050 1
1 659 . 19 1 1 A 60 60 VAL C C 60 175.203 173.811 1.392 1
1 660 . 19 1 1 A 60 60 VAL CA C 60 57.404 58.934 -1.530 1
1 661 . 19 1 1 A 60 60 VAL CB C 60 35.771 35.419 0.352 1
1 664 . 19 1 1 A 60 60 VAL N N 60 111.046 120.657 -9.611 1
1 665 . 19 1 1 A 61 61 LYS H H 61 8.937 8.751 0.186 1
1 666 . 19 1 1 A 61 61 LYS HA H 61 5.100 5.043 0.057 1
1 675 . 19 1 1 A 61 61 LYS C C 61 173.610 176.230 -2.620 1
1 676 . 19 1 1 A 61 61 LYS CA C 61 53.762 54.862 -1.100 1
1 677 . 19 1 1 A 61 61 LYS CB C 61 36.273 34.704 1.569 1
1 681 . 19 1 1 A 61 61 LYS N N 61 121.930 123.033 -1.103 1
1 682 . 19 1 1 A 62 62 VAL H H 62 8.429 9.337 -0.908 1
1 683 . 19 1 1 A 62 62 VAL HA H 62 4.074 4.074 0.000 1
1 691 . 19 1 1 A 62 62 VAL C C 62 176.912 175.916 0.996 1
1 692 . 19 1 1 A 62 62 VAL CA C 62 63.188 63.687 -0.499 1
1 693 . 19 1 1 A 62 62 VAL CB C 62 30.813 31.380 -0.567 1
1 696 . 19 1 1 A 62 62 VAL N N 62 126.329 127.180 -0.851 1
1 697 . 19 1 1 A 63 63 LEU H H 63 9.109 9.215 -0.106 1
1 698 . 19 1 1 A 63 63 LEU HA H 63 4.423 4.483 -0.060 1
1 708 . 19 1 1 A 63 63 LEU C C 63 176.091 176.209 -0.118 1
1 709 . 19 1 1 A 63 63 LEU CA C 63 55.876 56.257 -0.381 1
1 710 . 19 1 1 A 63 63 LEU CB C 63 42.800 43.887 -1.087 1
1 714 . 19 1 1 A 63 63 LEU N N 63 129.436 129.952 -0.516 1
1 715 . 19 1 1 A 64 64 ALA H H 64 7.594 7.379 0.215 1
1 716 . 19 1 1 A 64 64 ALA HA H 64 4.455 4.725 -0.270 1
1 720 . 19 1 1 A 64 64 ALA C C 64 177.314 174.975 2.339 1
1 721 . 19 1 1 A 64 64 ALA CA C 64 52.557 51.748 0.809 1
1 722 . 19 1 1 A 64 64 ALA CB C 64 21.458 22.683 -1.225 1
1 723 . 19 1 1 A 64 64 ALA N N 64 117.791 118.769 -0.978 1
1 724 . 19 1 1 A 65 65 VAL H H 65 8.583 8.501 0.082 1
1 725 . 19 1 1 A 65 65 VAL HA H 65 4.470 4.872 -0.402 1
1 733 . 19 1 1 A 65 65 VAL C C 65 174.697 174.558 0.139 1
1 734 . 19 1 1 A 65 65 VAL CA C 65 61.936 60.622 1.314 1
1 735 . 19 1 1 A 65 65 VAL CB C 65 35.288 35.695 -0.407 1
1 738 . 19 1 1 A 65 65 VAL N N 65 120.009 119.557 0.452 1
1 739 . 19 1 1 A 66 66 ASP H H 66 8.567 8.983 -0.416 1
1 740 . 19 1 1 A 66 66 ASP HA H 66 4.880 4.965 -0.085 1
1 743 . 19 1 1 A 66 66 ASP C C 66 174.355 176.087 -1.732 1
1 744 . 19 1 1 A 66 66 ASP CA C 66 52.681 52.724 -0.043 1
1 745 . 19 1 1 A 66 66 ASP CB C 66 41.775 41.004 0.771 1
1 746 . 19 1 1 A 66 66 ASP N N 66 126.262 125.243 1.019 1
1 747 . 19 1 1 A 67 67 GLU H H 67 9.148 8.491 0.657 1
1 748 . 19 1 1 A 67 67 GLU HA H 67 4.110 3.892 0.218 1
1 753 . 19 1 1 A 67 67 GLU C C 67 177.052 178.016 -0.964 1
1 754 . 19 1 1 A 67 67 GLU CA C 67 59.044 59.620 -0.576 1
1 755 . 19 1 1 A 67 67 GLU CB C 67 29.919 29.583 0.336 1
1 757 . 19 1 1 A 67 67 GLU N N 67 125.480 125.743 -0.263 1
1 758 . 19 1 1 A 68 68 GLU H H 68 8.384 8.284 0.100 1
1 759 . 19 1 1 A 68 68 GLU HA H 68 4.140 4.123 0.017 1
1 764 . 19 1 1 A 68 68 GLU C C 68 178.383 179.696 -1.313 1
1 765 . 19 1 1 A 68 68 GLU CA C 68 59.044 58.931 0.113 1
1 766 . 19 1 1 A 68 68 GLU CB C 68 29.919 29.563 0.356 1
1 768 . 19 1 1 A 68 68 GLU N N 68 119.760 118.911 0.849 1
1 769 . 19 1 1 A 69 69 LYS H H 69 7.799 7.987 -0.188 1
1 770 . 19 1 1 A 69 69 LYS HA H 69 4.375 4.318 0.057 1
1 779 . 19 1 1 A 69 69 LYS C C 69 178.297 176.752 1.545 1
1 780 . 19 1 1 A 69 69 LYS CA C 69 55.704 57.680 -1.976 1
1 781 . 19 1 1 A 69 69 LYS CB C 69 33.622 33.226 0.396 1
1 785 . 19 1 1 A 69 69 LYS N N 69 115.476 119.347 -3.871 1
1 786 . 19 1 1 A 70 70 GLY H H 70 7.994 8.357 -0.363 1
1 787 . 19 1 1 A 70 70 GLY HA2 H 70 3.940 3.946 -0.006 1
1 788 . 19 1 1 A 70 70 GLY HA3 H 70 3.960 3.953 0.007 1
1 789 . 19 1 1 A 70 70 GLY C C 70 177.215 173.965 3.250 1
1 790 . 19 1 1 A 70 70 GLY CA C 70 46.773 46.566 0.207 1
1 791 . 19 1 1 A 70 70 GLY N N 70 110.245 108.356 1.889 1
1 792 . 19 1 1 A 71 71 LYS H H 71 7.560 7.929 -0.369 1
1 793 . 19 1 1 A 71 71 LYS HA H 71 4.690 4.929 -0.239 1
1 802 . 19 1 1 A 71 71 LYS C C 71 174.607 174.805 -0.198 1
1 803 . 19 1 1 A 71 71 LYS CA C 71 55.332 54.490 0.842 1
1 804 . 19 1 1 A 71 71 LYS CB C 71 34.903 36.183 -1.280 1
1 808 . 19 1 1 A 71 71 LYS N N 71 118.201 118.825 -0.624 1
1 809 . 19 1 1 A 72 72 ILE H H 72 8.867 8.710 0.157 1
1 810 . 19 1 1 A 72 72 ILE HA H 72 4.630 4.827 -0.197 1
1 820 . 19 1 1 A 72 72 ILE C C 72 175.708 174.667 1.041 1
1 821 . 19 1 1 A 72 72 ILE CA C 72 61.494 60.235 1.259 1
1 822 . 19 1 1 A 72 72 ILE CB C 72 40.652 41.746 -1.094 1
1 826 . 19 1 1 A 72 72 ILE N N 72 126.827 121.932 4.895 1
1 827 . 19 1 1 A 73 73 SER H H 73 8.815 9.023 -0.208 1
1 828 . 19 1 1 A 73 73 SER HA H 73 5.110 5.041 0.069 1
1 831 . 19 1 1 A 73 73 SER C C 73 175.122 173.559 1.563 1
1 832 . 19 1 1 A 73 73 SER CA C 73 57.487 58.583 -1.096 1
1 833 . 19 1 1 A 73 73 SER CB C 73 64.386 64.206 0.180 1
1 834 . 19 1 1 A 73 73 SER N N 73 123.640 124.281 -0.641 1
1 835 . 19 1 1 A 74 74 LEU H H 74 8.585 8.768 -0.183 1
1 836 . 19 1 1 A 74 74 LEU HA H 74 5.450 5.215 0.235 1
1 846 . 19 1 1 A 74 74 LEU C C 74 174.061 175.773 -1.712 1
1 847 . 19 1 1 A 74 74 LEU CA C 74 53.101 53.536 -0.435 1
1 848 . 19 1 1 A 74 74 LEU CB C 74 48.268 46.684 1.584 1
1 852 . 19 1 1 A 74 74 LEU N N 74 125.221 124.482 0.739 1
1 853 . 19 1 1 A 75 75 SER H H 75 8.840 8.993 -0.153 1
1 854 . 19 1 1 A 75 75 SER HA H 75 5.040 5.168 -0.128 1
1 857 . 19 1 1 A 75 75 SER C C 75 176.552 173.352 3.200 1
1 858 . 19 1 1 A 75 75 SER CA C 75 57.487 56.432 1.055 1
1 859 . 19 1 1 A 75 75 SER CB C 75 64.993 65.374 -0.381 1
1 860 . 19 1 1 A 75 75 SER N N 75 111.252 114.448 -3.196 1
1 861 . 19 1 1 A 76 76 ILE H H 76 7.790 8.824 -1.034 1
1 862 . 19 1 1 A 76 76 ILE HA H 76 4.690 4.578 0.112 1
1 872 . 19 1 1 A 76 76 ILE C C 76 175.780 176.983 -1.203 1
1 873 . 19 1 1 A 76 76 ILE CA C 76 63.631 61.636 1.995 1
1 874 . 19 1 1 A 76 76 ILE CB C 76 39.484 39.626 -0.142 1
1 878 . 19 1 1 A 76 76 ILE N N 76 129.205 127.262 1.943 1
1 879 . 19 1 1 A 77 77 ARG H H 77 8.115 8.502 -0.387 1
1 880 . 19 1 1 A 77 77 ARG HA H 77 3.760 4.003 -0.243 1
1 887 . 19 1 1 A 77 77 ARG C C 77 178.704 177.928 0.776 1
1 888 . 19 1 1 A 77 77 ARG CA C 77 58.933 58.645 0.288 1
1 889 . 19 1 1 A 77 77 ARG CB C 77 29.463 29.298 0.165 1
1 892 . 19 1 1 A 77 77 ARG N N 77 123.257 122.025 1.232 1
1 893 . 19 1 1 A 78 78 ALA H H 78 8.304 7.537 0.767 1
1 894 . 19 1 1 A 78 78 ALA HA H 78 4.296 4.153 0.143 1
1 898 . 19 1 1 A 78 78 ALA C C 78 176.870 177.732 -0.862 1
1 899 . 19 1 1 A 78 78 ALA CA C 78 53.548 54.343 -0.795 1
1 900 . 19 1 1 A 78 78 ALA CB C 78 19.872 18.460 1.412 1
1 901 . 19 1 1 A 78 78 ALA N N 78 118.764 121.721 -2.957 1
1 902 . 19 1 1 A 79 79 THR H H 79 7.931 7.607 0.324 1
1 903 . 19 1 1 A 79 79 THR HA H 79 4.370 4.499 -0.129 1
1 908 . 19 1 1 A 79 79 THR C C 79 178.356 175.077 3.279 1
1 909 . 19 1 1 A 79 79 THR CA C 79 62.381 60.732 1.649 1
1 910 . 19 1 1 A 79 79 THR CB C 79 69.693 69.730 -0.037 1
1 912 . 19 1 1 A 79 79 THR N N 79 107.360 103.491 3.869 1
1 913 . 19 1 1 A 80 80 GLN H H 80 7.651 7.635 0.016 1
1 914 . 19 1 1 A 80 80 GLN HA H 80 4.527 4.385 0.142 1
1 921 . 19 1 1 A 80 80 GLN C C 80 174.249 175.654 -1.405 1
1 922 . 19 1 1 A 80 80 GLN CA C 80 54.760 56.289 -1.529 1
1 923 . 19 1 1 A 80 80 GLN CB C 80 30.565 29.782 0.783 1
1 925 . 19 1 1 A 80 80 GLN N N 80 121.588 123.432 -1.844 1
1 927 . 19 1 1 A 81 81 ALA H H 81 8.498 8.847 -0.349 1
1 928 . 19 1 1 A 81 81 ALA HA H 81 4.252 4.520 -0.268 1
1 932 . 19 1 1 A 81 81 ALA C C 81 175.693 177.156 -1.463 1
1 933 . 19 1 1 A 81 81 ALA CA C 81 52.345 53.466 -1.121 1
1 934 . 19 1 1 A 81 81 ALA CB C 81 19.062 21.782 -2.720 1
1 935 . 19 1 1 A 81 81 ALA N N 81 126.423 123.572 2.851 1
1 936 . 19 1 1 A 82 82 ALA H H 82 8.324 7.477 0.847 1
1 937 . 19 1 1 A 82 82 ALA HA H 82 4.000 4.607 -0.607 1
1 941 . 19 1 1 A 82 82 ALA C C 82 177.065 174.578 2.487 1
1 942 . 19 1 1 A 82 82 ALA CA C 82 50.240 50.404 -0.164 1
1 943 . 19 1 1 A 82 82 ALA CB C 82 17.650 21.731 -4.081 1
1 944 . 19 1 1 A 82 82 ALA N N 82 125.114 116.699 8.415 1
1 945 . 19 1 1 A 83 83 PRO HA H 83 4.350 4.444 -0.094 1
1 952 . 19 1 1 A 83 83 PRO CA C 83 63.148 62.187 0.961 1
1 953 . 19 1 1 A 83 83 PRO CB C 83 32.054 32.724 -0.670 1
1 956 . 19 1 1 A 84 84 GLU H H 84 8.517 8.933 -0.416 1
1 957 . 19 1 1 A 84 84 GLU HA H 84 4.197 4.768 -0.571 1
1 962 . 19 1 1 A 84 84 GLU C C 84 176.948 175.081 1.867 1
1 963 . 19 1 1 A 84 84 GLU CA C 84 56.674 55.303 1.371 1
1 964 . 19 1 1 A 84 84 GLU CB C 84 30.459 33.444 -2.985 1
1 966 . 19 1 1 A 84 84 GLU N N 84 121.479 120.076 1.403 1
1 967 . 19 1 1 A 85 85 LYS H H 85 8.381 8.598 -0.217 1
1 968 . 19 1 1 A 85 85 LYS HA H 85 4.309 4.510 -0.201 1
1 977 . 19 1 1 A 85 85 LYS C C 85 176.457 176.172 0.285 1
1 978 . 19 1 1 A 85 85 LYS CA C 85 56.272 56.847 -0.575 1
1 979 . 19 1 1 A 85 85 LYS CB C 85 32.961 32.569 0.392 1
1 983 . 19 1 1 A 85 85 LYS N N 85 123.266 126.854 -3.588 1
1 984 . 19 1 1 A 86 86 LYS H H 86 8.403 8.808 -0.405 1
1 985 . 19 1 1 A 86 86 LYS HA H 86 4.308 4.759 -0.451 1
1 994 . 19 1 1 A 86 86 LYS C C 86 176.435 176.924 -0.489 1
1 995 . 19 1 1 A 86 86 LYS CA C 86 56.272 55.405 0.867 1
1 996 . 19 1 1 A 86 86 LYS CB C 86 32.961 33.422 -0.461 1
1 1000 . 19 1 1 A 86 86 LYS N N 86 123.688 126.262 -2.574 1
1 1001 . 19 1 1 A 87 87 GLU H H 87 8.540 8.039 0.501 1
1 1002 . 19 1 1 A 87 87 GLU HA H 87 4.358 4.046 0.312 1
1 1007 . 19 1 1 A 87 87 GLU C C 87 176.556 176.026 0.530 1
1 1008 . 19 1 1 A 87 87 GLU CA C 87 56.406 59.275 -2.869 1
1 1009 . 19 1 1 A 87 87 GLU CB C 87 30.607 30.152 0.455 1
1 1011 . 19 1 1 A 87 87 GLU N N 87 122.633 121.360 1.273 1
1 1012 . 19 1 1 A 88 88 SER H H 88 8.520 7.905 0.615 1
1 1013 . 19 1 1 A 88 88 SER HA H 88 4.490 4.884 -0.394 1
1 1016 . 19 1 1 A 88 88 SER C C 88 175.780 173.281 2.499 1
1 1017 . 19 1 1 A 88 88 SER CA C 88 58.431 57.221 1.210 1
1 1018 . 19 1 1 A 88 88 SER CB C 88 63.858 65.670 -1.812 1
1 1019 . 19 1 1 A 88 88 SER N N 88 118.333 110.557 7.776 1
1 1020 . 19 1 1 A 89 89 LYS H H 89 8.339 8.430 -0.091 1
1 1021 . 19 1 1 A 89 89 LYS HA H 89 4.620 4.501 0.119 1
1 1030 . 19 1 1 A 89 89 LYS C C 89 174.160 174.666 -0.506 1
1 1031 . 19 1 1 A 89 89 LYS CA C 89 54.265 54.981 -0.716 1
1 1032 . 19 1 1 A 89 89 LYS CB C 89 32.672 31.603 1.069 1
1 1036 . 19 1 1 A 89 89 LYS N N 89 124.433 122.016 2.417 1
1 1037 . 19 1 1 A 90 90 PRO HA H 90 4.417 4.373 0.044 1
1 1044 . 19 1 1 A 90 90 PRO CA C 90 63.064 63.108 -0.044 1
1 1045 . 19 1 1 A 90 90 PRO CB C 90 32.266 32.341 -0.075 1
1 1048 . 19 1 1 A 91 91 ARG H H 91 8.502 8.928 -0.426 1
1 1049 . 19 1 1 A 91 91 ARG HA H 91 4.305 3.962 0.343 1
1 1056 . 19 1 1 A 91 91 ARG C C 91 176.831 175.682 1.149 1
1 1057 . 19 1 1 A 91 91 ARG CA C 91 56.002 57.313 -1.311 1
1 1058 . 19 1 1 A 91 91 ARG CB C 91 30.913 29.345 1.568 1
1 1061 . 19 1 1 A 91 91 ARG N N 91 122.193 121.492 0.701 1
1 1062 . 19 1 1 A 92 92 LYS H H 92 8.415 7.584 0.831 1
1 1063 . 19 1 1 A 92 92 LYS HA H 92 4.610 4.481 0.129 1
1 1072 . 19 1 1 A 92 92 LYS C C 92 176.262 175.807 0.455 1
1 1073 . 19 1 1 A 92 92 LYS CA C 92 54.258 55.271 -1.013 1
1 1074 . 19 1 1 A 92 92 LYS CB C 92 32.672 32.371 0.301 1
1 1078 . 19 1 1 A 92 92 LYS N N 92 124.243 116.357 7.886 1
1 1079 . 19 1 1 A 93 93 PRO HA H 93 4.415 4.473 -0.058 1
1 1086 . 19 1 1 A 93 93 PRO CA C 93 62.899 62.585 0.314 1
1 1087 . 19 1 1 A 93 93 PRO CB C 93 32.323 31.814 0.509 1
1 1090 . 19 1 1 A 94 94 LYS H H 94 8.420 8.336 0.084 1
1 1091 . 19 1 1 A 94 94 LYS HA H 94 4.290 4.382 -0.092 1
1 1100 . 19 1 1 A 94 94 LYS C C 94 176.714 176.691 0.023 1
1 1101 . 19 1 1 A 94 94 LYS CA C 94 56.585 56.458 0.127 1
1 1102 . 19 1 1 A 94 94 LYS CB C 94 33.161 32.693 0.468 1
1 1106 . 19 1 1 A 94 94 LYS N N 94 122.121 122.536 -0.415 1
1 1107 . 19 1 1 A 95 95 ALA H H 95 8.348 8.878 -0.530 1
1 1108 . 19 1 1 A 95 95 ALA HA H 95 4.250 4.745 -0.495 1
1 1112 . 19 1 1 A 95 95 ALA C C 95 176.453 175.828 0.625 1
1 1113 . 19 1 1 A 95 95 ALA CA C 95 52.471 51.450 1.021 1
1 1114 . 19 1 1 A 95 95 ALA CB C 95 19.347 23.087 -3.740 1
1 1115 . 19 1 1 A 95 95 ALA N N 95 125.624 125.380 0.244 1
1 1116 . 19 1 1 A 96 96 ALA H H 96 8.348 8.431 -0.083 1
1 1117 . 19 1 1 A 96 96 ALA HA H 96 4.254 4.459 -0.205 1
1 1121 . 19 1 1 A 96 96 ALA C C 96 176.462 177.136 -0.674 1
1 1122 . 19 1 1 A 96 96 ALA CA C 96 52.471 52.820 -0.349 1
1 1123 . 19 1 1 A 96 96 ALA CB C 96 19.347 19.385 -0.038 1
1 1124 . 19 1 1 A 96 96 ALA N N 96 125.624 122.860 2.764 1
1 1125 . 19 1 1 A 97 97 GLN H H 97 8.333 8.705 -0.372 1
1 1126 . 19 1 1 A 97 97 GLN HA H 97 4.362 4.821 -0.459 1
1 1133 . 19 1 1 A 97 97 GLN C C 97 177.684 173.501 4.183 1
1 1134 . 19 1 1 A 97 97 GLN CA C 97 55.848 54.907 0.941 1
1 1135 . 19 1 1 A 97 97 GLN CB C 97 29.643 32.042 -2.399 1
1 1137 . 19 1 1 A 97 97 GLN N N 97 120.049 117.532 2.517 1
1 1139 . 19 1 1 A 98 98 VAL H H 98 8.230 8.415 -0.185 1
1 1140 . 19 1 1 A 98 98 VAL HA H 98 4.145 4.471 -0.326 1
1 1148 . 19 1 1 A 98 98 VAL C C 98 176.033 175.510 0.523 1
1 1149 . 19 1 1 A 98 98 VAL CA C 98 62.444 61.853 0.591 1
1 1150 . 19 1 1 A 98 98 VAL CB C 98 32.942 32.195 0.747 1
1 1153 . 19 1 1 A 98 98 VAL N N 98 121.607 120.371 1.236 1
1 1154 . 19 1 1 A 99 99 SER H H 99 8.375 8.318 0.057 1
1 1155 . 19 1 1 A 99 99 SER HA H 99 4.473 4.439 0.034 1
1 1158 . 19 1 1 A 99 99 SER C C 99 176.204 174.341 1.863 1
1 1159 . 19 1 1 A 99 99 SER CA C 99 58.379 59.190 -0.811 1
1 1160 . 19 1 1 A 99 99 SER CB C 99 63.914 63.977 -0.063 1
1 1161 . 19 1 1 A 99 99 SER N N 99 119.455 121.671 -2.216 1
1 1162 . 19 1 1 A 100 100 GLU H H 100 8.547 8.304 0.243 1
1 1163 . 19 1 1 A 100 100 GLU HA H 100 4.304 4.164 0.140 1
1 1168 . 19 1 1 A 100 100 GLU C C 100 174.620 177.191 -2.571 1
1 1169 . 19 1 1 A 100 100 GLU CA C 100 56.835 57.143 -0.308 1
1 1170 . 19 1 1 A 100 100 GLU CB C 100 30.365 30.806 -0.441 1
1 1172 . 19 1 1 A 100 100 GLU N N 100 123.419 123.048 0.371 1
1 1173 . 19 1 1 A 101 101 GLU H H 101 8.432 9.077 -0.645 1
1 1174 . 19 1 1 A 101 101 GLU HA H 101 4.252 4.356 -0.104 1
1 1179 . 19 1 1 A 101 101 GLU C C 101 176.693 176.961 -0.268 1
1 1180 . 19 1 1 A 101 101 GLU CA C 101 56.835 57.737 -0.902 1
1 1181 . 19 1 1 A 101 101 GLU CB C 101 30.365 29.990 0.375 1
1 1183 . 19 1 1 A 101 101 GLU N N 101 122.025 126.281 -4.256 1
1 1184 . 19 1 1 A 102 102 ALA H H 102 8.324 7.948 0.376 1
1 1185 . 19 1 1 A 102 102 ALA HA H 102 4.361 4.390 -0.029 1
1 1189 . 19 1 1 A 102 102 ALA C C 102 177.065 177.674 -0.609 1
