data_16102_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16102
_Entry.PDB_ID 2KD1
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 1 A 3 3 PRO HA H 3 4.390 4.609 -0.219 1
1 12 . 1 1 1 A 3 3 PRO C C 3 176.847 176.172 0.675 1
1 13 . 1 1 1 A 3 3 PRO CA C 3 63.449 62.500 0.949 1
1 14 . 1 1 1 A 3 3 PRO CB C 3 31.938 32.853 -0.915 1
1 17 . 1 1 1 A 4 4 SER H H 4 8.531 8.699 -0.168 1
1 18 . 1 1 1 A 4 4 SER HA H 4 4.262 4.515 -0.253 1
1 21 . 1 1 1 A 4 4 SER C C 4 175.414 174.111 1.303 1
1 22 . 1 1 1 A 4 4 SER CA C 4 59.163 57.461 1.702 1
1 23 . 1 1 1 A 4 4 SER CB C 4 63.242 60.798 2.444 1
1 24 . 1 1 1 A 4 4 SER N N 4 114.246 118.495 -4.249 1
1 25 . 1 1 1 A 5 5 LYS H H 5 8.468 7.960 0.508 1
1 26 . 1 1 1 A 5 5 LYS HA H 5 4.433 4.348 0.085 1
1 35 . 1 1 1 A 5 5 LYS C C 5 175.984 176.936 -0.952 1
1 36 . 1 1 1 A 5 5 LYS CA C 5 55.724 56.879 -1.155 1
1 37 . 1 1 1 A 5 5 LYS CB C 5 32.881 33.281 -0.400 1
1 41 . 1 1 1 A 5 5 LYS N N 5 123.488 124.690 -1.202 1
1 42 . 1 1 1 A 6 6 LEU H H 6 7.707 7.445 0.262 1
1 43 . 1 1 1 A 6 6 LEU HA H 6 4.381 4.323 0.058 1
1 53 . 1 1 1 A 6 6 LEU C C 6 177.820 175.974 1.846 1
1 54 . 1 1 1 A 6 6 LEU CA C 6 55.507 55.422 0.085 1
1 55 . 1 1 1 A 6 6 LEU CB C 6 43.374 42.549 0.825 1
1 59 . 1 1 1 A 6 6 LEU N N 6 121.233 122.803 -1.570 1
1 60 . 1 1 1 A 7 7 SER H H 7 9.433 8.915 0.518 1
1 61 . 1 1 1 A 7 7 SER HA H 7 4.638 4.593 0.045 1
1 64 . 1 1 1 A 7 7 SER C C 7 174.120 175.061 -0.941 1
1 65 . 1 1 1 A 7 7 SER CA C 7 57.962 58.687 -0.725 1
1 66 . 1 1 1 A 7 7 SER CB C 7 64.197 63.799 0.398 1
1 67 . 1 1 1 A 7 7 SER N N 7 122.977 122.058 0.919 1
1 68 . 1 1 1 A 8 8 TYR H H 8 9.764 9.174 0.590 1
1 69 . 1 1 1 A 8 8 TYR HA H 8 4.732 4.254 0.478 1
1 76 . 1 1 1 A 8 8 TYR C C 8 177.206 177.549 -0.343 1
1 77 . 1 1 1 A 8 8 TYR CA C 8 58.762 61.805 -3.043 1
1 78 . 1 1 1 A 8 8 TYR CB C 8 36.605 38.868 -2.263 1
1 83 . 1 1 1 A 8 8 TYR N N 8 123.312 128.704 -5.392 1
1 84 . 1 1 1 A 9 9 GLY H H 9 10.131 8.343 1.788 1
1 85 . 1 1 1 A 9 9 GLY HA2 H 9 3.983 3.636 0.347 1
1 86 . 1 1 1 A 9 9 GLY HA3 H 9 3.423 3.727 -0.304 1
1 87 . 1 1 1 A 9 9 GLY C C 9 175.163 176.592 -1.429 1
1 88 . 1 1 1 A 9 9 GLY CA C 9 47.153 47.573 -0.420 1
1 89 . 1 1 1 A 9 9 GLY N N 9 107.177 105.946 1.231 1
1 90 . 1 1 1 A 10 10 GLU H H 10 7.876 8.034 -0.158 1
1 91 . 1 1 1 A 10 10 GLU HA H 10 4.107 4.090 0.017 1
1 96 . 1 1 1 A 10 10 GLU C C 10 179.924 179.065 0.859 1
1 97 . 1 1 1 A 10 10 GLU CA C 10 58.890 59.506 -0.616 1
1 98 . 1 1 1 A 10 10 GLU CB C 10 29.750 29.426 0.324 1
1 100 . 1 1 1 A 10 10 GLU N N 10 122.219 121.879 0.340 1
1 101 . 1 1 1 A 11 11 TYR H H 11 8.384 8.114 0.270 1
1 102 . 1 1 1 A 11 11 TYR HA H 11 4.305 4.187 0.118 1
1 107 . 1 1 1 A 11 11 TYR C C 11 176.854 177.038 -0.184 1
1 108 . 1 1 1 A 11 11 TYR CA C 11 61.040 61.498 -0.458 1
1 109 . 1 1 1 A 11 11 TYR CB C 11 37.593 39.064 -1.471 1
1 112 . 1 1 1 A 11 11 TYR N N 11 120.809 122.744 -1.935 1
1 113 . 1 1 1 A 12 12 LEU H H 12 9.027 8.299 0.728 1
1 114 . 1 1 1 A 12 12 LEU HA H 12 3.778 3.700 0.078 1
1 124 . 1 1 1 A 12 12 LEU C C 12 178.621 179.371 -0.750 1
1 125 . 1 1 1 A 12 12 LEU CA C 12 57.534 57.568 -0.034 1
1 126 . 1 1 1 A 12 12 LEU CB C 12 41.957 40.728 1.229 1
1 130 . 1 1 1 A 12 12 LEU N N 12 121.080 119.050 2.030 1
1 131 . 1 1 1 A 13 13 GLU H H 13 7.614 7.943 -0.329 1
1 132 . 1 1 1 A 13 13 GLU HA H 13 4.102 4.058 0.044 1
1 137 . 1 1 1 A 13 13 GLU C C 13 178.449 179.485 -1.036 1
1 138 . 1 1 1 A 13 13 GLU CA C 13 59.609 59.450 0.159 1
1 139 . 1 1 1 A 13 13 GLU CB C 13 29.124 29.747 -0.623 1
1 141 . 1 1 1 A 13 13 GLU N N 13 118.475 120.646 -2.171 1
1 142 . 1 1 1 A 14 14 SER H H 14 7.329 7.914 -0.585 1
1 143 . 1 1 1 A 14 14 SER HA H 14 4.358 4.238 0.120 1
1 146 . 1 1 1 A 14 14 SER C C 14 176.794 176.085 0.709 1
1 147 . 1 1 1 A 14 14 SER CA C 14 61.064 62.392 -1.328 1
1 148 . 1 1 1 A 14 14 SER CB C 14 62.513 63.472 -0.959 1
1 149 . 1 1 1 A 14 14 SER N N 14 115.209 117.188 -1.979 1
1 150 . 1 1 1 A 15 15 TRP H H 15 8.870 7.843 1.027 1
1 151 . 1 1 1 A 15 15 TRP HA H 15 4.005 4.264 -0.259 1
1 160 . 1 1 1 A 15 15 TRP C C 15 177.547 178.003 -0.456 1
1 161 . 1 1 1 A 15 15 TRP CA C 15 61.210 61.123 0.087 1
1 162 . 1 1 1 A 15 15 TRP CB C 15 27.341 29.227 -1.886 1
1 168 . 1 1 1 A 15 15 TRP N N 15 124.998 123.627 1.371 1
1 170 . 1 1 1 A 16 16 PHE H H 16 9.087 8.369 0.718 1
1 171 . 1 1 1 A 16 16 PHE HA H 16 3.210 3.703 -0.493 1
1 179 . 1 1 1 A 16 16 PHE C C 16 175.909 177.181 -1.272 1
1 180 . 1 1 1 A 16 16 PHE CA C 16 61.473 61.195 0.278 1
1 181 . 1 1 1 A 16 16 PHE CB C 16 38.506 39.242 -0.736 1
1 187 . 1 1 1 A 16 16 PHE N N 16 119.825 120.898 -1.073 1
1 188 . 1 1 1 A 17 17 ASN H H 17 7.768 8.403 -0.635 1
1 189 . 1 1 1 A 17 17 ASN HA H 17 4.078 4.155 -0.077 1
1 194 . 1 1 1 A 17 17 ASN C C 17 176.604 177.614 -1.010 1
1 195 . 1 1 1 A 17 17 ASN CA C 17 55.621 56.021 -0.400 1
1 196 . 1 1 1 A 17 17 ASN CB C 17 37.830 38.072 -0.242 1
1 197 . 1 1 1 A 17 17 ASN N N 17 115.600 117.253 -1.653 1
1 199 . 1 1 1 A 18 18 THR H H 18 7.454 7.534 -0.080 1
1 200 . 1 1 1 A 18 18 THR HA H 18 4.147 3.947 0.200 1
1 205 . 1 1 1 A 18 18 THR C C 18 175.692 176.072 -0.380 1
1 206 . 1 1 1 A 18 18 THR CA C 18 64.679 64.751 -0.072 1
1 207 . 1 1 1 A 18 18 THR CB C 18 68.940 68.747 0.193 1
1 209 . 1 1 1 A 18 18 THR N N 18 113.049 115.101 -2.052 1
1 210 . 1 1 1 A 19 19 LYS H H 19 7.918 7.514 0.404 1
1 211 . 1 1 1 A 19 19 LYS HA H 19 3.791 3.748 0.043 1
1 220 . 1 1 1 A 19 19 LYS C C 19 178.120 178.793 -0.673 1
1 221 . 1 1 1 A 19 19 LYS CA C 19 55.985 58.731 -2.746 1
1 222 . 1 1 1 A 19 19 LYS CB C 19 31.130 31.025 0.105 1
1 226 . 1 1 1 A 19 19 LYS N N 19 122.614 120.683 1.931 1
1 227 . 1 1 1 A 20 20 ARG H H 20 7.845 7.611 0.234 1
1 228 . 1 1 1 A 20 20 ARG HA H 20 3.396 3.726 -0.330 1
1 236 . 1 1 1 A 20 20 ARG C C 20 175.601 178.430 -2.829 1
1 237 . 1 1 1 A 20 20 ARG CA C 20 58.182 59.059 -0.877 1
1 238 . 1 1 1 A 20 20 ARG CB C 20 28.045 29.665 -1.620 1
1 241 . 1 1 1 A 20 20 ARG N N 20 116.282 118.387 -2.105 1
1 243 . 1 1 1 A 21 21 HIS H H 21 7.163 7.700 -0.537 1
1 244 . 1 1 1 A 21 21 HIS HA H 21 4.500 4.351 0.149 1
1 249 . 1 1 1 A 21 21 HIS C C 21 175.618 176.483 -0.865 1
1 250 . 1 1 1 A 21 21 HIS CA C 21 56.912 58.865 -1.953 1
1 251 . 1 1 1 A 21 21 HIS CB C 21 29.400 29.215 0.185 1
1 254 . 1 1 1 A 21 21 HIS N N 21 115.452 118.675 -3.223 1
1 255 . 1 1 1 A 22 22 SER H H 22 7.951 7.728 0.223 1
1 256 . 1 1 1 A 22 22 SER HA H 22 4.573 4.369 0.204 1
1 259 . 1 1 1 A 22 22 SER C C 22 173.948 175.292 -1.344 1
1 260 . 1 1 1 A 22 22 SER CA C 22 58.589 60.887 -2.298 1
1 261 . 1 1 1 A 22 22 SER CB C 22 64.228 63.608 0.620 1
1 262 . 1 1 1 A 22 22 SER N N 22 113.209 114.955 -1.746 1
1 263 . 1 1 1 A 23 23 VAL H H 23 7.179 7.631 -0.452 1
1 264 . 1 1 1 A 23 23 VAL HA H 23 4.626 4.046 0.580 1
1 272 . 1 1 1 A 23 23 VAL C C 23 175.397 175.915 -0.518 1
1 273 . 1 1 1 A 23 23 VAL CA C 23 59.556 63.122 -3.566 1
1 274 . 1 1 1 A 23 23 VAL CB C 23 33.810 33.138 0.672 1
1 277 . 1 1 1 A 23 23 VAL N N 23 113.108 114.385 -1.277 1
1 278 . 1 1 1 A 24 24 GLY H H 24 8.189 7.598 0.591 1
1 279 . 1 1 1 A 24 24 GLY HA2 H 24 4.074 3.993 0.081 1
1 280 . 1 1 1 A 24 24 GLY HA3 H 24 4.195 4.017 0.178 1
1 281 . 1 1 1 A 24 24 GLY C C 24 174.037 174.991 -0.954 1
1 282 . 1 1 1 A 24 24 GLY CA C 24 44.452 44.458 -0.006 1
1 283 . 1 1 1 A 24 24 GLY N N 24 108.374 109.788 -1.414 1
1 284 . 1 1 1 A 25 25 ILE H H 25 8.331 8.667 -0.336 1
1 285 . 1 1 1 A 25 25 ILE HA H 25 3.839 3.694 0.145 1
1 295 . 1 1 1 A 25 25 ILE C C 25 178.042 177.739 0.303 1
1 296 . 1 1 1 A 25 25 ILE CA C 25 64.238 64.209 0.029 1
1 297 . 1 1 1 A 25 25 ILE CB C 25 37.931 37.698 0.233 1
1 301 . 1 1 1 A 25 25 ILE N N 25 119.895 120.874 -0.979 1
1 302 . 1 1 1 A 26 26 GLN H H 26 8.545 8.626 -0.081 1
1 303 . 1 1 1 A 26 26 GLN HA H 26 4.129 4.040 0.089 1
1 310 . 1 1 1 A 26 26 GLN C C 26 178.454 177.108 1.346 1
1 311 . 1 1 1 A 26 26 GLN CA C 26 58.772 58.083 0.689 1
1 312 . 1 1 1 A 26 26 GLN CB C 26 27.346 26.707 0.639 1
1 314 . 1 1 1 A 26 26 GLN N N 26 120.013 120.044 -0.031 1
1 316 . 1 1 1 A 27 27 THR H H 27 7.944 7.808 0.136 1
1 317 . 1 1 1 A 27 27 THR HA H 27 3.953 3.900 0.053 1
1 322 . 1 1 1 A 27 27 THR C C 27 175.818 175.747 0.071 1
1 323 . 1 1 1 A 27 27 THR CA C 27 65.855 66.546 -0.691 1
1 324 . 1 1 1 A 27 27 THR CB C 27 68.127 68.602 -0.475 1
1 326 . 1 1 1 A 27 27 THR N N 27 117.645 117.232 0.413 1
1 327 . 1 1 1 A 28 28 ALA H H 28 8.593 8.101 0.492 1
1 328 . 1 1 1 A 28 28 ALA HA H 28 3.899 4.088 -0.189 1
1 332 . 1 1 1 A 28 28 ALA C C 28 178.515 179.873 -1.358 1
1 333 . 1 1 1 A 28 28 ALA CA C 28 55.742 55.394 0.348 1
1 334 . 1 1 1 A 28 28 ALA CB C 28 17.513 18.070 -0.557 1
1 335 . 1 1 1 A 28 28 ALA N N 28 123.917 123.627 0.290 1
1 336 . 1 1 1 A 29 29 LYS H H 29 7.800 8.023 -0.223 1
1 337 . 1 1 1 A 29 29 LYS HA H 29 3.982 3.974 0.008 1
1 346 . 1 1 1 A 29 29 LYS C C 29 179.527 178.779 0.748 1
1 347 . 1 1 1 A 29 29 LYS CA C 29 59.761 59.541 0.220 1
1 348 . 1 1 1 A 29 29 LYS CB C 29 32.223 32.291 -0.068 1
1 352 . 1 1 1 A 29 29 LYS N N 29 117.474 118.935 -1.461 1
1 353 . 1 1 1 A 30 30 VAL H H 30 7.591 7.621 -0.030 1
1 354 . 1 1 1 A 30 30 VAL HA H 30 3.503 3.394 0.109 1
1 362 . 1 1 1 A 30 30 VAL C C 30 178.389 177.999 0.390 1
1 363 . 1 1 1 A 30 30 VAL CA C 30 65.640 65.981 -0.341 1
1 364 . 1 1 1 A 30 30 VAL CB C 30 31.644 31.536 0.108 1
1 367 . 1 1 1 A 30 30 VAL N N 30 121.749 120.176 1.573 1
1 368 . 1 1 1 A 31 31 LEU H H 31 8.333 7.879 0.454 1
1 369 . 1 1 1 A 31 31 LEU HA H 31 4.074 4.069 0.005 1
1 379 . 1 1 1 A 31 31 LEU C C 31 177.780 178.816 -1.036 1
1 380 . 1 1 1 A 31 31 LEU CA C 31 58.157 58.106 0.051 1
1 381 . 1 1 1 A 31 31 LEU CB C 31 42.230 41.207 1.023 1
1 385 . 1 1 1 A 31 31 LEU N N 31 120.901 120.225 0.676 1
1 386 . 1 1 1 A 32 32 LYS H H 32 8.562 7.768 0.794 1
1 387 . 1 1 1 A 32 32 LYS HA H 32 3.290 3.752 -0.462 1
1 395 . 1 1 1 A 32 32 LYS C C 32 178.037 178.788 -0.751 1
1 396 . 1 1 1 A 32 32 LYS CA C 32 58.911 59.347 -0.436 1
1 397 . 1 1 1 A 32 32 LYS CB C 32 31.605 31.150 0.455 1
1 401 . 1 1 1 A 32 32 LYS N N 32 119.075 119.287 -0.212 1
1 402 . 1 1 1 A 33 33 GLY H H 33 7.694 8.008 -0.314 1
1 403 . 1 1 1 A 33 33 GLY HA2 H 33 3.949 3.594 0.355 1
1 404 . 1 1 1 A 33 33 GLY HA3 H 33 3.826 3.676 0.150 1
1 405 . 1 1 1 A 33 33 GLY C C 33 177.101 176.502 0.599 1
1 406 . 1 1 1 A 33 33 GLY CA C 33 46.928 47.098 -0.170 1
1 407 . 1 1 1 A 33 33 GLY N N 33 105.282 106.935 -1.653 1
1 408 . 1 1 1 A 34 34 TYR H H 34 8.015 7.702 0.313 1
1 409 . 1 1 1 A 34 34 TYR HA H 34 4.558 4.682 -0.124 1
1 416 . 1 1 1 A 34 34 TYR C C 34 179.611 178.089 1.522 1
1 417 . 1 1 1 A 34 34 TYR CA C 34 59.349 60.360 -1.011 1
1 418 . 1 1 1 A 34 34 TYR CB C 34 37.344 38.526 -1.182 1
1 423 . 1 1 1 A 34 34 TYR N N 34 121.781 121.759 0.022 1
1 424 . 1 1 1 A 35 35 LEU H H 35 8.689 8.132 0.557 1
1 425 . 1 1 1 A 35 35 LEU HA H 35 3.977 3.841 0.136 1
1 435 . 1 1 1 A 35 35 LEU C C 35 177.081 178.982 -1.901 1
1 436 . 1 1 1 A 35 35 LEU CA C 35 59.155 58.354 0.801 1
1 437 . 1 1 1 A 35 35 LEU CB C 35 41.103 41.772 -0.669 1
1 441 . 1 1 1 A 35 35 LEU N N 35 120.392 120.596 -0.204 1
1 442 . 1 1 1 A 36 36 ASN H H 36 8.721 8.597 0.124 1
1 443 . 1 1 1 A 36 36 ASN HA H 36 4.435 4.457 -0.022 1
1 448 . 1 1 1 A 36 36 ASN C C 36 176.792 177.434 -0.642 1
1 449 . 1 1 1 A 36 36 ASN CA C 36 55.642 55.381 0.261 1
1 450 . 1 1 1 A 36 36 ASN CB C 36 38.319 37.067 1.252 1
1 451 . 1 1 1 A 36 36 ASN N N 36 114.623 115.742 -1.119 1
1 453 . 1 1 1 A 37 37 SER H H 37 8.511 7.924 0.587 1
1 454 . 1 1 1 A 37 37 SER HA H 37 4.642 4.378 0.264 1
1 457 . 1 1 1 A 37 37 SER C C 37 175.039 176.185 -1.146 1
1 458 . 1 1 1 A 37 37 SER CA C 37 59.825 61.274 -1.449 1
1 459 . 1 1 1 A 37 37 SER CB C 37 64.056 63.024 1.032 1
1 460 . 1 1 1 A 37 37 SER N N 37 110.941 115.336 -4.395 1
1 461 . 1 1 1 A 38 38 ARG H H 38 7.242 8.061 -0.819 1
1 462 . 1 1 1 A 38 38 ARG HA H 38 4.919 4.451 0.468 1
1 469 . 1 1 1 A 38 38 ARG C C 38 176.514 178.195 -1.681 1