1 1190 . 19 1 1 A 102 102 ALA CA C 102 52.647 52.305 0.342 1
1 1191 . 19 1 1 A 102 102 ALA CB C 102 19.227 18.419 0.808 1
1 1192 . 19 1 1 A 102 102 ALA N N 102 125.114 123.020 2.094 1
1 1193 . 19 1 1 A 103 103 SER H H 103 8.259 8.145 0.114 1
1 1194 . 19 1 1 A 103 103 SER HA H 103 4.473 3.909 0.564 1
1 1197 . 19 1 1 A 103 103 SER C C 103 177.772 175.908 1.864 1
1 1198 . 19 1 1 A 103 103 SER CA C 103 58.301 62.249 -3.948 1
1 1199 . 19 1 1 A 103 103 SER CB C 103 63.961 63.116 0.845 1
1 1200 . 19 1 1 A 103 103 SER N N 103 115.109 116.605 -1.496 1
1 1201 . 19 1 1 A 104 104 THR H H 104 8.127 7.958 0.169 1
1 1202 . 19 1 1 A 104 104 THR HA H 104 4.600 3.907 0.693 1
1 1207 . 19 1 1 A 104 104 THR C C 104 174.427 173.103 1.324 1
1 1208 . 19 1 1 A 104 104 THR CA C 104 59.954 67.737 -7.783 1
1 1209 . 19 1 1 A 104 104 THR CB C 104 69.868 67.218 2.650 1
1 1211 . 19 1 1 A 104 104 THR N N 104 117.882 116.645 1.237 1
1 1212 . 19 1 1 A 105 105 PRO HA H 105 4.414 3.678 0.736 1
1 1219 . 19 1 1 A 105 105 PRO CA C 105 63.300 64.446 -1.146 1
1 1220 . 19 1 1 A 105 105 PRO CB C 105 32.227 31.272 0.955 1
1 1223 . 19 1 1 A 106 106 GLN H H 106 8.524 7.976 0.548 1
1 1224 . 19 1 1 A 106 106 GLN HA H 106 4.276 4.458 -0.182 1
1 1229 . 19 1 1 A 106 106 GLN C C 106 177.083 175.172 1.911 1
1 1230 . 19 1 1 A 106 106 GLN CA C 106 56.209 55.248 0.961 1
1 1231 . 19 1 1 A 106 106 GLN CB C 106 29.490 30.645 -1.155 1
1 1233 . 19 1 1 A 106 106 GLN N N 106 120.754 116.796 3.958 1
1 1234 . 19 1 1 A 107 107 GLY H H 107 8.394 6.888 1.506 1
1 1235 . 19 1 1 A 107 107 GLY HA2 H 107 3.895 4.016 -0.121 1
1 1236 . 19 1 1 A 107 107 GLY HA3 H 107 3.895 4.058 -0.163 1
1 1237 . 19 1 1 A 107 107 GLY C C 107 176.651 174.172 2.479 1
1 1238 . 19 1 1 A 107 107 GLY CA C 107 45.330 45.567 -0.237 1
1 1239 . 19 1 1 A 107 107 GLY N N 107 110.026 106.253 3.773 1
1 1240 . 19 1 1 A 108 108 PHE H H 108 8.099 8.335 -0.236 1
1 1241 . 19 1 1 A 108 108 PHE HA H 108 4.582 4.321 0.261 1
1 1245 . 19 1 1 A 108 108 PHE C C 108 173.944 177.666 -3.722 1
1 1246 . 19 1 1 A 108 108 PHE CA C 108 58.054 60.567 -2.513 1
1 1247 . 19 1 1 A 108 108 PHE CB C 108 39.708 38.330 1.378 1
1 1248 . 19 1 1 A 108 108 PHE N N 108 120.180 118.891 1.289 1
1 1249 . 19 1 1 A 109 109 ASN H H 109 8.482 8.334 0.148 1
1 1250 . 19 1 1 A 109 109 ASN HA H 109 4.691 4.621 0.070 1
1 1255 . 19 1 1 A 109 109 ASN C C 109 175.627 177.781 -2.154 1
1 1256 . 19 1 1 A 109 109 ASN CA C 109 53.402 56.070 -2.668 1
1 1257 . 19 1 1 A 109 109 ASN CB C 109 38.883 39.205 -0.322 1
1 1258 . 19 1 1 A 109 109 ASN N N 109 120.752 119.267 1.485 1
1 1260 . 19 1 1 A 110 110 THR H H 110 8.112 7.658 0.454 1
1 1261 . 19 1 1 A 110 110 THR HA H 110 4.251 4.131 0.120 1
1 1266 . 19 1 1 A 110 110 THR C C 110 175.275 175.397 -0.122 1
1 1267 . 19 1 1 A 110 110 THR CA C 110 62.460 65.537 -3.077 1
1 1268 . 19 1 1 A 110 110 THR CB C 110 69.726 68.499 1.227 1
1 1270 . 19 1 1 A 110 110 THR N N 110 114.601 112.809 1.792 1
1 1271 . 19 1 1 A 111 111 LEU H H 111 8.168 7.736 0.432 1
1 1272 . 19 1 1 A 111 111 LEU HA H 111 4.308 4.420 -0.112 1
1 1282 . 19 1 1 A 111 111 LEU CA C 111 55.704 53.528 2.176 1
1 1283 . 19 1 1 A 111 111 LEU CB C 111 42.071 40.340 1.731 1
1 1287 . 19 1 1 A 111 111 LEU N N 111 123.756 121.734 2.022 1
1 1288 . 19 1 1 A 112 112 LYS H H 112 8.123 7.915 0.208 1
1 1289 . 19 1 1 A 112 112 LYS HA H 112 4.242 4.322 -0.080 1
1 1298 . 19 1 1 A 112 112 LYS C C 112 177.547 176.103 1.444 1
1 1299 . 19 1 1 A 112 112 LYS CA C 112 56.928 57.255 -0.327 1
1 1300 . 19 1 1 A 112 112 LYS CB C 112 33.055 33.507 -0.452 1
1 1304 . 19 1 1 A 112 112 LYS N N 112 121.442 123.421 -1.979 1
1 1305 . 19 1 1 A 113 113 ASP H H 113 8.230 8.578 -0.348 1
1 1306 . 19 1 1 A 113 113 ASP HA H 113 4.526 5.224 -0.698 1
1 1309 . 19 1 1 A 113 113 ASP C C 113 176.532 174.259 2.273 1
1 1310 . 19 1 1 A 113 113 ASP CA C 113 54.896 53.532 1.364 1
1 1311 . 19 1 1 A 113 113 ASP CB C 113 41.362 45.187 -3.825 1
1 1312 . 19 1 1 A 113 113 ASP N N 113 120.598 122.482 -1.884 1
1 1313 . 19 1 1 A 114 114 LYS H H 114 8.127 8.688 -0.561 1
1 1314 . 19 1 1 A 114 114 LYS HA H 114 4.300 5.117 -0.817 1
1 1323 . 19 1 1 A 114 114 LYS C C 114 176.303 174.260 2.043 1
1 1324 . 19 1 1 A 114 114 LYS CA C 114 56.633 55.550 1.083 1
1 1325 . 19 1 1 A 114 114 LYS CB C 114 32.818 36.774 -3.956 1
1 1329 . 19 1 1 A 114 114 LYS N N 114 120.897 123.742 -2.845 1
1 1330 . 19 1 1 A 115 115 LEU H H 115 8.244 7.874 0.370 1
1 1331 . 19 1 1 A 115 115 LEU HA H 115 4.254 4.903 -0.649 1
1 1341 . 19 1 1 A 115 115 LEU C C 115 176.909 175.846 1.063 1
1 1342 . 19 1 1 A 115 115 LEU CA C 115 56.282 52.997 3.285 1
1 1343 . 19 1 1 A 115 115 LEU CB C 115 42.188 45.044 -2.856 1
1 1347 . 19 1 1 A 115 115 LEU N N 115 123.251 124.457 -1.206 1
1 1348 . 19 1 1 A 116 116 GLU H H 116 8.421 8.776 -0.355 1
1 1349 . 19 1 1 A 116 116 GLU HA H 116 4.190 4.022 0.168 1
1 1352 . 19 1 1 A 116 116 GLU C C 116 177.828 175.946 1.882 1
1 1353 . 19 1 1 A 116 116 GLU CA C 116 57.466 57.943 -0.477 1
1 1354 . 19 1 1 A 116 116 GLU CB C 116 30.124 29.058 1.066 1
1 1355 . 19 1 1 A 116 116 GLU N N 116 120.575 122.421 -1.846 1
1 1356 . 19 1 1 A 117 117 GLU H H 117 8.255 7.308 0.947 1
1 1357 . 19 1 1 A 117 117 GLU HA H 117 4.192 4.639 -0.447 1
1 1362 . 19 1 1 A 117 117 GLU CA C 117 57.491 55.377 2.114 1
1 1363 . 19 1 1 A 117 117 GLU CB C 117 30.365 32.835 -2.470 1
1 1365 . 19 1 1 A 117 117 GLU N N 117 120.933 118.213 2.720 1
1 1366 . 19 1 1 A 118 118 TRP H H 118 8.143 8.596 -0.453 1
1 1367 . 19 1 1 A 118 118 TRP HA H 118 4.581 4.967 -0.386 1
1 1372 . 19 1 1 A 118 118 TRP C C 118 176.794 176.176 0.618 1
1 1373 . 19 1 1 A 118 118 TRP CA C 118 58.363 56.641 1.722 1
1 1374 . 19 1 1 A 118 118 TRP CB C 118 29.333 30.712 -1.379 1
1 1375 . 19 1 1 A 118 118 TRP N N 118 121.592 122.042 -0.450 1
1 1376 . 19 1 1 A 119 119 ILE H H 119 7.908 7.646 0.262 1
1 1377 . 19 1 1 A 119 119 ILE HA H 119 3.828 4.044 -0.216 1
1 1387 . 19 1 1 A 119 119 ILE C C 119 176.984 177.187 -0.203 1
1 1388 . 19 1 1 A 119 119 ILE CA C 119 62.335 61.879 0.456 1
1 1389 . 19 1 1 A 119 119 ILE CB C 119 38.649 40.086 -1.437 1
1 1393 . 19 1 1 A 119 119 ILE N N 119 122.744 122.107 0.637 1
1 1394 . 19 1 1 A 120 120 GLU H H 120 8.143 9.026 -0.883 1
1 1395 . 19 1 1 A 120 120 GLU HA H 120 4.093 4.044 0.049 1
1 1400 . 19 1 1 A 120 120 GLU C C 120 176.565 178.210 -1.645 1
1 1401 . 19 1 1 A 120 120 GLU CA C 120 57.613 59.573 -1.960 1
1 1402 . 19 1 1 A 120 120 GLU CB C 120 29.834 29.292 0.542 1
1 1404 . 19 1 1 A 120 120 GLU N N 120 123.139 129.167 -6.028 1
1 1405 . 19 1 1 A 121 121 MET H H 121 8.254 8.071 0.183 1
1 1406 . 19 1 1 A 121 121 MET HA H 121 4.357 4.489 -0.132 1
1 1411 . 19 1 1 A 121 121 MET CA C 121 56.625 56.059 0.566 1
1 1412 . 19 1 1 A 121 121 MET CB C 121 32.664 32.560 0.104 1
1 1414 . 19 1 1 A 121 121 MET N N 121 120.449 118.219 2.230 1
1 1415 . 19 1 1 A 122 122 SER H H 122 8.199 8.348 -0.149 1
1 1416 . 19 1 1 A 122 122 SER HA H 122 4.280 4.098 0.182 1
1 1419 . 19 1 1 A 122 122 SER C C 122 177.224 174.095 3.129 1
1 1420 . 19 1 1 A 122 122 SER CA C 122 59.635 59.476 0.159 1
1 1421 . 19 1 1 A 122 122 SER CB C 122 63.560 61.360 2.200 1
1 1422 . 19 1 1 A 122 122 SER N N 122 115.857 113.814 2.043 1
1 1423 . 19 1 1 A 123 123 ASN H H 123 8.211 8.372 -0.161 1
1 1424 . 19 1 1 A 123 123 ASN HA H 123 4.737 4.451 0.286 1
1 1429 . 19 1 1 A 123 123 ASN C C 123 174.709 175.767 -1.058 1
1 1430 . 19 1 1 A 123 123 ASN CA C 123 53.507 54.288 -0.781 1
1 1431 . 19 1 1 A 123 123 ASN CB C 123 38.800 38.161 0.639 1
1 1432 . 19 1 1 A 123 123 ASN N N 123 119.923 117.678 2.245 1
1 1434 . 19 1 1 A 124 124 ARG H H 124 7.997 7.959 0.038 1
1 1435 . 19 1 1 A 124 124 ARG HA H 124 4.305 4.046 0.259 1
1 1442 . 19 1 1 A 124 124 ARG C C 124 175.477 179.356 -3.879 1
1 1443 . 19 1 1 A 124 124 ARG CA C 124 56.709 59.249 -2.540 1
1 1444 . 19 1 1 A 124 124 ARG CB C 124 30.584 29.894 0.690 1
1 1447 . 19 1 1 A 124 124 ARG N N 124 120.821 118.539 2.282 1
1 1448 . 19 1 1 A 125 125 LYS H H 125 8.327 7.830 0.497 1
1 1449 . 19 1 1 A 125 125 LYS HA H 125 4.254 4.096 0.158 1
1 1458 . 19 1 1 A 125 125 LYS C C 125 176.777 177.585 -0.808 1
1 1459 . 19 1 1 A 125 125 LYS CA C 125 56.860 58.787 -1.927 1
1 1460 . 19 1 1 A 125 125 LYS CB C 125 32.879 32.066 0.813 1
1 1464 . 19 1 1 A 125 125 LYS N N 125 121.891 120.150 1.741 1
1 1465 . 19 1 1 A 126 126 ASP H H 126 8.343 8.045 0.298 1
1 1466 . 19 1 1 A 126 126 ASP HA H 126 4.581 4.458 0.123 1
1 1469 . 19 1 1 A 126 126 ASP C C 126 176.538 176.433 0.105 1
1 1470 . 19 1 1 A 126 126 ASP CA C 126 54.540 57.142 -2.602 1
1 1471 . 19 1 1 A 126 126 ASP CB C 126 40.907 40.484 0.423 1
1 1472 . 19 1 1 A 126 126 ASP N N 126 119.814 119.510 0.304 1
1 1473 . 19 1 1 A 127 127 LEU H H 127 7.946 8.091 -0.145 1
1 1474 . 19 1 1 A 127 127 LEU HA H 127 4.309 4.531 -0.222 1
1 1484 . 19 1 1 A 127 127 LEU C C 127 176.043 175.146 0.897 1
1 1485 . 19 1 1 A 127 127 LEU CA C 127 55.427 53.868 1.559 1
1 1486 . 19 1 1 A 127 127 LEU CB C 127 42.394 42.536 -0.142 1
1 1490 . 19 1 1 A 127 127 LEU N N 127 121.432 119.797 1.635 1
1 1491 . 19 1 1 A 128 128 ILE H H 128 7.967 7.931 0.036 1
1 1492 . 19 1 1 A 128 128 ILE HA H 128 4.141 3.998 0.143 1
1 1502 . 19 1 1 A 128 128 ILE C C 128 177.200 174.580 2.620 1
1 1503 . 19 1 1 A 128 128 ILE CA C 128 61.150 62.093 -0.943 1
1 1504 . 19 1 1 A 128 128 ILE CB C 128 38.489 38.630 -0.141 1
1 1508 . 19 1 1 A 128 128 ILE N N 128 121.579 124.569 -2.990 1
1 1509 . 19 1 1 A 129 129 LYS H H 129 8.331 8.916 -0.585 1
1 1510 . 19 1 1 A 129 129 LYS HA H 129 4.328 4.818 -0.490 1
1 1519 . 19 1 1 A 129 129 LYS C C 129 175.952 176.345 -0.393 1
1 1520 . 19 1 1 A 129 129 LYS CA C 129 56.330 54.041 2.289 1
1 1521 . 19 1 1 A 129 129 LYS CB C 129 33.010 36.914 -3.904 1
1 1525 . 19 1 1 A 129 129 LYS N N 129 126.955 127.232 -0.277 1
1 1 . 20 1 1 A 2 2 ALA HA H 2 4.070 4.753 -0.683 1
1 5 . 20 1 1 A 2 2 ALA CA C 2 52.067 51.055 1.012 1
1 6 . 20 1 1 A 2 2 ALA CB C 2 19.577 23.201 -3.624 1
1 7 . 20 1 1 A 3 3 ALA H H 3 8.714 8.817 -0.103 1
1 8 . 20 1 1 A 3 3 ALA HA H 3 4.253 4.356 -0.103 1
1 12 . 20 1 1 A 3 3 ALA C C 3 173.672 178.687 -5.015 1
1 13 . 20 1 1 A 3 3 ALA CA C 3 52.067 52.463 -0.396 1
1 14 . 20 1 1 A 3 3 ALA CB C 3 19.577 19.304 0.273 1
1 15 . 20 1 1 A 3 3 ALA N N 3 124.480 122.639 1.841 1
1 16 . 20 1 1 A 4 4 LYS H H 4 8.227 8.567 -0.340 1
1 17 . 20 1 1 A 4 4 LYS HA H 4 3.976 3.940 0.036 1
1 26 . 20 1 1 A 4 4 LYS C C 4 176.672 176.957 -0.285 1
1 27 . 20 1 1 A 4 4 LYS CA C 4 57.274 58.429 -1.155 1
1 28 . 20 1 1 A 4 4 LYS CB C 4 33.209 31.729 1.480 1
1 32 . 20 1 1 A 4 4 LYS N N 4 120.988 120.176 0.812 1
1 33 . 20 1 1 A 5 5 PHE H H 5 7.719 7.411 0.308 1
1 34 . 20 1 1 A 5 5 PHE HA H 5 4.384 4.706 -0.322 1
1 38 . 20 1 1 A 5 5 PHE C C 5 175.364 176.050 -0.686 1
1 39 . 20 1 1 A 5 5 PHE CA C 5 57.074 58.889 -1.815 1
1 40 . 20 1 1 A 5 5 PHE CB C 5 39.669 40.391 -0.722 1
1 41 . 20 1 1 A 5 5 PHE N N 5 119.246 119.717 -0.471 1
1 42 . 20 1 1 A 6 6 GLU H H 6 8.515 8.941 -0.426 1
1 43 . 20 1 1 A 6 6 GLU HA H 6 4.370 4.919 -0.549 1
1 48 . 20 1 1 A 6 6 GLU CA C 6 55.669 54.545 1.124 1
1 49 . 20 1 1 A 6 6 GLU CB C 6 32.094 34.045 -1.951 1
1 51 . 20 1 1 A 6 6 GLU N N 6 122.193 120.812 1.381 1
1 52 . 20 1 1 A 7 7 VAL H H 7 8.636 8.461 0.175 1
1 53 . 20 1 1 A 7 7 VAL HA H 7 3.406 3.950 -0.544 1
1 61 . 20 1 1 A 7 7 VAL C C 7 176.611 176.409 0.202 1
1 62 . 20 1 1 A 7 7 VAL CA C 7 65.358 63.623 1.735 1
1 63 . 20 1 1 A 7 7 VAL CB C 7 31.391 31.303 0.088 1
1 66 . 20 1 1 A 7 7 VAL N N 7 122.949 122.139 0.810 1
1 67 . 20 1 1 A 8 8 GLY H H 8 9.394 9.185 0.209 1
1 68 . 20 1 1 A 8 8 GLY HA2 H 8 3.600 4.040 -0.440 1
1 69 . 20 1 1 A 8 8 GLY HA3 H 8 4.546 4.040 0.506 1
1 70 . 20 1 1 A 8 8 GLY C C 8 178.074 174.566 3.508 1
1 71 . 20 1 1 A 8 8 GLY CA C 8 45.121 44.885 0.236 1
1 72 . 20 1 1 A 8 8 GLY N N 8 116.837 115.412 1.425 1
1 73 . 20 1 1 A 9 9 SER H H 9 8.021 8.206 -0.185 1
1 74 . 20 1 1 A 9 9 SER HA H 9 4.680 4.485 0.195 1
1 77 . 20 1 1 A 9 9 SER C C 9 174.234 173.715 0.519 1
1 78 . 20 1 1 A 9 9 SER CA C 9 59.387 58.712 0.675 1
1 79 . 20 1 1 A 9 9 SER CB C 9 65.584 65.018 0.566 1
1 80 . 20 1 1 A 9 9 SER N N 9 118.208 116.232 1.976 1
1 81 . 20 1 1 A 10 10 VAL H H 10 7.945 8.184 -0.239 1
1 82 . 20 1 1 A 10 10 VAL HA H 10 4.980 5.209 -0.229 1
1 90 . 20 1 1 A 10 10 VAL C C 10 171.388 173.389 -2.001 1
1 91 . 20 1 1 A 10 10 VAL CA C 10 61.021 59.947 1.074 1
1 92 . 20 1 1 A 10 10 VAL CB C 10 33.400 35.014 -1.614 1
1 95 . 20 1 1 A 10 10 VAL N N 10 121.118 120.569 0.549 1
1 96 . 20 1 1 A 11 11 TYR H H 11 9.008 9.245 -0.237 1
1 97 . 20 1 1 A 11 11 TYR HA H 11 4.850 5.336 -0.486 1
1 101 . 20 1 1 A 11 11 TYR C C 11 174.926 174.698 0.228 1
1 102 . 20 1 1 A 11 11 TYR CA C 11 56.803 56.306 0.497 1
1 103 . 20 1 1 A 11 11 TYR CB C 11 43.676 43.914 -0.238 1
1 104 . 20 1 1 A 11 11 TYR N N 11 125.043 126.353 -1.310 1
1 105 . 20 1 1 A 12 12 THR H H 12 8.809 8.685 0.124 1
1 106 . 20 1 1 A 12 12 THR HA H 12 5.020 5.458 -0.438 1
1 111 . 20 1 1 A 12 12 THR C C 12 174.195 174.405 -0.210 1
1 112 . 20 1 1 A 12 12 THR CA C 12 62.487 59.963 2.524 1
1 113 . 20 1 1 A 12 12 THR CB C 12 69.743 72.034 -2.291 1
1 115 . 20 1 1 A 12 12 THR N N 12 116.850 115.180 1.670 1
1 116 . 20 1 1 A 13 13 GLY H H 13 9.179 8.499 0.680 1
1 117 . 20 1 1 A 13 13 GLY HA2 H 13 3.250 4.362 -1.112 1
1 118 . 20 1 1 A 13 13 GLY HA3 H 13 4.801 4.379 0.422 1
1 119 . 20 1 1 A 13 13 GLY C C 13 174.654 171.890 2.764 1
1 120 . 20 1 1 A 13 13 GLY CA C 13 44.377 45.507 -1.130 1
1 121 . 20 1 1 A 13 13 GLY N N 13 113.654 111.449 2.205 1
1 122 . 20 1 1 A 14 14 LYS H H 14 7.770 8.597 -0.827 1
1 123 . 20 1 1 A 14 14 LYS HA H 14 5.426 5.157 0.269 1
1 132 . 20 1 1 A 14 14 LYS C C 14 171.343 175.754 -4.411 1
1 133 . 20 1 1 A 14 14 LYS CA C 14 53.879 54.526 -0.647 1
1 134 . 20 1 1 A 14 14 LYS CB C 14 36.032 35.838 0.194 1
1 138 . 20 1 1 A 14 14 LYS N N 14 118.322 120.557 -2.235 1
1 139 . 20 1 1 A 15 15 VAL H H 15 9.206 9.270 -0.064 1
1 140 . 20 1 1 A 15 15 VAL HA H 15 4.400 4.282 0.118 1
1 148 . 20 1 1 A 15 15 VAL C C 15 176.306 177.026 -0.720 1
1 149 . 20 1 1 A 15 15 VAL CA C 15 63.648 63.371 0.277 1
1 150 . 20 1 1 A 15 15 VAL CB C 15 31.769 31.479 0.290 1
1 153 . 20 1 1 A 15 15 VAL N N 15 125.308 123.562 1.746 1
1 154 . 20 1 1 A 16 16 THR H H 16 9.403 9.255 0.148 1
1 155 . 20 1 1 A 16 16 THR HA H 16 4.562 4.651 -0.089 1
1 160 . 20 1 1 A 16 16 THR C C 16 178.098 174.654 3.444 1
1 161 . 20 1 1 A 16 16 THR CA C 16 62.018 61.546 0.472 1
1 162 . 20 1 1 A 16 16 THR CB C 16 69.720 69.779 -0.059 1
1 164 . 20 1 1 A 16 16 THR N N 16 121.753 117.772 3.981 1
1 165 . 20 1 1 A 17 17 GLY H H 17 7.600 7.157 0.443 1
1 166 . 20 1 1 A 17 17 GLY HA2 H 17 4.110 4.076 0.034 1
1 167 . 20 1 1 A 17 17 GLY HA3 H 17 4.250 4.189 0.061 1
1 168 . 20 1 1 A 17 17 GLY C C 17 175.551 171.304 4.247 1
1 169 . 20 1 1 A 17 17 GLY CA C 17 46.258 45.611 0.647 1
1 170 . 20 1 1 A 17 17 GLY N N 17 109.407 108.881 0.526 1
1 171 . 20 1 1 A 18 18 LEU H H 18 8.820 8.485 0.335 1
1 172 . 20 1 1 A 18 18 LEU HA H 18 4.852 4.960 -0.108 1
1 182 . 20 1 1 A 18 18 LEU CA C 18 54.245 53.258 0.987 1
1 183 . 20 1 1 A 18 18 LEU CB C 18 44.906 46.368 -1.462 1
1 187 . 20 1 1 A 18 18 LEU N N 18 123.419 121.451 1.968 1
1 188 . 20 1 1 A 19 19 GLN H H 19 8.537 8.014 0.523 1
1 189 . 20 1 1 A 19 19 GLN HA H 19 4.520 4.681 -0.161 1
1 196 . 20 1 1 A 19 19 GLN C C 19 175.258 175.597 -0.339 1
1 197 . 20 1 1 A 19 19 GLN CA C 19 53.269 53.975 -0.706 1
1 198 . 20 1 1 A 19 19 GLN CB C 19 31.522 32.513 -0.991 1
1 200 . 20 1 1 A 19 19 GLN N N 19 120.187 121.514 -1.327 1
1 202 . 20 1 1 A 20 20 ALA H H 20 8.798 8.658 0.140 1
1 203 . 20 1 1 A 20 20 ALA HA H 20 4.010 4.057 -0.047 1
1 207 . 20 1 1 A 20 20 ALA C C 20 175.698 177.205 -1.507 1
1 208 . 20 1 1 A 20 20 ALA CA C 20 55.084 54.071 1.013 1
1 209 . 20 1 1 A 20 20 ALA CB C 20 18.277 18.480 -0.203 1
1 210 . 20 1 1 A 20 20 ALA N N 20 120.606 124.054 -3.448 1
1 211 . 20 1 1 A 21 21 TYR H H 21 6.618 7.660 -1.042 1
1 212 . 20 1 1 A 21 21 TYR HA H 21 4.540 4.639 -0.099 1
1 216 . 20 1 1 A 21 21 TYR C C 21 178.437 174.860 3.577 1
1 217 . 20 1 1 A 21 21 TYR CA C 21 55.120 56.696 -1.576 1
1 218 . 20 1 1 A 21 21 TYR CB C 21 37.891 40.206 -2.315 1
1 219 . 20 1 1 A 21 21 TYR N N 21 105.570 113.496 -7.926 1
1 220 . 20 1 1 A 22 22 GLY H H 22 7.203 6.968 0.235 1
1 221 . 20 1 1 A 22 22 GLY HA2 H 22 3.460 3.643 -0.183 1
1 222 . 20 1 1 A 22 22 GLY HA3 H 22 4.360 3.798 0.562 1
1 223 . 20 1 1 A 22 22 GLY C C 22 175.833 171.153 4.680 1
1 224 . 20 1 1 A 22 22 GLY CA C 22 46.356 45.370 0.986 1
1 225 . 20 1 1 A 22 22 GLY N N 22 109.854 108.254 1.600 1
1 226 . 20 1 1 A 23 23 ALA H H 23 8.549 8.490 0.059 1
1 227 . 20 1 1 A 23 23 ALA HA H 23 4.981 5.149 -0.168 1
1 231 . 20 1 1 A 23 23 ALA C C 23 168.810 175.812 -7.002 1
1 232 . 20 1 1 A 23 23 ALA CA C 23 49.178 50.703 -1.525 1
1 233 . 20 1 1 A 23 23 ALA CB C 23 22.797 21.740 1.057 1
1 234 . 20 1 1 A 23 23 ALA N N 23 118.749 122.460 -3.711 1
1 235 . 20 1 1 A 24 24 PHE H H 24 8.812 8.453 0.359 1
1 236 . 20 1 1 A 24 24 PHE HA H 24 5.125 4.847 0.278 1
1 240 . 20 1 1 A 24 24 PHE CA C 24 58.017 57.996 0.021 1
1 241 . 20 1 1 A 24 24 PHE CB C 24 40.475 40.464 0.011 1
1 242 . 20 1 1 A 24 24 PHE N N 24 122.891 121.862 1.029 1
1 243 . 20 1 1 A 25 25 VAL H H 25 8.880 8.963 -0.083 1
1 244 . 20 1 1 A 25 25 VAL HA H 25 4.660 4.706 -0.046 1
1 252 . 20 1 1 A 25 25 VAL CA C 25 60.379 61.107 -0.728 1
1 253 . 20 1 1 A 25 25 VAL CB C 25 35.654 35.056 0.598 1
1 256 . 20 1 1 A 25 25 VAL N N 25 122.908 121.326 1.582 1
1 257 . 20 1 1 A 26 26 ALA H H 26 9.403 8.743 0.660 1
1 258 . 20 1 1 A 26 26 ALA HA H 26 4.750 4.360 0.390 1
1 262 . 20 1 1 A 26 26 ALA C C 26 174.445 176.786 -2.341 1
1 263 . 20 1 1 A 26 26 ALA CA C 26 51.711 52.523 -0.812 1
1 264 . 20 1 1 A 26 26 ALA CB C 26 19.319 19.020 0.299 1
1 265 . 20 1 1 A 26 26 ALA N N 26 129.425 130.379 -0.954 1
1 266 . 20 1 1 A 27 27 LEU H H 27 8.601 9.322 -0.721 1
1 267 . 20 1 1 A 27 27 LEU HA H 27 4.158 4.593 -0.435 1
1 277 . 20 1 1 A 27 27 LEU C C 27 177.814 176.331 1.483 1
1 278 . 20 1 1 A 27 27 LEU CA C 27 55.869 55.745 0.124 1
1 279 . 20 1 1 A 27 27 LEU CB C 27 42.251 43.549 -1.298 1
1 283 . 20 1 1 A 27 27 LEU N N 27 127.169 122.854 4.315 1
1 284 . 20 1 1 A 28 28 ASP H H 28 8.172 7.806 0.366 1
1 285 . 20 1 1 A 28 28 ASP HA H 28 4.420 4.799 -0.379 1
1 288 . 20 1 1 A 28 28 ASP C C 28 177.116 175.347 1.769 1
1 289 . 20 1 1 A 28 28 ASP CA C 28 53.755 53.535 0.220 1
1 290 . 20 1 1 A 28 28 ASP CB C 28 39.833 43.693 -3.860 1
1 291 . 20 1 1 A 28 28 ASP N N 28 115.657 117.394 -1.737 1
1 292 . 20 1 1 A 29 29 GLU H H 29 8.857 8.643 0.214 1
1 293 . 20 1 1 A 29 29 GLU HA H 29 4.090 4.118 -0.028 1
1 298 . 20 1 1 A 29 29 GLU C C 29 175.965 176.690 -0.725 1
1 299 . 20 1 1 A 29 29 GLU CA C 29 59.470 58.940 0.530 1
1 300 . 20 1 1 A 29 29 GLU CB C 29 29.409 29.297 0.112 1
1 302 . 20 1 1 A 29 29 GLU N N 29 114.738 121.895 -7.157 1
1 303 . 20 1 1 A 30 30 GLU H H 30 8.326 8.215 0.111 1
1 304 . 20 1 1 A 30 30 GLU HA H 30 4.640 4.548 0.092 1
1 309 . 20 1 1 A 30 30 GLU C C 30 176.817 174.969 1.848 1
1 310 . 20 1 1 A 30 30 GLU CA C 30 56.073 55.969 0.104 1
1 311 . 20 1 1 A 30 30 GLU CB C 30 32.453 31.261 1.192 1
1 313 . 20 1 1 A 30 30 GLU N N 30 115.753 117.555 -1.802 1
1 314 . 20 1 1 A 31 31 THR H H 31 7.819 7.575 0.244 1
1 315 . 20 1 1 A 31 31 THR HA H 31 4.484 5.094 -0.610 1
1 320 . 20 1 1 A 31 31 THR C C 31 176.330 172.998 3.332 1
1 321 . 20 1 1 A 31 31 THR CA C 31 63.398 61.121 2.277 1
1 322 . 20 1 1 A 31 31 THR CB C 31 69.367 72.416 -3.049 1
1 324 . 20 1 1 A 31 31 THR N N 31 118.750 115.534 3.216 1
1 325 . 20 1 1 A 32 32 GLN H H 32 8.913 8.705 0.208 1
1 326 . 20 1 1 A 32 32 GLN HA H 32 5.337 4.801 0.536 1
1 333 . 20 1 1 A 32 32 GLN C C 32 173.087 174.432 -1.345 1
1 334 . 20 1 1 A 32 32 GLN CA C 32 54.051 54.857 -0.806 1
1 335 . 20 1 1 A 32 32 GLN CB C 32 32.672 32.909 -0.237 1
1 337 . 20 1 1 A 32 32 GLN N N 32 127.294 125.091 2.203 1
1 339 . 20 1 1 A 33 33 GLY H H 33 8.900 8.506 0.394 1
1 340 . 20 1 1 A 33 33 GLY HA2 H 33 3.290 4.350 -1.060 1
1 341 . 20 1 1 A 33 33 GLY HA3 H 33 4.530 4.414 0.116 1
1 342 . 20 1 1 A 33 33 GLY C C 33 174.918 172.259 2.659 1
1 343 . 20 1 1 A 33 33 GLY CA C 33 44.534 44.776 -0.242 1
1 344 . 20 1 1 A 33 33 GLY N N 33 107.639 110.662 -3.023 1
1 345 . 20 1 1 A 34 34 LEU H H 34 8.127 8.667 -0.540 1
1 346 . 20 1 1 A 34 34 LEU HA H 34 4.950 4.898 0.052 1
1 356 . 20 1 1 A 34 34 LEU CA C 34 53.755 53.772 -0.017 1
1 357 . 20 1 1 A 34 34 LEU CB C 34 45.493 45.324 0.169 1
1 361 . 20 1 1 A 34 34 LEU N N 34 120.897 121.045 -0.148 1
1 362 . 20 1 1 A 35 35 VAL H H 35 9.386 8.902 0.484 1
1 363 . 20 1 1 A 35 35 VAL HA H 35 4.479 4.387 0.092 1
1 371 . 20 1 1 A 35 35 VAL C C 35 176.402 175.401 1.001 1
1 372 . 20 1 1 A 35 35 VAL CA C 35 59.594 62.420 -2.826 1
1 373 . 20 1 1 A 35 35 VAL CB C 35 32.590 31.938 0.652 1
1 376 . 20 1 1 A 35 35 VAL N N 35 128.897 127.879 1.018 1
1 377 . 20 1 1 A 36 36 HIS H H 36 9.194 8.852 0.342 1
1 378 . 20 1 1 A 36 36 HIS HA H 36 4.487 4.541 -0.054 1
1 381 . 20 1 1 A 36 36 HIS C C 36 174.864 176.162 -1.298 1
1 382 . 20 1 1 A 36 36 HIS CA C 36 59.426 56.657 2.769 1
1 383 . 20 1 1 A 36 36 HIS CB C 36 31.542 30.824 0.718 1
1 384 . 20 1 1 A 36 36 HIS N N 36 127.751 126.953 0.798 1
1 385 . 20 1 1 A 37 37 ILE H H 37 7.454 8.463 -1.009 1
1 386 . 20 1 1 A 37 37 ILE HA H 37 3.810 3.587 0.223 1
1 396 . 20 1 1 A 37 37 ILE C C 37 176.948 177.739 -0.791 1
1 397 . 20 1 1 A 37 37 ILE CA C 37 63.773 64.738 -0.965 1
1 398 . 20 1 1 A 37 37 ILE CB C 37 38.993 37.366 1.627 1
1 402 . 20 1 1 A 37 37 ILE N N 37 126.266 127.055 -0.789 1
1 403 . 20 1 1 A 38 38 SER H H 38 8.343 8.212 0.131 1
1 404 . 20 1 1 A 38 38 SER HA H 38 4.370 4.328 0.042 1
1 407 . 20 1 1 A 38 38 SER C C 38 174.792 175.037 -0.245 1
1 408 . 20 1 1 A 38 38 SER CA C 38 60.567 61.967 -1.400 1
1 409 . 20 1 1 A 38 38 SER CB C 38 63.632 63.159 0.473 1
1 410 . 20 1 1 A 38 38 SER N N 38 118.079 118.537 -0.458 1
1 411 . 20 1 1 A 39 39 GLU H H 39 8.536 8.005 0.531 1
1 412 . 20 1 1 A 39 39 GLU HA H 39 4.503 4.652 -0.149 1
1 417 . 20 1 1 A 39 39 GLU C C 39 175.131 176.724 -1.593 1
1 418 . 20 1 1 A 39 39 GLU CA C 39 54.928 56.003 -1.075 1
1 419 . 20 1 1 A 39 39 GLU CB C 39 29.621 30.404 -0.783 1
1 421 . 20 1 1 A 39 39 GLU N N 39 118.349 117.075 1.274 1
1 422 . 20 1 1 A 40 40 VAL H H 40 7.776 7.611 0.165 1
1 423 . 20 1 1 A 40 40 VAL HA H 40 3.616 3.930 -0.314 1
1 431 . 20 1 1 A 40 40 VAL C C 40 177.277 176.164 1.113 1
1 432 . 20 1 1 A 40 40 VAL CA C 40 66.245 64.256 1.989 1
1 433 . 20 1 1 A 40 40 VAL CB C 40 32.590 32.157 0.433 1
1 436 . 20 1 1 A 40 40 VAL N N 40 125.443 117.509 7.934 1
1 437 . 20 1 1 A 41 41 THR H H 41 7.888 7.577 0.311 1
1 438 . 20 1 1 A 41 41 THR HA H 41 4.345 4.718 -0.373 1
1 443 . 20 1 1 A 41 41 THR C C 41 173.492 174.018 -0.526 1
1 444 . 20 1 1 A 41 41 THR CA C 41 59.047 61.453 -2.406 1
1 445 . 20 1 1 A 41 41 THR CB C 41 68.992 72.906 -3.914 1
1 447 . 20 1 1 A 41 41 THR N N 41 109.905 113.748 -3.843 1
1 448 . 20 1 1 A 42 42 HIS H H 42 8.063 8.119 -0.056 1
1 449 . 20 1 1 A 42 42 HIS HA H 42 4.510 4.629 -0.119 1
1 452 . 20 1 1 A 42 42 HIS C C 42 172.139 174.857 -2.718 1
1 453 . 20 1 1 A 42 42 HIS CA C 42 57.735 55.056 2.679 1
1 454 . 20 1 1 A 42 42 HIS CB C 42 31.144 29.289 1.855 1
1 455 . 20 1 1 A 42 42 HIS N N 42 121.760 121.349 0.411 1
1 456 . 20 1 1 A 43 43 GLY H H 43 8.286 7.393 0.893 1
1 457 . 20 1 1 A 43 43 GLY HA2 H 43 3.980 3.880 0.100 1
1 458 . 20 1 1 A 43 43 GLY HA3 H 43 3.980 4.036 -0.056 1
1 459 . 20 1 1 A 43 43 GLY C C 43 176.307 171.597 4.710 1
1 460 . 20 1 1 A 43 43 GLY CA C 43 44.336 45.743 -1.407 1
1 461 . 20 1 1 A 43 43 GLY N N 43 110.133 107.826 2.307 1
1 462 . 20 1 1 A 44 44 PHE H H 44 8.327 8.383 -0.056 1
1 463 . 20 1 1 A 44 44 PHE HA H 44 4.489 4.566 -0.077 1
1 467 . 20 1 1 A 44 44 PHE C C 44 171.877 176.179 -4.302 1
1 468 . 20 1 1 A 44 44 PHE CA C 44 58.027 58.248 -0.221 1
1 469 . 20 1 1 A 44 44 PHE CB C 44 39.850 39.870 -0.020 1
1 470 . 20 1 1 A 44 44 PHE N N 44 120.049 119.907 0.142 1
1 471 . 20 1 1 A 45 45 VAL H H 45 7.939 8.624 -0.685 1
1 472 . 20 1 1 A 45 45 VAL HA H 45 3.865 3.740 0.125 1
1 480 . 20 1 1 A 45 45 VAL C C 45 175.523 175.970 -0.447 1
1 481 . 20 1 1 A 45 45 VAL CA C 45 61.536 60.446 1.090 1
1 482 . 20 1 1 A 45 45 VAL CB C 45 33.127 33.936 -0.809 1
1 485 . 20 1 1 A 45 45 VAL N N 45 127.882 120.537 7.345 1
1 486 . 20 1 1 A 46 46 LYS H H 46 8.868 8.653 0.215 1
1 487 . 20 1 1 A 46 46 LYS HA H 46 4.170 4.117 0.053 1
1 496 . 20 1 1 A 46 46 LYS C C 46 175.728 176.188 -0.460 1
1 497 . 20 1 1 A 46 46 LYS CA C 46 57.198 58.593 -1.395 1
1 498 . 20 1 1 A 46 46 LYS CB C 46 33.299 33.039 0.260 1
1 502 . 20 1 1 A 46 46 LYS N N 46 127.308 127.358 -0.050 1
1 503 . 20 1 1 A 47 47 ASP H H 47 7.652 7.892 -0.240 1
1 504 . 20 1 1 A 47 47 ASP HA H 47 4.710 4.890 -0.180 1
1 507 . 20 1 1 A 47 47 ASP C C 47 176.411 176.036 0.375 1
1 508 . 20 1 1 A 47 47 ASP CA C 47 53.390 53.806 -0.416 1
1 509 . 20 1 1 A 47 47 ASP CB C 47 42.635 44.153 -1.518 1
1 510 . 20 1 1 A 47 47 ASP N N 47 117.932 114.866 3.066 1
1 511 . 20 1 1 A 48 48 ILE H H 48 9.230 8.625 0.605 1
1 512 . 20 1 1 A 48 48 ILE HA H 48 3.579 3.863 -0.284 1
1 522 . 20 1 1 A 48 48 ILE C C 48 177.249 177.933 -0.684 1
1 523 . 20 1 1 A 48 48 ILE CA C 48 65.525 63.509 2.016 1
1 524 . 20 1 1 A 48 48 ILE CB C 48 38.797 37.773 1.024 1
1 528 . 20 1 1 A 48 48 ILE N N 48 129.049 125.028 4.021 1
1 529 . 20 1 1 A 49 49 ASN H H 49 8.468 8.473 -0.005 1
1 530 . 20 1 1 A 49 49 ASN HA H 49 4.690 4.633 0.057 1
1 535 . 20 1 1 A 49 49 ASN C C 49 175.779 176.613 -0.834 1
1 536 . 20 1 1 A 49 49 ASN CA C 49 55.587 55.867 -0.280 1
1 537 . 20 1 1 A 49 49 ASN CB C 49 38.587 38.062 0.525 1
1 538 . 20 1 1 A 49 49 ASN N N 49 118.835 119.539 -0.704 1
1 540 . 20 1 1 A 50 50 GLU H H 50 7.853 7.999 -0.146 1
1 541 . 20 1 1 A 50 50 GLU HA H 50 4.040 4.283 -0.243 1
1 546 . 20 1 1 A 50 50 GLU C C 50 176.148 177.424 -1.276 1
1 547 . 20 1 1 A 50 50 GLU CA C 50 57.404 57.144 0.260 1
1 548 . 20 1 1 A 50 50 GLU CB C 50 29.491 30.125 -0.634 1
1 550 . 20 1 1 A 50 50 GLU N N 50 116.358 117.750 -1.392 1
1 551 . 20 1 1 A 51 51 HIS H H 51 7.575 7.863 -0.288 1
1 552 . 20 1 1 A 51 51 HIS HA H 51 4.431 4.754 -0.323 1
1 555 . 20 1 1 A 51 51 HIS C C 51 176.383 174.715 1.668 1
1 556 . 20 1 1 A 51 51 HIS CA C 51 57.089 56.337 0.752 1
1 557 . 20 1 1 A 51 51 HIS CB C 51 33.168 31.812 1.356 1
1 558 . 20 1 1 A 51 51 HIS N N 51 115.828 115.028 0.800 1
1 559 . 20 1 1 A 52 52 LEU H H 52 7.640 7.464 0.176 1
1 560 . 20 1 1 A 52 52 LEU HA H 52 4.796 4.811 -0.015 1
1 570 . 20 1 1 A 52 52 LEU C C 52 174.452 175.172 -0.720 1
1 571 . 20 1 1 A 52 52 LEU CA C 52 53.398 53.432 -0.034 1
1 572 . 20 1 1 A 52 52 LEU CB C 52 48.805 47.739 1.066 1
1 576 . 20 1 1 A 52 52 LEU N N 52 117.932 119.666 -1.734 1
1 577 . 20 1 1 A 53 53 SER H H 53 8.151 8.713 -0.562 1
1 578 . 20 1 1 A 53 53 SER HA H 53 4.680 4.906 -0.226 1
1 581 . 20 1 1 A 53 53 SER C C 53 174.304 172.917 1.387 1
1 582 . 20 1 1 A 53 53 SER CA C 53 56.714 57.486 -0.772 1
1 583 . 20 1 1 A 53 53 SER CB C 53 65.431 66.457 -1.026 1
1 584 . 20 1 1 A 53 53 SER N N 53 113.496 116.740 -3.244 1
1 585 . 20 1 1 A 54 54 VAL H H 54 8.782 8.524 0.258 1
1 586 . 20 1 1 A 54 54 VAL HA H 54 3.230 3.773 -0.543 1
1 594 . 20 1 1 A 54 54 VAL C C 54 173.745 177.183 -3.438 1
1 595 . 20 1 1 A 54 54 VAL CA C 54 66.232 63.627 2.605 1
1 596 . 20 1 1 A 54 54 VAL CB C 54 31.067 31.753 -0.686 1
1 599 . 20 1 1 A 54 54 VAL N N 54 124.401 126.386 -1.985 1
1 600 . 20 1 1 A 55 55 GLY H H 55 9.079 9.007 0.072 1
1 601 . 20 1 1 A 55 55 GLY HA2 H 55 3.530 3.847 -0.317 1
1 602 . 20 1 1 A 55 55 GLY HA3 H 55 4.553 3.849 0.704 1
1 603 . 20 1 1 A 55 55 GLY C C 55 177.219 173.191 4.028 1
1 604 . 20 1 1 A 55 55 GLY CA C 55 44.647 46.206 -1.559 1
1 605 . 20 1 1 A 55 55 GLY N N 55 117.320 116.007 1.313 1
1 606 . 20 1 1 A 56 56 ASP H H 56 7.943 7.735 0.208 1
1 607 . 20 1 1 A 56 56 ASP HA H 56 4.460 5.153 -0.693 1
1 610 . 20 1 1 A 56 56 ASP C C 56 176.055 173.913 2.142 1
1 611 . 20 1 1 A 56 56 ASP CA C 56 55.456 52.453 3.003 1
1 612 . 20 1 1 A 56 56 ASP CB C 56 40.914 44.433 -3.519 1
1 613 . 20 1 1 A 56 56 ASP N N 56 121.782 119.692 2.090 1
1 614 . 20 1 1 A 57 57 GLU H H 57 8.649 8.803 -0.154 1
1 615 . 20 1 1 A 57 57 GLU HA H 57 5.100 5.194 -0.094 1
1 620 . 20 1 1 A 57 57 GLU C C 57 175.635 175.824 -0.189 1
1 621 . 20 1 1 A 57 57 GLU CA C 57 55.805 55.495 0.310 1
1 622 . 20 1 1 A 57 57 GLU CB C 57 30.915 31.414 -0.499 1