1 470 . 1 1 1 A 38 38 ARG CA C 38 56.687 57.981 -1.294 1
1 471 . 1 1 1 A 38 38 ARG CB C 38 32.434 31.024 1.410 1
1 474 . 1 1 1 A 38 38 ARG N N 38 117.062 120.684 -3.622 1
1 475 . 1 1 1 A 39 39 ILE H H 39 8.462 8.014 0.448 1
1 476 . 1 1 1 A 39 39 ILE HA H 39 3.618 3.759 -0.141 1
1 486 . 1 1 1 A 39 39 ILE C C 39 176.267 178.300 -2.033 1
1 487 . 1 1 1 A 39 39 ILE CA C 39 66.134 65.067 1.067 1
1 488 . 1 1 1 A 39 39 ILE CB C 39 39.787 37.703 2.084 1
1 492 . 1 1 1 A 39 39 ILE N N 39 121.214 120.340 0.874 1
1 493 . 1 1 1 A 40 40 ILE H H 40 9.339 8.184 1.155 1
1 494 . 1 1 1 A 40 40 ILE HA H 40 3.401 3.748 -0.347 1
1 504 . 1 1 1 A 40 40 ILE CA C 40 67.844 66.392 1.452 1
1 505 . 1 1 1 A 40 40 ILE CB C 40 34.406 35.804 -1.398 1
1 509 . 1 1 1 A 40 40 ILE N N 40 119.695 121.548 -1.853 1
1 510 . 1 1 1 A 41 41 PRO HA H 41 4.314 4.426 -0.112 1
1 517 . 1 1 1 A 41 41 PRO C C 41 177.418 178.737 -1.319 1
1 518 . 1 1 1 A 41 41 PRO CA C 41 65.912 64.992 0.920 1
1 519 . 1 1 1 A 41 41 PRO CB C 41 30.686 31.462 -0.776 1
1 522 . 1 1 1 A 42 42 SER H H 42 6.857 8.250 -1.393 1
1 523 . 1 1 1 A 42 42 SER HA H 42 4.558 4.554 0.004 1
1 526 . 1 1 1 A 42 42 SER C C 42 174.813 176.381 -1.568 1
1 527 . 1 1 1 A 42 42 SER CA C 42 61.279 60.174 1.105 1
1 528 . 1 1 1 A 42 42 SER CB C 42 64.285 64.462 -0.177 1
1 529 . 1 1 1 A 42 42 SER N N 42 108.994 113.498 -4.504 1
1 530 . 1 1 1 A 43 43 LEU H H 43 8.230 8.115 0.115 1
1 531 . 1 1 1 A 43 43 LEU HA H 43 4.572 4.260 0.312 1
1 541 . 1 1 1 A 43 43 LEU C C 43 177.301 179.328 -2.027 1
1 542 . 1 1 1 A 43 43 LEU CA C 43 54.113 56.825 -2.712 1
1 543 . 1 1 1 A 43 43 LEU CB C 43 44.800 42.060 2.740 1
1 547 . 1 1 1 A 43 43 LEU N N 43 118.715 120.460 -1.745 1
1 548 . 1 1 1 A 44 44 GLY H H 44 8.498 8.516 -0.018 1
1 549 . 1 1 1 A 44 44 GLY HA2 H 44 4.010 3.803 0.207 1
1 550 . 1 1 1 A 44 44 GLY HA3 H 44 3.613 3.915 -0.302 1
1 551 . 1 1 1 A 44 44 GLY C C 44 174.178 176.310 -2.132 1
1 552 . 1 1 1 A 44 44 GLY CA C 44 46.271 47.477 -1.206 1
1 553 . 1 1 1 A 44 44 GLY N N 44 105.371 106.984 -1.613 1
1 554 . 1 1 1 A 45 45 ASN H H 45 8.385 7.852 0.533 1
1 555 . 1 1 1 A 45 45 ASN HA H 45 4.789 4.632 0.157 1
1 560 . 1 1 1 A 45 45 ASN C C 45 175.386 176.435 -1.049 1
1 561 . 1 1 1 A 45 45 ASN CA C 45 53.144 55.201 -2.057 1
1 562 . 1 1 1 A 45 45 ASN CB C 45 37.928 38.356 -0.428 1
1 563 . 1 1 1 A 45 45 ASN N N 45 114.387 118.532 -4.145 1
1 565 . 1 1 1 A 46 46 ILE H H 46 7.465 7.550 -0.085 1
1 566 . 1 1 1 A 46 46 ILE HA H 46 3.856 4.122 -0.266 1
1 576 . 1 1 1 A 46 46 ILE C C 46 175.997 176.238 -0.241 1
1 577 . 1 1 1 A 46 46 ILE CA C 46 60.853 61.228 -0.375 1
1 578 . 1 1 1 A 46 46 ILE CB C 46 38.042 38.567 -0.525 1
1 582 . 1 1 1 A 46 46 ILE N N 46 123.998 119.822 4.176 1
1 583 . 1 1 1 A 47 47 LYS H H 47 8.717 8.703 0.014 1
1 584 . 1 1 1 A 47 47 LYS HA H 47 4.249 4.332 -0.083 1
1 591 . 1 1 1 A 47 47 LYS C C 47 177.583 177.698 -0.115 1
1 592 . 1 1 1 A 47 47 LYS CA C 47 56.320 56.824 -0.504 1
1 593 . 1 1 1 A 47 47 LYS CB C 47 30.393 32.858 -2.465 1
1 596 . 1 1 1 A 47 47 LYS N N 47 126.114 124.424 1.690 1
1 597 . 1 1 1 A 48 48 LEU H H 48 8.323 8.440 -0.117 1
1 598 . 1 1 1 A 48 48 LEU HA H 48 3.691 3.977 -0.286 1
1 608 . 1 1 1 A 48 48 LEU C C 48 177.274 178.482 -1.208 1
1 609 . 1 1 1 A 48 48 LEU CA C 48 58.443 58.438 0.005 1
1 610 . 1 1 1 A 48 48 LEU CB C 48 42.282 41.265 1.017 1
1 614 . 1 1 1 A 48 48 LEU N N 48 125.857 126.230 -0.373 1
1 615 . 1 1 1 A 49 49 ALA H H 49 8.929 7.900 1.029 1
1 616 . 1 1 1 A 49 49 ALA HA H 49 4.067 4.045 0.022 1
1 620 . 1 1 1 A 49 49 ALA C C 49 177.468 178.345 -0.877 1
1 621 . 1 1 1 A 49 49 ALA CA C 49 53.092 54.096 -1.004 1
1 622 . 1 1 1 A 49 49 ALA CB C 49 18.562 18.563 -0.001 1
1 623 . 1 1 1 A 49 49 ALA N N 49 115.543 120.096 -4.553 1
1 624 . 1 1 1 A 50 50 LYS H H 50 7.684 7.513 0.171 1
1 625 . 1 1 1 A 50 50 LYS HA H 50 4.395 4.314 0.081 1
1 634 . 1 1 1 A 50 50 LYS C C 50 174.958 176.904 -1.946 1
1 635 . 1 1 1 A 50 50 LYS CA C 50 53.977 57.010 -3.033 1
1 636 . 1 1 1 A 50 50 LYS CB C 50 32.645 32.631 0.014 1
1 640 . 1 1 1 A 50 50 LYS N N 50 114.788 115.091 -0.303 1
1 641 . 1 1 1 A 51 51 LEU H H 51 6.776 6.834 -0.058 1
1 642 . 1 1 1 A 51 51 LEU HA H 51 4.569 4.403 0.166 1
1 652 . 1 1 1 A 51 51 LEU C C 51 177.953 175.618 2.335 1
1 653 . 1 1 1 A 51 51 LEU CA C 51 55.318 55.107 0.211 1
1 654 . 1 1 1 A 51 51 LEU CB C 51 43.182 40.971 2.211 1
1 658 . 1 1 1 A 51 51 LEU N N 51 121.408 122.158 -0.750 1
1 659 . 1 1 1 A 52 52 THR H H 52 10.680 7.543 3.137 1
1 660 . 1 1 1 A 52 52 THR HA H 52 4.938 4.520 0.418 1
1 665 . 1 1 1 A 52 52 THR C C 52 175.553 174.536 1.017 1
1 666 . 1 1 1 A 52 52 THR CA C 52 59.740 59.877 -0.137 1
1 667 . 1 1 1 A 52 52 THR CB C 52 73.557 70.918 2.639 1
1 669 . 1 1 1 A 52 52 THR N N 52 119.481 119.250 0.231 1
1 670 . 1 1 1 A 53 53 SER H H 53 9.278 9.033 0.245 1
1 671 . 1 1 1 A 53 53 SER HA H 53 4.261 4.069 0.192 1
1 674 . 1 1 1 A 53 53 SER C C 53 176.990 176.280 0.710 1
1 675 . 1 1 1 A 53 53 SER CA C 53 61.025 60.993 0.032 1
1 676 . 1 1 1 A 53 53 SER CB C 53 62.312 62.902 -0.590 1
1 677 . 1 1 1 A 53 53 SER N N 53 116.343 121.780 -5.437 1
1 678 . 1 1 1 A 54 54 LEU H H 54 7.808 7.986 -0.178 1
1 679 . 1 1 1 A 54 54 LEU HA H 54 4.229 4.041 0.188 1
1 688 . 1 1 1 A 54 54 LEU C C 54 178.505 178.546 -0.041 1
1 689 . 1 1 1 A 54 54 LEU CA C 54 57.719 57.882 -0.163 1
1 690 . 1 1 1 A 54 54 LEU CB C 54 40.997 41.727 -0.730 1
1 694 . 1 1 1 A 54 54 LEU N N 54 126.055 122.514 3.541 1
1 695 . 1 1 1 A 55 55 HIS H H 55 7.798 7.913 -0.115 1
1 696 . 1 1 1 A 55 55 HIS HA H 55 4.311 4.298 0.013 1
1 701 . 1 1 1 A 55 55 HIS C C 55 180.044 177.801 2.243 1
1 702 . 1 1 1 A 55 55 HIS CA C 55 60.583 59.632 0.951 1
1 703 . 1 1 1 A 55 55 HIS CB C 55 31.445 29.960 1.485 1
1 706 . 1 1 1 A 55 55 HIS N N 55 118.683 117.852 0.831 1
1 707 . 1 1 1 A 56 56 MET H H 56 7.375 7.817 -0.442 1
1 708 . 1 1 1 A 56 56 MET HA H 56 4.513 4.276 0.237 1
1 716 . 1 1 1 A 56 56 MET C C 56 177.169 178.408 -1.239 1
1 717 . 1 1 1 A 56 56 MET CA C 56 55.823 58.446 -2.623 1
1 718 . 1 1 1 A 56 56 MET CB C 56 31.303 31.294 0.009 1
1 721 . 1 1 1 A 56 56 MET N N 56 114.530 117.957 -3.427 1
1 722 . 1 1 1 A 57 57 GLN H H 57 8.387 8.285 0.102 1
1 723 . 1 1 1 A 57 57 GLN HA H 57 3.981 4.039 -0.058 1
1 730 . 1 1 1 A 57 57 GLN C C 57 178.033 178.502 -0.469 1
1 731 . 1 1 1 A 57 57 GLN CA C 57 57.922 59.193 -1.271 1
1 732 . 1 1 1 A 57 57 GLN CB C 57 29.012 28.509 0.503 1
1 734 . 1 1 1 A 57 57 GLN N N 57 120.713 120.678 0.035 1
1 736 . 1 1 1 A 58 58 ASN H H 58 8.765 8.522 0.243 1
1 737 . 1 1 1 A 58 58 ASN HA H 58 4.539 4.442 0.097 1
1 742 . 1 1 1 A 58 58 ASN C C 58 178.084 177.736 0.348 1
1 743 . 1 1 1 A 58 58 ASN CA C 58 55.345 56.365 -1.020 1
1 744 . 1 1 1 A 58 58 ASN CB C 58 36.924 37.775 -0.851 1
1 745 . 1 1 1 A 58 58 ASN N N 58 117.390 117.434 -0.044 1
1 747 . 1 1 1 A 59 59 TYR H H 59 8.239 7.818 0.421 1
1 748 . 1 1 1 A 59 59 TYR HA H 59 4.586 4.155 0.431 1
1 755 . 1 1 1 A 59 59 TYR C C 59 178.015 176.913 1.102 1
1 756 . 1 1 1 A 59 59 TYR CA C 59 60.779 61.550 -0.771 1
1 757 . 1 1 1 A 59 59 TYR CB C 59 38.047 38.658 -0.611 1
1 762 . 1 1 1 A 59 59 TYR N N 59 122.335 123.016 -0.681 1
1 763 . 1 1 1 A 60 60 VAL H H 60 8.416 8.457 -0.041 1
1 764 . 1 1 1 A 60 60 VAL HA H 60 3.244 3.569 -0.325 1
1 772 . 1 1 1 A 60 60 VAL C C 60 177.309 178.208 -0.899 1
1 773 . 1 1 1 A 60 60 VAL CA C 60 67.022 66.519 0.503 1
1 774 . 1 1 1 A 60 60 VAL CB C 60 30.929 31.475 -0.546 1
1 777 . 1 1 1 A 60 60 VAL N N 60 119.842 119.563 0.279 1
1 778 . 1 1 1 A 61 61 ASN H H 61 8.264 8.199 0.065 1
1 779 . 1 1 1 A 61 61 ASN HA H 61 4.305 4.450 -0.145 1
1 784 . 1 1 1 A 61 61 ASN C C 61 177.263 177.793 -0.530 1
1 785 . 1 1 1 A 61 61 ASN CA C 61 55.548 56.194 -0.646 1
1 786 . 1 1 1 A 61 61 ASN CB C 61 36.645 37.338 -0.693 1
1 787 . 1 1 1 A 61 61 ASN N N 61 119.103 119.826 -0.723 1
1 789 . 1 1 1 A 62 62 SER H H 62 8.143 7.568 0.575 1
1 790 . 1 1 1 A 62 62 SER HA H 62 4.343 4.187 0.156 1
1 793 . 1 1 1 A 62 62 SER C C 62 176.409 177.413 -1.004 1
1 794 . 1 1 1 A 62 62 SER CA C 62 61.612 61.060 0.552 1
1 795 . 1 1 1 A 62 62 SER CB C 62 62.219 62.827 -0.608 1
1 796 . 1 1 1 A 62 62 SER N N 62 118.254 115.355 2.899 1
1 797 . 1 1 1 A 63 63 LEU H H 63 7.664 7.948 -0.284 1
1 798 . 1 1 1 A 63 63 LEU HA H 63 4.003 3.846 0.157 1
1 808 . 1 1 1 A 63 63 LEU C C 63 178.748 178.981 -0.233 1
1 809 . 1 1 1 A 63 63 LEU CA C 63 57.171 57.880 -0.709 1
1 810 . 1 1 1 A 63 63 LEU CB C 63 41.134 41.193 -0.059 1
1 814 . 1 1 1 A 63 63 LEU N N 63 123.812 122.334 1.478 1
1 815 . 1 1 1 A 64 64 ARG H H 64 7.969 7.508 0.461 1
1 816 . 1 1 1 A 64 64 ARG HA H 64 4.038 3.861 0.177 1
1 824 . 1 1 1 A 64 64 ARG C C 64 180.797 178.642 2.155 1
1 825 . 1 1 1 A 64 64 ARG CA C 64 58.598 59.935 -1.337 1
1 826 . 1 1 1 A 64 64 ARG CB C 64 28.849 30.146 -1.297 1
1 829 . 1 1 1 A 64 64 ARG N N 64 120.376 120.316 0.060 1
1 831 . 1 1 1 A 65 65 ASP H H 65 8.465 7.890 0.575 1
1 832 . 1 1 1 A 65 65 ASP HA H 65 4.408 4.457 -0.049 1
1 835 . 1 1 1 A 65 65 ASP C C 65 177.336 178.994 -1.658 1
1 836 . 1 1 1 A 65 65 ASP CA C 65 56.957 56.839 0.118 1
1 837 . 1 1 1 A 65 65 ASP CB C 65 39.602 39.934 -0.332 1
1 838 . 1 1 1 A 65 65 ASP N N 65 122.402 119.983 2.419 1
1 839 . 1 1 1 A 66 66 GLU H H 66 7.703 7.961 -0.258 1
1 840 . 1 1 1 A 66 66 GLU HA H 66 4.213 4.245 -0.032 1
1 845 . 1 1 1 A 66 66 GLU C C 66 176.586 177.387 -0.801 1
1 846 . 1 1 1 A 66 66 GLU CA C 66 56.974 56.424 0.550 1
1 847 . 1 1 1 A 66 66 GLU CB C 66 29.821 29.839 -0.018 1
1 849 . 1 1 1 A 66 66 GLU N N 66 119.076 116.676 2.400 1
1 850 . 1 1 1 A 67 67 GLY H H 67 7.861 7.711 0.150 1
1 851 . 1 1 1 A 67 67 GLY HA2 H 67 4.269 3.929 0.340 1
1 852 . 1 1 1 A 67 67 GLY HA3 H 67 3.731 3.935 -0.204 1
1 853 . 1 1 1 A 67 67 GLY C C 67 174.614 174.961 -0.347 1
1 854 . 1 1 1 A 67 67 GLY CA C 67 44.608 46.398 -1.790 1
1 855 . 1 1 1 A 67 67 GLY N N 67 105.730 109.422 -3.692 1
1 856 . 1 1 1 A 68 68 LEU H H 68 7.324 7.855 -0.531 1
1 857 . 1 1 1 A 68 68 LEU HA H 68 4.257 4.196 0.061 1
1 867 . 1 1 1 A 68 68 LEU C C 68 176.136 177.257 -1.121 1
1 868 . 1 1 1 A 68 68 LEU CA C 68 55.659 54.802 0.857 1
1 869 . 1 1 1 A 68 68 LEU CB C 68 41.874 42.172 -0.298 1
1 873 . 1 1 1 A 68 68 LEU N N 68 121.062 121.273 -0.211 1
1 874 . 1 1 1 A 69 69 LYS H H 69 8.368 8.520 -0.152 1
1 875 . 1 1 1 A 69 69 LYS HA H 69 4.281 4.577 -0.296 1
1 884 . 1 1 1 A 69 69 LYS C C 69 177.940 177.871 0.069 1
1 885 . 1 1 1 A 69 69 LYS CA C 69 55.412 55.159 0.253 1
1 886 . 1 1 1 A 69 69 LYS CB C 69 32.761 33.407 -0.646 1
1 890 . 1 1 1 A 69 69 LYS N N 69 120.120 122.281 -2.161 1
1 891 . 1 1 1 A 70 70 ARG H H 70 9.095 8.865 0.230 1
1 892 . 1 1 1 A 70 70 ARG HA H 70 3.684 4.100 -0.416 1
1 900 . 1 1 1 A 70 70 ARG C C 70 177.712 178.707 -0.995 1
1 901 . 1 1 1 A 70 70 ARG CA C 70 60.216 58.537 1.679 1
1 902 . 1 1 1 A 70 70 ARG CB C 70 29.539 29.913 -0.374 1
1 905 . 1 1 1 A 70 70 ARG N N 70 123.339 118.829 4.510 1
1 907 . 1 1 1 A 71 71 GLY H H 71 8.985 7.875 1.110 1
1 908 . 1 1 1 A 71 71 GLY HA2 H 71 3.932 3.662 0.270 1
1 909 . 1 1 1 A 71 71 GLY HA3 H 71 3.905 3.674 0.231 1
1 910 . 1 1 1 A 71 71 GLY C C 71 176.324 175.776 0.548 1
1 911 . 1 1 1 A 71 71 GLY CA C 71 46.752 47.402 -0.650 1
1 912 . 1 1 1 A 71 71 GLY N N 71 104.509 109.356 -4.847 1
1 913 . 1 1 1 A 72 72 THR H H 72 7.295 8.043 -0.748 1
1 914 . 1 1 1 A 72 72 THR HA H 72 4.014 3.888 0.126 1
1 919 . 1 1 1 A 72 72 THR C C 72 175.135 175.866 -0.731 1
1 920 . 1 1 1 A 72 72 THR CA C 72 65.848 66.492 -0.644 1
1 921 . 1 1 1 A 72 72 THR CB C 72 68.160 68.431 -0.271 1
1 923 . 1 1 1 A 72 72 THR N N 72 118.617 117.472 1.145 1
1 924 . 1 1 1 A 73 73 ILE H H 73 7.883 8.102 -0.219 1
1 925 . 1 1 1 A 73 73 ILE HA H 73 3.258 3.546 -0.288 1
1 935 . 1 1 1 A 73 73 ILE C C 73 177.060 178.429 -1.369 1
1 936 . 1 1 1 A 73 73 ILE CA C 73 66.561 65.672 0.889 1
1 937 . 1 1 1 A 73 73 ILE CB C 73 37.339 37.888 -0.549 1
1 941 . 1 1 1 A 73 73 ILE N N 73 121.692 121.368 0.324 1
1 942 . 1 1 1 A 74 74 GLU H H 74 8.723 7.834 0.889 1
1 943 . 1 1 1 A 74 74 GLU HA H 74 3.807 4.012 -0.205 1
1 948 . 1 1 1 A 74 74 GLU C C 74 178.319 179.232 -0.913 1
1 949 . 1 1 1 A 74 74 GLU CA C 74 59.637 59.569 0.068 1
1 950 . 1 1 1 A 74 74 GLU CB C 74 29.257 29.042 0.215 1
1 952 . 1 1 1 A 74 74 GLU N N 74 117.701 120.504 -2.803 1
1 953 . 1 1 1 A 75 75 LYS H H 75 7.361 7.831 -0.470 1
1 954 . 1 1 1 A 75 75 LYS HA H 75 3.958 4.106 -0.148 1
1 963 . 1 1 1 A 75 75 LYS C C 75 178.554 179.777 -1.223 1
1 964 . 1 1 1 A 75 75 LYS CA C 75 59.764 59.495 0.269 1
1 965 . 1 1 1 A 75 75 LYS CB C 75 32.314 32.428 -0.114 1
1 969 . 1 1 1 A 75 75 LYS N N 75 118.734 119.186 -0.452 1
1 970 . 1 1 1 A 76 76 ILE H H 76 7.713 7.616 0.097 1
1 971 . 1 1 1 A 76 76 ILE HA H 76 3.221 3.872 -0.651 1
1 981 . 1 1 1 A 76 76 ILE C C 76 177.504 178.253 -0.749 1
1 982 . 1 1 1 A 76 76 ILE CA C 76 65.796 64.579 1.217 1
1 983 . 1 1 1 A 76 76 ILE CB C 76 37.732 37.223 0.509 1
1 987 . 1 1 1 A 76 76 ILE N N 76 120.312 116.760 3.552 1
1 988 . 1 1 1 A 77 77 ILE H H 77 8.587 7.924 0.663 1
1 989 . 1 1 1 A 77 77 ILE HA H 77 3.778 3.558 0.220 1
1 999 . 1 1 1 A 77 77 ILE C C 77 177.074 177.754 -0.680 1
1 1000 . 1 1 1 A 77 77 ILE CA C 77 63.168 65.343 -2.175 1
1 1001 . 1 1 1 A 77 77 ILE CB C 77 36.617 37.439 -0.822 1
1 1005 . 1 1 1 A 77 77 ILE N N 77 118.978 121.858 -2.880 1
1 1006 . 1 1 1 A 78 78 LYS H H 78 8.050 8.041 0.009 1
1 1007 . 1 1 1 A 78 78 LYS HA H 78 3.925 4.069 -0.144 1
1 1016 . 1 1 1 A 78 78 LYS C C 78 178.291 179.329 -1.038 1
1 1017 . 1 1 1 A 78 78 LYS CA C 78 60.192 59.915 0.277 1
1 1018 . 1 1 1 A 78 78 LYS CB C 78 31.886 32.625 -0.739 1
1 1022 . 1 1 1 A 78 78 LYS N N 78 121.618 119.579 2.039 1
1 1023 . 1 1 1 A 79 79 VAL H H 79 7.619 7.635 -0.016 1
1 1024 . 1 1 1 A 79 79 VAL HA H 79 3.846 3.662 0.184 1
1 1032 . 1 1 1 A 79 79 VAL C C 79 177.712 178.262 -0.550 1
1 1033 . 1 1 1 A 79 79 VAL CA C 79 66.494 66.376 0.118 1
1 1034 . 1 1 1 A 79 79 VAL CB C 79 31.298 31.605 -0.307 1
1 1037 . 1 1 1 A 79 79 VAL N N 79 120.254 119.682 0.572 1
1 1038 . 1 1 1 A 80 80 ILE H H 80 7.885 8.079 -0.194 1
1 1039 . 1 1 1 A 80 80 ILE HA H 80 3.367 3.564 -0.197 1
1 1049 . 1 1 1 A 80 80 ILE C C 80 179.892 177.840 2.052 1
1 1050 . 1 1 1 A 80 80 ILE CA C 80 65.343 65.504 -0.161 1
1 1051 . 1 1 1 A 80 80 ILE CB C 80 38.129 37.543 0.586 1
1 1055 . 1 1 1 A 80 80 ILE N N 80 119.666 120.692 -1.026 1
1 1056 . 1 1 1 A 81 81 ARG H H 81 9.384 8.377 1.007 1
1 1057 . 1 1 1 A 81 81 ARG HA H 81 3.834 3.910 -0.076 1
1 1065 . 1 1 1 A 81 81 ARG C C 81 178.204 179.478 -1.274 1
1 1066 . 1 1 1 A 81 81 ARG CA C 81 60.560 59.738 0.822 1
1 1067 . 1 1 1 A 81 81 ARG CB C 81 30.196 30.103 0.093 1
1 1070 . 1 1 1 A 81 81 ARG N N 81 121.030 120.455 0.575 1
1 1072 . 1 1 1 A 82 82 ASN H H 82 8.773 8.477 0.296 1
1 1073 . 1 1 1 A 82 82 ASN HA H 82 4.587 4.561 0.026 1
1 1078 . 1 1 1 A 82 82 ASN C C 82 178.300 177.826 0.474 1
1 1079 . 1 1 1 A 82 82 ASN CA C 82 56.160 56.086 0.074 1
1 1080 . 1 1 1 A 82 82 ASN CB C 82 38.464 38.003 0.461 1
1 1081 . 1 1 1 A 82 82 ASN N N 82 118.483 118.532 -0.049 1
1 1083 . 1 1 1 A 83 83 SER H H 83 8.526 7.678 0.848 1
1 1084 . 1 1 1 A 83 83 SER HA H 83 2.765 3.479 -0.714 1
1 1087 . 1 1 1 A 83 83 SER C C 83 176.386 177.918 -1.532 1
1 1088 . 1 1 1 A 83 83 SER CA C 83 61.245 60.897 0.348 1
1 1089 . 1 1 1 A 83 83 SER CB C 83 61.287 61.900 -0.613 1
1 1090 . 1 1 1 A 83 83 SER N N 83 118.286 114.528 3.758 1
1 1091 . 1 1 1 A 84 84 LEU H H 84 7.782 8.230 -0.448 1
1 1092 . 1 1 1 A 84 84 LEU HA H 84 4.221 4.068 0.153 1
1 1102 . 1 1 1 A 84 84 LEU C C 84 177.846 179.381 -1.535 1
1 1103 . 1 1 1 A 84 84 LEU CA C 84 57.166 57.869 -0.703 1
1 1104 . 1 1 1 A 84 84 LEU CB C 84 40.520 40.996 -0.476 1
1 1108 . 1 1 1 A 84 84 LEU N N 84 127.445 122.154 5.291 1
1 1109 . 1 1 1 A 85 85 GLU H H 85 8.264 8.579 -0.315 1
1 1110 . 1 1 1 A 85 85 GLU HA H 85 3.981 3.966 0.015 1
1 1115 . 1 1 1 A 85 85 GLU C C 85 179.288 179.354 -0.066 1
1 1116 . 1 1 1 A 85 85 GLU CA C 85 59.025 59.815 -0.790 1
1 1117 . 1 1 1 A 85 85 GLU CB C 85 29.182 29.333 -0.151 1
1 1119 . 1 1 1 A 85 85 GLU N N 85 121.538 120.425 1.113 1
1 1120 . 1 1 1 A 86 86 HIS H H 86 7.683 8.135 -0.452 1
1 1121 . 1 1 1 A 86 86 HIS HA H 86 4.573 4.348 0.225 1
1 1125 . 1 1 1 A 86 86 HIS C C 86 175.484 177.583 -2.099 1
1 1126 . 1 1 1 A 86 86 HIS CA C 86 58.940 59.395 -0.455 1
1 1127 . 1 1 1 A 86 86 HIS CB C 86 29.267 30.152 -0.885 1
1 1129 . 1 1 1 A 86 86 HIS N N 86 117.087 120.367 -3.280 1
1 1130 . 1 1 1 A 87 87 ALA H H 87 7.197 8.191 -0.994 1
1 1131 . 1 1 1 A 87 87 ALA HA H 87 3.925 3.859 0.066 1
1 1135 . 1 1 1 A 87 87 ALA C C 87 179.038 180.372 -1.334 1
1 1136 . 1 1 1 A 87 87 ALA CA C 87 54.863 54.930 -0.067 1
1 1137 . 1 1 1 A 87 87 ALA CB C 87 17.034 18.309 -1.275 1
1 1138 . 1 1 1 A 87 87 ALA N N 87 121.510 120.859 0.651 1
1 1139 . 1 1 1 A 88 88 ILE H H 88 7.819 7.689 0.130 1
1 1140 . 1 1 1 A 88 88 ILE HA H 88 4.067 3.885 0.182 1
1 1150 . 1 1 1 A 88 88 ILE C C 88 180.846 177.362 3.484 1
1 1151 . 1 1 1 A 88 88 ILE CA C 88 64.021 65.180 -1.159 1
1 1152 . 1 1 1 A 88 88 ILE CB C 88 37.557 37.562 -0.005 1
1 1156 . 1 1 1 A 88 88 ILE N N 88 120.898 119.231 1.667 1
1 1157 . 1 1 1 A 89 89 ASP H H 89 7.808 8.214 -0.406 1
1 1158 . 1 1 1 A 89 89 ASP HA H 89 4.437 4.322 0.115 1
1 1161 . 1 1 1 A 89 89 ASP C C 89 178.033 178.133 -0.100 1
1 1162 . 1 1 1 A 89 89 ASP CA C 89 57.343 57.722 -0.379 1
1 1163 . 1 1 1 A 89 89 ASP CB C 89 39.689 42.015 -2.326 1
1 1164 . 1 1 1 A 89 89 ASP N N 89 125.174 121.631 3.543 1
1 1165 . 1 1 1 A 90 90 LEU H H 90 7.607 7.783 -0.176 1
1 1166 . 1 1 1 A 90 90 LEU HA H 90 4.198 4.199 -0.001 1
1 1176 . 1 1 1 A 90 90 LEU C C 90 175.416 175.955 -0.539 1
1 1177 . 1 1 1 A 90 90 LEU CA C 90 54.755 54.966 -0.211 1
1 1178 . 1 1 1 A 90 90 LEU CB C 90 42.960 42.222 0.738 1
1 1182 . 1 1 1 A 90 90 LEU N N 90 117.576 117.343 0.233 1
1 1183 . 1 1 1 A 91 91 GLU H H 91 8.143 7.984 0.159 1
1 1184 . 1 1 1 A 91 91 GLU HA H 91 4.005 4.080 -0.075 1
1 1189 . 1 1 1 A 91 91 GLU C C 91 175.792 176.095 -0.303 1
1 1190 . 1 1 1 A 91 91 GLU CA C 91 57.202 57.506 -0.304 1
1 1191 . 1 1 1 A 91 91 GLU CB C 91 26.125 26.610 -0.485 1
1 1193 . 1 1 1 A 91 91 GLU N N 91 113.620 114.957 -1.337 1
1 1194 . 1 1 1 A 92 92 LEU H H 92 8.290 7.935 0.355 1
1 1195 . 1 1 1 A 92 92 LEU HA H 92 4.216 4.038 0.178 1
1 1205 . 1 1 1 A 92 92 LEU C C 92 176.622 177.050 -0.428 1
1 1206 . 1 1 1 A 92 92 LEU CA C 92 56.410 57.118 -0.708 1
1 1207 . 1 1 1 A 92 92 LEU CB C 92 43.378 42.404 0.974 1
1 1211 . 1 1 1 A 92 92 LEU N N 92 116.868 119.621 -2.753 1
1 1212 . 1 1 1 A 93 93 ILE H H 93 6.988 6.974 0.014 1
1 1213 . 1 1 1 A 93 93 ILE HA H 93 4.580 4.638 -0.058 1
1 1223 . 1 1 1 A 93 93 ILE C C 93 175.145 175.791 -0.646 1
1 1224 . 1 1 1 A 93 93 ILE CA C 93 58.707 58.432 0.275 1
1 1225 . 1 1 1 A 93 93 ILE CB C 93 42.864 40.951 1.913 1
1 1229 . 1 1 1 A 93 93 ILE N N 93 107.565 114.261 -6.696 1
1 1230 . 1 1 1 A 94 94 THR H H 94 8.742 8.662 0.080 1
1 1231 . 1 1 1 A 94 94 THR HA H 94 4.489 4.351 0.138 1
1 1236 . 1 1 1 A 94 94 THR C C 94 173.875 174.530 -0.655 1
1 1237 . 1 1 1 A 94 94 THR CA C 94 61.842 62.849 -1.007 1
1 1238 . 1 1 1 A 94 94 THR CB C 94 69.972 69.141 0.831 1
1 1240 . 1 1 1 A 94 94 THR N N 94 107.904 113.611 -5.707 1
1 1241 . 1 1 1 A 95 95 LYS H H 95 7.294 7.509 -0.215 1
1 1242 . 1 1 1 A 95 95 LYS HA H 95 4.566 4.766 -0.200 1
1 1251 . 1 1 1 A 95 95 LYS C C 95 173.791 174.327 -0.536 1
1 1252 . 1 1 1 A 95 95 LYS CA C 95 54.533 55.998 -1.465 1
1 1253 . 1 1 1 A 95 95 LYS CB C 95 35.123 35.692 -0.569 1
1 1257 . 1 1 1 A 95 95 LYS N N 95 119.458 120.583 -1.125 1
1 1258 . 1 1 1 A 96 96 ASN H H 96 9.157 8.877 0.280 1
1 1259 . 1 1 1 A 96 96 ASN HA H 96 4.408 4.828 -0.420 1
1 1264 . 1 1 1 A 96 96 ASN C C 96 176.653 176.495 0.158 1
1 1265 . 1 1 1 A 96 96 ASN CA C 96 51.088 52.526 -1.438 1
1 1266 . 1 1 1 A 96 96 ASN CB C 96 37.292 38.596 -1.304 1
1 1267 . 1 1 1 A 96 96 ASN N N 96 121.031 124.452 -3.421 1
1 1269 . 1 1 1 A 97 97 VAL H H 97 8.193 8.379 -0.186 1
1 1270 . 1 1 1 A 97 97 VAL HA H 97 4.019 4.028 -0.009 1
1 1278 . 1 1 1 A 97 97 VAL C C 97 175.089 175.698 -0.609 1
1 1279 . 1 1 1 A 97 97 VAL CA C 97 63.437 63.274 0.163 1
1 1280 . 1 1 1 A 97 97 VAL CB C 97 29.934 31.576 -1.642 1
1 1283 . 1 1 1 A 97 97 VAL N N 97 118.839 121.143 -2.304 1
1 1284 . 1 1 1 A 98 98 ALA H H 98 7.994 7.643 0.351 1
1 1285 . 1 1 1 A 98 98 ALA HA H 98 5.108 4.520 0.588 1
1 1289 . 1 1 1 A 98 98 ALA C C 98 178.033 177.945 0.088 1
1 1290 . 1 1 1 A 98 98 ALA CA C 98 50.342 51.708 -1.366 1
1 1291 . 1 1 1 A 98 98 ALA CB C 98 19.659 19.792 -0.133 1
1 1292 . 1 1 1 A 98 98 ALA N N 98 121.031 123.953 -2.922 1
1 1293 . 1 1 1 A 99 99 ALA H H 99 7.347 7.555 -0.208 1
1 1294 . 1 1 1 A 99 99 ALA HA H 99 3.818 3.997 -0.179 1
1 1298 . 1 1 1 A 99 99 ALA C C 99 177.712 178.642 -0.930 1
1 1299 . 1 1 1 A 99 99 ALA CA C 99 55.117 54.814 0.303 1
1 1300 . 1 1 1 A 99 99 ALA CB C 99 18.879 18.678 0.201 1
1 1301 . 1 1 1 A 99 99 ALA N N 99 122.816 121.027 1.789 1
1 1302 . 1 1 1 A 100 100 LYS H H 100 8.190 7.630 0.560 1
1 1303 . 1 1 1 A 100 100 LYS HA H 100 4.483 4.321 0.162 1
1 1312 . 1 1 1 A 100 100 LYS C C 100 175.899 175.248 0.651 1
1 1313 . 1 1 1 A 100 100 LYS CA C 100 54.231 56.354 -2.123 1
1 1314 . 1 1 1 A 100 100 LYS CB C 100 32.066 33.027 -0.961 1
1 1318 . 1 1 1 A 100 100 LYS N N 100 113.197 114.365 -1.168 1
1 1319 . 1 1 1 A 101 101 THR H H 101 7.128 7.515 -0.387 1
1 1320 . 1 1 1 A 101 101 THR HA H 101 3.834 4.588 -0.754 1
1 1325 . 1 1 1 A 101 101 THR C C 101 173.255 173.753 -0.498 1
1 1326 . 1 1 1 A 101 101 THR CA C 101 64.392 62.165 2.227 1
1 1327 . 1 1 1 A 101 101 THR CB C 101 69.160 68.776 0.384 1
1 1329 . 1 1 1 A 101 101 THR N N 101 118.368 115.824 2.544 1
1 1330 . 1 1 1 A 102 102 LYS H H 102 8.753 9.035 -0.282 1
1 1331 . 1 1 1 A 102 102 LYS HA H 102 4.438 5.113 -0.675 1
1 1340 . 1 1 1 A 102 102 LYS C C 102 175.627 175.238 0.389 1
1 1341 . 1 1 1 A 102 102 LYS CA C 102 55.117 54.087 1.030 1
1 1342 . 1 1 1 A 102 102 LYS CB C 102 33.901 35.874 -1.973 1
1 1346 . 1 1 1 A 102 102 LYS N N 102 126.513 123.583 2.930 1
1 1347 . 1 1 1 A 103 103 LEU H H 103 8.602 8.424 0.178 1
1 1348 . 1 1 1 A 103 103 LEU HA H 103 4.486 4.427 0.059 1
1 1358 . 1 1 1 A 103 103 LEU CA C 103 52.233 53.225 -0.992 1
1 1359 . 1 1 1 A 103 103 LEU CB C 103 41.028 42.867 -1.839 1
1 1363 . 1 1 1 A 103 103 LEU N N 103 124.466 123.098 1.368 1
1 1364 . 1 1 1 A 104 104 PRO HA H 104 4.437 4.541 -0.104 1
1 1371 . 1 1 1 A 104 104 PRO C C 104 175.779 176.443 -0.664 1
1 1372 . 1 1 1 A 104 104 PRO CA C 104 62.322 62.319 0.003 1
1 1373 . 1 1 1 A 104 104 PRO CB C 104 31.899 32.927 -1.028 1
1 1376 . 1 1 1 A 105 105 LYS H H 105 8.460 8.581 -0.121 1
1 1377 . 1 1 1 A 105 105 LYS HA H 105 4.154 4.140 0.014 1
1 1386 . 1 1 1 A 105 105 LYS C C 105 175.998 175.760 0.238 1
1 1387 . 1 1 1 A 105 105 LYS CA C 105 56.480 55.767 0.713 1
1 1388 . 1 1 1 A 105 105 LYS CB C 105 32.909 31.108 1.801 1
1 1392 . 1 1 1 A 105 105 LYS N N 105 122.139 122.202 -0.063 1
1 1393 . 1 1 1 A 106 106 ALA H H 106 8.448 7.924 0.524 1
1 1394 . 1 1 1 A 106 106 ALA HA H 106 4.309 4.826 -0.517 1
1 1398 . 1 1 1 A 106 106 ALA C C 106 176.828 174.942 1.886 1
1 1399 . 1 1 1 A 106 106 ALA CA C 106 51.862 51.443 0.419 1
1 1400 . 1 1 1 A 106 106 ALA CB C 106 19.323 22.868 -3.545 1
1 1401 . 1 1 1 A 106 106 ALA N N 106 125.278 126.374 -1.096 1
1 1402 . 1 1 1 A 107 107 ASP H H 107 8.428 8.853 -0.425 1
1 1403 . 1 1 1 A 107 107 ASP HA H 107 4.574 4.814 -0.240 1
1 1406 . 1 1 1 A 107 107 ASP C C 107 175.951 175.052 0.899 1
1 1407 . 1 1 1 A 107 107 ASP CA C 107 54.214 51.988 2.226 1
1 1408 . 1 1 1 A 107 107 ASP CB C 107 41.141 43.002 -1.861 1
1 1409 . 1 1 1 A 107 107 ASP N N 107 120.771 120.587 0.184 1
1 1410 . 1 1 1 A 108 108 LYS H H 108 8.329 8.316 0.013 1
1 1411 . 1 1 1 A 108 108 LYS HA H 108 4.203 4.509 -0.306 1
1 1420 . 1 1 1 A 108 108 LYS C C 108 176.483 175.849 0.634 1