1 624 . 20 1 1 A 57 57 GLU N N 57 122.513 122.904 -0.391 1
1 625 . 20 1 1 A 58 58 VAL H H 58 8.809 9.112 -0.303 1
1 626 . 20 1 1 A 58 58 VAL HA H 58 4.817 4.807 0.010 1
1 634 . 20 1 1 A 58 58 VAL C C 58 176.528 174.281 2.247 1
1 635 . 20 1 1 A 58 58 VAL CA C 58 58.719 59.275 -0.556 1
1 636 . 20 1 1 A 58 58 VAL CB C 58 35.523 35.950 -0.427 1
1 639 . 20 1 1 A 58 58 VAL N N 58 118.382 119.532 -1.150 1
1 640 . 20 1 1 A 59 59 GLN H H 59 8.255 8.500 -0.245 1
1 641 . 20 1 1 A 59 59 GLN HA H 59 5.030 4.970 0.060 1
1 646 . 20 1 1 A 59 59 GLN CA C 59 54.843 56.136 -1.293 1
1 647 . 20 1 1 A 59 59 GLN CB C 59 30.111 29.609 0.502 1
1 649 . 20 1 1 A 59 59 GLN N N 59 120.933 122.450 -1.517 1
1 650 . 20 1 1 A 60 60 VAL H H 60 8.970 9.274 -0.304 1
1 651 . 20 1 1 A 60 60 VAL HA H 60 4.990 4.864 0.126 1
1 659 . 20 1 1 A 60 60 VAL C C 60 175.203 173.918 1.285 1
1 660 . 20 1 1 A 60 60 VAL CA C 60 57.404 59.494 -2.090 1
1 661 . 20 1 1 A 60 60 VAL CB C 60 35.771 35.526 0.245 1
1 664 . 20 1 1 A 60 60 VAL N N 60 111.046 118.738 -7.692 1
1 665 . 20 1 1 A 61 61 LYS H H 61 8.937 8.842 0.095 1
1 666 . 20 1 1 A 61 61 LYS HA H 61 5.100 4.940 0.160 1
1 675 . 20 1 1 A 61 61 LYS C C 61 173.610 176.193 -2.583 1
1 676 . 20 1 1 A 61 61 LYS CA C 61 53.762 54.913 -1.151 1
1 677 . 20 1 1 A 61 61 LYS CB C 61 36.273 34.659 1.614 1
1 681 . 20 1 1 A 61 61 LYS N N 61 121.930 124.421 -2.491 1
1 682 . 20 1 1 A 62 62 VAL H H 62 8.429 9.275 -0.846 1
1 683 . 20 1 1 A 62 62 VAL HA H 62 4.074 4.006 0.068 1
1 691 . 20 1 1 A 62 62 VAL C C 62 176.912 175.824 1.088 1
1 692 . 20 1 1 A 62 62 VAL CA C 62 63.188 63.617 -0.429 1
1 693 . 20 1 1 A 62 62 VAL CB C 62 30.813 31.643 -0.830 1
1 696 . 20 1 1 A 62 62 VAL N N 62 126.329 127.253 -0.924 1
1 697 . 20 1 1 A 63 63 LEU H H 63 9.109 9.213 -0.104 1
1 698 . 20 1 1 A 63 63 LEU HA H 63 4.423 4.623 -0.200 1
1 708 . 20 1 1 A 63 63 LEU C C 63 176.091 176.685 -0.594 1
1 709 . 20 1 1 A 63 63 LEU CA C 63 55.876 55.531 0.345 1
1 710 . 20 1 1 A 63 63 LEU CB C 63 42.800 43.796 -0.996 1
1 714 . 20 1 1 A 63 63 LEU N N 63 129.436 127.545 1.891 1
1 715 . 20 1 1 A 64 64 ALA H H 64 7.594 7.427 0.167 1
1 716 . 20 1 1 A 64 64 ALA HA H 64 4.455 4.786 -0.331 1
1 720 . 20 1 1 A 64 64 ALA C C 64 177.314 175.229 2.085 1
1 721 . 20 1 1 A 64 64 ALA CA C 64 52.557 51.443 1.114 1
1 722 . 20 1 1 A 64 64 ALA CB C 64 21.458 22.798 -1.340 1
1 723 . 20 1 1 A 64 64 ALA N N 64 117.791 118.268 -0.477 1
1 724 . 20 1 1 A 65 65 VAL H H 65 8.583 8.641 -0.058 1
1 725 . 20 1 1 A 65 65 VAL HA H 65 4.470 4.803 -0.333 1
1 733 . 20 1 1 A 65 65 VAL C C 65 174.697 174.544 0.153 1
1 734 . 20 1 1 A 65 65 VAL CA C 65 61.936 60.875 1.061 1
1 735 . 20 1 1 A 65 65 VAL CB C 65 35.288 35.933 -0.645 1
1 738 . 20 1 1 A 65 65 VAL N N 65 120.009 120.205 -0.196 1
1 739 . 20 1 1 A 66 66 ASP H H 66 8.567 8.927 -0.360 1
1 740 . 20 1 1 A 66 66 ASP HA H 66 4.880 4.970 -0.090 1
1 743 . 20 1 1 A 66 66 ASP C C 66 174.355 175.754 -1.399 1
1 744 . 20 1 1 A 66 66 ASP CA C 66 52.681 53.346 -0.665 1
1 745 . 20 1 1 A 66 66 ASP CB C 66 41.775 42.183 -0.408 1
1 746 . 20 1 1 A 66 66 ASP N N 66 126.262 124.912 1.350 1
1 747 . 20 1 1 A 67 67 GLU H H 67 9.148 8.902 0.246 1
1 748 . 20 1 1 A 67 67 GLU HA H 67 4.110 4.263 -0.153 1
1 753 . 20 1 1 A 67 67 GLU C C 67 177.052 178.442 -1.390 1
1 754 . 20 1 1 A 67 67 GLU CA C 67 59.044 58.276 0.768 1
1 755 . 20 1 1 A 67 67 GLU CB C 67 29.919 29.545 0.374 1
1 757 . 20 1 1 A 67 67 GLU N N 67 125.480 124.718 0.762 1
1 758 . 20 1 1 A 68 68 GLU H H 68 8.384 7.993 0.391 1
1 759 . 20 1 1 A 68 68 GLU HA H 68 4.140 4.171 -0.031 1
1 764 . 20 1 1 A 68 68 GLU C C 68 178.383 179.078 -0.695 1
1 765 . 20 1 1 A 68 68 GLU CA C 68 59.044 58.936 0.108 1
1 766 . 20 1 1 A 68 68 GLU CB C 68 29.919 29.968 -0.049 1
1 768 . 20 1 1 A 68 68 GLU N N 68 119.760 120.132 -0.372 1
1 769 . 20 1 1 A 69 69 LYS H H 69 7.799 7.963 -0.164 1
1 770 . 20 1 1 A 69 69 LYS HA H 69 4.375 4.163 0.212 1
1 779 . 20 1 1 A 69 69 LYS C C 69 178.297 177.368 0.929 1
1 780 . 20 1 1 A 69 69 LYS CA C 69 55.704 56.520 -0.816 1
1 781 . 20 1 1 A 69 69 LYS CB C 69 33.622 32.780 0.842 1
1 785 . 20 1 1 A 69 69 LYS N N 69 115.476 116.968 -1.492 1
1 786 . 20 1 1 A 70 70 GLY H H 70 7.994 8.261 -0.267 1
1 787 . 20 1 1 A 70 70 GLY HA2 H 70 3.940 3.961 -0.021 1
1 788 . 20 1 1 A 70 70 GLY HA3 H 70 3.960 3.968 -0.008 1
1 789 . 20 1 1 A 70 70 GLY C C 70 177.215 174.097 3.118 1
1 790 . 20 1 1 A 70 70 GLY CA C 70 46.773 46.653 0.120 1
1 791 . 20 1 1 A 70 70 GLY N N 70 110.245 108.446 1.799 1
1 792 . 20 1 1 A 71 71 LYS H H 71 7.560 8.051 -0.491 1
1 793 . 20 1 1 A 71 71 LYS HA H 71 4.690 4.957 -0.267 1
1 802 . 20 1 1 A 71 71 LYS C C 71 174.607 175.188 -0.581 1
1 803 . 20 1 1 A 71 71 LYS CA C 71 55.332 54.382 0.950 1
1 804 . 20 1 1 A 71 71 LYS CB C 71 34.903 36.263 -1.360 1
1 808 . 20 1 1 A 71 71 LYS N N 71 118.201 118.703 -0.502 1
1 809 . 20 1 1 A 72 72 ILE H H 72 8.867 8.722 0.145 1
1 810 . 20 1 1 A 72 72 ILE HA H 72 4.630 4.972 -0.342 1
1 820 . 20 1 1 A 72 72 ILE C C 72 175.708 174.429 1.279 1
1 821 . 20 1 1 A 72 72 ILE CA C 72 61.494 60.172 1.322 1
1 822 . 20 1 1 A 72 72 ILE CB C 72 40.652 42.217 -1.565 1
1 826 . 20 1 1 A 72 72 ILE N N 72 126.827 121.672 5.155 1
1 827 . 20 1 1 A 73 73 SER H H 73 8.815 8.994 -0.179 1
1 828 . 20 1 1 A 73 73 SER HA H 73 5.110 5.279 -0.169 1
1 831 . 20 1 1 A 73 73 SER C C 73 175.122 173.412 1.710 1
1 832 . 20 1 1 A 73 73 SER CA C 73 57.487 58.060 -0.573 1
1 833 . 20 1 1 A 73 73 SER CB C 73 64.386 64.742 -0.356 1
1 834 . 20 1 1 A 73 73 SER N N 73 123.640 124.913 -1.273 1
1 835 . 20 1 1 A 74 74 LEU H H 74 8.585 8.925 -0.340 1
1 836 . 20 1 1 A 74 74 LEU HA H 74 5.450 5.311 0.139 1
1 846 . 20 1 1 A 74 74 LEU C C 74 174.061 175.582 -1.521 1
1 847 . 20 1 1 A 74 74 LEU CA C 74 53.101 53.359 -0.258 1
1 848 . 20 1 1 A 74 74 LEU CB C 74 48.268 46.587 1.681 1
1 852 . 20 1 1 A 74 74 LEU N N 74 125.221 125.181 0.040 1
1 853 . 20 1 1 A 75 75 SER H H 75 8.840 8.734 0.106 1
1 854 . 20 1 1 A 75 75 SER HA H 75 5.040 5.052 -0.012 1
1 857 . 20 1 1 A 75 75 SER C C 75 176.552 173.398 3.154 1
1 858 . 20 1 1 A 75 75 SER CA C 75 57.487 57.149 0.338 1
1 859 . 20 1 1 A 75 75 SER CB C 75 64.993 66.550 -1.557 1
1 860 . 20 1 1 A 75 75 SER N N 75 111.252 116.190 -4.938 1
1 861 . 20 1 1 A 76 76 ILE H H 76 7.790 8.763 -0.973 1
1 862 . 20 1 1 A 76 76 ILE HA H 76 4.690 4.613 0.077 1
1 872 . 20 1 1 A 76 76 ILE C C 76 175.780 177.020 -1.240 1
1 873 . 20 1 1 A 76 76 ILE CA C 76 63.631 61.188 2.443 1
1 874 . 20 1 1 A 76 76 ILE CB C 76 39.484 39.280 0.204 1
1 878 . 20 1 1 A 76 76 ILE N N 76 129.205 124.176 5.029 1
1 879 . 20 1 1 A 77 77 ARG H H 77 8.115 8.587 -0.472 1
1 880 . 20 1 1 A 77 77 ARG HA H 77 3.760 4.085 -0.325 1
1 887 . 20 1 1 A 77 77 ARG C C 77 178.704 178.035 0.669 1
1 888 . 20 1 1 A 77 77 ARG CA C 77 58.933 58.678 0.255 1
1 889 . 20 1 1 A 77 77 ARG CB C 77 29.463 29.884 -0.421 1
1 892 . 20 1 1 A 77 77 ARG N N 77 123.257 122.024 1.233 1
1 893 . 20 1 1 A 78 78 ALA H H 78 8.304 7.716 0.588 1
1 894 . 20 1 1 A 78 78 ALA HA H 78 4.296 4.162 0.134 1
1 898 . 20 1 1 A 78 78 ALA C C 78 176.870 178.015 -1.145 1
1 899 . 20 1 1 A 78 78 ALA CA C 78 53.548 54.244 -0.696 1
1 900 . 20 1 1 A 78 78 ALA CB C 78 19.872 18.408 1.464 1
1 901 . 20 1 1 A 78 78 ALA N N 78 118.764 121.553 -2.789 1
1 902 . 20 1 1 A 79 79 THR H H 79 7.931 7.746 0.185 1
1 903 . 20 1 1 A 79 79 THR HA H 79 4.370 4.578 -0.208 1
1 908 . 20 1 1 A 79 79 THR C C 79 178.356 175.807 2.549 1
1 909 . 20 1 1 A 79 79 THR CA C 79 62.381 61.564 0.817 1
1 910 . 20 1 1 A 79 79 THR CB C 79 69.693 70.337 -0.644 1
1 912 . 20 1 1 A 79 79 THR N N 79 107.360 106.302 1.058 1
1 913 . 20 1 1 A 80 80 GLN H H 80 7.651 8.064 -0.413 1
1 914 . 20 1 1 A 80 80 GLN HA H 80 4.527 4.117 0.410 1
1 921 . 20 1 1 A 80 80 GLN C C 80 174.249 177.248 -2.999 1
1 922 . 20 1 1 A 80 80 GLN CA C 80 54.760 58.761 -4.001 1
1 923 . 20 1 1 A 80 80 GLN CB C 80 30.565 28.129 2.436 1
1 925 . 20 1 1 A 80 80 GLN N N 80 121.588 120.075 1.513 1
1 927 . 20 1 1 A 81 81 ALA H H 81 8.498 7.571 0.927 1
1 928 . 20 1 1 A 81 81 ALA HA H 81 4.252 4.350 -0.098 1
1 932 . 20 1 1 A 81 81 ALA C C 81 175.693 177.724 -2.031 1
1 933 . 20 1 1 A 81 81 ALA CA C 81 52.345 52.939 -0.594 1
1 934 . 20 1 1 A 81 81 ALA CB C 81 19.062 18.606 0.456 1
1 935 . 20 1 1 A 81 81 ALA N N 81 126.423 122.300 4.123 1
1 936 . 20 1 1 A 82 82 ALA H H 82 8.324 8.686 -0.362 1
1 937 . 20 1 1 A 82 82 ALA HA H 82 4.000 3.828 0.172 1
1 941 . 20 1 1 A 82 82 ALA C C 82 177.065 176.189 0.876 1
1 942 . 20 1 1 A 82 82 ALA CA C 82 50.240 52.815 -2.575 1
1 943 . 20 1 1 A 82 82 ALA CB C 82 17.650 17.683 -0.033 1
1 944 . 20 1 1 A 82 82 ALA N N 82 125.114 122.678 2.436 1
1 945 . 20 1 1 A 83 83 PRO HA H 83 4.350 4.538 -0.188 1
1 952 . 20 1 1 A 83 83 PRO CA C 83 63.148 62.785 0.363 1
1 953 . 20 1 1 A 83 83 PRO CB C 83 32.054 32.545 -0.491 1
1 956 . 20 1 1 A 84 84 GLU H H 84 8.517 9.191 -0.674 1
1 957 . 20 1 1 A 84 84 GLU HA H 84 4.197 4.208 -0.011 1
1 962 . 20 1 1 A 84 84 GLU C C 84 176.948 177.359 -0.411 1
1 963 . 20 1 1 A 84 84 GLU CA C 84 56.674 58.672 -1.998 1
1 964 . 20 1 1 A 84 84 GLU CB C 84 30.459 29.635 0.824 1
1 966 . 20 1 1 A 84 84 GLU N N 84 121.479 121.286 0.193 1
1 967 . 20 1 1 A 85 85 LYS H H 85 8.381 7.392 0.989 1
1 968 . 20 1 1 A 85 85 LYS HA H 85 4.309 4.334 -0.025 1
1 977 . 20 1 1 A 85 85 LYS C C 85 176.457 177.714 -1.257 1
1 978 . 20 1 1 A 85 85 LYS CA C 85 56.272 56.642 -0.370 1
1 979 . 20 1 1 A 85 85 LYS CB C 85 32.961 32.812 0.149 1
1 983 . 20 1 1 A 85 85 LYS N N 85 123.266 120.784 2.482 1
1 984 . 20 1 1 A 86 86 LYS H H 86 8.403 8.482 -0.079 1
1 985 . 20 1 1 A 86 86 LYS HA H 86 4.308 4.026 0.282 1
1 994 . 20 1 1 A 86 86 LYS C C 86 176.435 176.707 -0.272 1
1 995 . 20 1 1 A 86 86 LYS CA C 86 56.272 58.303 -2.031 1
1 996 . 20 1 1 A 86 86 LYS CB C 86 32.961 32.750 0.211 1
1 1000 . 20 1 1 A 86 86 LYS N N 86 123.688 122.354 1.334 1
1 1001 . 20 1 1 A 87 87 GLU H H 87 8.540 7.874 0.666 1
1 1002 . 20 1 1 A 87 87 GLU HA H 87 4.358 4.656 -0.298 1
1 1007 . 20 1 1 A 87 87 GLU C C 87 176.556 176.257 0.299 1
1 1008 . 20 1 1 A 87 87 GLU CA C 87 56.406 55.572 0.834 1
1 1009 . 20 1 1 A 87 87 GLU CB C 87 30.607 32.056 -1.449 1
1 1011 . 20 1 1 A 87 87 GLU N N 87 122.633 118.700 3.933 1
1 1012 . 20 1 1 A 88 88 SER H H 88 8.520 8.934 -0.414 1
1 1013 . 20 1 1 A 88 88 SER HA H 88 4.490 4.290 0.200 1
1 1016 . 20 1 1 A 88 88 SER C C 88 175.780 175.440 0.340 1
1 1017 . 20 1 1 A 88 88 SER CA C 88 58.431 62.089 -3.658 1
1 1018 . 20 1 1 A 88 88 SER CB C 88 63.858 63.207 0.651 1
1 1019 . 20 1 1 A 88 88 SER N N 88 118.333 121.191 -2.858 1
1 1020 . 20 1 1 A 89 89 LYS H H 89 8.339 7.627 0.712 1
1 1021 . 20 1 1 A 89 89 LYS HA H 89 4.620 4.440 0.180 1
1 1030 . 20 1 1 A 89 89 LYS C C 89 174.160 174.578 -0.418 1
1 1031 . 20 1 1 A 89 89 LYS CA C 89 54.265 54.823 -0.558 1
1 1032 . 20 1 1 A 89 89 LYS CB C 89 32.672 31.453 1.219 1
1 1036 . 20 1 1 A 89 89 LYS N N 89 124.433 120.054 4.379 1
1 1037 . 20 1 1 A 90 90 PRO HA H 90 4.417 4.559 -0.142 1
1 1044 . 20 1 1 A 90 90 PRO CA C 90 63.064 62.375 0.689 1
1 1045 . 20 1 1 A 90 90 PRO CB C 90 32.266 32.654 -0.388 1
1 1048 . 20 1 1 A 91 91 ARG H H 91 8.502 8.487 0.015 1
1 1049 . 20 1 1 A 91 91 ARG HA H 91 4.305 3.959 0.346 1
1 1056 . 20 1 1 A 91 91 ARG C C 91 176.831 176.098 0.733 1
1 1057 . 20 1 1 A 91 91 ARG CA C 91 56.002 58.939 -2.937 1
1 1058 . 20 1 1 A 91 91 ARG CB C 91 30.913 30.665 0.248 1
1 1061 . 20 1 1 A 91 91 ARG N N 91 122.193 121.125 1.068 1
1 1062 . 20 1 1 A 92 92 LYS H H 92 8.415 7.757 0.658 1
1 1063 . 20 1 1 A 92 92 LYS HA H 92 4.610 4.180 0.430 1
1 1072 . 20 1 1 A 92 92 LYS C C 92 176.262 175.811 0.451 1
1 1073 . 20 1 1 A 92 92 LYS CA C 92 54.258 56.523 -2.265 1
1 1074 . 20 1 1 A 92 92 LYS CB C 92 32.672 30.715 1.957 1
1 1078 . 20 1 1 A 92 92 LYS N N 92 124.243 115.162 9.081 1
1 1079 . 20 1 1 A 93 93 PRO HA H 93 4.415 4.335 0.080 1
1 1086 . 20 1 1 A 93 93 PRO CA C 93 62.899 63.853 -0.954 1
1 1087 . 20 1 1 A 93 93 PRO CB C 93 32.323 32.017 0.306 1
1 1090 . 20 1 1 A 94 94 LYS H H 94 8.420 8.673 -0.253 1
1 1091 . 20 1 1 A 94 94 LYS HA H 94 4.290 3.884 0.406 1
1 1100 . 20 1 1 A 94 94 LYS C C 94 176.714 175.931 0.783 1
1 1101 . 20 1 1 A 94 94 LYS CA C 94 56.585 58.254 -1.669 1
1 1102 . 20 1 1 A 94 94 LYS CB C 94 33.161 30.678 2.483 1
1 1106 . 20 1 1 A 94 94 LYS N N 94 122.121 116.739 5.382 1
1 1107 . 20 1 1 A 95 95 ALA H H 95 8.348 7.716 0.632 1
1 1108 . 20 1 1 A 95 95 ALA HA H 95 4.250 4.505 -0.255 1
1 1112 . 20 1 1 A 95 95 ALA C C 95 176.453 176.516 -0.063 1
1 1113 . 20 1 1 A 95 95 ALA CA C 95 52.471 51.257 1.214 1
1 1114 . 20 1 1 A 95 95 ALA CB C 95 19.347 19.460 -0.113 1
1 1115 . 20 1 1 A 95 95 ALA N N 95 125.624 119.048 6.576 1
1 1116 . 20 1 1 A 96 96 ALA H H 96 8.348 7.499 0.849 1
1 1117 . 20 1 1 A 96 96 ALA HA H 96 4.254 4.356 -0.102 1
1 1121 . 20 1 1 A 96 96 ALA C C 96 176.462 177.744 -1.282 1
1 1122 . 20 1 1 A 96 96 ALA CA C 96 52.471 53.220 -0.749 1
1 1123 . 20 1 1 A 96 96 ALA CB C 96 19.347 18.990 0.357 1
1 1124 . 20 1 1 A 96 96 ALA N N 96 125.624 121.543 4.081 1
1 1125 . 20 1 1 A 97 97 GLN H H 97 8.333 8.602 -0.269 1
1 1126 . 20 1 1 A 97 97 GLN HA H 97 4.362 4.389 -0.027 1
1 1133 . 20 1 1 A 97 97 GLN C C 97 177.684 175.148 2.536 1
1 1134 . 20 1 1 A 97 97 GLN CA C 97 55.848 55.952 -0.104 1
1 1135 . 20 1 1 A 97 97 GLN CB C 97 29.643 29.881 -0.238 1
1 1137 . 20 1 1 A 97 97 GLN N N 97 120.049 121.461 -1.412 1
1 1139 . 20 1 1 A 98 98 VAL H H 98 8.230 8.334 -0.104 1
1 1140 . 20 1 1 A 98 98 VAL HA H 98 4.145 4.033 0.112 1
1 1148 . 20 1 1 A 98 98 VAL C C 98 176.033 175.535 0.498 1
1 1149 . 20 1 1 A 98 98 VAL CA C 98 62.444 62.002 0.442 1
1 1150 . 20 1 1 A 98 98 VAL CB C 98 32.942 32.824 0.118 1
1 1153 . 20 1 1 A 98 98 VAL N N 98 121.607 120.781 0.826 1
1 1154 . 20 1 1 A 99 99 SER H H 99 8.375 8.422 -0.047 1
1 1155 . 20 1 1 A 99 99 SER HA H 99 4.473 4.420 0.053 1
1 1158 . 20 1 1 A 99 99 SER C C 99 176.204 174.286 1.918 1
1 1159 . 20 1 1 A 99 99 SER CA C 99 58.379 59.330 -0.951 1
1 1160 . 20 1 1 A 99 99 SER CB C 99 63.914 64.150 -0.236 1
1 1161 . 20 1 1 A 99 99 SER N N 99 119.455 119.899 -0.444 1
1 1162 . 20 1 1 A 100 100 GLU H H 100 8.547 8.723 -0.176 1
1 1163 . 20 1 1 A 100 100 GLU HA H 100 4.304 4.725 -0.421 1
1 1168 . 20 1 1 A 100 100 GLU C C 100 174.620 176.610 -1.990 1