1 1421 . 1 1 1 A 108 108 LYS CA C 108 56.831 54.748 2.083 1
1 1422 . 1 1 1 A 108 108 LYS CB C 108 32.648 33.552 -0.904 1
1 1426 . 1 1 1 A 108 108 LYS N N 108 120.727 120.207 0.520 1
1 1427 . 1 1 1 A 109 109 GLU H H 109 8.447 8.611 -0.164 1
1 1428 . 1 1 1 A 109 109 GLU HA H 109 4.215 4.545 -0.330 1
1 1433 . 1 1 1 A 109 109 GLU C C 109 176.513 177.484 -0.971 1
1 1434 . 1 1 1 A 109 109 GLU CA C 109 56.936 56.097 0.839 1
1 1435 . 1 1 1 A 109 109 GLU CB C 109 29.833 30.558 -0.725 1
1 1437 . 1 1 1 A 109 109 GLU N N 109 121.471 119.631 1.840 1
1 1438 . 1 1 1 A 110 110 GLU H H 110 8.352 8.859 -0.507 1
1 1439 . 1 1 1 A 110 110 GLU HA H 110 4.233 4.199 0.034 1
1 1444 . 1 1 1 A 110 110 GLU C C 110 176.439 178.411 -1.972 1
1 1445 . 1 1 1 A 110 110 GLU CA C 110 56.681 58.840 -2.159 1
1 1446 . 1 1 1 A 110 110 GLU CB C 110 29.860 29.078 0.782 1
1 1448 . 1 1 1 A 110 110 GLU N N 110 121.559 125.662 -4.103 1
1 1449 . 1 1 1 A 111 111 LEU H H 111 8.145 7.806 0.339 1
1 1450 . 1 1 1 A 111 111 LEU HA H 111 4.251 4.194 0.057 1
1 1460 . 1 1 1 A 111 111 LEU C C 111 177.306 177.111 0.195 1
1 1461 . 1 1 1 A 111 111 LEU CA C 111 55.277 57.946 -2.669 1
1 1462 . 1 1 1 A 111 111 LEU CB C 111 42.054 42.061 -0.007 1
1 1466 . 1 1 1 A 111 111 LEU N N 111 122.181 119.740 2.441 1
1 1467 . 1 1 1 A 112 112 GLU H H 112 8.212 7.965 0.247 1
1 1468 . 1 1 1 A 112 112 GLU N N 112 120.291 117.759 2.532 1
1 1469 . 1 1 1 A 114 114 HIS C C 114 176.070 174.180 1.890 1
1 1470 . 1 1 1 A 116 116 HIS H H 116 8.227 9.046 -0.819 1
1 1471 . 1 1 1 A 116 116 HIS C C 116 173.580 174.868 -1.288 1
1 1472 . 1 1 1 A 116 116 HIS N N 116 119.156 124.152 -4.996 1
1 5 . 2 1 1 A 3 3 PRO HA H 3 4.390 4.580 -0.190 1
1 12 . 2 1 1 A 3 3 PRO C C 3 176.847 176.881 -0.034 1
1 13 . 2 1 1 A 3 3 PRO CA C 3 63.449 62.696 0.753 1
1 14 . 2 1 1 A 3 3 PRO CB C 3 31.938 30.666 1.272 1
1 17 . 2 1 1 A 4 4 SER H H 4 8.531 8.487 0.044 1
1 18 . 2 1 1 A 4 4 SER HA H 4 4.262 4.573 -0.311 1
1 21 . 2 1 1 A 4 4 SER C C 4 175.414 174.279 1.135 1
1 22 . 2 1 1 A 4 4 SER CA C 4 59.163 57.821 1.342 1
1 23 . 2 1 1 A 4 4 SER CB C 4 63.242 62.226 1.016 1
1 24 . 2 1 1 A 4 4 SER N N 4 114.246 118.929 -4.683 1
1 25 . 2 1 1 A 5 5 LYS H H 5 8.468 8.068 0.400 1
1 26 . 2 1 1 A 5 5 LYS HA H 5 4.433 4.307 0.126 1
1 35 . 2 1 1 A 5 5 LYS C C 5 175.984 176.907 -0.923 1
1 36 . 2 1 1 A 5 5 LYS CA C 5 55.724 57.635 -1.911 1
1 37 . 2 1 1 A 5 5 LYS CB C 5 32.881 33.085 -0.204 1
1 41 . 2 1 1 A 5 5 LYS N N 5 123.488 126.803 -3.315 1
1 42 . 2 1 1 A 6 6 LEU H H 6 7.707 7.370 0.337 1
1 43 . 2 1 1 A 6 6 LEU HA H 6 4.381 4.312 0.069 1
1 53 . 2 1 1 A 6 6 LEU C C 6 177.820 176.017 1.803 1
1 54 . 2 1 1 A 6 6 LEU CA C 6 55.507 55.539 -0.032 1
1 55 . 2 1 1 A 6 6 LEU CB C 6 43.374 42.600 0.774 1
1 59 . 2 1 1 A 6 6 LEU N N 6 121.233 123.074 -1.841 1
1 60 . 2 1 1 A 7 7 SER H H 7 9.433 8.748 0.685 1
1 61 . 2 1 1 A 7 7 SER HA H 7 4.638 4.704 -0.066 1
1 64 . 2 1 1 A 7 7 SER C C 7 174.120 175.024 -0.904 1
1 65 . 2 1 1 A 7 7 SER CA C 7 57.962 57.539 0.423 1
1 66 . 2 1 1 A 7 7 SER CB C 7 64.197 64.964 -0.767 1
1 67 . 2 1 1 A 7 7 SER N N 7 122.977 118.810 4.167 1
1 68 . 2 1 1 A 8 8 TYR H H 8 9.764 9.209 0.555 1
1 69 . 2 1 1 A 8 8 TYR HA H 8 4.732 4.271 0.461 1
1 76 . 2 1 1 A 8 8 TYR C C 8 177.206 177.637 -0.431 1
1 77 . 2 1 1 A 8 8 TYR CA C 8 58.762 61.804 -3.042 1
1 78 . 2 1 1 A 8 8 TYR CB C 8 36.605 38.855 -2.250 1
1 83 . 2 1 1 A 8 8 TYR N N 8 123.312 122.621 0.691 1
1 84 . 2 1 1 A 9 9 GLY H H 9 10.131 8.331 1.800 1
1 85 . 2 1 1 A 9 9 GLY HA2 H 9 3.983 3.608 0.375 1
1 86 . 2 1 1 A 9 9 GLY HA3 H 9 3.423 3.701 -0.278 1
1 87 . 2 1 1 A 9 9 GLY C C 9 175.163 176.072 -0.909 1
1 88 . 2 1 1 A 9 9 GLY CA C 9 47.153 47.312 -0.159 1
1 89 . 2 1 1 A 9 9 GLY N N 9 107.177 106.093 1.084 1
1 90 . 2 1 1 A 10 10 GLU H H 10 7.876 8.048 -0.172 1
1 91 . 2 1 1 A 10 10 GLU HA H 10 4.107 4.099 0.008 1
1 96 . 2 1 1 A 10 10 GLU C C 10 179.924 178.887 1.037 1
1 97 . 2 1 1 A 10 10 GLU CA C 10 58.890 59.350 -0.460 1
1 98 . 2 1 1 A 10 10 GLU CB C 10 29.750 29.368 0.382 1
1 100 . 2 1 1 A 10 10 GLU N N 10 122.219 121.754 0.465 1
1 101 . 2 1 1 A 11 11 TYR H H 11 8.384 8.352 0.032 1
1 102 . 2 1 1 A 11 11 TYR HA H 11 4.305 4.227 0.078 1
1 107 . 2 1 1 A 11 11 TYR C C 11 176.854 177.023 -0.169 1
1 108 . 2 1 1 A 11 11 TYR CA C 11 61.040 61.484 -0.444 1
1 109 . 2 1 1 A 11 11 TYR CB C 11 37.593 38.986 -1.393 1
1 112 . 2 1 1 A 11 11 TYR N N 11 120.809 123.164 -2.355 1
1 113 . 2 1 1 A 12 12 LEU H H 12 9.027 8.193 0.834 1
1 114 . 2 1 1 A 12 12 LEU HA H 12 3.778 3.929 -0.151 1
1 124 . 2 1 1 A 12 12 LEU C C 12 178.621 179.190 -0.569 1
1 125 . 2 1 1 A 12 12 LEU CA C 12 57.534 57.427 0.107 1
1 126 . 2 1 1 A 12 12 LEU CB C 12 41.957 41.207 0.750 1
1 130 . 2 1 1 A 12 12 LEU N N 12 121.080 118.800 2.280 1
1 131 . 2 1 1 A 13 13 GLU H H 13 7.614 7.907 -0.293 1
1 132 . 2 1 1 A 13 13 GLU HA H 13 4.102 4.038 0.064 1
1 137 . 2 1 1 A 13 13 GLU C C 13 178.449 178.904 -0.455 1
1 138 . 2 1 1 A 13 13 GLU CA C 13 59.609 59.629 -0.020 1
1 139 . 2 1 1 A 13 13 GLU CB C 13 29.124 29.788 -0.664 1
1 141 . 2 1 1 A 13 13 GLU N N 13 118.475 120.499 -2.024 1
1 142 . 2 1 1 A 14 14 SER H H 14 7.329 7.606 -0.277 1
1 143 . 2 1 1 A 14 14 SER HA H 14 4.358 4.244 0.114 1
1 146 . 2 1 1 A 14 14 SER C C 14 176.794 176.722 0.072 1
1 147 . 2 1 1 A 14 14 SER CA C 14 61.064 61.274 -0.210 1
1 148 . 2 1 1 A 14 14 SER CB C 14 62.513 62.664 -0.151 1
1 149 . 2 1 1 A 14 14 SER N N 14 115.209 115.024 0.185 1
1 150 . 2 1 1 A 15 15 TRP H H 15 8.870 8.074 0.796 1
1 151 . 2 1 1 A 15 15 TRP HA H 15 4.005 4.185 -0.180 1
1 160 . 2 1 1 A 15 15 TRP C C 15 177.547 177.930 -0.383 1
1 161 . 2 1 1 A 15 15 TRP CA C 15 61.210 61.128 0.082 1
1 162 . 2 1 1 A 15 15 TRP CB C 15 27.341 29.340 -1.999 1
1 168 . 2 1 1 A 15 15 TRP N N 15 124.998 123.719 1.279 1
1 170 . 2 1 1 A 16 16 PHE H H 16 9.087 7.987 1.100 1
1 171 . 2 1 1 A 16 16 PHE HA H 16 3.210 3.642 -0.432 1
1 179 . 2 1 1 A 16 16 PHE C C 16 175.909 176.900 -0.991 1
1 180 . 2 1 1 A 16 16 PHE CA C 16 61.473 61.343 0.130 1
1 181 . 2 1 1 A 16 16 PHE CB C 16 38.506 38.856 -0.350 1
1 187 . 2 1 1 A 16 16 PHE N N 16 119.825 120.991 -1.166 1
1 188 . 2 1 1 A 17 17 ASN H H 17 7.768 7.849 -0.081 1
1 189 . 2 1 1 A 17 17 ASN HA H 17 4.078 4.300 -0.222 1
1 194 . 2 1 1 A 17 17 ASN C C 17 176.604 177.610 -1.006 1
1 195 . 2 1 1 A 17 17 ASN CA C 17 55.621 56.217 -0.596 1
1 196 . 2 1 1 A 17 17 ASN CB C 17 37.830 39.306 -1.476 1
1 197 . 2 1 1 A 17 17 ASN N N 17 115.600 116.583 -0.983 1
1 199 . 2 1 1 A 18 18 THR H H 18 7.454 7.048 0.406 1
1 200 . 2 1 1 A 18 18 THR HA H 18 4.147 4.006 0.141 1
1 205 . 2 1 1 A 18 18 THR C C 18 175.692 176.126 -0.434 1
1 206 . 2 1 1 A 18 18 THR CA C 18 64.679 64.790 -0.111 1
1 207 . 2 1 1 A 18 18 THR CB C 18 68.940 68.683 0.257 1
1 209 . 2 1 1 A 18 18 THR N N 18 113.049 113.257 -0.208 1
1 210 . 2 1 1 A 19 19 LYS H H 19 7.918 7.614 0.304 1
1 211 . 2 1 1 A 19 19 LYS HA H 19 3.791 3.619 0.172 1
1 220 . 2 1 1 A 19 19 LYS C C 19 178.120 178.969 -0.849 1
1 221 . 2 1 1 A 19 19 LYS CA C 19 55.985 58.695 -2.710 1
1 222 . 2 1 1 A 19 19 LYS CB C 19 31.130 31.064 0.066 1
1 226 . 2 1 1 A 19 19 LYS N N 19 122.614 120.727 1.887 1
1 227 . 2 1 1 A 20 20 ARG H H 20 7.845 7.498 0.347 1
1 228 . 2 1 1 A 20 20 ARG HA H 20 3.396 3.792 -0.396 1
1 236 . 2 1 1 A 20 20 ARG C C 20 175.601 177.907 -2.306 1
1 237 . 2 1 1 A 20 20 ARG CA C 20 58.182 58.196 -0.014 1
1 238 . 2 1 1 A 20 20 ARG CB C 20 28.045 29.920 -1.875 1
1 241 . 2 1 1 A 20 20 ARG N N 20 116.282 118.099 -1.817 1
1 243 . 2 1 1 A 21 21 HIS H H 21 7.163 7.453 -0.290 1
1 244 . 2 1 1 A 21 21 HIS HA H 21 4.500 4.369 0.131 1
1 249 . 2 1 1 A 21 21 HIS C C 21 175.618 177.262 -1.644 1
1 250 . 2 1 1 A 21 21 HIS CA C 21 56.912 58.951 -2.039 1
1 251 . 2 1 1 A 21 21 HIS CB C 21 29.400 30.485 -1.085 1
1 254 . 2 1 1 A 21 21 HIS N N 21 115.452 117.779 -2.327 1
1 255 . 2 1 1 A 22 22 SER H H 22 7.951 7.513 0.438 1
1 256 . 2 1 1 A 22 22 SER HA H 22 4.573 4.241 0.332 1
1 259 . 2 1 1 A 22 22 SER C C 22 173.948 173.946 0.002 1
1 260 . 2 1 1 A 22 22 SER CA C 22 58.589 60.993 -2.404 1
1 261 . 2 1 1 A 22 22 SER CB C 22 64.228 63.327 0.901 1
1 262 . 2 1 1 A 22 22 SER N N 22 113.209 113.295 -0.086 1
1 263 . 2 1 1 A 23 23 VAL H H 23 7.179 7.371 -0.192 1
1 264 . 2 1 1 A 23 23 VAL HA H 23 4.626 4.505 0.121 1
1 272 . 2 1 1 A 23 23 VAL C C 23 175.397 176.009 -0.612 1
1 273 . 2 1 1 A 23 23 VAL CA C 23 59.556 60.193 -0.637 1
1 274 . 2 1 1 A 23 23 VAL CB C 23 33.810 34.236 -0.426 1
1 277 . 2 1 1 A 23 23 VAL N N 23 113.108 116.433 -3.325 1
1 278 . 2 1 1 A 24 24 GLY H H 24 8.189 8.365 -0.176 1
1 279 . 2 1 1 A 24 24 GLY HA2 H 24 4.074 4.024 0.050 1
1 280 . 2 1 1 A 24 24 GLY HA3 H 24 4.195 4.044 0.151 1
1 281 . 2 1 1 A 24 24 GLY C C 24 174.037 174.640 -0.603 1
1 282 . 2 1 1 A 24 24 GLY CA C 24 44.452 44.872 -0.420 1
1 283 . 2 1 1 A 24 24 GLY N N 24 108.374 108.890 -0.516 1
1 284 . 2 1 1 A 25 25 ILE H H 25 8.331 8.612 -0.281 1
1 285 . 2 1 1 A 25 25 ILE HA H 25 3.839 3.637 0.202 1
1 295 . 2 1 1 A 25 25 ILE C C 25 178.042 177.834 0.208 1
1 296 . 2 1 1 A 25 25 ILE CA C 25 64.238 64.595 -0.357 1
1 297 . 2 1 1 A 25 25 ILE CB C 25 37.931 37.605 0.326 1
1 301 . 2 1 1 A 25 25 ILE N N 25 119.895 119.572 0.323 1
1 302 . 2 1 1 A 26 26 GLN H H 26 8.545 8.423 0.122 1
1 303 . 2 1 1 A 26 26 GLN HA H 26 4.129 4.063 0.066 1
1 310 . 2 1 1 A 26 26 GLN C C 26 178.454 178.432 0.022 1
1 311 . 2 1 1 A 26 26 GLN CA C 26 58.772 58.283 0.489 1
1 312 . 2 1 1 A 26 26 GLN CB C 26 27.346 28.400 -1.054 1
1 314 . 2 1 1 A 26 26 GLN N N 26 120.013 119.945 0.068 1
1 316 . 2 1 1 A 27 27 THR H H 27 7.944 8.147 -0.203 1
1 317 . 2 1 1 A 27 27 THR HA H 27 3.953 3.900 0.053 1
1 322 . 2 1 1 A 27 27 THR C C 27 175.818 176.372 -0.554 1
1 323 . 2 1 1 A 27 27 THR CA C 27 65.855 66.229 -0.374 1
1 324 . 2 1 1 A 27 27 THR CB C 27 68.127 68.636 -0.509 1
1 326 . 2 1 1 A 27 27 THR N N 27 117.645 116.959 0.686 1
1 327 . 2 1 1 A 28 28 ALA H H 28 8.593 8.206 0.387 1
1 328 . 2 1 1 A 28 28 ALA HA H 28 3.899 4.144 -0.245 1
1 332 . 2 1 1 A 28 28 ALA C C 28 178.515 179.706 -1.191 1
1 333 . 2 1 1 A 28 28 ALA CA C 28 55.742 55.668 0.074 1
1 334 . 2 1 1 A 28 28 ALA CB C 28 17.513 18.682 -1.169 1
1 335 . 2 1 1 A 28 28 ALA N N 28 123.917 123.574 0.343 1
1 336 . 2 1 1 A 29 29 LYS H H 29 7.800 7.642 0.158 1
1 337 . 2 1 1 A 29 29 LYS HA H 29 3.982 4.007 -0.025 1
1 346 . 2 1 1 A 29 29 LYS C C 29 179.527 179.058 0.469 1
1 347 . 2 1 1 A 29 29 LYS CA C 29 59.761 59.457 0.304 1
1 348 . 2 1 1 A 29 29 LYS CB C 29 32.223 32.223 0.000 1
1 352 . 2 1 1 A 29 29 LYS N N 29 117.474 118.887 -1.413 1
1 353 . 2 1 1 A 30 30 VAL H H 30 7.591 7.414 0.177 1
1 354 . 2 1 1 A 30 30 VAL HA H 30 3.503 3.363 0.140 1
1 362 . 2 1 1 A 30 30 VAL C C 30 178.389 177.839 0.550 1
1 363 . 2 1 1 A 30 30 VAL CA C 30 65.640 65.873 -0.233 1
1 364 . 2 1 1 A 30 30 VAL CB C 30 31.644 31.445 0.199 1
1 367 . 2 1 1 A 30 30 VAL N N 30 121.749 120.527 1.222 1
1 368 . 2 1 1 A 31 31 LEU H H 31 8.333 8.335 -0.002 1
1 369 . 2 1 1 A 31 31 LEU HA H 31 4.074 4.157 -0.083 1
1 379 . 2 1 1 A 31 31 LEU C C 31 177.780 179.026 -1.246 1
1 380 . 2 1 1 A 31 31 LEU CA C 31 58.157 58.073 0.084 1
1 381 . 2 1 1 A 31 31 LEU CB C 31 42.230 41.063 1.167 1
1 385 . 2 1 1 A 31 31 LEU N N 31 120.901 120.203 0.698 1
1 386 . 2 1 1 A 32 32 LYS H H 32 8.562 7.956 0.606 1
1 387 . 2 1 1 A 32 32 LYS HA H 32 3.290 3.806 -0.516 1
1 395 . 2 1 1 A 32 32 LYS C C 32 178.037 178.709 -0.672 1
1 396 . 2 1 1 A 32 32 LYS CA C 32 58.911 59.498 -0.587 1
1 397 . 2 1 1 A 32 32 LYS CB C 32 31.605 31.258 0.347 1
1 401 . 2 1 1 A 32 32 LYS N N 32 119.075 119.462 -0.387 1
1 402 . 2 1 1 A 33 33 GLY H H 33 7.694 7.798 -0.104 1
1 403 . 2 1 1 A 33 33 GLY HA2 H 33 3.949 3.539 0.410 1
1 404 . 2 1 1 A 33 33 GLY HA3 H 33 3.826 3.622 0.204 1
1 405 . 2 1 1 A 33 33 GLY C C 33 177.101 176.605 0.496 1
1 406 . 2 1 1 A 33 33 GLY CA C 33 46.928 47.057 -0.129 1
1 407 . 2 1 1 A 33 33 GLY N N 33 105.282 106.868 -1.586 1
1 408 . 2 1 1 A 34 34 TYR H H 34 8.015 7.671 0.344 1
1 409 . 2 1 1 A 34 34 TYR HA H 34 4.558 4.701 -0.143 1
1 416 . 2 1 1 A 34 34 TYR C C 34 179.611 178.252 1.359 1
1 417 . 2 1 1 A 34 34 TYR CA C 34 59.349 59.929 -0.580 1
1 418 . 2 1 1 A 34 34 TYR CB C 34 37.344 38.067 -0.723 1
1 423 . 2 1 1 A 34 34 TYR N N 34 121.781 121.850 -0.069 1
1 424 . 2 1 1 A 35 35 LEU H H 35 8.689 8.309 0.380 1
1 425 . 2 1 1 A 35 35 LEU HA H 35 3.977 3.842 0.135 1
1 435 . 2 1 1 A 35 35 LEU C C 35 177.081 178.722 -1.641 1
1 436 . 2 1 1 A 35 35 LEU CA C 35 59.155 58.456 0.699 1
1 437 . 2 1 1 A 35 35 LEU CB C 35 41.103 41.539 -0.436 1
1 441 . 2 1 1 A 35 35 LEU N N 35 120.392 120.562 -0.170 1
1 442 . 2 1 1 A 36 36 ASN H H 36 8.721 8.351 0.370 1
1 443 . 2 1 1 A 36 36 ASN HA H 36 4.435 4.444 -0.009 1
1 448 . 2 1 1 A 36 36 ASN C C 36 176.792 177.749 -0.957 1
1 449 . 2 1 1 A 36 36 ASN CA C 36 55.642 55.898 -0.256 1
1 450 . 2 1 1 A 36 36 ASN CB C 36 38.319 37.857 0.462 1
1 451 . 2 1 1 A 36 36 ASN N N 36 114.623 116.786 -2.163 1
1 453 . 2 1 1 A 37 37 SER H H 37 8.511 7.985 0.526 1
1 454 . 2 1 1 A 37 37 SER HA H 37 4.642 4.307 0.335 1
1 457 . 2 1 1 A 37 37 SER C C 37 175.039 176.217 -1.178 1
1 458 . 2 1 1 A 37 37 SER CA C 37 59.825 61.271 -1.446 1
1 459 . 2 1 1 A 37 37 SER CB C 37 64.056 63.071 0.985 1
1 460 . 2 1 1 A 37 37 SER N N 37 110.941 115.559 -4.618 1
1 461 . 2 1 1 A 38 38 ARG H H 38 7.242 7.826 -0.584 1
1 462 . 2 1 1 A 38 38 ARG HA H 38 4.919 4.456 0.463 1
1 469 . 2 1 1 A 38 38 ARG C C 38 176.514 178.214 -1.700 1
1 470 . 2 1 1 A 38 38 ARG CA C 38 56.687 57.953 -1.266 1
1 471 . 2 1 1 A 38 38 ARG CB C 38 32.434 31.415 1.019 1
1 474 . 2 1 1 A 38 38 ARG N N 38 117.062 120.338 -3.276 1
1 475 . 2 1 1 A 39 39 ILE H H 39 8.462 7.992 0.470 1
1 476 . 2 1 1 A 39 39 ILE HA H 39 3.618 3.973 -0.355 1
1 486 . 2 1 1 A 39 39 ILE C C 39 176.267 178.360 -2.093 1
1 487 . 2 1 1 A 39 39 ILE CA C 39 66.134 64.620 1.514 1
1 488 . 2 1 1 A 39 39 ILE CB C 39 39.787 38.059 1.728 1
1 492 . 2 1 1 A 39 39 ILE N N 39 121.214 120.460 0.754 1
1 493 . 2 1 1 A 40 40 ILE H H 40 9.339 8.065 1.274 1
1 494 . 2 1 1 A 40 40 ILE HA H 40 3.401 3.751 -0.350 1
1 504 . 2 1 1 A 40 40 ILE CA C 40 67.844 66.342 1.502 1
1 505 . 2 1 1 A 40 40 ILE CB C 40 34.406 35.490 -1.084 1
1 509 . 2 1 1 A 40 40 ILE N N 40 119.695 121.446 -1.751 1
1 510 . 2 1 1 A 41 41 PRO HA H 41 4.314 4.399 -0.085 1
1 517 . 2 1 1 A 41 41 PRO C C 41 177.418 177.735 -0.317 1
1 518 . 2 1 1 A 41 41 PRO CA C 41 65.912 64.697 1.215 1
1 519 . 2 1 1 A 41 41 PRO CB C 41 30.686 31.633 -0.947 1
1 522 . 2 1 1 A 42 42 SER H H 42 6.857 7.972 -1.115 1
1 523 . 2 1 1 A 42 42 SER HA H 42 4.558 4.662 -0.104 1
1 526 . 2 1 1 A 42 42 SER C C 42 174.813 176.083 -1.270 1
1 527 . 2 1 1 A 42 42 SER CA C 42 61.279 59.613 1.666 1
1 528 . 2 1 1 A 42 42 SER CB C 42 64.285 64.513 -0.228 1
1 529 . 2 1 1 A 42 42 SER N N 42 108.994 113.952 -4.958 1
1 530 . 2 1 1 A 43 43 LEU H H 43 8.230 8.128 0.102 1
1 531 . 2 1 1 A 43 43 LEU HA H 43 4.572 4.271 0.301 1
1 541 . 2 1 1 A 43 43 LEU C C 43 177.301 178.830 -1.529 1
1 542 . 2 1 1 A 43 43 LEU CA C 43 54.113 55.511 -1.398 1
1 543 . 2 1 1 A 43 43 LEU CB C 43 44.800 42.374 2.426 1
1 547 . 2 1 1 A 43 43 LEU N N 43 118.715 120.447 -1.732 1
1 548 . 2 1 1 A 44 44 GLY H H 44 8.498 8.379 0.119 1
1 549 . 2 1 1 A 44 44 GLY HA2 H 44 4.010 3.721 0.289 1
1 550 . 2 1 1 A 44 44 GLY HA3 H 44 3.613 3.749 -0.136 1
1 551 . 2 1 1 A 44 44 GLY C C 44 174.178 176.160 -1.982 1
1 552 . 2 1 1 A 44 44 GLY CA C 44 46.271 47.473 -1.202 1
1 553 . 2 1 1 A 44 44 GLY N N 44 105.371 107.599 -2.228 1
1 554 . 2 1 1 A 45 45 ASN H H 45 8.385 7.935 0.450 1
1 555 . 2 1 1 A 45 45 ASN HA H 45 4.789 4.644 0.145 1
1 560 . 2 1 1 A 45 45 ASN C C 45 175.386 176.453 -1.067 1
1 561 . 2 1 1 A 45 45 ASN CA C 45 53.144 55.066 -1.922 1
1 562 . 2 1 1 A 45 45 ASN CB C 45 37.928 38.150 -0.222 1
1 563 . 2 1 1 A 45 45 ASN N N 45 114.387 117.484 -3.097 1
1 565 . 2 1 1 A 46 46 ILE H H 46 7.465 7.530 -0.065 1
1 566 . 2 1 1 A 46 46 ILE HA H 46 3.856 4.050 -0.194 1
1 576 . 2 1 1 A 46 46 ILE C C 46 175.997 176.010 -0.013 1
1 577 . 2 1 1 A 46 46 ILE CA C 46 60.853 62.004 -1.151 1
1 578 . 2 1 1 A 46 46 ILE CB C 46 38.042 38.229 -0.187 1
1 582 . 2 1 1 A 46 46 ILE N N 46 123.998 120.677 3.321 1
1 583 . 2 1 1 A 47 47 LYS H H 47 8.717 8.663 0.054 1
1 584 . 2 1 1 A 47 47 LYS HA H 47 4.249 4.330 -0.081 1
1 591 . 2 1 1 A 47 47 LYS C C 47 177.583 177.686 -0.103 1
1 592 . 2 1 1 A 47 47 LYS CA C 47 56.320 56.932 -0.612 1
1 593 . 2 1 1 A 47 47 LYS CB C 47 30.393 32.981 -2.588 1
1 596 . 2 1 1 A 47 47 LYS N N 47 126.114 125.638 0.476 1
1 597 . 2 1 1 A 48 48 LEU H H 48 8.323 8.209 0.114 1
1 598 . 2 1 1 A 48 48 LEU HA H 48 3.691 3.973 -0.282 1
1 608 . 2 1 1 A 48 48 LEU C C 48 177.274 178.260 -0.986 1
1 609 . 2 1 1 A 48 48 LEU CA C 48 58.443 58.392 0.051 1
1 610 . 2 1 1 A 48 48 LEU CB C 48 42.282 41.241 1.041 1
1 614 . 2 1 1 A 48 48 LEU N N 48 125.857 125.861 -0.004 1
1 615 . 2 1 1 A 49 49 ALA H H 49 8.929 7.924 1.005 1
1 616 . 2 1 1 A 49 49 ALA HA H 49 4.067 3.998 0.069 1
1 620 . 2 1 1 A 49 49 ALA C C 49 177.468 179.159 -1.691 1
1 621 . 2 1 1 A 49 49 ALA CA C 49 53.092 54.811 -1.719 1
1 622 . 2 1 1 A 49 49 ALA CB C 49 18.562 18.047 0.515 1
1 623 . 2 1 1 A 49 49 ALA N N 49 115.543 120.135 -4.592 1
1 624 . 2 1 1 A 50 50 LYS H H 50 7.684 7.528 0.156 1
1 625 . 2 1 1 A 50 50 LYS HA H 50 4.395 4.292 0.103 1
1 634 . 2 1 1 A 50 50 LYS C C 50 174.958 176.698 -1.740 1
1 635 . 2 1 1 A 50 50 LYS CA C 50 53.977 57.256 -3.279 1
1 636 . 2 1 1 A 50 50 LYS CB C 50 32.645 32.591 0.054 1
1 640 . 2 1 1 A 50 50 LYS N N 50 114.788 115.359 -0.571 1
1 641 . 2 1 1 A 51 51 LEU H H 51 6.776 7.318 -0.542 1
1 642 . 2 1 1 A 51 51 LEU HA H 51 4.569 4.306 0.263 1
1 652 . 2 1 1 A 51 51 LEU C C 51 177.953 175.710 2.243 1
1 653 . 2 1 1 A 51 51 LEU CA C 51 55.318 54.805 0.513 1
1 654 . 2 1 1 A 51 51 LEU CB C 51 43.182 41.214 1.968 1
1 658 . 2 1 1 A 51 51 LEU N N 51 121.408 121.821 -0.413 1
1 659 . 2 1 1 A 52 52 THR H H 52 10.680 7.700 2.980 1
1 660 . 2 1 1 A 52 52 THR HA H 52 4.938 4.554 0.384 1
1 665 . 2 1 1 A 52 52 THR C C 52 175.553 174.405 1.148 1
1 666 . 2 1 1 A 52 52 THR CA C 52 59.740 60.168 -0.428 1
1 667 . 2 1 1 A 52 52 THR CB C 52 73.557 70.739 2.818 1
1 669 . 2 1 1 A 52 52 THR N N 52 119.481 119.374 0.107 1
1 670 . 2 1 1 A 53 53 SER H H 53 9.278 9.003 0.275 1
1 671 . 2 1 1 A 53 53 SER HA H 53 4.261 4.171 0.090 1
1 674 . 2 1 1 A 53 53 SER C C 53 176.990 176.235 0.755 1
1 675 . 2 1 1 A 53 53 SER CA C 53 61.025 60.994 0.031 1
1 676 . 2 1 1 A 53 53 SER CB C 53 62.312 62.999 -0.687 1
1 677 . 2 1 1 A 53 53 SER N N 53 116.343 121.788 -5.445 1
1 678 . 2 1 1 A 54 54 LEU H H 54 7.808 8.082 -0.274 1
1 679 . 2 1 1 A 54 54 LEU HA H 54 4.229 4.090 0.139 1
1 688 . 2 1 1 A 54 54 LEU C C 54 178.505 178.838 -0.333 1
1 689 . 2 1 1 A 54 54 LEU CA C 54 57.719 57.731 -0.012 1
1 690 . 2 1 1 A 54 54 LEU CB C 54 40.997 41.659 -0.662 1
1 694 . 2 1 1 A 54 54 LEU N N 54 126.055 123.159 2.896 1
1 695 . 2 1 1 A 55 55 HIS H H 55 7.798 7.903 -0.105 1
1 696 . 2 1 1 A 55 55 HIS HA H 55 4.311 4.340 -0.029 1
1 701 . 2 1 1 A 55 55 HIS C C 55 180.044 177.710 2.334 1
1 702 . 2 1 1 A 55 55 HIS CA C 55 60.583 59.560 1.023 1
1 703 . 2 1 1 A 55 55 HIS CB C 55 31.445 29.875 1.570 1
1 706 . 2 1 1 A 55 55 HIS N N 55 118.683 118.711 -0.028 1
1 707 . 2 1 1 A 56 56 MET H H 56 7.375 7.860 -0.485 1
1 708 . 2 1 1 A 56 56 MET HA H 56 4.513 4.002 0.511 1
1 716 . 2 1 1 A 56 56 MET C C 56 177.169 178.498 -1.329 1
1 717 . 2 1 1 A 56 56 MET CA C 56 55.823 59.291 -3.468 1
1 718 . 2 1 1 A 56 56 MET CB C 56 31.303 33.407 -2.104 1
1 721 . 2 1 1 A 56 56 MET N N 56 114.530 117.565 -3.035 1
1 722 . 2 1 1 A 57 57 GLN H H 57 8.387 8.310 0.077 1
1 723 . 2 1 1 A 57 57 GLN HA H 57 3.981 4.008 -0.027 1
1 730 . 2 1 1 A 57 57 GLN C C 57 178.033 178.538 -0.505 1
1 731 . 2 1 1 A 57 57 GLN CA C 57 57.922 59.088 -1.166 1
1 732 . 2 1 1 A 57 57 GLN CB C 57 29.012 28.462 0.550 1
1 734 . 2 1 1 A 57 57 GLN N N 57 120.713 119.508 1.205 1
1 736 . 2 1 1 A 58 58 ASN H H 58 8.765 8.489 0.276 1
1 737 . 2 1 1 A 58 58 ASN HA H 58 4.539 4.511 0.028 1
1 742 . 2 1 1 A 58 58 ASN C C 58 178.084 177.498 0.586 1
1 743 . 2 1 1 A 58 58 ASN CA C 58 55.345 56.132 -0.787 1
1 744 . 2 1 1 A 58 58 ASN CB C 58 36.924 38.504 -1.580 1
1 745 . 2 1 1 A 58 58 ASN N N 58 117.390 117.684 -0.294 1
1 747 . 2 1 1 A 59 59 TYR H H 59 8.239 7.880 0.359 1
1 748 . 2 1 1 A 59 59 TYR HA H 59 4.586 4.180 0.406 1
1 755 . 2 1 1 A 59 59 TYR C C 59 178.015 176.926 1.089 1
1 756 . 2 1 1 A 59 59 TYR CA C 59 60.779 61.566 -0.787 1
1 757 . 2 1 1 A 59 59 TYR CB C 59 38.047 38.728 -0.681 1
1 762 . 2 1 1 A 59 59 TYR N N 59 122.335 123.237 -0.902 1
1 763 . 2 1 1 A 60 60 VAL H H 60 8.416 8.509 -0.093 1
1 764 . 2 1 1 A 60 60 VAL HA H 60 3.244 3.549 -0.305 1
1 772 . 2 1 1 A 60 60 VAL C C 60 177.309 178.303 -0.994 1
1 773 . 2 1 1 A 60 60 VAL CA C 60 67.022 66.501 0.521 1
1 774 . 2 1 1 A 60 60 VAL CB C 60 30.929 31.317 -0.388 1
1 777 . 2 1 1 A 60 60 VAL N N 60 119.842 119.547 0.295 1
1 778 . 2 1 1 A 61 61 ASN H H 61 8.264 8.228 0.036 1
1 779 . 2 1 1 A 61 61 ASN HA H 61 4.305 4.434 -0.129 1
1 784 . 2 1 1 A 61 61 ASN C C 61 177.263 178.144 -0.881 1
1 785 . 2 1 1 A 61 61 ASN CA C 61 55.548 56.189 -0.641 1
1 786 . 2 1 1 A 61 61 ASN CB C 61 36.645 37.300 -0.655 1
1 787 . 2 1 1 A 61 61 ASN N N 61 119.103 120.033 -0.930 1
1 789 . 2 1 1 A 62 62 SER H H 62 8.143 7.929 0.214 1
1 790 . 2 1 1 A 62 62 SER HA H 62 4.343 4.057 0.286 1
1 793 . 2 1 1 A 62 62 SER C C 62 176.409 175.919 0.490 1
1 794 . 2 1 1 A 62 62 SER CA C 62 61.612 62.346 -0.734 1
1 795 . 2 1 1 A 62 62 SER CB C 62 62.219 63.047 -0.828 1
1 796 . 2 1 1 A 62 62 SER N N 62 118.254 116.787 1.467 1
1 797 . 2 1 1 A 63 63 LEU H H 63 7.664 8.178 -0.514 1
1 798 . 2 1 1 A 63 63 LEU HA H 63 4.003 3.868 0.135 1
1 808 . 2 1 1 A 63 63 LEU C C 63 178.748 178.958 -0.210 1
1 809 . 2 1 1 A 63 63 LEU CA C 63 57.171 58.026 -0.855 1
1 810 . 2 1 1 A 63 63 LEU CB C 63 41.134 41.271 -0.137 1
1 814 . 2 1 1 A 63 63 LEU N N 63 123.812 120.786 3.026 1
1 815 . 2 1 1 A 64 64 ARG H H 64 7.969 7.783 0.186 1
1 816 . 2 1 1 A 64 64 ARG HA H 64 4.038 3.872 0.166 1
1 824 . 2 1 1 A 64 64 ARG C C 64 180.797 178.909 1.888 1
1 825 . 2 1 1 A 64 64 ARG CA C 64 58.598 59.901 -1.303 1
1 826 . 2 1 1 A 64 64 ARG CB C 64 28.849 30.011 -1.162 1
1 829 . 2 1 1 A 64 64 ARG N N 64 120.376 120.211 0.165 1
1 831 . 2 1 1 A 65 65 ASP H H 65 8.465 8.186 0.279 1
1 832 . 2 1 1 A 65 65 ASP HA H 65 4.408 4.436 -0.028 1
1 835 . 2 1 1 A 65 65 ASP C C 65 177.336 177.588 -0.252 1
1 836 . 2 1 1 A 65 65 ASP CA C 65 56.957 56.701 0.256 1
1 837 . 2 1 1 A 65 65 ASP CB C 65 39.602 40.492 -0.890 1
1 838 . 2 1 1 A 65 65 ASP N N 65 122.402 119.814 2.588 1
1 839 . 2 1 1 A 66 66 GLU H H 66 7.703 7.837 -0.134 1
1 840 . 2 1 1 A 66 66 GLU HA H 66 4.213 4.334 -0.121 1
1 845 . 2 1 1 A 66 66 GLU C C 66 176.586 177.104 -0.518 1
1 846 . 2 1 1 A 66 66 GLU CA C 66 56.974 56.283 0.691 1
1 847 . 2 1 1 A 66 66 GLU CB C 66 29.821 30.134 -0.313 1
1 849 . 2 1 1 A 66 66 GLU N N 66 119.076 117.253 1.823 1
1 850 . 2 1 1 A 67 67 GLY H H 67 7.861 7.794 0.067 1
1 851 . 2 1 1 A 67 67 GLY HA2 H 67 4.269 3.936 0.333 1
1 852 . 2 1 1 A 67 67 GLY HA3 H 67 3.731 3.940 -0.209 1
1 853 . 2 1 1 A 67 67 GLY C C 67 174.614 174.925 -0.311 1
1 854 . 2 1 1 A 67 67 GLY CA C 67 44.608 46.456 -1.848 1
1 855 . 2 1 1 A 67 67 GLY N N 67 105.730 109.914 -4.184 1
1 856 . 2 1 1 A 68 68 LEU H H 68 7.324 8.091 -0.767 1
1 857 . 2 1 1 A 68 68 LEU HA H 68 4.257 4.247 0.010 1
1 867 . 2 1 1 A 68 68 LEU C C 68 176.136 176.949 -0.813 1
1 868 . 2 1 1 A 68 68 LEU CA C 68 55.659 54.468 1.191 1
1 869 . 2 1 1 A 68 68 LEU CB C 68 41.874 41.971 -0.097 1
1 873 . 2 1 1 A 68 68 LEU N N 68 121.062 121.415 -0.353 1
1 874 . 2 1 1 A 69 69 LYS H H 69 8.368 8.395 -0.027 1
1 875 . 2 1 1 A 69 69 LYS HA H 69 4.281 4.538 -0.257 1
1 884 . 2 1 1 A 69 69 LYS C C 69 177.940 178.155 -0.215 1
1 885 . 2 1 1 A 69 69 LYS CA C 69 55.412 55.584 -0.172 1