1 1169 . 20 1 1 A 100 100 GLU CA C 100 56.835 54.495 2.340 1
1 1170 . 20 1 1 A 100 100 GLU CB C 100 30.365 32.984 -2.619 1
1 1172 . 20 1 1 A 100 100 GLU N N 100 123.419 122.865 0.554 1
1 1173 . 20 1 1 A 101 101 GLU H H 101 8.432 8.920 -0.488 1
1 1174 . 20 1 1 A 101 101 GLU HA H 101 4.252 4.065 0.187 1
1 1179 . 20 1 1 A 101 101 GLU C C 101 176.693 177.298 -0.605 1
1 1180 . 20 1 1 A 101 101 GLU CA C 101 56.835 59.018 -2.183 1
1 1181 . 20 1 1 A 101 101 GLU CB C 101 30.365 29.436 0.929 1
1 1183 . 20 1 1 A 101 101 GLU N N 101 122.025 122.736 -0.711 1
1 1184 . 20 1 1 A 102 102 ALA H H 102 8.324 7.443 0.881 1
1 1185 . 20 1 1 A 102 102 ALA HA H 102 4.361 4.116 0.245 1
1 1189 . 20 1 1 A 102 102 ALA C C 102 177.065 177.702 -0.637 1
1 1190 . 20 1 1 A 102 102 ALA CA C 102 52.647 53.204 -0.557 1
1 1191 . 20 1 1 A 102 102 ALA CB C 102 19.227 19.236 -0.009 1
1 1192 . 20 1 1 A 102 102 ALA N N 102 125.114 122.800 2.314 1
1 1193 . 20 1 1 A 103 103 SER H H 103 8.259 8.702 -0.443 1
1 1194 . 20 1 1 A 103 103 SER HA H 103 4.473 4.761 -0.288 1
1 1197 . 20 1 1 A 103 103 SER C C 103 177.772 173.848 3.924 1
1 1198 . 20 1 1 A 103 103 SER CA C 103 58.301 57.790 0.511 1
1 1199 . 20 1 1 A 103 103 SER CB C 103 63.961 64.954 -0.993 1
1 1200 . 20 1 1 A 103 103 SER N N 103 115.109 120.257 -5.148 1
1 1201 . 20 1 1 A 104 104 THR H H 104 8.127 7.469 0.658 1
1 1202 . 20 1 1 A 104 104 THR HA H 104 4.600 4.422 0.178 1
1 1207 . 20 1 1 A 104 104 THR C C 104 174.427 174.711 -0.284 1
1 1208 . 20 1 1 A 104 104 THR CA C 104 59.954 61.512 -1.558 1
1 1209 . 20 1 1 A 104 104 THR CB C 104 69.868 68.660 1.208 1
1 1211 . 20 1 1 A 104 104 THR N N 104 117.882 117.041 0.841 1
1 1212 . 20 1 1 A 105 105 PRO HA H 105 4.414 4.292 0.122 1
1 1219 . 20 1 1 A 105 105 PRO CA C 105 63.300 65.226 -1.926 1
1 1220 . 20 1 1 A 105 105 PRO CB C 105 32.227 31.750 0.477 1
1 1223 . 20 1 1 A 106 106 GLN H H 106 8.524 8.248 0.276 1
1 1224 . 20 1 1 A 106 106 GLN HA H 106 4.276 4.052 0.224 1
1 1229 . 20 1 1 A 106 106 GLN C C 106 177.083 178.661 -1.578 1
1 1230 . 20 1 1 A 106 106 GLN CA C 106 56.209 59.188 -2.979 1
1 1231 . 20 1 1 A 106 106 GLN CB C 106 29.490 28.270 1.220 1
1 1233 . 20 1 1 A 106 106 GLN N N 106 120.754 117.644 3.110 1
1 1234 . 20 1 1 A 107 107 GLY H H 107 8.394 8.376 0.018 1
1 1235 . 20 1 1 A 107 107 GLY HA2 H 107 3.895 3.697 0.198 1
1 1236 . 20 1 1 A 107 107 GLY HA3 H 107 3.895 3.719 0.176 1
1 1237 . 20 1 1 A 107 107 GLY C C 107 176.651 175.837 0.814 1
1 1238 . 20 1 1 A 107 107 GLY CA C 107 45.330 47.328 -1.998 1
1 1239 . 20 1 1 A 107 107 GLY N N 107 110.026 106.498 3.528 1
1 1240 . 20 1 1 A 108 108 PHE H H 108 8.099 7.789 0.310 1
1 1241 . 20 1 1 A 108 108 PHE HA H 108 4.582 4.029 0.553 1
1 1245 . 20 1 1 A 108 108 PHE C C 108 173.944 177.960 -4.016 1
1 1246 . 20 1 1 A 108 108 PHE CA C 108 58.054 60.692 -2.638 1
1 1247 . 20 1 1 A 108 108 PHE CB C 108 39.708 39.400 0.308 1
1 1248 . 20 1 1 A 108 108 PHE N N 108 120.180 122.619 -2.439 1
1 1249 . 20 1 1 A 109 109 ASN H H 109 8.482 8.502 -0.020 1
1 1250 . 20 1 1 A 109 109 ASN HA H 109 4.691 4.537 0.154 1
1 1255 . 20 1 1 A 109 109 ASN C C 109 175.627 177.400 -1.773 1
1 1256 . 20 1 1 A 109 109 ASN CA C 109 53.402 55.887 -2.485 1
1 1257 . 20 1 1 A 109 109 ASN CB C 109 38.883 39.279 -0.396 1
1 1258 . 20 1 1 A 109 109 ASN N N 109 120.752 117.695 3.057 1
1 1260 . 20 1 1 A 110 110 THR H H 110 8.112 7.834 0.278 1
1 1261 . 20 1 1 A 110 110 THR HA H 110 4.251 4.048 0.203 1
1 1266 . 20 1 1 A 110 110 THR C C 110 175.275 174.862 0.413 1
1 1267 . 20 1 1 A 110 110 THR CA C 110 62.460 65.761 -3.301 1
1 1268 . 20 1 1 A 110 110 THR CB C 110 69.726 68.648 1.078 1
1 1270 . 20 1 1 A 110 110 THR N N 110 114.601 113.023 1.578 1
1 1271 . 20 1 1 A 111 111 LEU H H 111 8.168 7.352 0.816 1
1 1272 . 20 1 1 A 111 111 LEU HA H 111 4.308 4.159 0.149 1
1 1282 . 20 1 1 A 111 111 LEU CA C 111 55.704 54.976 0.728 1
1 1283 . 20 1 1 A 111 111 LEU CB C 111 42.071 42.128 -0.057 1
1 1287 . 20 1 1 A 111 111 LEU N N 111 123.756 120.204 3.552 1
1 1288 . 20 1 1 A 112 112 LYS H H 112 8.123 9.174 -1.051 1
1 1289 . 20 1 1 A 112 112 LYS HA H 112 4.242 4.259 -0.017 1
1 1298 . 20 1 1 A 112 112 LYS C C 112 177.547 175.903 1.644 1
1 1299 . 20 1 1 A 112 112 LYS CA C 112 56.928 56.806 0.122 1
1 1300 . 20 1 1 A 112 112 LYS CB C 112 33.055 33.043 0.012 1
1 1304 . 20 1 1 A 112 112 LYS N N 112 121.442 122.788 -1.346 1
1 1305 . 20 1 1 A 113 113 ASP H H 113 8.230 7.665 0.565 1
1 1306 . 20 1 1 A 113 113 ASP HA H 113 4.526 4.944 -0.418 1
1 1309 . 20 1 1 A 113 113 ASP C C 113 176.532 174.404 2.128 1
1 1310 . 20 1 1 A 113 113 ASP CA C 113 54.896 53.027 1.869 1
1 1311 . 20 1 1 A 113 113 ASP CB C 113 41.362 44.691 -3.329 1
1 1312 . 20 1 1 A 113 113 ASP N N 113 120.598 118.015 2.583 1
1 1313 . 20 1 1 A 114 114 LYS H H 114 8.127 8.483 -0.356 1
1 1314 . 20 1 1 A 114 114 LYS HA H 114 4.300 3.941 0.359 1
1 1323 . 20 1 1 A 114 114 LYS C C 114 176.303 177.398 -1.095 1
1 1324 . 20 1 1 A 114 114 LYS CA C 114 56.633 57.146 -0.513 1
1 1325 . 20 1 1 A 114 114 LYS CB C 114 32.818 32.827 -0.009 1
1 1329 . 20 1 1 A 114 114 LYS N N 114 120.897 122.973 -2.076 1
1 1330 . 20 1 1 A 115 115 LEU H H 115 8.244 8.519 -0.275 1
1 1331 . 20 1 1 A 115 115 LEU HA H 115 4.254 3.946 0.308 1
1 1341 . 20 1 1 A 115 115 LEU C C 115 176.909 176.489 0.420 1
1 1342 . 20 1 1 A 115 115 LEU CA C 115 56.282 56.032 0.250 1
1 1343 . 20 1 1 A 115 115 LEU CB C 115 42.188 41.636 0.552 1
1 1347 . 20 1 1 A 115 115 LEU N N 115 123.251 123.437 -0.186 1
1 1348 . 20 1 1 A 116 116 GLU H H 116 8.421 7.478 0.943 1
1 1349 . 20 1 1 A 116 116 GLU HA H 116 4.190 3.730 0.460 1
1 1352 . 20 1 1 A 116 116 GLU C C 116 177.828 177.054 0.774 1
1 1353 . 20 1 1 A 116 116 GLU CA C 116 57.466 57.689 -0.223 1
1 1354 . 20 1 1 A 116 116 GLU CB C 116 30.124 29.423 0.701 1
1 1355 . 20 1 1 A 116 116 GLU N N 116 120.575 120.655 -0.080 1
1 1356 . 20 1 1 A 117 117 GLU H H 117 8.255 9.216 -0.961 1
1 1357 . 20 1 1 A 117 117 GLU HA H 117 4.192 3.942 0.250 1
1 1362 . 20 1 1 A 117 117 GLU CA C 117 57.491 57.825 -0.334 1
1 1363 . 20 1 1 A 117 117 GLU CB C 117 30.365 28.032 2.333 1
1 1365 . 20 1 1 A 117 117 GLU N N 117 120.933 124.491 -3.558 1
1 1366 . 20 1 1 A 118 118 TRP H H 118 8.143 7.741 0.402 1
1 1367 . 20 1 1 A 118 118 TRP HA H 118 4.581 4.198 0.383 1
1 1372 . 20 1 1 A 118 118 TRP C C 118 176.794 175.283 1.511 1
1 1373 . 20 1 1 A 118 118 TRP CA C 118 58.363 58.367 -0.004 1
1 1374 . 20 1 1 A 118 118 TRP CB C 118 29.333 26.511 2.822 1
1 1375 . 20 1 1 A 118 118 TRP N N 118 121.592 111.774 9.818 1
1 1376 . 20 1 1 A 119 119 ILE H H 119 7.908 7.966 -0.058 1
1 1377 . 20 1 1 A 119 119 ILE HA H 119 3.828 4.170 -0.342 1
1 1387 . 20 1 1 A 119 119 ILE C C 119 176.984 175.096 1.888 1
1 1388 . 20 1 1 A 119 119 ILE CA C 119 62.335 61.931 0.404 1
1 1389 . 20 1 1 A 119 119 ILE CB C 119 38.649 39.346 -0.697 1
1 1393 . 20 1 1 A 119 119 ILE N N 119 122.744 121.934 0.810 1
1 1394 . 20 1 1 A 120 120 GLU H H 120 8.143 8.704 -0.561 1
1 1395 . 20 1 1 A 120 120 GLU HA H 120 4.093 4.512 -0.419 1
1 1400 . 20 1 1 A 120 120 GLU C C 120 176.565 176.746 -0.181 1
1 1401 . 20 1 1 A 120 120 GLU CA C 120 57.613 55.532 2.081 1
1 1402 . 20 1 1 A 120 120 GLU CB C 120 29.834 29.276 0.558 1
1 1404 . 20 1 1 A 120 120 GLU N N 120 123.139 129.202 -6.063 1
1 1405 . 20 1 1 A 121 121 MET H H 121 8.254 8.345 -0.091 1
1 1406 . 20 1 1 A 121 121 MET HA H 121 4.357 4.448 -0.091 1
1 1411 . 20 1 1 A 121 121 MET CA C 121 56.625 58.262 -1.637 1
1 1412 . 20 1 1 A 121 121 MET CB C 121 32.664 31.317 1.347 1
1 1414 . 20 1 1 A 121 121 MET N N 121 120.449 124.583 -4.134 1
1 1415 . 20 1 1 A 122 122 SER H H 122 8.199 8.307 -0.108 1
1 1416 . 20 1 1 A 122 122 SER HA H 122 4.280 4.267 0.013 1
1 1419 . 20 1 1 A 122 122 SER C C 122 177.224 176.076 1.148 1
1 1420 . 20 1 1 A 122 122 SER CA C 122 59.635 61.797 -2.162 1
1 1421 . 20 1 1 A 122 122 SER CB C 122 63.560 62.976 0.584 1
1 1422 . 20 1 1 A 122 122 SER N N 122 115.857 117.749 -1.892 1
1 1423 . 20 1 1 A 123 123 ASN H H 123 8.211 8.234 -0.023 1
1 1424 . 20 1 1 A 123 123 ASN HA H 123 4.737 4.378 0.359 1
1 1429 . 20 1 1 A 123 123 ASN C C 123 174.709 177.816 -3.107 1
1 1430 . 20 1 1 A 123 123 ASN CA C 123 53.507 56.565 -3.058 1
1 1431 . 20 1 1 A 123 123 ASN CB C 123 38.800 39.021 -0.221 1
1 1432 . 20 1 1 A 123 123 ASN N N 123 119.923 120.065 -0.142 1
1 1434 . 20 1 1 A 124 124 ARG H H 124 7.997 7.667 0.330 1
1 1435 . 20 1 1 A 124 124 ARG HA H 124 4.305 3.808 0.497 1
1 1442 . 20 1 1 A 124 124 ARG C C 124 175.477 178.707 -3.230 1
1 1443 . 20 1 1 A 124 124 ARG CA C 124 56.709 58.726 -2.017 1
1 1444 . 20 1 1 A 124 124 ARG CB C 124 30.584 29.275 1.309 1
1 1447 . 20 1 1 A 124 124 ARG N N 124 120.821 119.944 0.877 1
1 1448 . 20 1 1 A 125 125 LYS H H 125 8.327 7.426 0.901 1
1 1449 . 20 1 1 A 125 125 LYS HA H 125 4.254 4.236 0.018 1
1 1458 . 20 1 1 A 125 125 LYS C C 125 176.777 175.687 1.090 1
1 1459 . 20 1 1 A 125 125 LYS CA C 125 56.860 56.306 0.554 1
1 1460 . 20 1 1 A 125 125 LYS CB C 125 32.879 32.654 0.225 1
1 1464 . 20 1 1 A 125 125 LYS N N 125 121.891 115.933 5.958 1
1 1465 . 20 1 1 A 126 126 ASP H H 126 8.343 8.123 0.220 1
1 1466 . 20 1 1 A 126 126 ASP HA H 126 4.581 4.263 0.318 1
1 1469 . 20 1 1 A 126 126 ASP C C 126 176.538 176.071 0.467 1
1 1470 . 20 1 1 A 126 126 ASP CA C 126 54.540 54.945 -0.405 1
1 1471 . 20 1 1 A 126 126 ASP CB C 126 40.907 39.675 1.232 1
1 1472 . 20 1 1 A 126 126 ASP N N 126 119.814 118.816 0.998 1
1 1473 . 20 1 1 A 127 127 LEU H H 127 7.946 7.961 -0.015 1
1 1474 . 20 1 1 A 127 127 LEU HA H 127 4.309 4.609 -0.300 1
1 1484 . 20 1 1 A 127 127 LEU C C 127 176.043 175.017 1.026 1
1 1485 . 20 1 1 A 127 127 LEU CA C 127 55.427 53.859 1.568 1
1 1486 . 20 1 1 A 127 127 LEU CB C 127 42.394 42.273 0.121 1
1 1490 . 20 1 1 A 127 127 LEU N N 127 121.432 119.389 2.043 1
1 1491 . 20 1 1 A 128 128 ILE H H 128 7.967 7.691 0.276 1
1 1492 . 20 1 1 A 128 128 ILE HA H 128 4.141 4.989 -0.848 1
1 1502 . 20 1 1 A 128 128 ILE C C 128 177.200 173.474 3.726 1
1 1503 . 20 1 1 A 128 128 ILE CA C 128 61.150 59.284 1.866 1
1 1504 . 20 1 1 A 128 128 ILE CB C 128 38.489 42.351 -3.862 1
1 1508 . 20 1 1 A 128 128 ILE N N 128 121.579 124.497 -2.918 1
1 1509 . 20 1 1 A 129 129 LYS H H 129 8.331 8.648 -0.317 1
1 1510 . 20 1 1 A 129 129 LYS HA H 129 4.328 4.725 -0.397 1
1 1519 . 20 1 1 A 129 129 LYS C C 129 175.952 174.515 1.437 1
1 1520 . 20 1 1 A 129 129 LYS CA C 129 56.330 54.902 1.428 1
1 1521 . 20 1 1 A 129 129 LYS CB C 129 33.010 36.782 -3.772 1
1 1525 . 20 1 1 A 129 129 LYS N N 129 126.955 126.104 0.851 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 114 2.122 1
2 1 1 1 "RMS(OBS, PRED)" CA 128 1.510 1
3 1 1 1 "RMS(OBS, PRED)" CB 119 1.641 1
4 1 1 1 "RMS(OBS, PRED)" H 123 0.508 1
5 1 1 1 "RMS(OBS, PRED)" HA 137 0.358 1
6 1 1 1 "RMS(OBS, PRED)" N 123 3.246 1
7 1 2 1 "RMS(OBS, PRED)" C 114 2.108 1
8 1 2 1 "RMS(OBS, PRED)" CA 128 1.366 1
9 1 2 1 "RMS(OBS, PRED)" CB 119 1.714 1
10 1 2 1 "RMS(OBS, PRED)" H 123 0.456 1
11 1 2 1 "RMS(OBS, PRED)" HA 137 0.360 1
12 1 2 1 "RMS(OBS, PRED)" N 123 3.125 1
13 1 3 1 "RMS(OBS, PRED)" C 114 2.100 1
14 1 3 1 "RMS(OBS, PRED)" CA 128 1.567 1
15 1 3 1 "RMS(OBS, PRED)" CB 119 1.777 1
16 1 3 1 "RMS(OBS, PRED)" H 123 0.520 1
17 1 3 1 "RMS(OBS, PRED)" HA 137 0.373 1
18 1 3 1 "RMS(OBS, PRED)" N 123 3.418 1
19 1 4 1 "RMS(OBS, PRED)" C 114 2.108 1
20 1 4 1 "RMS(OBS, PRED)" CA 128 1.327 1
21 1 4 1 "RMS(OBS, PRED)" CB 119 1.757 1
22 1 4 1 "RMS(OBS, PRED)" H 123 0.518 1
23 1 4 1 "RMS(OBS, PRED)" HA 137 0.344 1
24 1 4 1 "RMS(OBS, PRED)" N 123 3.086 1
25 1 5 1 "RMS(OBS, PRED)" C 114 2.084 1
26 1 5 1 "RMS(OBS, PRED)" CA 128 1.258 1
27 1 5 1 "RMS(OBS, PRED)" CB 119 1.567 1
28 1 5 1 "RMS(OBS, PRED)" H 123 0.446 1
29 1 5 1 "RMS(OBS, PRED)" HA 137 0.353 1
30 1 5 1 "RMS(OBS, PRED)" N 123 2.996 1
31 1 6 1 "RMS(OBS, PRED)" C 114 2.136 1
32 1 6 1 "RMS(OBS, PRED)" CA 128 1.495 1
33 1 6 1 "RMS(OBS, PRED)" CB 119 1.728 1
34 1 6 1 "RMS(OBS, PRED)" H 123 0.486 1
35 1 6 1 "RMS(OBS, PRED)" HA 137 0.340 1
36 1 6 1 "RMS(OBS, PRED)" N 123 2.998 1
37 1 7 1 "RMS(OBS, PRED)" C 114 2.083 1
38 1 7 1 "RMS(OBS, PRED)" CA 128 1.564 1
39 1 7 1 "RMS(OBS, PRED)" CB 119 1.715 1
40 1 7 1 "RMS(OBS, PRED)" H 123 0.472 1
41 1 7 1 "RMS(OBS, PRED)" HA 137 0.372 1
42 1 7 1 "RMS(OBS, PRED)" N 123 3.114 1
43 1 8 1 "RMS(OBS, PRED)" C 114 2.109 1
44 1 8 1 "RMS(OBS, PRED)" CA 128 1.549 1
45 1 8 1 "RMS(OBS, PRED)" CB 119 1.893 1
46 1 8 1 "RMS(OBS, PRED)" H 123 0.490 1
47 1 8 1 "RMS(OBS, PRED)" HA 137 0.389 1
48 1 8 1 "RMS(OBS, PRED)" N 123 3.086 1
49 1 9 1 "RMS(OBS, PRED)" C 114 2.055 1
50 1 9 1 "RMS(OBS, PRED)" CA 128 1.346 1
51 1 9 1 "RMS(OBS, PRED)" CB 119 1.769 1
52 1 9 1 "RMS(OBS, PRED)" H 123 0.479 1
53 1 9 1 "RMS(OBS, PRED)" HA 137 0.361 1
54 1 9 1 "RMS(OBS, PRED)" N 123 3.228 1
55 1 10 1 "RMS(OBS, PRED)" C 114 2.028 1
56 1 10 1 "RMS(OBS, PRED)" CA 128 1.331 1
57 1 10 1 "RMS(OBS, PRED)" CB 119 1.764 1
58 1 10 1 "RMS(OBS, PRED)" H 123 0.468 1
59 1 10 1 "RMS(OBS, PRED)" HA 137 0.371 1
60 1 10 1 "RMS(OBS, PRED)" N 123 3.198 1
61 1 11 1 "RMS(OBS, PRED)" C 114 2.114 1
62 1 11 1 "RMS(OBS, PRED)" CA 128 1.318 1
63 1 11 1 "RMS(OBS, PRED)" CB 119 1.765 1
64 1 11 1 "RMS(OBS, PRED)" H 123 0.481 1
65 1 11 1 "RMS(OBS, PRED)" HA 137 0.319 1
66 1 11 1 "RMS(OBS, PRED)" N 123 3.180 1
67 1 12 1 "RMS(OBS, PRED)" C 114 2.159 1
68 1 12 1 "RMS(OBS, PRED)" CA 128 1.577 1
69 1 12 1 "RMS(OBS, PRED)" CB 119 1.720 1
70 1 12 1 "RMS(OBS, PRED)" H 123 0.547 1
71 1 12 1 "RMS(OBS, PRED)" HA 137 0.367 1
72 1 12 1 "RMS(OBS, PRED)" N 123 3.224 1
73 1 13 1 "RMS(OBS, PRED)" C 114 2.132 1
74 1 13 1 "RMS(OBS, PRED)" CA 128 1.441 1
75 1 13 1 "RMS(OBS, PRED)" CB 119 1.717 1
76 1 13 1 "RMS(OBS, PRED)" H 123 0.458 1
77 1 13 1 "RMS(OBS, PRED)" HA 137 0.348 1
78 1 13 1 "RMS(OBS, PRED)" N 123 3.141 1
79 1 14 1 "RMS(OBS, PRED)" C 114 2.153 1
80 1 14 1 "RMS(OBS, PRED)" CA 128 1.340 1
81 1 14 1 "RMS(OBS, PRED)" CB 119 1.873 1
82 1 14 1 "RMS(OBS, PRED)" H 123 0.473 1
83 1 14 1 "RMS(OBS, PRED)" HA 137 0.375 1
84 1 14 1 "RMS(OBS, PRED)" N 123 3.447 1
85 1 15 1 "RMS(OBS, PRED)" C 114 2.090 1
86 1 15 1 "RMS(OBS, PRED)" CA 128 1.397 1
87 1 15 1 "RMS(OBS, PRED)" CB 119 1.626 1
88 1 15 1 "RMS(OBS, PRED)" H 123 0.475 1