1 886 . 2 1 1 A 69 69 LYS CB C 69 32.761 33.672 -0.911 1
1 890 . 2 1 1 A 69 69 LYS N N 69 120.120 122.160 -2.040 1
1 891 . 2 1 1 A 70 70 ARG H H 70 9.095 8.852 0.243 1
1 892 . 2 1 1 A 70 70 ARG HA H 70 3.684 4.089 -0.405 1
1 900 . 2 1 1 A 70 70 ARG C C 70 177.712 178.698 -0.986 1
1 901 . 2 1 1 A 70 70 ARG CA C 70 60.216 58.403 1.813 1
1 902 . 2 1 1 A 70 70 ARG CB C 70 29.539 29.710 -0.171 1
1 905 . 2 1 1 A 70 70 ARG N N 70 123.339 119.220 4.119 1
1 907 . 2 1 1 A 71 71 GLY H H 71 8.985 8.275 0.710 1
1 908 . 2 1 1 A 71 71 GLY HA2 H 71 3.932 3.577 0.355 1
1 909 . 2 1 1 A 71 71 GLY HA3 H 71 3.905 3.581 0.324 1
1 910 . 2 1 1 A 71 71 GLY C C 71 176.324 175.726 0.598 1
1 911 . 2 1 1 A 71 71 GLY CA C 71 46.752 47.383 -0.631 1
1 912 . 2 1 1 A 71 71 GLY N N 71 104.509 108.761 -4.252 1
1 913 . 2 1 1 A 72 72 THR H H 72 7.295 8.056 -0.761 1
1 914 . 2 1 1 A 72 72 THR HA H 72 4.014 3.920 0.094 1
1 919 . 2 1 1 A 72 72 THR C C 72 175.135 176.218 -1.083 1
1 920 . 2 1 1 A 72 72 THR CA C 72 65.848 66.536 -0.688 1
1 921 . 2 1 1 A 72 72 THR CB C 72 68.160 68.477 -0.317 1
1 923 . 2 1 1 A 72 72 THR N N 72 118.617 117.450 1.167 1
1 924 . 2 1 1 A 73 73 ILE H H 73 7.883 7.934 -0.051 1
1 925 . 2 1 1 A 73 73 ILE HA H 73 3.258 3.549 -0.291 1
1 935 . 2 1 1 A 73 73 ILE C C 73 177.060 178.039 -0.979 1
1 936 . 2 1 1 A 73 73 ILE CA C 73 66.561 65.590 0.971 1
1 937 . 2 1 1 A 73 73 ILE CB C 73 37.339 37.663 -0.324 1
1 941 . 2 1 1 A 73 73 ILE N N 73 121.692 121.280 0.412 1
1 942 . 2 1 1 A 74 74 GLU H H 74 8.723 8.197 0.526 1
1 943 . 2 1 1 A 74 74 GLU HA H 74 3.807 3.885 -0.078 1
1 948 . 2 1 1 A 74 74 GLU C C 74 178.319 178.928 -0.609 1
1 949 . 2 1 1 A 74 74 GLU CA C 74 59.637 60.060 -0.423 1
1 950 . 2 1 1 A 74 74 GLU CB C 74 29.257 29.311 -0.054 1
1 952 . 2 1 1 A 74 74 GLU N N 74 117.701 120.900 -3.199 1
1 953 . 2 1 1 A 75 75 LYS H H 75 7.361 7.522 -0.161 1
1 954 . 2 1 1 A 75 75 LYS HA H 75 3.958 4.090 -0.132 1
1 963 . 2 1 1 A 75 75 LYS C C 75 178.554 179.398 -0.844 1
1 964 . 2 1 1 A 75 75 LYS CA C 75 59.764 59.352 0.412 1
1 965 . 2 1 1 A 75 75 LYS CB C 75 32.314 32.252 0.062 1
1 969 . 2 1 1 A 75 75 LYS N N 75 118.734 118.015 0.719 1
1 970 . 2 1 1 A 76 76 ILE H H 76 7.713 7.292 0.421 1
1 971 . 2 1 1 A 76 76 ILE HA H 76 3.221 3.812 -0.591 1
1 981 . 2 1 1 A 76 76 ILE C C 76 177.504 178.199 -0.695 1
1 982 . 2 1 1 A 76 76 ILE CA C 76 65.796 64.472 1.324 1
1 983 . 2 1 1 A 76 76 ILE CB C 76 37.732 37.163 0.569 1
1 987 . 2 1 1 A 76 76 ILE N N 76 120.312 117.042 3.270 1
1 988 . 2 1 1 A 77 77 ILE H H 77 8.587 8.015 0.572 1
1 989 . 2 1 1 A 77 77 ILE HA H 77 3.778 3.591 0.187 1
1 999 . 2 1 1 A 77 77 ILE C C 77 177.074 177.693 -0.619 1
1 1000 . 2 1 1 A 77 77 ILE CA C 77 63.168 65.202 -2.034 1
1 1001 . 2 1 1 A 77 77 ILE CB C 77 36.617 37.525 -0.908 1
1 1005 . 2 1 1 A 77 77 ILE N N 77 118.978 121.624 -2.646 1
1 1006 . 2 1 1 A 78 78 LYS H H 78 8.050 7.906 0.144 1
1 1007 . 2 1 1 A 78 78 LYS HA H 78 3.925 4.029 -0.104 1
1 1016 . 2 1 1 A 78 78 LYS C C 78 178.291 179.362 -1.071 1
1 1017 . 2 1 1 A 78 78 LYS CA C 78 60.192 59.560 0.632 1
1 1018 . 2 1 1 A 78 78 LYS CB C 78 31.886 32.641 -0.755 1
1 1022 . 2 1 1 A 78 78 LYS N N 78 121.618 119.442 2.176 1
1 1023 . 2 1 1 A 79 79 VAL H H 79 7.619 7.704 -0.085 1
1 1024 . 2 1 1 A 79 79 VAL HA H 79 3.846 3.731 0.115 1
1 1032 . 2 1 1 A 79 79 VAL C C 79 177.712 178.371 -0.659 1
1 1033 . 2 1 1 A 79 79 VAL CA C 79 66.494 66.374 0.120 1
1 1034 . 2 1 1 A 79 79 VAL CB C 79 31.298 31.739 -0.441 1
1 1037 . 2 1 1 A 79 79 VAL N N 79 120.254 119.513 0.741 1
1 1038 . 2 1 1 A 80 80 ILE H H 80 7.885 8.157 -0.272 1
1 1039 . 2 1 1 A 80 80 ILE HA H 80 3.367 3.700 -0.333 1
1 1049 . 2 1 1 A 80 80 ILE C C 80 179.892 177.875 2.017 1
1 1050 . 2 1 1 A 80 80 ILE CA C 80 65.343 65.246 0.097 1
1 1051 . 2 1 1 A 80 80 ILE CB C 80 38.129 37.650 0.479 1
1 1055 . 2 1 1 A 80 80 ILE N N 80 119.666 120.734 -1.068 1
1 1056 . 2 1 1 A 81 81 ARG H H 81 9.384 8.365 1.019 1
1 1057 . 2 1 1 A 81 81 ARG HA H 81 3.834 3.982 -0.148 1
1 1065 . 2 1 1 A 81 81 ARG C C 81 178.204 179.242 -1.038 1
1 1066 . 2 1 1 A 81 81 ARG CA C 81 60.560 59.744 0.816 1
1 1067 . 2 1 1 A 81 81 ARG CB C 81 30.196 30.207 -0.011 1
1 1070 . 2 1 1 A 81 81 ARG N N 81 121.030 120.507 0.523 1
1 1072 . 2 1 1 A 82 82 ASN H H 82 8.773 8.227 0.546 1
1 1073 . 2 1 1 A 82 82 ASN HA H 82 4.587 4.554 0.033 1
1 1078 . 2 1 1 A 82 82 ASN C C 82 178.300 177.579 0.721 1
1 1079 . 2 1 1 A 82 82 ASN CA C 82 56.160 56.498 -0.338 1
1 1080 . 2 1 1 A 82 82 ASN CB C 82 38.464 39.420 -0.956 1
1 1081 . 2 1 1 A 82 82 ASN N N 82 118.483 118.692 -0.209 1
1 1083 . 2 1 1 A 83 83 SER H H 83 8.526 7.449 1.077 1
1 1084 . 2 1 1 A 83 83 SER HA H 83 2.765 3.005 -0.240 1
1 1087 . 2 1 1 A 83 83 SER C C 83 176.386 177.406 -1.020 1
1 1088 . 2 1 1 A 83 83 SER CA C 83 61.245 60.865 0.380 1
1 1089 . 2 1 1 A 83 83 SER CB C 83 61.287 62.535 -1.248 1
1 1090 . 2 1 1 A 83 83 SER N N 83 118.286 114.145 4.141 1
1 1091 . 2 1 1 A 84 84 LEU H H 84 7.782 8.300 -0.518 1
1 1092 . 2 1 1 A 84 84 LEU HA H 84 4.221 3.964 0.257 1
1 1102 . 2 1 1 A 84 84 LEU C C 84 177.846 179.322 -1.476 1
1 1103 . 2 1 1 A 84 84 LEU CA C 84 57.166 57.675 -0.509 1
1 1104 . 2 1 1 A 84 84 LEU CB C 84 40.520 40.916 -0.396 1
1 1108 . 2 1 1 A 84 84 LEU N N 84 127.445 121.277 6.168 1
1 1109 . 2 1 1 A 85 85 GLU H H 85 8.264 8.381 -0.117 1
1 1110 . 2 1 1 A 85 85 GLU HA H 85 3.981 3.943 0.038 1
1 1115 . 2 1 1 A 85 85 GLU C C 85 179.288 179.317 -0.029 1
1 1116 . 2 1 1 A 85 85 GLU CA C 85 59.025 60.337 -1.312 1
1 1117 . 2 1 1 A 85 85 GLU CB C 85 29.182 29.277 -0.095 1
1 1119 . 2 1 1 A 85 85 GLU N N 85 121.538 120.262 1.276 1
1 1120 . 2 1 1 A 86 86 HIS H H 86 7.683 7.994 -0.311 1
1 1121 . 2 1 1 A 86 86 HIS HA H 86 4.573 4.328 0.245 1
1 1125 . 2 1 1 A 86 86 HIS C C 86 175.484 177.561 -2.077 1
1 1126 . 2 1 1 A 86 86 HIS CA C 86 58.940 59.352 -0.412 1
1 1127 . 2 1 1 A 86 86 HIS CB C 86 29.267 29.912 -0.645 1
1 1129 . 2 1 1 A 86 86 HIS N N 86 117.087 120.419 -3.332 1
1 1130 . 2 1 1 A 87 87 ALA H H 87 7.197 7.958 -0.761 1
1 1131 . 2 1 1 A 87 87 ALA HA H 87 3.925 3.952 -0.027 1
1 1135 . 2 1 1 A 87 87 ALA C C 87 179.038 180.375 -1.337 1
1 1136 . 2 1 1 A 87 87 ALA CA C 87 54.863 54.953 -0.090 1
1 1137 . 2 1 1 A 87 87 ALA CB C 87 17.034 18.238 -1.204 1
1 1138 . 2 1 1 A 87 87 ALA N N 87 121.510 120.835 0.675 1
1 1139 . 2 1 1 A 88 88 ILE H H 88 7.819 7.507 0.312 1
1 1140 . 2 1 1 A 88 88 ILE HA H 88 4.067 3.983 0.084 1
1 1150 . 2 1 1 A 88 88 ILE C C 88 180.846 177.451 3.395 1
1 1151 . 2 1 1 A 88 88 ILE CA C 88 64.021 65.206 -1.185 1
1 1152 . 2 1 1 A 88 88 ILE CB C 88 37.557 37.492 0.065 1
1 1156 . 2 1 1 A 88 88 ILE N N 88 120.898 119.605 1.293 1
1 1157 . 2 1 1 A 89 89 ASP H H 89 7.808 8.078 -0.270 1
1 1158 . 2 1 1 A 89 89 ASP HA H 89 4.437 4.287 0.150 1
1 1161 . 2 1 1 A 89 89 ASP C C 89 178.033 178.521 -0.488 1
1 1162 . 2 1 1 A 89 89 ASP CA C 89 57.343 57.700 -0.357 1
1 1163 . 2 1 1 A 89 89 ASP CB C 89 39.689 41.433 -1.744 1
1 1164 . 2 1 1 A 89 89 ASP N N 89 125.174 121.553 3.621 1
1 1165 . 2 1 1 A 90 90 LEU H H 90 7.607 7.611 -0.004 1
1 1166 . 2 1 1 A 90 90 LEU HA H 90 4.198 4.159 0.039 1
1 1176 . 2 1 1 A 90 90 LEU C C 90 175.416 176.068 -0.652 1
1 1177 . 2 1 1 A 90 90 LEU CA C 90 54.755 55.042 -0.287 1
1 1178 . 2 1 1 A 90 90 LEU CB C 90 42.960 42.095 0.865 1
1 1182 . 2 1 1 A 90 90 LEU N N 90 117.576 117.605 -0.029 1
1 1183 . 2 1 1 A 91 91 GLU H H 91 8.143 7.968 0.175 1
1 1184 . 2 1 1 A 91 91 GLU HA H 91 4.005 4.106 -0.101 1
1 1189 . 2 1 1 A 91 91 GLU C C 91 175.792 176.189 -0.397 1
1 1190 . 2 1 1 A 91 91 GLU CA C 91 57.202 57.532 -0.330 1
1 1191 . 2 1 1 A 91 91 GLU CB C 91 26.125 26.606 -0.481 1
1 1193 . 2 1 1 A 91 91 GLU N N 91 113.620 114.961 -1.341 1
1 1194 . 2 1 1 A 92 92 LEU H H 92 8.290 7.783 0.507 1
1 1195 . 2 1 1 A 92 92 LEU HA H 92 4.216 4.146 0.070 1
1 1205 . 2 1 1 A 92 92 LEU C C 92 176.622 176.994 -0.372 1
1 1206 . 2 1 1 A 92 92 LEU CA C 92 56.410 56.597 -0.187 1
1 1207 . 2 1 1 A 92 92 LEU CB C 92 43.378 42.398 0.980 1
1 1211 . 2 1 1 A 92 92 LEU N N 92 116.868 119.060 -2.192 1
1 1212 . 2 1 1 A 93 93 ILE H H 93 6.988 6.874 0.114 1
1 1213 . 2 1 1 A 93 93 ILE HA H 93 4.580 4.559 0.021 1
1 1223 . 2 1 1 A 93 93 ILE C C 93 175.145 175.463 -0.318 1
1 1224 . 2 1 1 A 93 93 ILE CA C 93 58.707 58.640 0.067 1
1 1225 . 2 1 1 A 93 93 ILE CB C 93 42.864 41.422 1.442 1
1 1229 . 2 1 1 A 93 93 ILE N N 93 107.565 114.082 -6.517 1
1 1230 . 2 1 1 A 94 94 THR H H 94 8.742 8.599 0.143 1
1 1231 . 2 1 1 A 94 94 THR HA H 94 4.489 4.391 0.098 1
1 1236 . 2 1 1 A 94 94 THR C C 94 173.875 174.625 -0.750 1
1 1237 . 2 1 1 A 94 94 THR CA C 94 61.842 62.465 -0.623 1
1 1238 . 2 1 1 A 94 94 THR CB C 94 69.972 69.300 0.672 1
1 1240 . 2 1 1 A 94 94 THR N N 94 107.904 113.214 -5.310 1
1 1241 . 2 1 1 A 95 95 LYS H H 95 7.294 7.663 -0.369 1
1 1242 . 2 1 1 A 95 95 LYS HA H 95 4.566 4.863 -0.297 1
1 1251 . 2 1 1 A 95 95 LYS C C 95 173.791 174.309 -0.518 1
1 1252 . 2 1 1 A 95 95 LYS CA C 95 54.533 55.565 -1.032 1
1 1253 . 2 1 1 A 95 95 LYS CB C 95 35.123 36.060 -0.937 1
1 1257 . 2 1 1 A 95 95 LYS N N 95 119.458 120.828 -1.370 1
1 1258 . 2 1 1 A 96 96 ASN H H 96 9.157 8.407 0.750 1
1 1259 . 2 1 1 A 96 96 ASN HA H 96 4.408 5.102 -0.694 1
1 1264 . 2 1 1 A 96 96 ASN C C 96 176.653 175.795 0.858 1
1 1265 . 2 1 1 A 96 96 ASN CA C 96 51.088 51.411 -0.323 1
1 1266 . 2 1 1 A 96 96 ASN CB C 96 37.292 40.492 -3.200 1
1 1267 . 2 1 1 A 96 96 ASN N N 96 121.031 123.078 -2.047 1
1 1269 . 2 1 1 A 97 97 VAL H H 97 8.193 8.318 -0.125 1
1 1270 . 2 1 1 A 97 97 VAL HA H 97 4.019 4.367 -0.348 1
1 1278 . 2 1 1 A 97 97 VAL C C 97 175.089 176.048 -0.959 1
1 1279 . 2 1 1 A 97 97 VAL CA C 97 63.437 61.796 1.641 1
1 1280 . 2 1 1 A 97 97 VAL CB C 97 29.934 32.069 -2.135 1
1 1283 . 2 1 1 A 97 97 VAL N N 97 118.839 116.052 2.787 1
1 1284 . 2 1 1 A 98 98 ALA H H 98 7.994 7.544 0.450 1
1 1285 . 2 1 1 A 98 98 ALA HA H 98 5.108 4.210 0.898 1
1 1289 . 2 1 1 A 98 98 ALA C C 98 178.033 179.359 -1.326 1
1 1290 . 2 1 1 A 98 98 ALA CA C 98 50.342 53.100 -2.758 1
1 1291 . 2 1 1 A 98 98 ALA CB C 98 19.659 19.258 0.401 1
1 1292 . 2 1 1 A 98 98 ALA N N 98 121.031 124.777 -3.746 1
1 1293 . 2 1 1 A 99 99 ALA H H 99 7.347 7.740 -0.393 1
1 1294 . 2 1 1 A 99 99 ALA HA H 99 3.818 4.143 -0.325 1
1 1298 . 2 1 1 A 99 99 ALA C C 99 177.712 178.208 -0.496 1
1 1299 . 2 1 1 A 99 99 ALA CA C 99 55.117 53.906 1.211 1
1 1300 . 2 1 1 A 99 99 ALA CB C 99 18.879 18.363 0.516 1
1 1301 . 2 1 1 A 99 99 ALA N N 99 122.816 119.619 3.197 1
1 1302 . 2 1 1 A 100 100 LYS H H 100 8.190 7.778 0.412 1
1 1303 . 2 1 1 A 100 100 LYS HA H 100 4.483 4.320 0.163 1
1 1312 . 2 1 1 A 100 100 LYS C C 100 175.899 176.365 -0.466 1
1 1313 . 2 1 1 A 100 100 LYS CA C 100 54.231 57.116 -2.885 1
1 1314 . 2 1 1 A 100 100 LYS CB C 100 32.066 33.373 -1.307 1
1 1318 . 2 1 1 A 100 100 LYS N N 100 113.197 115.346 -2.149 1
1 1319 . 2 1 1 A 101 101 THR H H 101 7.128 7.773 -0.645 1
1 1320 . 2 1 1 A 101 101 THR HA H 101 3.834 4.416 -0.582 1
1 1325 . 2 1 1 A 101 101 THR C C 101 173.255 173.802 -0.547 1
1 1326 . 2 1 1 A 101 101 THR CA C 101 64.392 61.759 2.633 1
1 1327 . 2 1 1 A 101 101 THR CB C 101 69.160 68.165 0.995 1
1 1329 . 2 1 1 A 101 101 THR N N 101 118.368 115.592 2.776 1
1 1330 . 2 1 1 A 102 102 LYS H H 102 8.753 8.323 0.430 1
1 1331 . 2 1 1 A 102 102 LYS HA H 102 4.438 4.641 -0.203 1
1 1340 . 2 1 1 A 102 102 LYS C C 102 175.627 176.327 -0.700 1
1 1341 . 2 1 1 A 102 102 LYS CA C 102 55.117 55.460 -0.343 1
1 1342 . 2 1 1 A 102 102 LYS CB C 102 33.901 33.606 0.295 1
1 1346 . 2 1 1 A 102 102 LYS N N 102 126.513 124.855 1.658 1
1 1347 . 2 1 1 A 103 103 LEU H H 103 8.602 8.163 0.439 1
1 1348 . 2 1 1 A 103 103 LEU HA H 103 4.486 4.410 0.076 1
1 1358 . 2 1 1 A 103 103 LEU CA C 103 52.233 53.185 -0.952 1
1 1359 . 2 1 1 A 103 103 LEU CB C 103 41.028 42.779 -1.751 1
1 1363 . 2 1 1 A 103 103 LEU N N 103 124.466 122.795 1.671 1
1 1364 . 2 1 1 A 104 104 PRO HA H 104 4.437 4.598 -0.161 1
1 1371 . 2 1 1 A 104 104 PRO C C 104 175.779 175.866 -0.087 1
1 1372 . 2 1 1 A 104 104 PRO CA C 104 62.322 62.166 0.156 1
1 1373 . 2 1 1 A 104 104 PRO CB C 104 31.899 33.108 -1.209 1
1 1376 . 2 1 1 A 105 105 LYS H H 105 8.460 8.483 -0.023 1
1 1377 . 2 1 1 A 105 105 LYS HA H 105 4.154 4.367 -0.213 1
1 1386 . 2 1 1 A 105 105 LYS C C 105 175.998 176.236 -0.238 1
1 1387 . 2 1 1 A 105 105 LYS CA C 105 56.480 55.675 0.805 1
1 1388 . 2 1 1 A 105 105 LYS CB C 105 32.909 31.085 1.824 1
1 1392 . 2 1 1 A 105 105 LYS N N 105 122.139 120.979 1.160 1
1 1393 . 2 1 1 A 106 106 ALA H H 106 8.448 8.021 0.427 1
1 1394 . 2 1 1 A 106 106 ALA HA H 106 4.309 4.670 -0.361 1
1 1398 . 2 1 1 A 106 106 ALA C C 106 176.828 175.719 1.109 1
1 1399 . 2 1 1 A 106 106 ALA CA C 106 51.862 51.101 0.761 1
1 1400 . 2 1 1 A 106 106 ALA CB C 106 19.323 19.296 0.027 1
1 1401 . 2 1 1 A 106 106 ALA N N 106 125.278 126.328 -1.050 1
1 1402 . 2 1 1 A 107 107 ASP H H 107 8.428 7.820 0.608 1
1 1403 . 2 1 1 A 107 107 ASP HA H 107 4.574 4.711 -0.137 1
1 1406 . 2 1 1 A 107 107 ASP C C 107 175.951 176.281 -0.330 1
1 1407 . 2 1 1 A 107 107 ASP CA C 107 54.214 53.861 0.353 1
1 1408 . 2 1 1 A 107 107 ASP CB C 107 41.141 41.277 -0.136 1
1 1409 . 2 1 1 A 107 107 ASP N N 107 120.771 118.066 2.705 1
1 1410 . 2 1 1 A 108 108 LYS H H 108 8.329 8.585 -0.256 1
1 1411 . 2 1 1 A 108 108 LYS HA H 108 4.203 4.814 -0.611 1
1 1420 . 2 1 1 A 108 108 LYS C C 108 176.483 175.922 0.561 1
1 1421 . 2 1 1 A 108 108 LYS CA C 108 56.831 55.349 1.482 1
1 1422 . 2 1 1 A 108 108 LYS CB C 108 32.648 34.423 -1.775 1
1 1426 . 2 1 1 A 108 108 LYS N N 108 120.727 121.396 -0.669 1
1 1427 . 2 1 1 A 109 109 GLU H H 109 8.447 8.842 -0.395 1
1 1428 . 2 1 1 A 109 109 GLU HA H 109 4.215 4.493 -0.278 1
1 1433 . 2 1 1 A 109 109 GLU C C 109 176.513 177.522 -1.009 1
1 1434 . 2 1 1 A 109 109 GLU CA C 109 56.936 56.052 0.884 1
1 1435 . 2 1 1 A 109 109 GLU CB C 109 29.833 30.551 -0.718 1
1 1437 . 2 1 1 A 109 109 GLU N N 109 121.471 120.927 0.544 1
1 1438 . 2 1 1 A 110 110 GLU H H 110 8.352 8.450 -0.098 1
1 1439 . 2 1 1 A 110 110 GLU HA H 110 4.233 4.033 0.200 1
1 1444 . 2 1 1 A 110 110 GLU C C 110 176.439 177.032 -0.593 1
1 1445 . 2 1 1 A 110 110 GLU CA C 110 56.681 59.370 -2.689 1
1 1446 . 2 1 1 A 110 110 GLU CB C 110 29.860 29.234 0.626 1
1 1448 . 2 1 1 A 110 110 GLU N N 110 121.559 124.086 -2.527 1
1 1449 . 2 1 1 A 111 111 LEU H H 111 8.145 7.909 0.236 1
1 1450 . 2 1 1 A 111 111 LEU HA H 111 4.251 3.979 0.272 1
1 1460 . 2 1 1 A 111 111 LEU C C 111 177.306 176.396 0.910 1
1 1461 . 2 1 1 A 111 111 LEU CA C 111 55.277 56.181 -0.904 1
1 1462 . 2 1 1 A 111 111 LEU CB C 111 42.054 39.694 2.360 1
1 1466 . 2 1 1 A 111 111 LEU N N 111 122.181 116.404 5.777 1
1 1467 . 2 1 1 A 112 112 GLU H H 112 8.212 7.857 0.355 1
1 1468 . 2 1 1 A 112 112 GLU N N 112 120.291 118.328 1.963 1
1 1469 . 2 1 1 A 114 114 HIS C C 114 176.070 174.446 1.624 1
1 1470 . 2 1 1 A 116 116 HIS H H 116 8.227 8.838 -0.611 1
1 1471 . 2 1 1 A 116 116 HIS C C 116 173.580 175.032 -1.452 1
1 1472 . 2 1 1 A 116 116 HIS N N 116 119.156 121.513 -2.357 1
1 5 . 3 1 1 A 3 3 PRO HA H 3 4.390 4.726 -0.336 1
1 12 . 3 1 1 A 3 3 PRO C C 3 176.847 176.911 -0.064 1
1 13 . 3 1 1 A 3 3 PRO CA C 3 63.449 62.517 0.932 1
1 14 . 3 1 1 A 3 3 PRO CB C 3 31.938 30.881 1.057 1
1 17 . 3 1 1 A 4 4 SER H H 4 8.531 8.366 0.165 1
1 18 . 3 1 1 A 4 4 SER HA H 4 4.262 4.458 -0.196 1
1 21 . 3 1 1 A 4 4 SER C C 4 175.414 174.523 0.891 1
1 22 . 3 1 1 A 4 4 SER CA C 4 59.163 58.168 0.995 1
1 23 . 3 1 1 A 4 4 SER CB C 4 63.242 62.469 0.773 1
1 24 . 3 1 1 A 4 4 SER N N 4 114.246 118.817 -4.571 1
1 25 . 3 1 1 A 5 5 LYS H H 5 8.468 8.087 0.381 1
1 26 . 3 1 1 A 5 5 LYS HA H 5 4.433 4.099 0.334 1
1 35 . 3 1 1 A 5 5 LYS C C 5 175.984 177.564 -1.580 1
1 36 . 3 1 1 A 5 5 LYS CA C 5 55.724 59.128 -3.404 1
1 37 . 3 1 1 A 5 5 LYS CB C 5 32.881 32.205 0.676 1
1 41 . 3 1 1 A 5 5 LYS N N 5 123.488 127.129 -3.641 1
1 42 . 3 1 1 A 6 6 LEU H H 6 7.707 7.373 0.334 1
1 43 . 3 1 1 A 6 6 LEU HA H 6 4.381 4.323 0.058 1
1 53 . 3 1 1 A 6 6 LEU C C 6 177.820 176.304 1.516 1
1 54 . 3 1 1 A 6 6 LEU CA C 6 55.507 54.928 0.579 1
1 55 . 3 1 1 A 6 6 LEU CB C 6 43.374 42.574 0.800 1
1 59 . 3 1 1 A 6 6 LEU N N 6 121.233 122.085 -0.852 1
1 60 . 3 1 1 A 7 7 SER H H 7 9.433 8.439 0.994 1
1 61 . 3 1 1 A 7 7 SER HA H 7 4.638 4.529 0.109 1
1 64 . 3 1 1 A 7 7 SER C C 7 174.120 174.865 -0.745 1
1 65 . 3 1 1 A 7 7 SER CA C 7 57.962 58.899 -0.937 1
1 66 . 3 1 1 A 7 7 SER CB C 7 64.197 64.148 0.049 1
1 67 . 3 1 1 A 7 7 SER N N 7 122.977 123.662 -0.685 1
1 68 . 3 1 1 A 8 8 TYR H H 8 9.764 9.259 0.505 1
1 69 . 3 1 1 A 8 8 TYR HA H 8 4.732 4.273 0.459 1
1 76 . 3 1 1 A 8 8 TYR C C 8 177.206 177.823 -0.617 1
1 77 . 3 1 1 A 8 8 TYR CA C 8 58.762 61.799 -3.037 1
1 78 . 3 1 1 A 8 8 TYR CB C 8 36.605 38.970 -2.365 1
1 83 . 3 1 1 A 8 8 TYR N N 8 123.312 124.492 -1.180 1
1 84 . 3 1 1 A 9 9 GLY H H 9 10.131 8.446 1.685 1
1 85 . 3 1 1 A 9 9 GLY HA2 H 9 3.983 3.602 0.381 1
1 86 . 3 1 1 A 9 9 GLY HA3 H 9 3.423 3.710 -0.287 1
1 87 . 3 1 1 A 9 9 GLY C C 9 175.163 176.154 -0.991 1
1 88 . 3 1 1 A 9 9 GLY CA C 9 47.153 47.284 -0.131 1
1 89 . 3 1 1 A 9 9 GLY N N 9 107.177 105.578 1.599 1
1 90 . 3 1 1 A 10 10 GLU H H 10 7.876 8.018 -0.142 1
1 91 . 3 1 1 A 10 10 GLU HA H 10 4.107 4.094 0.013 1
1 96 . 3 1 1 A 10 10 GLU C C 10 179.924 179.008 0.916 1
1 97 . 3 1 1 A 10 10 GLU CA C 10 58.890 59.495 -0.605 1
1 98 . 3 1 1 A 10 10 GLU CB C 10 29.750 29.466 0.284 1
1 100 . 3 1 1 A 10 10 GLU N N 10 122.219 121.950 0.269 1
1 101 . 3 1 1 A 11 11 TYR H H 11 8.384 8.349 0.035 1
1 102 . 3 1 1 A 11 11 TYR HA H 11 4.305 4.228 0.077 1
1 107 . 3 1 1 A 11 11 TYR C C 11 176.854 177.686 -0.832 1
1 108 . 3 1 1 A 11 11 TYR CA C 11 61.040 60.824 0.216 1
1 109 . 3 1 1 A 11 11 TYR CB C 11 37.593 38.879 -1.286 1
1 112 . 3 1 1 A 11 11 TYR N N 11 120.809 122.507 -1.698 1
1 113 . 3 1 1 A 12 12 LEU H H 12 9.027 8.185 0.842 1
1 114 . 3 1 1 A 12 12 LEU HA H 12 3.778 3.676 0.102 1
1 124 . 3 1 1 A 12 12 LEU C C 12 178.621 179.281 -0.660 1
1 125 . 3 1 1 A 12 12 LEU CA C 12 57.534 57.878 -0.344 1
1 126 . 3 1 1 A 12 12 LEU CB C 12 41.957 41.225 0.732 1
1 130 . 3 1 1 A 12 12 LEU N N 12 121.080 119.801 1.279 1
1 131 . 3 1 1 A 13 13 GLU H H 13 7.614 8.184 -0.570 1
1 132 . 3 1 1 A 13 13 GLU HA H 13 4.102 4.071 0.031 1
1 137 . 3 1 1 A 13 13 GLU C C 13 178.449 178.879 -0.430 1
1 138 . 3 1 1 A 13 13 GLU CA C 13 59.609 59.424 0.185 1
1 139 . 3 1 1 A 13 13 GLU CB C 13 29.124 29.709 -0.585 1
1 141 . 3 1 1 A 13 13 GLU N N 13 118.475 119.837 -1.362 1
1 142 . 3 1 1 A 14 14 SER H H 14 7.329 7.696 -0.367 1
1 143 . 3 1 1 A 14 14 SER HA H 14 4.358 4.187 0.171 1
1 146 . 3 1 1 A 14 14 SER C C 14 176.794 176.921 -0.127 1
1 147 . 3 1 1 A 14 14 SER CA C 14 61.064 61.730 -0.666 1
1 148 . 3 1 1 A 14 14 SER CB C 14 62.513 63.348 -0.835 1
1 149 . 3 1 1 A 14 14 SER N N 14 115.209 114.984 0.225 1
1 150 . 3 1 1 A 15 15 TRP H H 15 8.870 8.099 0.771 1
1 151 . 3 1 1 A 15 15 TRP HA H 15 4.005 4.397 -0.392 1
1 160 . 3 1 1 A 15 15 TRP C C 15 177.547 177.928 -0.381 1
1 161 . 3 1 1 A 15 15 TRP CA C 15 61.210 61.389 -0.179 1
1 162 . 3 1 1 A 15 15 TRP CB C 15 27.341 29.050 -1.709 1
1 168 . 3 1 1 A 15 15 TRP N N 15 124.998 123.636 1.362 1
1 170 . 3 1 1 A 16 16 PHE H H 16 9.087 8.117 0.970 1
1 171 . 3 1 1 A 16 16 PHE HA H 16 3.210 3.461 -0.251 1
1 179 . 3 1 1 A 16 16 PHE C C 16 175.909 177.532 -1.623 1
1 180 . 3 1 1 A 16 16 PHE CA C 16 61.473 61.275 0.198 1
1 181 . 3 1 1 A 16 16 PHE CB C 16 38.506 38.935 -0.429 1
1 187 . 3 1 1 A 16 16 PHE N N 16 119.825 120.974 -1.149 1
1 188 . 3 1 1 A 17 17 ASN H H 17 7.768 8.217 -0.449 1
1 189 . 3 1 1 A 17 17 ASN HA H 17 4.078 4.211 -0.133 1
1 194 . 3 1 1 A 17 17 ASN C C 17 176.604 177.758 -1.154 1
1 195 . 3 1 1 A 17 17 ASN CA C 17 55.621 56.217 -0.596 1
1 196 . 3 1 1 A 17 17 ASN CB C 17 37.830 37.844 -0.014 1
1 197 . 3 1 1 A 17 17 ASN N N 17 115.600 117.657 -2.057 1
1 199 . 3 1 1 A 18 18 THR H H 18 7.454 7.588 -0.134 1
1 200 . 3 1 1 A 18 18 THR HA H 18 4.147 3.476 0.671 1
1 205 . 3 1 1 A 18 18 THR C C 18 175.692 175.999 -0.307 1
1 206 . 3 1 1 A 18 18 THR CA C 18 64.679 66.771 -2.092 1
1 207 . 3 1 1 A 18 18 THR CB C 18 68.940 68.134 0.806 1
1 209 . 3 1 1 A 18 18 THR N N 18 113.049 116.613 -3.564 1
1 210 . 3 1 1 A 19 19 LYS H H 19 7.918 7.218 0.700 1
1 211 . 3 1 1 A 19 19 LYS HA H 19 3.791 3.680 0.111 1
1 220 . 3 1 1 A 19 19 LYS C C 19 178.120 178.990 -0.870 1
1 221 . 3 1 1 A 19 19 LYS CA C 19 55.985 58.716 -2.731 1
1 222 . 3 1 1 A 19 19 LYS CB C 19 31.130 31.041 0.089 1
1 226 . 3 1 1 A 19 19 LYS N N 19 122.614 119.761 2.853 1
1 227 . 3 1 1 A 20 20 ARG H H 20 7.845 7.713 0.132 1
1 228 . 3 1 1 A 20 20 ARG HA H 20 3.396 3.822 -0.426 1
1 236 . 3 1 1 A 20 20 ARG C C 20 175.601 178.827 -3.226 1
1 237 . 3 1 1 A 20 20 ARG CA C 20 58.182 58.304 -0.122 1
1 238 . 3 1 1 A 20 20 ARG CB C 20 28.045 30.113 -2.068 1
1 241 . 3 1 1 A 20 20 ARG N N 20 116.282 118.001 -1.719 1
1 243 . 3 1 1 A 21 21 HIS H H 21 7.163 7.909 -0.746 1
1 244 . 3 1 1 A 21 21 HIS HA H 21 4.500 4.167 0.333 1
1 249 . 3 1 1 A 21 21 HIS C C 21 175.618 176.034 -0.416 1
1 250 . 3 1 1 A 21 21 HIS CA C 21 56.912 59.253 -2.341 1
1 251 . 3 1 1 A 21 21 HIS CB C 21 29.400 30.050 -0.650 1
1 254 . 3 1 1 A 21 21 HIS N N 21 115.452 118.326 -2.874 1
1 255 . 3 1 1 A 22 22 SER H H 22 7.951 7.669 0.282 1
1 256 . 3 1 1 A 22 22 SER HA H 22 4.573 4.516 0.057 1
1 259 . 3 1 1 A 22 22 SER C C 22 173.948 173.960 -0.012 1
1 260 . 3 1 1 A 22 22 SER CA C 22 58.589 59.798 -1.209 1
1 261 . 3 1 1 A 22 22 SER CB C 22 64.228 64.685 -0.457 1
1 262 . 3 1 1 A 22 22 SER N N 22 113.209 113.148 0.061 1
1 263 . 3 1 1 A 23 23 VAL H H 23 7.179 7.386 -0.207 1
1 264 . 3 1 1 A 23 23 VAL HA H 23 4.626 4.164 0.462 1
1 272 . 3 1 1 A 23 23 VAL C C 23 175.397 176.024 -0.627 1
1 273 . 3 1 1 A 23 23 VAL CA C 23 59.556 61.884 -2.328 1
1 274 . 3 1 1 A 23 23 VAL CB C 23 33.810 32.636 1.174 1
1 277 . 3 1 1 A 23 23 VAL N N 23 113.108 117.022 -3.914 1
1 278 . 3 1 1 A 24 24 GLY H H 24 8.189 8.537 -0.348 1
1 279 . 3 1 1 A 24 24 GLY HA2 H 24 4.074 4.025 0.049 1
1 280 . 3 1 1 A 24 24 GLY HA3 H 24 4.195 4.042 0.153 1
1 281 . 3 1 1 A 24 24 GLY C C 24 174.037 174.609 -0.572 1
1 282 . 3 1 1 A 24 24 GLY CA C 24 44.452 44.917 -0.465 1
1 283 . 3 1 1 A 24 24 GLY N N 24 108.374 109.693 -1.319 1
1 284 . 3 1 1 A 25 25 ILE H H 25 8.331 8.675 -0.344 1
1 285 . 3 1 1 A 25 25 ILE HA H 25 3.839 3.678 0.161 1
1 295 . 3 1 1 A 25 25 ILE C C 25 178.042 177.710 0.332 1
1 296 . 3 1 1 A 25 25 ILE CA C 25 64.238 64.462 -0.224 1
1 297 . 3 1 1 A 25 25 ILE CB C 25 37.931 37.530 0.401 1
1 301 . 3 1 1 A 25 25 ILE N N 25 119.895 119.354 0.541 1
1 302 . 3 1 1 A 26 26 GLN H H 26 8.545 8.689 -0.144 1
1 303 . 3 1 1 A 26 26 GLN HA H 26 4.129 4.053 0.076 1
1 310 . 3 1 1 A 26 26 GLN C C 26 178.454 177.716 0.738 1
1 311 . 3 1 1 A 26 26 GLN CA C 26 58.772 58.082 0.690 1
1 312 . 3 1 1 A 26 26 GLN CB C 26 27.346 28.084 -0.738 1
1 314 . 3 1 1 A 26 26 GLN N N 26 120.013 119.848 0.165 1
1 316 . 3 1 1 A 27 27 THR H H 27 7.944 7.786 0.158 1
1 317 . 3 1 1 A 27 27 THR HA H 27 3.953 4.010 -0.057 1
1 322 . 3 1 1 A 27 27 THR C C 27 175.818 175.995 -0.177 1
1 323 . 3 1 1 A 27 27 THR CA C 27 65.855 66.398 -0.543 1
1 324 . 3 1 1 A 27 27 THR CB C 27 68.127 68.713 -0.586 1
1 326 . 3 1 1 A 27 27 THR N N 27 117.645 116.575 1.070 1
1 327 . 3 1 1 A 28 28 ALA H H 28 8.593 8.279 0.314 1
1 328 . 3 1 1 A 28 28 ALA HA H 28 3.899 4.159 -0.260 1
1 332 . 3 1 1 A 28 28 ALA C C 28 178.515 179.882 -1.367 1
1 333 . 3 1 1 A 28 28 ALA CA C 28 55.742 55.599 0.143 1
1 334 . 3 1 1 A 28 28 ALA CB C 28 17.513 18.217 -0.704 1
1 335 . 3 1 1 A 28 28 ALA N N 28 123.917 123.698 0.219 1
1 336 . 3 1 1 A 29 29 LYS H H 29 7.800 7.775 0.025 1
1 337 . 3 1 1 A 29 29 LYS HA H 29 3.982 3.967 0.015 1
1 346 . 3 1 1 A 29 29 LYS C C 29 179.527 178.980 0.547 1
1 347 . 3 1 1 A 29 29 LYS CA C 29 59.761 59.478 0.283 1