89 1 15 1 "RMS(OBS, PRED)" HA 137 0.356 1
90 1 15 1 "RMS(OBS, PRED)" N 123 2.910 1
91 1 16 1 "RMS(OBS, PRED)" C 114 2.099 1
92 1 16 1 "RMS(OBS, PRED)" CA 128 1.371 1
93 1 16 1 "RMS(OBS, PRED)" CB 119 1.909 1
94 1 16 1 "RMS(OBS, PRED)" H 123 0.448 1
95 1 16 1 "RMS(OBS, PRED)" HA 137 0.413 1
96 1 16 1 "RMS(OBS, PRED)" N 123 2.997 1
97 1 17 1 "RMS(OBS, PRED)" C 114 2.017 1
98 1 17 1 "RMS(OBS, PRED)" CA 128 1.355 1
99 1 17 1 "RMS(OBS, PRED)" CB 119 1.822 1
100 1 17 1 "RMS(OBS, PRED)" H 123 0.464 1
101 1 17 1 "RMS(OBS, PRED)" HA 137 0.374 1
102 1 17 1 "RMS(OBS, PRED)" N 123 2.948 1
103 1 18 1 "RMS(OBS, PRED)" C 114 2.006 1
104 1 18 1 "RMS(OBS, PRED)" CA 128 1.388 1
105 1 18 1 "RMS(OBS, PRED)" CB 119 1.665 1
106 1 18 1 "RMS(OBS, PRED)" H 123 0.498 1
107 1 18 1 "RMS(OBS, PRED)" HA 137 0.374 1
108 1 18 1 "RMS(OBS, PRED)" N 123 3.239 1
109 1 19 1 "RMS(OBS, PRED)" C 114 2.079 1
110 1 19 1 "RMS(OBS, PRED)" CA 128 1.577 1
111 1 19 1 "RMS(OBS, PRED)" CB 119 1.565 1
112 1 19 1 "RMS(OBS, PRED)" H 123 0.499 1
113 1 19 1 "RMS(OBS, PRED)" HA 137 0.353 1
114 1 19 1 "RMS(OBS, PRED)" N 123 3.307 1
115 1 20 1 "RMS(OBS, PRED)" C 114 2.116 1
116 1 20 1 "RMS(OBS, PRED)" CA 128 1.494 1
117 1 20 1 "RMS(OBS, PRED)" CB 119 1.387 1
118 1 20 1 "RMS(OBS, PRED)" H 123 0.462 1
119 1 20 1 "RMS(OBS, PRED)" HA 137 0.320 1
120 1 20 1 "RMS(OBS, PRED)" N 123 3.110 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 2 2 ALA HA H 2 4.070 4.579 -0.509 2
1 5 . 1 1 A 2 2 ALA CA C 2 52.067 52.030 0.037 2
1 6 . 1 1 A 2 2 ALA CB C 2 19.577 21.438 -1.861 2
1 7 . 1 1 A 3 3 ALA H H 3 8.714 8.343 0.371 2
1 8 . 1 1 A 3 3 ALA HA H 3 4.253 4.657 -0.404 2
1 12 . 1 1 A 3 3 ALA C C 3 173.672 177.333 -3.661 2
1 13 . 1 1 A 3 3 ALA CA C 3 52.067 51.426 0.641 2
1 14 . 1 1 A 3 3 ALA CB C 3 19.577 21.660 -2.083 2
1 15 . 1 1 A 3 3 ALA N N 3 124.480 120.277 4.203 2
1 16 . 1 1 A 4 4 LYS H H 4 8.227 8.627 -0.400 2
1 17 . 1 1 A 4 4 LYS HA H 4 3.976 4.168 -0.192 2
1 26 . 1 1 A 4 4 LYS C C 4 176.672 175.999 0.673 2
1 27 . 1 1 A 4 4 LYS CA C 4 57.274 57.643 -0.369 2
1 28 . 1 1 A 4 4 LYS CB C 4 33.209 32.351 0.858 2
1 32 . 1 1 A 4 4 LYS N N 4 120.988 118.484 2.504 2
1 33 . 1 1 A 5 5 PHE H H 5 7.719 7.694 0.025 2
1 34 . 1 1 A 5 5 PHE HA H 5 4.384 5.051 -0.667 2
1 38 . 1 1 A 5 5 PHE C C 5 175.364 174.503 0.861 2
1 39 . 1 1 A 5 5 PHE CA C 5 57.074 57.019 0.055 2
1 40 . 1 1 A 5 5 PHE CB C 5 39.669 42.413 -2.744 2
1 41 . 1 1 A 5 5 PHE N N 5 119.246 117.999 1.247 2
1 42 . 1 1 A 6 6 GLU H H 6 8.515 8.889 -0.374 2
1 43 . 1 1 A 6 6 GLU HA H 6 4.370 4.936 -0.566 2
1 48 . 1 1 A 6 6 GLU CA C 6 55.669 54.778 0.891 2
1 49 . 1 1 A 6 6 GLU CB C 6 32.094 33.823 -1.729 2
1 51 . 1 1 A 6 6 GLU N N 6 122.193 119.811 2.381 2
1 52 . 1 1 A 7 7 VAL H H 7 8.636 8.518 0.118 2
1 53 . 1 1 A 7 7 VAL HA H 7 3.406 3.830 -0.424 2
1 61 . 1 1 A 7 7 VAL C C 7 176.611 176.543 0.068 2
1 62 . 1 1 A 7 7 VAL CA C 7 65.358 63.915 1.443 2
1 63 . 1 1 A 7 7 VAL CB C 7 31.391 31.430 -0.039 2
1 66 . 1 1 A 7 7 VAL N N 7 122.949 122.311 0.638 2
1 67 . 1 1 A 8 8 GLY H H 8 9.394 9.108 0.286 2
1 68 . 1 1 A 8 8 GLY HA2 H 8 3.600 4.042 -0.442 2
1 69 . 1 1 A 8 8 GLY HA3 H 8 4.546 4.044 0.502 2
1 70 . 1 1 A 8 8 GLY C C 8 178.074 174.329 3.745 2
1 71 . 1 1 A 8 8 GLY CA C 8 45.121 44.913 0.208 2
1 72 . 1 1 A 8 8 GLY N N 8 116.837 115.392 1.445 2
1 73 . 1 1 A 9 9 SER H H 9 8.021 7.983 0.038 2
1 74 . 1 1 A 9 9 SER HA H 9 4.680 4.481 0.199 2
1 77 . 1 1 A 9 9 SER C C 9 174.234 173.137 1.097 2
1 78 . 1 1 A 9 9 SER CA C 9 59.387 59.373 0.014 2
1 79 . 1 1 A 9 9 SER CB C 9 65.584 64.631 0.953 2
1 80 . 1 1 A 9 9 SER N N 9 118.208 117.891 0.317 2
1 81 . 1 1 A 10 10 VAL H H 10 7.945 8.277 -0.332 2
1 82 . 1 1 A 10 10 VAL HA H 10 4.980 5.136 -0.156 2
1 90 . 1 1 A 10 10 VAL C C 10 171.388 174.237 -2.849 2
1 91 . 1 1 A 10 10 VAL CA C 10 61.021 60.984 0.037 2
1 92 . 1 1 A 10 10 VAL CB C 10 33.400 34.892 -1.492 2
1 95 . 1 1 A 10 10 VAL N N 10 121.118 122.455 -1.337 2
1 96 . 1 1 A 11 11 TYR H H 11 9.008 9.193 -0.185 2
1 97 . 1 1 A 11 11 TYR HA H 11 4.850 5.272 -0.422 2
1 101 . 1 1 A 11 11 TYR C C 11 174.926 174.583 0.343 2
1 102 . 1 1 A 11 11 TYR CA C 11 56.803 56.322 0.481 2
1 103 . 1 1 A 11 11 TYR CB C 11 43.676 43.294 0.382 2
1 104 . 1 1 A 11 11 TYR N N 11 125.043 125.888 -0.845 2
1 105 . 1 1 A 12 12 THR H H 12 8.809 8.584 0.225 2
1 106 . 1 1 A 12 12 THR HA H 12 5.020 5.393 -0.373 2
1 111 . 1 1 A 12 12 THR C C 12 174.195 174.472 -0.277 2
1 112 . 1 1 A 12 12 THR CA C 12 62.487 60.100 2.387 2
1 113 . 1 1 A 12 12 THR CB C 12 69.743 71.864 -2.120 2
1 115 . 1 1 A 12 12 THR N N 12 116.850 115.388 1.462 2
1 116 . 1 1 A 13 13 GLY H H 13 9.179 8.533 0.646 2
1 117 . 1 1 A 13 13 GLY HA2 H 13 3.250 4.319 -1.069 2
1 118 . 1 1 A 13 13 GLY HA3 H 13 4.801 4.335 0.466 2
1 119 . 1 1 A 13 13 GLY C C 13 174.654 171.920 2.734 2
1 120 . 1 1 A 13 13 GLY CA C 13 44.377 45.414 -1.037 2
1 121 . 1 1 A 13 13 GLY N N 13 113.654 111.731 1.923 2
1 122 . 1 1 A 14 14 LYS H H 14 7.770 8.600 -0.830 2
1 123 . 1 1 A 14 14 LYS HA H 14 5.426 5.165 0.261 2
1 132 . 1 1 A 14 14 LYS C C 14 171.343 175.790 -4.447 2
1 133 . 1 1 A 14 14 LYS CA C 14 53.879 54.653 -0.774 2
1 134 . 1 1 A 14 14 LYS CB C 14 36.032 35.643 0.389 2
1 138 . 1 1 A 14 14 LYS N N 14 118.322 120.586 -2.264 2
1 139 . 1 1 A 15 15 VAL H H 15 9.206 9.261 -0.055 2
1 140 . 1 1 A 15 15 VAL HA H 15 4.400 4.267 0.133 2
1 148 . 1 1 A 15 15 VAL C C 15 176.306 177.083 -0.777 2
1 149 . 1 1 A 15 15 VAL CA C 15 63.648 63.429 0.219 2
1 150 . 1 1 A 15 15 VAL CB C 15 31.769 31.547 0.221 2
1 153 . 1 1 A 15 15 VAL N N 15 125.308 125.083 0.225 2
1 154 . 1 1 A 16 16 THR H H 16 9.403 9.266 0.137 2
1 155 . 1 1 A 16 16 THR HA H 16 4.562 4.677 -0.115 2
1 160 . 1 1 A 16 16 THR C C 16 178.098 174.666 3.432 2
1 161 . 1 1 A 16 16 THR CA C 16 62.018 61.657 0.361 2
1 162 . 1 1 A 16 16 THR CB C 16 69.720 69.828 -0.108 2
1 164 . 1 1 A 16 16 THR N N 16 121.753 117.803 3.950 2
1 165 . 1 1 A 17 17 GLY H H 17 7.600 7.089 0.511 2
1 166 . 1 1 A 17 17 GLY HA2 H 17 4.110 4.111 -0.001 2
1 167 . 1 1 A 17 17 GLY HA3 H 17 4.250 4.215 0.036 2
1 168 . 1 1 A 17 17 GLY C C 17 175.551 171.377 4.174 2
1 169 . 1 1 A 17 17 GLY CA C 17 46.258 45.552 0.706 2
1 170 . 1 1 A 17 17 GLY N N 17 109.407 108.742 0.665 2
1 171 . 1 1 A 18 18 LEU H H 18 8.820 8.502 0.318 2
1 172 . 1 1 A 18 18 LEU HA H 18 4.852 5.059 -0.207 2
1 182 . 1 1 A 18 18 LEU CA C 18 54.245 53.236 1.009 2
1 183 . 1 1 A 18 18 LEU CB C 18 44.906 46.110 -1.204 2
1 187 . 1 1 A 18 18 LEU N N 18 123.419 121.299 2.120 2
1 188 . 1 1 A 19 19 GLN H H 19 8.537 8.279 0.258 2
1 189 . 1 1 A 19 19 GLN HA H 19 4.520 4.689 -0.169 2
1 196 . 1 1 A 19 19 GLN C C 19 175.258 175.724 -0.466 2
1 197 . 1 1 A 19 19 GLN CA C 19 53.269 53.824 -0.555 2
1 198 . 1 1 A 19 19 GLN CB C 19 31.522 32.426 -0.904 2
1 200 . 1 1 A 19 19 GLN N N 19 120.187 121.332 -1.145 2
1 202 . 1 1 A 20 20 ALA H H 20 8.798 8.670 0.128 2
1 203 . 1 1 A 20 20 ALA HA H 20 4.010 4.062 -0.052 2
1 207 . 1 1 A 20 20 ALA C C 20 175.698 177.295 -1.597 2
1 208 . 1 1 A 20 20 ALA CA C 20 55.084 54.185 0.898 2
1 209 . 1 1 A 20 20 ALA CB C 20 18.277 18.574 -0.297 2
1 210 . 1 1 A 20 20 ALA N N 20 120.606 123.924 -3.318 2
1 211 . 1 1 A 21 21 TYR H H 21 6.618 7.632 -1.014 2
1 212 . 1 1 A 21 21 TYR HA H 21 4.540 4.758 -0.218 2
1 216 . 1 1 A 21 21 TYR C C 21 178.437 175.102 3.335 2
1 217 . 1 1 A 21 21 TYR CA C 21 55.120 57.140 -2.020 2
1 218 . 1 1 A 21 21 TYR CB C 21 37.891 40.199 -2.308 2
1 219 . 1 1 A 21 21 TYR N N 21 105.570 114.594 -9.024 2
1 220 . 1 1 A 22 22 GLY H H 22 7.203 7.052 0.151 2
1 221 . 1 1 A 22 22 GLY HA2 H 22 3.460 3.825 -0.365 2
1 222 . 1 1 A 22 22 GLY HA3 H 22 4.360 3.929 0.431 2
1 223 . 1 1 A 22 22 GLY C C 22 175.833 171.214 4.619 2
1 224 . 1 1 A 22 22 GLY CA C 22 46.356 45.412 0.944 2
1 225 . 1 1 A 22 22 GLY N N 22 109.854 108.312 1.542 2
1 226 . 1 1 A 23 23 ALA H H 23 8.549 8.473 0.076 2
1 227 . 1 1 A 23 23 ALA HA H 23 4.981 5.167 -0.186 2
1 231 . 1 1 A 23 23 ALA C C 23 168.810 175.911 -7.101 2
1 232 . 1 1 A 23 23 ALA CA C 23 49.178 50.710 -1.532 2
1 233 . 1 1 A 23 23 ALA CB C 23 22.797 21.694 1.103 2
1 234 . 1 1 A 23 23 ALA N N 23 118.749 122.330 -3.581 2
1 235 . 1 1 A 24 24 PHE H H 24 8.812 8.589 0.223 2
1 236 . 1 1 A 24 24 PHE HA H 24 5.125 4.882 0.243 2
1 240 . 1 1 A 24 24 PHE CA C 24 58.017 58.060 -0.043 2
1 241 . 1 1 A 24 24 PHE CB C 24 40.475 40.547 -0.072 2
1 242 . 1 1 A 24 24 PHE N N 24 122.891 121.660 1.231 2
1 243 . 1 1 A 25 25 VAL H H 25 8.880 8.946 -0.066 2
1 244 . 1 1 A 25 25 VAL HA H 25 4.660 4.691 -0.031 2
1 252 . 1 1 A 25 25 VAL CA C 25 60.379 61.049 -0.670 2
1 253 . 1 1 A 25 25 VAL CB C 25 35.654 35.118 0.536 2
1 256 . 1 1 A 25 25 VAL N N 25 122.908 121.216 1.692 2
1 257 . 1 1 A 26 26 ALA H H 26 9.403 8.837 0.566 2
1 258 . 1 1 A 26 26 ALA HA H 26 4.750 4.375 0.375 2
1 262 . 1 1 A 26 26 ALA C C 26 174.445 176.810 -2.365 2
1 263 . 1 1 A 26 26 ALA CA C 26 51.711 52.491 -0.780 2
1 264 . 1 1 A 26 26 ALA CB C 26 19.319 19.095 0.224 2
1 265 . 1 1 A 26 26 ALA N N 26 129.425 130.232 -0.807 2
1 266 . 1 1 A 27 27 LEU H H 27 8.601 9.225 -0.624 2
1 267 . 1 1 A 27 27 LEU HA H 27 4.158 4.511 -0.353 2
1 277 . 1 1 A 27 27 LEU C C 27 177.814 176.287 1.527 2
1 278 . 1 1 A 27 27 LEU CA C 27 55.869 55.673 0.196 2
1 279 . 1 1 A 27 27 LEU CB C 27 42.251 43.530 -1.279 2
1 283 . 1 1 A 27 27 LEU N N 27 127.169 122.845 4.324 2
1 284 . 1 1 A 28 28 ASP H H 28 8.172 7.882 0.290 2
1 285 . 1 1 A 28 28 ASP HA H 28 4.420 4.873 -0.453 2
1 288 . 1 1 A 28 28 ASP C C 28 177.116 175.533 1.583 2
1 289 . 1 1 A 28 28 ASP CA C 28 53.755 53.323 0.432 2
1 290 . 1 1 A 28 28 ASP CB C 28 39.833 43.759 -3.926 2
1 291 . 1 1 A 28 28 ASP N N 28 115.657 116.706 -1.049 2
1 292 . 1 1 A 29 29 GLU H H 29 8.857 8.760 0.097 2
1 293 . 1 1 A 29 29 GLU HA H 29 4.090 4.102 -0.012 2
1 298 . 1 1 A 29 29 GLU C C 29 175.965 176.734 -0.770 2
1 299 . 1 1 A 29 29 GLU CA C 29 59.470 58.839 0.631 2
1 300 . 1 1 A 29 29 GLU CB C 29 29.409 29.160 0.249 2
1 302 . 1 1 A 29 29 GLU N N 29 114.738 122.155 -7.417 2
1 303 . 1 1 A 30 30 GLU H H 30 8.326 8.140 0.186 2
1 304 . 1 1 A 30 30 GLU HA H 30 4.640 4.548 0.092 2
1 309 . 1 1 A 30 30 GLU C C 30 176.817 175.368 1.449 2
1 310 . 1 1 A 30 30 GLU CA C 30 56.073 55.899 0.174 2
1 311 . 1 1 A 30 30 GLU CB C 30 32.453 31.167 1.286 2
1 313 . 1 1 A 30 30 GLU N N 30 115.753 117.163 -1.410 2
1 314 . 1 1 A 31 31 THR H H 31 7.819 7.528 0.291 2
1 315 . 1 1 A 31 31 THR HA H 31 4.484 5.052 -0.568 2
1 320 . 1 1 A 31 31 THR C C 31 176.330 173.053 3.277 2
1 321 . 1 1 A 31 31 THR CA C 31 63.398 61.092 2.306 2
1 322 . 1 1 A 31 31 THR CB C 31 69.367 72.471 -3.104 2
1 324 . 1 1 A 31 31 THR N N 31 118.750 115.185 3.565 2
1 325 . 1 1 A 32 32 GLN H H 32 8.913 8.653 0.260 2
1 326 . 1 1 A 32 32 GLN HA H 32 5.337 4.813 0.524 2
1 333 . 1 1 A 32 32 GLN C C 32 173.087 174.507 -1.420 2
1 334 . 1 1 A 32 32 GLN CA C 32 54.051 54.953 -0.902 2
1 335 . 1 1 A 32 32 GLN CB C 32 32.672 32.627 0.045 2
1 337 . 1 1 A 32 32 GLN N N 32 127.294 124.826 2.468 2
1 339 . 1 1 A 33 33 GLY H H 33 8.900 8.553 0.347 2
1 340 . 1 1 A 33 33 GLY HA2 H 33 3.290 4.367 -1.077 2
1 341 . 1 1 A 33 33 GLY HA3 H 33 4.530 4.421 0.109 2
1 342 . 1 1 A 33 33 GLY C C 33 174.918 172.262 2.656 2
1 343 . 1 1 A 33 33 GLY CA C 33 44.534 45.076 -0.542 2
1 344 . 1 1 A 33 33 GLY N N 33 107.639 110.564 -2.925 2
1 345 . 1 1 A 34 34 LEU H H 34 8.127 8.607 -0.480 2
1 346 . 1 1 A 34 34 LEU HA H 34 4.950 4.928 0.022 2
1 356 . 1 1 A 34 34 LEU CA C 34 53.755 53.986 -0.231 2
1 357 . 1 1 A 34 34 LEU CB C 34 45.493 45.007 0.486 2
1 361 . 1 1 A 34 34 LEU N N 34 120.897 121.229 -0.332 2
1 362 . 1 1 A 35 35 VAL H H 35 9.386 8.839 0.547 2
1 363 . 1 1 A 35 35 VAL HA H 35 4.479 4.400 0.079 2
1 371 . 1 1 A 35 35 VAL C C 35 176.402 175.887 0.515 2
1 372 . 1 1 A 35 35 VAL CA C 35 59.594 62.710 -3.116 2
1 373 . 1 1 A 35 35 VAL CB C 35 32.590 31.727 0.863 2
1 376 . 1 1 A 35 35 VAL N N 35 128.897 127.701 1.196 2
1 377 . 1 1 A 36 36 HIS H H 36 9.194 8.733 0.461 2
1 378 . 1 1 A 36 36 HIS HA H 36 4.487 4.576 -0.089 2
1 381 . 1 1 A 36 36 HIS C C 36 174.864 176.437 -1.573 2
1 382 . 1 1 A 36 36 HIS CA C 36 59.426 56.621 2.805 2
1 383 . 1 1 A 36 36 HIS CB C 36 31.542 30.517 1.025 2
1 384 . 1 1 A 36 36 HIS N N 36 127.751 126.536 1.215 2
1 385 . 1 1 A 37 37 ILE H H 37 7.454 8.710 -1.256 2
1 386 . 1 1 A 37 37 ILE HA H 37 3.810 3.634 0.176 2
1 396 . 1 1 A 37 37 ILE C C 37 176.948 177.786 -0.838 2
1 397 . 1 1 A 37 37 ILE CA C 37 63.773 64.811 -1.038 2
1 398 . 1 1 A 37 37 ILE CB C 37 38.993 37.408 1.585 2
1 402 . 1 1 A 37 37 ILE N N 37 126.266 126.338 -0.072 2
1 403 . 1 1 A 38 38 SER H H 38 8.343 8.035 0.308 2
1 404 . 1 1 A 38 38 SER HA H 38 4.370 4.229 0.141 2
1 407 . 1 1 A 38 38 SER C C 38 174.792 174.985 -0.193 2
1 408 . 1 1 A 38 38 SER CA C 38 60.567 61.064 -0.497 2
1 409 . 1 1 A 38 38 SER CB C 38 63.632 62.882 0.750 2
1 410 . 1 1 A 38 38 SER N N 38 118.079 118.289 -0.210 2
1 411 . 1 1 A 39 39 GLU H H 39 8.536 7.993 0.543 2
1 412 . 1 1 A 39 39 GLU HA H 39 4.503 4.544 -0.041 2
1 417 . 1 1 A 39 39 GLU C C 39 175.131 176.969 -1.838 2
1 418 . 1 1 A 39 39 GLU CA C 39 54.928 56.230 -1.302 2
1 419 . 1 1 A 39 39 GLU CB C 39 29.621 30.526 -0.905 2
1 421 . 1 1 A 39 39 GLU N N 39 118.349 118.252 0.097 2
1 422 . 1 1 A 40 40 VAL H H 40 7.776 7.684 0.092 2
1 423 . 1 1 A 40 40 VAL HA H 40 3.616 3.897 -0.281 2
1 431 . 1 1 A 40 40 VAL C C 40 177.277 176.015 1.262 2
1 432 . 1 1 A 40 40 VAL CA C 40 66.245 64.344 1.901 2
1 433 . 1 1 A 40 40 VAL CB C 40 32.590 32.127 0.464 2
1 436 . 1 1 A 40 40 VAL N N 40 125.443 117.700 7.743 2
1 437 . 1 1 A 41 41 THR H H 41 7.888 7.570 0.318 2
1 438 . 1 1 A 41 41 THR HA H 41 4.345 4.687 -0.342 2
1 443 . 1 1 A 41 41 THR C C 41 173.492 173.848 -0.356 2
1 444 . 1 1 A 41 41 THR CA C 41 59.047 60.934 -1.887 2
1 445 . 1 1 A 41 41 THR CB C 41 68.992 71.856 -2.864 2
1 447 . 1 1 A 41 41 THR N N 41 109.905 112.484 -2.579 2
1 448 . 1 1 A 42 42 HIS H H 42 8.063 8.648 -0.584 2
1 449 . 1 1 A 42 42 HIS HA H 42 4.510 4.466 0.044 2
1 452 . 1 1 A 42 42 HIS C C 42 172.139 175.130 -2.991 2
1 453 . 1 1 A 42 42 HIS CA C 42 57.735 56.873 0.862 2
1 454 . 1 1 A 42 42 HIS CB C 42 31.144 29.378 1.766 2
1 455 . 1 1 A 42 42 HIS N N 42 121.760 122.591 -0.831 2
1 456 . 1 1 A 43 43 GLY H H 43 8.286 7.463 0.823 2
1 457 . 1 1 A 43 43 GLY HA2 H 43 3.980 3.886 0.094 2
1 458 . 1 1 A 43 43 GLY HA3 H 43 3.980 3.982 -0.002 2
1 459 . 1 1 A 43 43 GLY C C 43 176.307 172.860 3.447 2
1 460 . 1 1 A 43 43 GLY CA C 43 44.336 45.421 -1.085 2
1 461 . 1 1 A 43 43 GLY N N 43 110.133 107.397 2.736 2
1 462 . 1 1 A 44 44 PHE H H 44 8.327 8.408 -0.081 2
1 463 . 1 1 A 44 44 PHE HA H 44 4.489 4.491 -0.002 2
1 467 . 1 1 A 44 44 PHE C C 44 171.877 175.349 -3.472 2
1 468 . 1 1 A 44 44 PHE CA C 44 58.027 58.235 -0.208 2
1 469 . 1 1 A 44 44 PHE CB C 44 39.850 39.291 0.559 2
1 470 . 1 1 A 44 44 PHE N N 44 120.049 120.018 0.031 2
1 471 . 1 1 A 45 45 VAL H H 45 7.939 8.186 -0.247 2
1 472 . 1 1 A 45 45 VAL HA H 45 3.865 3.617 0.248 2
1 480 . 1 1 A 45 45 VAL C C 45 175.523 175.915 -0.392 2
1 481 . 1 1 A 45 45 VAL CA C 45 61.536 61.665 -0.129 2
1 482 . 1 1 A 45 45 VAL CB C 45 33.127 31.387 1.740 2
1 485 . 1 1 A 45 45 VAL N N 45 127.882 123.097 4.785 2
1 486 . 1 1 A 46 46 LYS H H 46 8.868 8.394 0.474 2
1 487 . 1 1 A 46 46 LYS HA H 46 4.170 3.961 0.209 2
1 496 . 1 1 A 46 46 LYS C C 46 175.728 175.934 -0.206 2
1 497 . 1 1 A 46 46 LYS CA C 46 57.198 58.562 -1.364 2
1 498 . 1 1 A 46 46 LYS CB C 46 33.299 32.543 0.756 2
1 502 . 1 1 A 46 46 LYS N N 46 127.308 125.853 1.455 2
1 503 . 1 1 A 47 47 ASP H H 47 7.652 7.916 -0.264 2
1 504 . 1 1 A 47 47 ASP HA H 47 4.710 4.910 -0.200 2
1 507 . 1 1 A 47 47 ASP C C 47 176.411 176.104 0.307 2
1 508 . 1 1 A 47 47 ASP CA C 47 53.390 53.810 -0.420 2
1 509 . 1 1 A 47 47 ASP CB C 47 42.635 43.831 -1.196 2
1 510 . 1 1 A 47 47 ASP N N 47 117.932 116.630 1.302 2
1 511 . 1 1 A 48 48 ILE H H 48 9.230 8.658 0.572 2
1 512 . 1 1 A 48 48 ILE HA H 48 3.579 3.930 -0.351 2
1 522 . 1 1 A 48 48 ILE C C 48 177.249 177.589 -0.340 2
1 523 . 1 1 A 48 48 ILE CA C 48 65.525 63.642 1.883 2
1 524 . 1 1 A 48 48 ILE CB C 48 38.797 37.838 0.959 2
1 528 . 1 1 A 48 48 ILE N N 48 129.049 125.656 3.393 2
1 529 . 1 1 A 49 49 ASN H H 49 8.468 8.899 -0.431 2
1 530 . 1 1 A 49 49 ASN HA H 49 4.690 4.604 0.086 2
1 535 . 1 1 A 49 49 ASN C C 49 175.779 176.435 -0.656 2
1 536 . 1 1 A 49 49 ASN CA C 49 55.587 55.038 0.549 2
1 537 . 1 1 A 49 49 ASN CB C 49 38.587 36.975 1.612 2
1 538 . 1 1 A 49 49 ASN N N 49 118.835 118.052 0.783 2
1 540 . 1 1 A 50 50 GLU H H 50 7.853 7.938 -0.085 2
1 541 . 1 1 A 50 50 GLU HA H 50 4.040 4.191 -0.151 2
1 546 . 1 1 A 50 50 GLU C C 50 176.148 177.161 -1.013 2
1 547 . 1 1 A 50 50 GLU CA C 50 57.404 57.536 -0.132 2
1 548 . 1 1 A 50 50 GLU CB C 50 29.491 29.637 -0.146 2
1 550 . 1 1 A 50 50 GLU N N 50 116.358 118.077 -1.719 2
1 551 . 1 1 A 51 51 HIS H H 51 7.575 7.861 -0.286 2
1 552 . 1 1 A 51 51 HIS HA H 51 4.431 4.727 -0.296 2
1 555 . 1 1 A 51 51 HIS C C 51 176.383 174.651 1.732 2
1 556 . 1 1 A 51 51 HIS CA C 51 57.089 56.373 0.716 2
1 557 . 1 1 A 51 51 HIS CB C 51 33.168 31.890 1.278 2
1 558 . 1 1 A 51 51 HIS N N 51 115.828 115.453 0.375 2
1 559 . 1 1 A 52 52 LEU H H 52 7.640 7.528 0.112 2
1 560 . 1 1 A 52 52 LEU HA H 52 4.796 4.688 0.108 2
1 570 . 1 1 A 52 52 LEU C C 52 174.452 174.621 -0.169 2
1 571 . 1 1 A 52 52 LEU CA C 52 53.398 53.726 -0.328 2
1 572 . 1 1 A 52 52 LEU CB C 52 48.805 45.242 3.563 2
1 576 . 1 1 A 52 52 LEU N N 52 117.932 119.663 -1.731 2
1 577 . 1 1 A 53 53 SER H H 53 8.151 8.716 -0.565 2
1 578 . 1 1 A 53 53 SER HA H 53 4.680 4.956 -0.276 2
1 581 . 1 1 A 53 53 SER C C 53 174.304 172.977 1.327 2
1 582 . 1 1 A 53 53 SER CA C 53 56.714 57.543 -0.829 2
1 583 . 1 1 A 53 53 SER CB C 53 65.431 66.403 -0.972 2
1 584 . 1 1 A 53 53 SER N N 53 113.496 117.230 -3.734 2
1 585 . 1 1 A 54 54 VAL H H 54 8.782 8.553 0.229 2
1 586 . 1 1 A 54 54 VAL HA H 54 3.230 3.799 -0.569 2
1 594 . 1 1 A 54 54 VAL C C 54 173.745 177.161 -3.416 2
1 595 . 1 1 A 54 54 VAL CA C 54 66.232 63.722 2.510 2
1 596 . 1 1 A 54 54 VAL CB C 54 31.067 31.923 -0.856 2
1 599 . 1 1 A 54 54 VAL N N 54 124.401 125.820 -1.419 2
1 600 . 1 1 A 55 55 GLY H H 55 9.079 8.970 0.109 2
1 601 . 1 1 A 55 55 GLY HA2 H 55 3.530 3.818 -0.288 2
1 602 . 1 1 A 55 55 GLY HA3 H 55 4.553 3.848 0.705 2
1 603 . 1 1 A 55 55 GLY C C 55 177.219 173.226 3.993 2
1 604 . 1 1 A 55 55 GLY CA C 55 44.647 46.284 -1.637 2
1 605 . 1 1 A 55 55 GLY N N 55 117.320 115.633 1.687 2
1 606 . 1 1 A 56 56 ASP H H 56 7.943 7.747 0.196 2
1 607 . 1 1 A 56 56 ASP HA H 56 4.460 5.137 -0.677 2
1 610 . 1 1 A 56 56 ASP C C 56 176.055 173.775 2.280 2
1 611 . 1 1 A 56 56 ASP CA C 56 55.456 52.404 3.052 2
1 612 . 1 1 A 56 56 ASP CB C 56 40.914 44.595 -3.681 2
1 613 . 1 1 A 56 56 ASP N N 56 121.782 119.650 2.133 2
1 614 . 1 1 A 57 57 GLU H H 57 8.649 8.782 -0.133 2
1 615 . 1 1 A 57 57 GLU HA H 57 5.100 5.195 -0.095 2
1 620 . 1 1 A 57 57 GLU C C 57 175.635 175.823 -0.188 2
1 621 . 1 1 A 57 57 GLU CA C 57 55.805 55.450 0.355 2
1 622 . 1 1 A 57 57 GLU CB C 57 30.915 31.626 -0.711 2
1 624 . 1 1 A 57 57 GLU N N 57 122.513 123.576 -1.063 2
1 625 . 1 1 A 58 58 VAL H H 58 8.809 9.099 -0.290 2
1 626 . 1 1 A 58 58 VAL HA H 58 4.817 4.803 0.014 2
1 634 . 1 1 A 58 58 VAL C C 58 176.528 174.075 2.453 2
1 635 . 1 1 A 58 58 VAL CA C 58 58.719 59.232 -0.513 2
1 636 . 1 1 A 58 58 VAL CB C 58 35.523 35.914 -0.392 2
1 639 . 1 1 A 58 58 VAL N N 58 118.382 119.648 -1.266 2
1 640 . 1 1 A 59 59 GLN H H 59 8.255 8.598 -0.343 2
1 641 . 1 1 A 59 59 GLN HA H 59 5.030 4.951 0.079 2
1 646 . 1 1 A 59 59 GLN CA C 59 54.843 55.569 -0.726 2
1 647 . 1 1 A 59 59 GLN CB C 59 30.111 30.024 0.087 2
1 649 . 1 1 A 59 59 GLN N N 59 120.933 122.810 -1.877 2
1 650 . 1 1 A 60 60 VAL H H 60 8.970 9.290 -0.320 2
1 651 . 1 1 A 60 60 VAL HA H 60 4.990 4.955 0.035 2
1 659 . 1 1 A 60 60 VAL C C 60 175.203 173.927 1.276 2
1 660 . 1 1 A 60 60 VAL CA C 60 57.404 59.201 -1.797 2
1 661 . 1 1 A 60 60 VAL CB C 60 35.771 35.473 0.298 2
1 664 . 1 1 A 60 60 VAL N N 60 111.046 119.234 -8.188 2
1 665 . 1 1 A 61 61 LYS H H 61 8.937 8.662 0.275 2
1 666 . 1 1 A 61 61 LYS HA H 61 5.100 4.872 0.228 2
1 675 . 1 1 A 61 61 LYS C C 61 173.610 176.362 -2.752 2
1 676 . 1 1 A 61 61 LYS CA C 61 53.762 55.085 -1.323 2
1 677 . 1 1 A 61 61 LYS CB C 61 36.273 34.382 1.891 2
1 681 . 1 1 A 61 61 LYS N N 61 121.930 123.855 -1.924 2
1 682 . 1 1 A 62 62 VAL H H 62 8.429 9.299 -0.870 2
1 683 . 1 1 A 62 62 VAL HA H 62 4.074 4.054 0.020 2
1 691 . 1 1 A 62 62 VAL C C 62 176.912 175.911 1.001 2
1 692 . 1 1 A 62 62 VAL CA C 62 63.188 63.592 -0.404 2
1 693 . 1 1 A 62 62 VAL CB C 62 30.813 31.459 -0.646 2
1 696 . 1 1 A 62 62 VAL N N 62 126.329 127.146 -0.817 2
1 697 . 1 1 A 63 63 LEU H H 63 9.109 9.219 -0.110 2
1 698 . 1 1 A 63 63 LEU HA H 63 4.423 4.476 -0.053 2
1 708 . 1 1 A 63 63 LEU C C 63 176.091 176.178 -0.087 2
1 709 . 1 1 A 63 63 LEU CA C 63 55.876 56.174 -0.298 2
1 710 . 1 1 A 63 63 LEU CB C 63 42.800 43.852 -1.052 2
1 714 . 1 1 A 63 63 LEU N N 63 129.436 129.576 -0.140 2
1 715 . 1 1 A 64 64 ALA H H 64 7.594 7.331 0.263 2
1 716 . 1 1 A 64 64 ALA HA H 64 4.455 4.736 -0.281 2
1 720 . 1 1 A 64 64 ALA C C 64 177.314 175.135 2.179 2
1 721 . 1 1 A 64 64 ALA CA C 64 52.557 51.677 0.880 2
1 722 . 1 1 A 64 64 ALA CB C 64 21.458 22.686 -1.228 2
1 723 . 1 1 A 64 64 ALA N N 64 117.791 118.512 -0.721 2
1 724 . 1 1 A 65 65 VAL H H 65 8.583 8.592 -0.009 2
1 725 . 1 1 A 65 65 VAL HA H 65 4.470 4.852 -0.382 2
1 733 . 1 1 A 65 65 VAL C C 65 174.697 174.312 0.385 2
1 734 . 1 1 A 65 65 VAL CA C 65 61.936 60.677 1.259 2
1 735 . 1 1 A 65 65 VAL CB C 65 35.288 35.572 -0.284 2
1 738 . 1 1 A 65 65 VAL N N 65 120.009 119.447 0.562 2
1 739 . 1 1 A 66 66 ASP H H 66 8.567 8.919 -0.352 2
1 740 . 1 1 A 66 66 ASP HA H 66 4.880 4.945 -0.065 2
1 743 . 1 1 A 66 66 ASP C C 66 174.355 175.952 -1.597 2
1 744 . 1 1 A 66 66 ASP CA C 66 52.681 53.351 -0.670 2
1 745 . 1 1 A 66 66 ASP CB C 66 41.775 41.392 0.383 2
1 746 . 1 1 A 66 66 ASP N N 66 126.262 125.963 0.299 2
1 747 . 1 1 A 67 67 GLU H H 67 9.148 8.694 0.454 2
1 748 . 1 1 A 67 67 GLU HA H 67 4.110 4.096 0.014 2
1 753 . 1 1 A 67 67 GLU C C 67 177.052 178.284 -1.232 2
1 754 . 1 1 A 67 67 GLU CA C 67 59.044 58.768 0.276 2
1 755 . 1 1 A 67 67 GLU CB C 67 29.919 29.348 0.571 2
1 757 . 1 1 A 67 67 GLU N N 67 125.480 124.733 0.747 2
1 758 . 1 1 A 68 68 GLU H H 68 8.384 8.039 0.345 2
1 759 . 1 1 A 68 68 GLU HA H 68 4.140 4.168 -0.028 2
1 764 . 1 1 A 68 68 GLU C C 68 178.383 178.699 -0.316 2
1 765 . 1 1 A 68 68 GLU CA C 68 59.044 58.944 0.100 2
1 766 . 1 1 A 68 68 GLU CB C 68 29.919 29.808 0.111 2
1 768 . 1 1 A 68 68 GLU N N 68 119.760 119.238 0.522 2
1 769 . 1 1 A 69 69 LYS H H 69 7.799 7.918 -0.119 2
1 770 . 1 1 A 69 69 LYS HA H 69 4.375 4.325 0.050 2
1 779 . 1 1 A 69 69 LYS C C 69 178.297 176.998 1.299 2
1 780 . 1 1 A 69 69 LYS CA C 69 55.704 56.579 -0.875 2
1 781 . 1 1 A 69 69 LYS CB C 69 33.622 33.424 0.198 2
1 785 . 1 1 A 69 69 LYS N N 69 115.476 117.948 -2.472 2
1 786 . 1 1 A 70 70 GLY H H 70 7.994 8.187 -0.193 2
1 787 . 1 1 A 70 70 GLY HA2 H 70 3.940 3.950 -0.010 2
1 788 . 1 1 A 70 70 GLY HA3 H 70 3.960 3.956 0.004 2
1 789 . 1 1 A 70 70 GLY C C 70 177.215 174.073 3.141 2
1 790 . 1 1 A 70 70 GLY CA C 70 46.773 46.496 0.277 2
1 791 . 1 1 A 70 70 GLY N N 70 110.245 108.716 1.529 2
1 792 . 1 1 A 71 71 LYS H H 71 7.560 7.876 -0.316 2
1 793 . 1 1 A 71 71 LYS HA H 71 4.690 4.926 -0.236 2
1 802 . 1 1 A 71 71 LYS C C 71 174.607 175.100 -0.493 2
1 803 . 1 1 A 71 71 LYS CA C 71 55.332 54.465 0.867 2
1 804 . 1 1 A 71 71 LYS CB C 71 34.903 35.996 -1.093 2
1 808 . 1 1 A 71 71 LYS N N 71 118.201 118.097 0.104 2
1 809 . 1 1 A 72 72 ILE H H 72 8.867 8.693 0.174 2
1 810 . 1 1 A 72 72 ILE HA H 72 4.630 4.919 -0.289 2
1 820 . 1 1 A 72 72 ILE C C 72 175.708 174.693 1.015 2
1 821 . 1 1 A 72 72 ILE CA C 72 61.494 60.112 1.382 2
1 822 . 1 1 A 72 72 ILE CB C 72 40.652 42.059 -1.407 2
1 826 . 1 1 A 72 72 ILE N N 72 126.827 121.667 5.160 2
1 827 . 1 1 A 73 73 SER H H 73 8.815 9.004 -0.189 2
1 828 . 1 1 A 73 73 SER HA H 73 5.110 5.264 -0.154 2
1 831 . 1 1 A 73 73 SER C C 73 175.122 173.288 1.834 2
1 832 . 1 1 A 73 73 SER CA C 73 57.487 58.004 -0.517 2
1 833 . 1 1 A 73 73 SER CB C 73 64.386 64.811 -0.425 2
1 834 . 1 1 A 73 73 SER N N 73 123.640 124.488 -0.848 2
1 835 . 1 1 A 74 74 LEU H H 74 8.585 8.838 -0.253 2
1 836 . 1 1 A 74 74 LEU HA H 74 5.450 5.300 0.150 2
1 846 . 1 1 A 74 74 LEU C C 74 174.061 175.557 -1.496 2
1 847 . 1 1 A 74 74 LEU CA C 74 53.101 53.465 -0.364 2
1 848 . 1 1 A 74 74 LEU CB C 74 48.268 46.746 1.522 2
1 852 . 1 1 A 74 74 LEU N N 74 125.221 124.387 0.834 2
1 853 . 1 1 A 75 75 SER H H 75 8.840 8.708 0.132 2
1 854 . 1 1 A 75 75 SER HA H 75 5.040 5.220 -0.180 2
1 857 . 1 1 A 75 75 SER C C 75 176.552 173.511 3.041 2
1 858 . 1 1 A 75 75 SER CA C 75 57.487 56.626 0.861 2
1 859 . 1 1 A 75 75 SER CB C 75 64.993 66.203 -1.210 2
1 860 . 1 1 A 75 75 SER N N 75 111.252 114.186 -2.934 2
1 861 . 1 1 A 76 76 ILE H H 76 7.790 8.842 -1.052 2
1 862 . 1 1 A 76 76 ILE HA H 76 4.690 4.506 0.184 2
1 872 . 1 1 A 76 76 ILE C C 76 175.780 177.236 -1.456 2
1 873 . 1 1 A 76 76 ILE CA C 76 63.631 62.036 1.595 2
1 874 . 1 1 A 76 76 ILE CB C 76 39.484 39.472 0.012 2
1 878 . 1 1 A 76 76 ILE N N 76 129.205 123.284 5.921 2
1 879 . 1 1 A 77 77 ARG H H 77 8.115 8.527 -0.412 2
1 880 . 1 1 A 77 77 ARG HA H 77 3.760 4.102 -0.342 2
1 887 . 1 1 A 77 77 ARG C C 77 178.704 177.895 0.809 2
1 888 . 1 1 A 77 77 ARG CA C 77 58.933 58.514 0.419 2
1 889 . 1 1 A 77 77 ARG CB C 77 29.463 29.696 -0.233 2
1 892 . 1 1 A 77 77 ARG N N 77 123.257 121.760 1.497 2
1 893 . 1 1 A 78 78 ALA H H 78 8.304 7.676 0.628 2
1 894 . 1 1 A 78 78 ALA HA H 78 4.296 4.159 0.137 2
1 898 . 1 1 A 78 78 ALA C C 78 176.870 178.493 -1.623 2
1 899 . 1 1 A 78 78 ALA CA C 78 53.548 54.407 -0.859 2
1 900 . 1 1 A 78 78 ALA CB C 78 19.872 18.412 1.460 2
1 901 . 1 1 A 78 78 ALA N N 78 118.764 121.843 -3.079 2
1 902 . 1 1 A 79 79 THR H H 79 7.931 7.817 0.114 2
1 903 . 1 1 A 79 79 THR HA H 79 4.370 4.491 -0.121 2
1 908 . 1 1 A 79 79 THR C C 79 178.356 175.089 3.267 2
1 909 . 1 1 A 79 79 THR CA C 79 62.381 62.552 -0.171 2
1 910 . 1 1 A 79 79 THR CB C 79 69.693 70.302 -0.609 2
1 912 . 1 1 A 79 79 THR N N 79 107.360 106.723 0.637 2
1 913 . 1 1 A 80 80 GLN H H 80 7.651 8.039 -0.388 2
1 914 . 1 1 A 80 80 GLN HA H 80 4.527 4.503 0.024 2
1 921 . 1 1 A 80 80 GLN C C 80 174.249 175.681 -1.433 2
1 922 . 1 1 A 80 80 GLN CA C 80 54.760 55.719 -0.959 2
1 923 . 1 1 A 80 80 GLN CB C 80 30.565 30.087 0.478 2
1 925 . 1 1 A 80 80 GLN N N 80 121.588 120.193 1.395 2
1 927 . 1 1 A 81 81 ALA H H 81 8.498 8.347 0.151 2
1 928 . 1 1 A 81 81 ALA HA H 81 4.252 4.546 -0.294 2
1 932 . 1 1 A 81 81 ALA C C 81 175.693 176.814 -1.121 2
1 933 . 1 1 A 81 81 ALA CA C 81 52.345 52.586 -0.241 2
1 934 . 1 1 A 81 81 ALA CB C 81 19.062 20.371 -1.309 2
1 935 . 1 1 A 81 81 ALA N N 81 126.423 122.317 4.106 2
1 936 . 1 1 A 82 82 ALA H H 82 8.324 7.900 0.424 2
1 937 . 1 1 A 82 82 ALA HA H 82 4.000 4.469 -0.469 2
1 941 . 1 1 A 82 82 ALA C C 82 177.065 176.113 0.952 2
1 942 . 1 1 A 82 82 ALA CA C 82 50.240 50.943 -0.703 2
1 943 . 1 1 A 82 82 ALA CB C 82 17.650 19.304 -1.654 2
1 944 . 1 1 A 82 82 ALA N N 82 125.114 120.056 5.058 2
1 945 . 1 1 A 83 83 PRO HA H 83 4.350 4.500 -0.150 2
1 952 . 1 1 A 83 83 PRO CA C 83 63.148 63.351 -0.203 2
1 953 . 1 1 A 83 83 PRO CB C 83 32.054 32.318 -0.264 2
1 956 . 1 1 A 84 84 GLU H H 84 8.517 8.465 0.052 2
1 957 . 1 1 A 84 84 GLU HA H 84 4.197 4.527 -0.330 2
1 962 . 1 1 A 84 84 GLU C C 84 176.948 175.733 1.215 2
1 963 . 1 1 A 84 84 GLU CA C 84 56.674 56.243 0.431 2
1 964 . 1 1 A 84 84 GLU CB C 84 30.459 31.694 -1.235 2
1 966 . 1 1 A 84 84 GLU N N 84 121.479 119.340 2.139 2
1 967 . 1 1 A 85 85 LYS H H 85 8.381 8.310 0.071 2
1 968 . 1 1 A 85 85 LYS HA H 85 4.309 4.599 -0.290 2
1 977 . 1 1 A 85 85 LYS C C 85 176.457 175.868 0.589 2
1 978 . 1 1 A 85 85 LYS CA C 85 56.272 55.839 0.433 2
1 979 . 1 1 A 85 85 LYS CB C 85 32.961 34.129 -1.167 2
1 983 . 1 1 A 85 85 LYS N N 85 123.266 122.019 1.247 2
1 984 . 1 1 A 86 86 LYS H H 86 8.403 8.470 -0.067 2
1 985 . 1 1 A 86 86 LYS HA H 86 4.308 4.527 -0.219 2
1 994 . 1 1 A 86 86 LYS C C 86 176.435 176.004 0.431 2
1 995 . 1 1 A 86 86 LYS CA C 86 56.272 56.181 0.091 2
1 996 . 1 1 A 86 86 LYS CB C 86 32.961 33.845 -0.884 2
1 1000 . 1 1 A 86 86 LYS N N 86 123.688 121.979 1.709 2
1 1001 . 1 1 A 87 87 GLU H H 87 8.540 8.422 0.118 2
1 1002 . 1 1 A 87 87 GLU HA H 87 4.358 4.520 -0.162 2
1 1007 . 1 1 A 87 87 GLU C C 87 176.556 176.298 0.258 2
1 1008 . 1 1 A 87 87 GLU CA C 87 56.406 56.241 0.165 2
1 1009 . 1 1 A 87 87 GLU CB C 87 30.607 31.533 -0.926 2
1 1011 . 1 1 A 87 87 GLU N N 87 122.633 121.447 1.186 2
1 1012 . 1 1 A 88 88 SER H H 88 8.520 8.487 0.033 2
1 1013 . 1 1 A 88 88 SER HA H 88 4.490 4.529 -0.039 2
1 1016 . 1 1 A 88 88 SER C C 88 175.780 174.428 1.352 2
1 1017 . 1 1 A 88 88 SER CA C 88 58.431 59.424 -0.993 2
1 1018 . 1 1 A 88 88 SER CB C 88 63.858 64.303 -0.445 2
1 1019 . 1 1 A 88 88 SER N N 88 118.333 117.538 0.795 2
1 1020 . 1 1 A 89 89 LYS H H 89 8.339 7.906 0.433 2
1 1021 . 1 1 A 89 89 LYS HA H 89 4.620 4.561 0.059 2
1 1030 . 1 1 A 89 89 LYS C C 89 174.160 174.821 -0.661 2
1 1031 . 1 1 A 89 89 LYS CA C 89 54.265 54.699 -0.434 2
1 1032 . 1 1 A 89 89 LYS CB C 89 32.672 33.066 -0.394 2
1 1036 . 1 1 A 89 89 LYS N N 89 124.433 120.684 3.749 2
1 1037 . 1 1 A 90 90 PRO HA H 90 4.417 4.543 -0.126 2
1 1044 . 1 1 A 90 90 PRO CA C 90 63.064 62.880 0.184 2
1 1045 . 1 1 A 90 90 PRO CB C 90 32.266 32.601 -0.335 2
1 1048 . 1 1 A 91 91 ARG H H 91 8.502 8.683 -0.181 2
1 1049 . 1 1 A 91 91 ARG HA H 91 4.305 4.328 -0.023 2
1 1056 . 1 1 A 91 91 ARG C C 91 176.831 175.848 0.983 2
1 1057 . 1 1 A 91 91 ARG CA C 91 56.002 56.816 -0.814 2
1 1058 . 1 1 A 91 91 ARG CB C 91 30.913 31.307 -0.394 2
1 1061 . 1 1 A 91 91 ARG N N 91 122.193 121.275 0.918 2
1 1062 . 1 1 A 92 92 LYS H H 92 8.415 7.976 0.439 2
1 1063 . 1 1 A 92 92 LYS HA H 92 4.610 4.493 0.117 2
1 1072 . 1 1 A 92 92 LYS C C 92 176.262 175.164 1.098 2
1 1073 . 1 1 A 92 92 LYS CA C 92 54.258 55.063 -0.805 2
1 1074 . 1 1 A 92 92 LYS CB C 92 32.672 33.028 -0.356 2
1 1078 . 1 1 A 92 92 LYS N N 92 124.243 121.031 3.212 2
1 1079 . 1 1 A 93 93 PRO HA H 93 4.415 4.481 -0.066 2
1 1086 . 1 1 A 93 93 PRO CA C 93 62.899 63.658 -0.759 2
1 1087 . 1 1 A 93 93 PRO CB C 93 32.323 32.258 0.065 2
1 1090 . 1 1 A 94 94 LYS H H 94 8.420 8.374 0.046 2
1 1091 . 1 1 A 94 94 LYS HA H 94 4.290 4.397 -0.107 2
1 1100 . 1 1 A 94 94 LYS C C 94 176.714 176.129 0.585 2
1 1101 . 1 1 A 94 94 LYS CA C 94 56.585 56.976 -0.391 2
1 1102 . 1 1 A 94 94 LYS CB C 94 33.161 33.495 -0.334 2
1 1106 . 1 1 A 94 94 LYS N N 94 122.121 119.359 2.762 2
1 1107 . 1 1 A 95 95 ALA H H 95 8.348 8.056 0.292 2
1 1108 . 1 1 A 95 95 ALA HA H 95 4.250 4.479 -0.229 2
1 1112 . 1 1 A 95 95 ALA C C 95 176.453 176.997 -0.544 2
1 1113 . 1 1 A 95 95 ALA CA C 95 52.471 51.936 0.535 2
1 1114 . 1 1 A 95 95 ALA CB C 95 19.347 20.539 -1.192 2
1 1115 . 1 1 A 95 95 ALA N N 95 125.624 122.634 2.990 2
1 1116 . 1 1 A 96 96 ALA H H 96 8.348 8.216 0.132 2
1 1117 . 1 1 A 96 96 ALA HA H 96 4.254 4.385 -0.131 2
1 1121 . 1 1 A 96 96 ALA C C 96 176.462 177.307 -0.845 2
1 1122 . 1 1 A 96 96 ALA CA C 96 52.471 52.511 -0.040 2
1 1123 . 1 1 A 96 96 ALA CB C 96 19.347 19.649 -0.302 2
1 1124 . 1 1 A 96 96 ALA N N 96 125.624 121.273 4.351 2
1 1125 . 1 1 A 97 97 GLN H H 97 8.333 8.331 0.002 2
1 1126 . 1 1 A 97 97 GLN HA H 97 4.362 4.496 -0.134 2
1 1133 . 1 1 A 97 97 GLN C C 97 177.684 175.791 1.893 2
1 1134 . 1 1 A 97 97 GLN CA C 97 55.848 55.913 -0.065 2
1 1135 . 1 1 A 97 97 GLN CB C 97 29.643 30.099 -0.456 2
1 1137 . 1 1 A 97 97 GLN N N 97 120.049 118.988 1.061 2
1 1139 . 1 1 A 98 98 VAL H H 98 8.230 8.382 -0.152 2
1 1140 . 1 1 A 98 98 VAL HA H 98 4.145 4.304 -0.159 2
1 1148 . 1 1 A 98 98 VAL C C 98 176.033 175.837 0.196 2
1 1149 . 1 1 A 98 98 VAL CA C 98 62.444 61.918 0.526 2
1 1150 . 1 1 A 98 98 VAL CB C 98 32.942 33.133 -0.191 2
1 1153 . 1 1 A 98 98 VAL N N 98 121.607 119.640 1.967 2
1 1154 . 1 1 A 99 99 SER H H 99 8.375 8.194 0.181 2
1 1155 . 1 1 A 99 99 SER HA H 99 4.473 4.456 0.017 2
1 1158 . 1 1 A 99 99 SER C C 99 176.204 174.524 1.680 2
1 1159 . 1 1 A 99 99 SER CA C 99 58.379 59.553 -1.174 2
1 1160 . 1 1 A 99 99 SER CB C 99 63.914 64.098 -0.184 2
1 1161 . 1 1 A 99 99 SER N N 99 119.455 117.626 1.829 2
1 1162 . 1 1 A 100 100 GLU H H 100 8.547 8.369 0.178 2
1 1163 . 1 1 A 100 100 GLU HA H 100 4.304 4.515 -0.211 2
1 1168 . 1 1 A 100 100 GLU C C 100 174.620 176.198 -1.578 2
1 1169 . 1 1 A 100 100 GLU CA C 100 56.835 56.523 0.312 2
1 1170 . 1 1 A 100 100 GLU CB C 100 30.365 31.795 -1.430 2
1 1172 . 1 1 A 100 100 GLU N N 100 123.419 121.607 1.812 2
1 1173 . 1 1 A 101 101 GLU H H 101 8.432 8.512 -0.080 2
1 1174 . 1 1 A 101 101 GLU HA H 101 4.252 4.466 -0.214 2
1 1179 . 1 1 A 101 101 GLU C C 101 176.693 176.411 0.282 2
1 1180 . 1 1 A 101 101 GLU CA C 101 56.835 56.902 -0.067 2
1 1181 . 1 1 A 101 101 GLU CB C 101 30.365 30.763 -0.398 2
1 1183 . 1 1 A 101 101 GLU N N 101 122.025 121.302 0.723 2
1 1184 . 1 1 A 102 102 ALA H H 102 8.324 7.996 0.328 2
1 1185 . 1 1 A 102 102 ALA HA H 102 4.361 4.355 0.006 2
1 1189 . 1 1 A 102 102 ALA C C 102 177.065 177.013 0.052 2
1 1190 . 1 1 A 102 102 ALA CA C 102 52.647 52.074 0.573 2
1 1191 . 1 1 A 102 102 ALA CB C 102 19.227 20.175 -0.948 2
1 1192 . 1 1 A 102 102 ALA N N 102 125.114 123.333 1.781 2
1 1193 . 1 1 A 103 103 SER H H 103 8.259 8.260 -0.001 2
1 1194 . 1 1 A 103 103 SER HA H 103 4.473 4.484 -0.011 2
1 1197 . 1 1 A 103 103 SER C C 103 177.772 174.276 3.496 2
1 1198 . 1 1 A 103 103 SER CA C 103 58.301 59.126 -0.825 2
1 1199 . 1 1 A 103 103 SER CB C 103 63.961 63.666 0.295 2
1 1200 . 1 1 A 103 103 SER N N 103 115.109 114.526 0.583 2
1 1201 . 1 1 A 104 104 THR H H 104 8.127 7.987 0.140 2
1 1202 . 1 1 A 104 104 THR HA H 104 4.600 4.451 0.149 2
1 1207 . 1 1 A 104 104 THR C C 104 174.427 174.130 0.297 2
1 1208 . 1 1 A 104 104 THR CA C 104 59.954 61.554 -1.600 2
1 1209 . 1 1 A 104 104 THR CB C 104 69.868 68.933 0.935 2
1 1211 . 1 1 A 104 104 THR N N 104 117.882 114.779 3.103 2
1 1212 . 1 1 A 105 105 PRO HA H 105 4.414 4.459 -0.045 2
1 1219 . 1 1 A 105 105 PRO CA C 105 63.300 63.718 -0.418 2
1 1220 . 1 1 A 105 105 PRO CB C 105 32.227 32.131 0.096 2
1 1223 . 1 1 A 106 106 GLN H H 106 8.524 8.281 0.243 2
1 1224 . 1 1 A 106 106 GLN HA H 106 4.276 4.386 -0.110 2
1 1229 . 1 1 A 106 106 GLN C C 106 177.083 175.848 1.235 2
1 1230 . 1 1 A 106 106 GLN CA C 106 56.209 56.033 0.176 2
1 1231 . 1 1 A 106 106 GLN CB C 106 29.490 30.069 -0.579 2
1 1233 . 1 1 A 106 106 GLN N N 106 120.754 118.464 2.290 2
1 1234 . 1 1 A 107 107 GLY H H 107 8.394 8.071 0.323 2
1 1235 . 1 1 A 107 107 GLY HA2 H 107 3.895 4.023 -0.128 2
1 1236 . 1 1 A 107 107 GLY HA3 H 107 3.895 4.064 -0.169 2
1 1237 . 1 1 A 107 107 GLY C C 107 176.651 173.431 3.220 2
1 1238 . 1 1 A 107 107 GLY CA C 107 45.330 45.562 -0.232 2
1 1239 . 1 1 A 107 107 GLY N N 107 110.026 108.209 1.817 2
1 1240 . 1 1 A 108 108 PHE H H 108 8.099 8.349 -0.250 2
1 1241 . 1 1 A 108 108 PHE HA H 108 4.582 4.669 -0.087 2
1 1245 . 1 1 A 108 108 PHE C C 108 173.944 175.150 -1.206 2
1 1246 . 1 1 A 108 108 PHE CA C 108 58.054 58.440 -0.386 2
1 1247 . 1 1 A 108 108 PHE CB C 108 39.708 40.123 -0.414 2
1 1248 . 1 1 A 108 108 PHE N N 108 120.180 119.253 0.927 2
1 1249 . 1 1 A 109 109 ASN H H 109 8.482 8.144 0.338 2
1 1250 . 1 1 A 109 109 ASN HA H 109 4.691 4.824 -0.133 2
1 1255 . 1 1 A 109 109 ASN C C 109 175.627 175.060 0.567 2
1 1256 . 1 1 A 109 109 ASN CA C 109 53.402 53.517 -0.115 2
1 1257 . 1 1 A 109 109 ASN CB C 109 38.883 40.537 -1.654 2
1 1258 . 1 1 A 109 109 ASN N N 109 120.752 119.297 1.455 2
1 1260 . 1 1 A 110 110 THR H H 110 8.112 8.254 -0.142 2
1 1261 . 1 1 A 110 110 THR HA H 110 4.251 4.312 -0.061 2
1 1266 . 1 1 A 110 110 THR C C 110 175.275 174.712 0.563 2
1 1267 . 1 1 A 110 110 THR CA C 110 62.460 63.168 -0.708 2
1 1268 . 1 1 A 110 110 THR CB C 110 69.726 69.448 0.278 2
1 1270 . 1 1 A 110 110 THR N N 110 114.601 115.706 -1.105 2
1 1271 . 1 1 A 111 111 LEU H H 111 8.168 8.019 0.149 2
1 1272 . 1 1 A 111 111 LEU HA H 111 4.308 4.405 -0.097 2
1 1282 . 1 1 A 111 111 LEU CA C 111 55.704 55.317 0.387 2
1 1283 . 1 1 A 111 111 LEU CB C 111 42.071 43.193 -1.122 2
1 1287 . 1 1 A 111 111 LEU N N 111 123.756 123.080 0.676 2
1 1288 . 1 1 A 112 112 LYS H H 112 8.123 8.395 -0.272 2
1 1289 . 1 1 A 112 112 LYS HA H 112 4.242 4.353 -0.111 2
1 1298 . 1 1 A 112 112 LYS C C 112 177.547 176.078 1.469 2
1 1299 . 1 1 A 112 112 LYS CA C 112 56.928 56.989 -0.061 2
1 1300 . 1 1 A 112 112 LYS CB C 112 33.055 33.609 -0.554 2
1 1304 . 1 1 A 112 112 LYS N N 112 121.442 121.768 -0.326 2
1 1305 . 1 1 A 113 113 ASP H H 113 8.230 8.330 -0.100 2
1 1306 . 1 1 A 113 113 ASP HA H 113 4.526 4.661 -0.135 2
1 1309 . 1 1 A 113 113 ASP C C 113 176.532 175.666 0.866 2
1 1310 . 1 1 A 113 113 ASP CA C 113 54.896 54.753 0.143 2
1 1311 . 1 1 A 113 113 ASP CB C 113 41.362 42.459 -1.097 2
1 1312 . 1 1 A 113 113 ASP N N 113 120.598 121.515 -0.917 2
1 1313 . 1 1 A 114 114 LYS H H 114 8.127 8.298 -0.171 2
1 1314 . 1 1 A 114 114 LYS HA H 114 4.300 4.550 -0.250 2
1 1323 . 1 1 A 114 114 LYS C C 114 176.303 176.113 0.190 2
1 1324 . 1 1 A 114 114 LYS CA C 114 56.633 56.146 0.487 2
1 1325 . 1 1 A 114 114 LYS CB C 114 32.818 34.274 -1.456 2
1 1329 . 1 1 A 114 114 LYS N N 114 120.897 121.314 -0.417 2
1 1330 . 1 1 A 115 115 LEU H H 115 8.244 8.297 -0.053 2
1 1331 . 1 1 A 115 115 LEU HA H 115 4.254 4.372 -0.118 2
1 1341 . 1 1 A 115 115 LEU C C 115 176.909 176.476 0.433 2
1 1342 . 1 1 A 115 115 LEU CA C 115 56.282 55.374 0.908 2
1 1343 . 1 1 A 115 115 LEU CB C 115 42.188 43.386 -1.197 2
1 1347 . 1 1 A 115 115 LEU N N 115 123.251 123.808 -0.557 2
1 1348 . 1 1 A 116 116 GLU H H 116 8.421 8.369 0.052 2
1 1349 . 1 1 A 116 116 GLU HA H 116 4.190 4.351 -0.161 2
1 1352 . 1 1 A 116 116 GLU C C 116 177.828 176.301 1.527 2
1 1353 . 1 1 A 116 116 GLU CA C 116 57.466 56.787 0.679 2
1 1354 . 1 1 A 116 116 GLU CB C 116 30.124 30.924 -0.800 2
1 1355 . 1 1 A 116 116 GLU N N 116 120.575 121.355 -0.780 2
1 1356 . 1 1 A 117 117 GLU H H 117 8.255 8.270 -0.015 2
1 1357 . 1 1 A 117 117 GLU HA H 117 4.192 4.370 -0.178 2
1 1362 . 1 1 A 117 117 GLU CA C 117 57.491 56.677 0.814 2
1 1363 . 1 1 A 117 117 GLU CB C 117 30.365 31.365 -1.000 2
1 1365 . 1 1 A 117 117 GLU N N 117 120.933 119.854 1.079 2
1 1366 . 1 1 A 118 118 TRP H H 118 8.143 8.096 0.047 2
1 1367 . 1 1 A 118 118 TRP HA H 118 4.581 4.705 -0.124 2
1 1372 . 1 1 A 118 118 TRP C C 118 176.794 176.353 0.441 2
1 1373 . 1 1 A 118 118 TRP CA C 118 58.363 57.912 0.451 2
1 1374 . 1 1 A 118 118 TRP CB C 118 29.333 29.951 -0.619 2
1 1375 . 1 1 A 118 118 TRP N N 118 121.592 120.420 1.172 2
1 1376 . 1 1 A 119 119 ILE H H 119 7.908 7.895 0.013 2
1 1377 . 1 1 A 119 119 ILE HA H 119 3.828 4.242 -0.414 2
1 1387 . 1 1 A 119 119 ILE C C 119 176.984 175.968 1.016 2
1 1388 . 1 1 A 119 119 ILE CA C 119 62.335 61.411 0.924 2
1 1389 . 1 1 A 119 119 ILE CB C 119 38.649 39.465 -0.816 2
1 1393 . 1 1 A 119 119 ILE N N 119 122.744 119.641 3.103 2
1 1394 . 1 1 A 120 120 GLU H H 120 8.143 8.394 -0.251 2
1 1395 . 1 1 A 120 120 GLU HA H 120 4.093 4.344 -0.251 2
1 1400 . 1 1 A 120 120 GLU C C 120 176.565 176.552 0.013 2
1 1401 . 1 1 A 120 120 GLU CA C 120 57.613 56.984 0.629 2
1 1402 . 1 1 A 120 120 GLU CB C 120 29.834 30.811 -0.977 2
1 1404 . 1 1 A 120 120 GLU N N 120 123.139 123.391 -0.252 2
1 1405 . 1 1 A 121 121 MET H H 121 8.254 8.327 -0.073 2
1 1406 . 1 1 A 121 121 MET HA H 121 4.357 4.479 -0.122 2
1 1411 . 1 1 A 121 121 MET CA C 121 56.625 56.210 0.415 2
1 1412 . 1 1 A 121 121 MET CB C 121 32.664 33.611 -0.947 2
1 1414 . 1 1 A 121 121 MET N N 121 120.449 120.529 -0.080 2
1 1415 . 1 1 A 122 122 SER H H 122 8.199 8.340 -0.141 2
1 1416 . 1 1 A 122 122 SER HA H 122 4.280 4.456 -0.176 2
1 1419 . 1 1 A 122 122 SER C C 122 177.224 174.348 2.876 2
1 1420 . 1 1 A 122 122 SER CA C 122 59.635 59.742 -0.107 2
1 1421 . 1 1 A 122 122 SER CB C 122 63.560 63.801 -0.241 2
1 1422 . 1 1 A 122 122 SER N N 122 115.857 115.878 -0.021 2
1 1423 . 1 1 A 123 123 ASN H H 123 8.211 8.267 -0.056 2
1 1424 . 1 1 A 123 123 ASN HA H 123 4.737 4.759 -0.022 2
1 1429 . 1 1 A 123 123 ASN C C 123 174.709 175.347 -0.638 2
1 1430 . 1 1 A 123 123 ASN CA C 123 53.507 53.856 -0.349 2
1 1431 . 1 1 A 123 123 ASN CB C 123 38.800 39.724 -0.924 2
1 1432 . 1 1 A 123 123 ASN N N 123 119.923 119.740 0.183 2
1 1434 . 1 1 A 124 124 ARG H H 124 7.997 8.110 -0.113 2
1 1435 . 1 1 A 124 124 ARG HA H 124 4.305 4.347 -0.042 2
1 1442 . 1 1 A 124 124 ARG C C 124 175.477 176.770 -1.293 2
1 1443 . 1 1 A 124 124 ARG CA C 124 56.709 56.671 0.038 2
1 1444 . 1 1 A 124 124 ARG CB C 124 30.584 31.320 -0.736 2
1 1447 . 1 1 A 124 124 ARG N N 124 120.821 121.451 -0.630 2
1 1448 . 1 1 A 125 125 LYS H H 125 8.327 8.236 0.091 2
1 1449 . 1 1 A 125 125 LYS HA H 125 4.254 4.192 0.061 2
1 1458 . 1 1 A 125 125 LYS C C 125 176.777 176.746 0.031 2
1 1459 . 1 1 A 125 125 LYS CA C 125 56.860 57.572 -0.712 2
1 1460 . 1 1 A 125 125 LYS CB C 125 32.879 32.852 0.027 2
1 1464 . 1 1 A 125 125 LYS N N 125 121.891 121.393 0.498 2
1 1465 . 1 1 A 126 126 ASP H H 126 8.343 8.369 -0.026 2
1 1466 . 1 1 A 126 126 ASP HA H 126 4.581 4.612 -0.031 2
1 1469 . 1 1 A 126 126 ASP C C 126 176.538 175.971 0.567 2
1 1470 . 1 1 A 126 126 ASP CA C 126 54.540 55.328 -0.788 2
1 1471 . 1 1 A 126 126 ASP CB C 126 40.907 41.624 -0.717 2
1 1472 . 1 1 A 126 126 ASP N N 126 119.814 121.791 -1.977 2
1 1473 . 1 1 A 127 127 LEU H H 127 7.946 7.999 -0.053 2
1 1474 . 1 1 A 127 127 LEU HA H 127 4.309 4.494 -0.184 2
1 1484 . 1 1 A 127 127 LEU C C 127 176.043 175.976 0.067 2
1 1485 . 1 1 A 127 127 LEU CA C 127 55.427 54.857 0.570 2
1 1486 . 1 1 A 127 127 LEU CB C 127 42.394 43.260 -0.866 2
1 1490 . 1 1 A 127 127 LEU N N 127 121.432 120.238 1.194 2
1 1491 . 1 1 A 128 128 ILE H H 128 7.967 8.292 -0.325 2
1 1492 . 1 1 A 128 128 ILE HA H 128 4.141 4.362 -0.221 2
1 1502 . 1 1 A 128 128 ILE C C 128 177.200 175.273 1.927 2
1 1503 . 1 1 A 128 128 ILE CA C 128 61.150 61.013 0.137 2
1 1504 . 1 1 A 128 128 ILE CB C 128 38.489 39.903 -1.414 2
1 1508 . 1 1 A 128 128 ILE N N 128 121.579 122.129 -0.550 2
1 1509 . 1 1 A 129 129 LYS H H 129 8.331 8.532 -0.201 2
1 1510 . 1 1 A 129 129 LYS HA H 129 4.328 4.584 -0.256 2
1 1519 . 1 1 A 129 129 LYS C C 129 175.952 176.128 -0.176 2
1 1520 . 1 1 A 129 129 LYS CA C 129 56.330 55.850 0.480 2
1 1521 . 1 1 A 129 129 LYS CB C 129 33.010 34.520 -1.510 2
1 1525 . 1 1 A 129 129 LYS N N 129 126.955 124.366 2.589 2
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