1 348 . 3 1 1 A 29 29 LYS CB C 29 32.223 32.343 -0.120 1
1 352 . 3 1 1 A 29 29 LYS N N 29 117.474 118.973 -1.499 1
1 353 . 3 1 1 A 30 30 VAL H H 30 7.591 7.700 -0.109 1
1 354 . 3 1 1 A 30 30 VAL HA H 30 3.503 3.390 0.113 1
1 362 . 3 1 1 A 30 30 VAL C C 30 178.389 177.753 0.636 1
1 363 . 3 1 1 A 30 30 VAL CA C 30 65.640 65.991 -0.351 1
1 364 . 3 1 1 A 30 30 VAL CB C 30 31.644 31.765 -0.121 1
1 367 . 3 1 1 A 30 30 VAL N N 30 121.749 120.605 1.144 1
1 368 . 3 1 1 A 31 31 LEU H H 31 8.333 8.218 0.115 1
1 369 . 3 1 1 A 31 31 LEU HA H 31 4.074 4.118 -0.044 1
1 379 . 3 1 1 A 31 31 LEU C C 31 177.780 179.170 -1.390 1
1 380 . 3 1 1 A 31 31 LEU CA C 31 58.157 58.500 -0.343 1
1 381 . 3 1 1 A 31 31 LEU CB C 31 42.230 41.699 0.531 1
1 385 . 3 1 1 A 31 31 LEU N N 31 120.901 119.020 1.881 1
1 386 . 3 1 1 A 32 32 LYS H H 32 8.562 7.899 0.663 1
1 387 . 3 1 1 A 32 32 LYS HA H 32 3.290 3.819 -0.529 1
1 395 . 3 1 1 A 32 32 LYS C C 32 178.037 178.769 -0.732 1
1 396 . 3 1 1 A 32 32 LYS CA C 32 58.911 59.436 -0.525 1
1 397 . 3 1 1 A 32 32 LYS CB C 32 31.605 31.179 0.426 1
1 401 . 3 1 1 A 32 32 LYS N N 32 119.075 119.087 -0.012 1
1 402 . 3 1 1 A 33 33 GLY H H 33 7.694 7.905 -0.211 1
1 403 . 3 1 1 A 33 33 GLY HA2 H 33 3.949 3.576 0.373 1
1 404 . 3 1 1 A 33 33 GLY HA3 H 33 3.826 3.654 0.172 1
1 405 . 3 1 1 A 33 33 GLY C C 33 177.101 176.573 0.528 1
1 406 . 3 1 1 A 33 33 GLY CA C 33 46.928 47.062 -0.134 1
1 407 . 3 1 1 A 33 33 GLY N N 33 105.282 106.962 -1.680 1
1 408 . 3 1 1 A 34 34 TYR H H 34 8.015 7.666 0.349 1
1 409 . 3 1 1 A 34 34 TYR HA H 34 4.558 4.695 -0.137 1
1 416 . 3 1 1 A 34 34 TYR C C 34 179.611 178.088 1.523 1
1 417 . 3 1 1 A 34 34 TYR CA C 34 59.349 59.931 -0.582 1
1 418 . 3 1 1 A 34 34 TYR CB C 34 37.344 38.158 -0.814 1
1 423 . 3 1 1 A 34 34 TYR N N 34 121.781 121.912 -0.131 1
1 424 . 3 1 1 A 35 35 LEU H H 35 8.689 7.988 0.701 1
1 425 . 3 1 1 A 35 35 LEU HA H 35 3.977 3.900 0.077 1
1 435 . 3 1 1 A 35 35 LEU C C 35 177.081 179.312 -2.231 1
1 436 . 3 1 1 A 35 35 LEU CA C 35 59.155 58.499 0.656 1
1 437 . 3 1 1 A 35 35 LEU CB C 35 41.103 41.849 -0.746 1
1 441 . 3 1 1 A 35 35 LEU N N 35 120.392 120.528 -0.136 1
1 442 . 3 1 1 A 36 36 ASN H H 36 8.721 8.433 0.288 1
1 443 . 3 1 1 A 36 36 ASN HA H 36 4.435 4.448 -0.013 1
1 448 . 3 1 1 A 36 36 ASN C C 36 176.792 177.507 -0.715 1
1 449 . 3 1 1 A 36 36 ASN CA C 36 55.642 56.016 -0.374 1
1 450 . 3 1 1 A 36 36 ASN CB C 36 38.319 38.066 0.253 1
1 451 . 3 1 1 A 36 36 ASN N N 36 114.623 117.418 -2.795 1
1 453 . 3 1 1 A 37 37 SER H H 37 8.511 7.972 0.539 1
1 454 . 3 1 1 A 37 37 SER HA H 37 4.642 4.368 0.274 1
1 457 . 3 1 1 A 37 37 SER C C 37 175.039 175.582 -0.543 1
1 458 . 3 1 1 A 37 37 SER CA C 37 59.825 61.591 -1.766 1
1 459 . 3 1 1 A 37 37 SER CB C 37 64.056 63.811 0.245 1
1 460 . 3 1 1 A 37 37 SER N N 37 110.941 116.445 -5.504 1
1 461 . 3 1 1 A 38 38 ARG H H 38 7.242 7.944 -0.702 1
1 462 . 3 1 1 A 38 38 ARG HA H 38 4.919 4.443 0.476 1
1 469 . 3 1 1 A 38 38 ARG C C 38 176.514 178.330 -1.816 1
1 470 . 3 1 1 A 38 38 ARG CA C 38 56.687 57.967 -1.280 1
1 471 . 3 1 1 A 38 38 ARG CB C 38 32.434 31.098 1.336 1
1 474 . 3 1 1 A 38 38 ARG N N 38 117.062 120.027 -2.965 1
1 475 . 3 1 1 A 39 39 ILE H H 39 8.462 7.932 0.530 1
1 476 . 3 1 1 A 39 39 ILE HA H 39 3.618 3.872 -0.254 1
1 486 . 3 1 1 A 39 39 ILE C C 39 176.267 178.671 -2.404 1
1 487 . 3 1 1 A 39 39 ILE CA C 39 66.134 64.796 1.338 1
1 488 . 3 1 1 A 39 39 ILE CB C 39 39.787 36.931 2.856 1
1 492 . 3 1 1 A 39 39 ILE N N 39 121.214 120.565 0.649 1
1 493 . 3 1 1 A 40 40 ILE H H 40 9.339 7.979 1.360 1
1 494 . 3 1 1 A 40 40 ILE HA H 40 3.401 3.747 -0.346 1
1 504 . 3 1 1 A 40 40 ILE CA C 40 67.844 66.367 1.477 1
1 505 . 3 1 1 A 40 40 ILE CB C 40 34.406 35.739 -1.333 1
1 509 . 3 1 1 A 40 40 ILE N N 40 119.695 122.069 -2.374 1
1 510 . 3 1 1 A 41 41 PRO HA H 41 4.314 4.438 -0.124 1
1 517 . 3 1 1 A 41 41 PRO C C 41 177.418 177.910 -0.492 1
1 518 . 3 1 1 A 41 41 PRO CA C 41 65.912 64.801 1.111 1
1 519 . 3 1 1 A 41 41 PRO CB C 41 30.686 31.478 -0.792 1
1 522 . 3 1 1 A 42 42 SER H H 42 6.857 8.387 -1.530 1
1 523 . 3 1 1 A 42 42 SER HA H 42 4.558 4.524 0.034 1
1 526 . 3 1 1 A 42 42 SER C C 42 174.813 176.116 -1.303 1
1 527 . 3 1 1 A 42 42 SER CA C 42 61.279 61.014 0.265 1
1 528 . 3 1 1 A 42 42 SER CB C 42 64.285 64.192 0.093 1
1 529 . 3 1 1 A 42 42 SER N N 42 108.994 112.336 -3.342 1
1 530 . 3 1 1 A 43 43 LEU H H 43 8.230 7.944 0.286 1
1 531 . 3 1 1 A 43 43 LEU HA H 43 4.572 4.442 0.130 1
1 541 . 3 1 1 A 43 43 LEU C C 43 177.301 178.514 -1.213 1
1 542 . 3 1 1 A 43 43 LEU CA C 43 54.113 54.568 -0.455 1
1 543 . 3 1 1 A 43 43 LEU CB C 43 44.800 42.490 2.310 1
1 547 . 3 1 1 A 43 43 LEU N N 43 118.715 119.493 -0.778 1
1 548 . 3 1 1 A 44 44 GLY H H 44 8.498 8.371 0.127 1
1 549 . 3 1 1 A 44 44 GLY HA2 H 44 4.010 3.646 0.364 1
1 550 . 3 1 1 A 44 44 GLY HA3 H 44 3.613 3.676 -0.063 1
1 551 . 3 1 1 A 44 44 GLY C C 44 174.178 175.629 -1.451 1
1 552 . 3 1 1 A 44 44 GLY CA C 44 46.271 47.316 -1.045 1
1 553 . 3 1 1 A 44 44 GLY N N 44 105.371 107.563 -2.192 1
1 554 . 3 1 1 A 45 45 ASN H H 45 8.385 7.500 0.885 1
1 555 . 3 1 1 A 45 45 ASN HA H 45 4.789 4.813 -0.024 1
1 560 . 3 1 1 A 45 45 ASN C C 45 175.386 176.067 -0.681 1
1 561 . 3 1 1 A 45 45 ASN CA C 45 53.144 53.584 -0.440 1
1 562 . 3 1 1 A 45 45 ASN CB C 45 37.928 38.644 -0.716 1
1 563 . 3 1 1 A 45 45 ASN N N 45 114.387 118.204 -3.817 1
1 565 . 3 1 1 A 46 46 ILE H H 46 7.465 7.397 0.068 1
1 566 . 3 1 1 A 46 46 ILE HA H 46 3.856 4.144 -0.288 1
1 576 . 3 1 1 A 46 46 ILE C C 46 175.997 176.595 -0.598 1
1 577 . 3 1 1 A 46 46 ILE CA C 46 60.853 60.878 -0.025 1
1 578 . 3 1 1 A 46 46 ILE CB C 46 38.042 38.548 -0.506 1
1 582 . 3 1 1 A 46 46 ILE N N 46 123.998 120.545 3.453 1
1 583 . 3 1 1 A 47 47 LYS H H 47 8.717 8.744 -0.027 1
1 584 . 3 1 1 A 47 47 LYS HA H 47 4.249 4.345 -0.096 1
1 591 . 3 1 1 A 47 47 LYS C C 47 177.583 177.838 -0.255 1
1 592 . 3 1 1 A 47 47 LYS CA C 47 56.320 56.688 -0.368 1
1 593 . 3 1 1 A 47 47 LYS CB C 47 30.393 32.990 -2.597 1
1 596 . 3 1 1 A 47 47 LYS N N 47 126.114 124.287 1.827 1
1 597 . 3 1 1 A 48 48 LEU H H 48 8.323 8.263 0.060 1
1 598 . 3 1 1 A 48 48 LEU HA H 48 3.691 4.107 -0.416 1
1 608 . 3 1 1 A 48 48 LEU C C 48 177.274 178.462 -1.188 1
1 609 . 3 1 1 A 48 48 LEU CA C 48 58.443 58.379 0.064 1
1 610 . 3 1 1 A 48 48 LEU CB C 48 42.282 41.281 1.001 1
1 614 . 3 1 1 A 48 48 LEU N N 48 125.857 125.895 -0.038 1
1 615 . 3 1 1 A 49 49 ALA H H 49 8.929 7.596 1.333 1
1 616 . 3 1 1 A 49 49 ALA HA H 49 4.067 4.041 0.026 1
1 620 . 3 1 1 A 49 49 ALA C C 49 177.468 178.345 -0.877 1
1 621 . 3 1 1 A 49 49 ALA CA C 49 53.092 54.426 -1.334 1
1 622 . 3 1 1 A 49 49 ALA CB C 49 18.562 18.438 0.124 1
1 623 . 3 1 1 A 49 49 ALA N N 49 115.543 120.492 -4.949 1
1 624 . 3 1 1 A 50 50 LYS H H 50 7.684 7.466 0.218 1
1 625 . 3 1 1 A 50 50 LYS HA H 50 4.395 4.221 0.174 1
1 634 . 3 1 1 A 50 50 LYS C C 50 174.958 176.902 -1.944 1
1 635 . 3 1 1 A 50 50 LYS CA C 50 53.977 57.202 -3.225 1
1 636 . 3 1 1 A 50 50 LYS CB C 50 32.645 32.765 -0.120 1
1 640 . 3 1 1 A 50 50 LYS N N 50 114.788 115.084 -0.296 1
1 641 . 3 1 1 A 51 51 LEU H H 51 6.776 6.937 -0.161 1
1 642 . 3 1 1 A 51 51 LEU HA H 51 4.569 4.129 0.440 1
1 652 . 3 1 1 A 51 51 LEU C C 51 177.953 175.592 2.361 1
1 653 . 3 1 1 A 51 51 LEU CA C 51 55.318 54.779 0.539 1
1 654 . 3 1 1 A 51 51 LEU CB C 51 43.182 40.414 2.768 1
1 658 . 3 1 1 A 51 51 LEU N N 51 121.408 121.553 -0.145 1
1 659 . 3 1 1 A 52 52 THR H H 52 10.680 7.706 2.974 1
1 660 . 3 1 1 A 52 52 THR HA H 52 4.938 4.545 0.393 1
1 665 . 3 1 1 A 52 52 THR C C 52 175.553 174.654 0.899 1
1 666 . 3 1 1 A 52 52 THR CA C 52 59.740 59.705 0.035 1
1 667 . 3 1 1 A 52 52 THR CB C 52 73.557 71.059 2.498 1
1 669 . 3 1 1 A 52 52 THR N N 52 119.481 119.142 0.339 1
1 670 . 3 1 1 A 53 53 SER H H 53 9.278 9.102 0.176 1
1 671 . 3 1 1 A 53 53 SER HA H 53 4.261 4.132 0.129 1
1 674 . 3 1 1 A 53 53 SER C C 53 176.990 176.305 0.685 1
1 675 . 3 1 1 A 53 53 SER CA C 53 61.025 61.097 -0.072 1
1 676 . 3 1 1 A 53 53 SER CB C 53 62.312 63.024 -0.712 1
1 677 . 3 1 1 A 53 53 SER N N 53 116.343 121.822 -5.479 1
1 678 . 3 1 1 A 54 54 LEU H H 54 7.808 8.010 -0.202 1
1 679 . 3 1 1 A 54 54 LEU HA H 54 4.229 4.063 0.166 1
1 688 . 3 1 1 A 54 54 LEU C C 54 178.505 178.604 -0.099 1
1 689 . 3 1 1 A 54 54 LEU CA C 54 57.719 58.140 -0.421 1
1 690 . 3 1 1 A 54 54 LEU CB C 54 40.997 41.765 -0.768 1
1 694 . 3 1 1 A 54 54 LEU N N 54 126.055 122.876 3.179 1
1 695 . 3 1 1 A 55 55 HIS H H 55 7.798 8.363 -0.565 1
1 696 . 3 1 1 A 55 55 HIS HA H 55 4.311 4.287 0.024 1
1 701 . 3 1 1 A 55 55 HIS C C 55 180.044 177.615 2.429 1
1 702 . 3 1 1 A 55 55 HIS CA C 55 60.583 59.513 1.070 1
1 703 . 3 1 1 A 55 55 HIS CB C 55 31.445 29.655 1.790 1
1 706 . 3 1 1 A 55 55 HIS N N 55 118.683 117.355 1.328 1
1 707 . 3 1 1 A 56 56 MET H H 56 7.375 7.950 -0.575 1
1 708 . 3 1 1 A 56 56 MET HA H 56 4.513 4.028 0.485 1
1 716 . 3 1 1 A 56 56 MET C C 56 177.169 178.568 -1.399 1
1 717 . 3 1 1 A 56 56 MET CA C 56 55.823 59.342 -3.519 1
1 718 . 3 1 1 A 56 56 MET CB C 56 31.303 33.406 -2.103 1
1 721 . 3 1 1 A 56 56 MET N N 56 114.530 117.750 -3.220 1
1 722 . 3 1 1 A 57 57 GLN H H 57 8.387 8.300 0.087 1
1 723 . 3 1 1 A 57 57 GLN HA H 57 3.981 3.993 -0.012 1
1 730 . 3 1 1 A 57 57 GLN C C 57 178.033 178.509 -0.476 1
1 731 . 3 1 1 A 57 57 GLN CA C 57 57.922 59.202 -1.280 1
1 732 . 3 1 1 A 57 57 GLN CB C 57 29.012 28.439 0.573 1
1 734 . 3 1 1 A 57 57 GLN N N 57 120.713 119.473 1.240 1
1 736 . 3 1 1 A 58 58 ASN H H 58 8.765 8.338 0.427 1
1 737 . 3 1 1 A 58 58 ASN HA H 58 4.539 4.514 0.025 1
1 742 . 3 1 1 A 58 58 ASN C C 58 178.084 177.548 0.536 1
1 743 . 3 1 1 A 58 58 ASN CA C 58 55.345 56.090 -0.745 1
1 744 . 3 1 1 A 58 58 ASN CB C 58 36.924 38.534 -1.610 1
1 745 . 3 1 1 A 58 58 ASN N N 58 117.390 117.782 -0.392 1
1 747 . 3 1 1 A 59 59 TYR H H 59 8.239 7.766 0.473 1
1 748 . 3 1 1 A 59 59 TYR HA H 59 4.586 4.162 0.424 1
1 755 . 3 1 1 A 59 59 TYR C C 59 178.015 177.010 1.005 1
1 756 . 3 1 1 A 59 59 TYR CA C 59 60.779 61.530 -0.751 1
1 757 . 3 1 1 A 59 59 TYR CB C 59 38.047 38.645 -0.598 1
1 762 . 3 1 1 A 59 59 TYR N N 59 122.335 123.218 -0.883 1
1 763 . 3 1 1 A 60 60 VAL H H 60 8.416 8.551 -0.135 1
1 764 . 3 1 1 A 60 60 VAL HA H 60 3.244 3.538 -0.294 1
1 772 . 3 1 1 A 60 60 VAL C C 60 177.309 178.244 -0.935 1
1 773 . 3 1 1 A 60 60 VAL CA C 60 67.022 66.580 0.442 1
1 774 . 3 1 1 A 60 60 VAL CB C 60 30.929 31.475 -0.546 1
1 777 . 3 1 1 A 60 60 VAL N N 60 119.842 119.538 0.304 1
1 778 . 3 1 1 A 61 61 ASN H H 61 8.264 8.153 0.111 1
1 779 . 3 1 1 A 61 61 ASN HA H 61 4.305 4.461 -0.156 1
1 784 . 3 1 1 A 61 61 ASN C C 61 177.263 177.961 -0.698 1
1 785 . 3 1 1 A 61 61 ASN CA C 61 55.548 56.342 -0.794 1
1 786 . 3 1 1 A 61 61 ASN CB C 61 36.645 37.576 -0.931 1
1 787 . 3 1 1 A 61 61 ASN N N 61 119.103 119.846 -0.743 1
1 789 . 3 1 1 A 62 62 SER H H 62 8.143 7.744 0.399 1
1 790 . 3 1 1 A 62 62 SER HA H 62 4.343 4.269 0.074 1
1 793 . 3 1 1 A 62 62 SER C C 62 176.409 176.594 -0.185 1
1 794 . 3 1 1 A 62 62 SER CA C 62 61.612 62.033 -0.421 1
1 795 . 3 1 1 A 62 62 SER CB C 62 62.219 62.650 -0.431 1
1 796 . 3 1 1 A 62 62 SER N N 62 118.254 116.289 1.965 1
1 797 . 3 1 1 A 63 63 LEU H H 63 7.664 7.892 -0.228 1
1 798 . 3 1 1 A 63 63 LEU HA H 63 4.003 3.869 0.134 1
1 808 . 3 1 1 A 63 63 LEU C C 63 178.748 178.834 -0.086 1
1 809 . 3 1 1 A 63 63 LEU CA C 63 57.171 57.894 -0.723 1
1 810 . 3 1 1 A 63 63 LEU CB C 63 41.134 41.180 -0.046 1
1 814 . 3 1 1 A 63 63 LEU N N 63 123.812 121.541 2.271 1
1 815 . 3 1 1 A 64 64 ARG H H 64 7.969 7.628 0.341 1
1 816 . 3 1 1 A 64 64 ARG HA H 64 4.038 3.925 0.113 1
1 824 . 3 1 1 A 64 64 ARG C C 64 180.797 178.689 2.108 1
1 825 . 3 1 1 A 64 64 ARG CA C 64 58.598 59.241 -0.643 1
1 826 . 3 1 1 A 64 64 ARG CB C 64 28.849 29.861 -1.012 1
1 829 . 3 1 1 A 64 64 ARG N N 64 120.376 120.286 0.090 1
1 831 . 3 1 1 A 65 65 ASP H H 65 8.465 8.072 0.393 1
1 832 . 3 1 1 A 65 65 ASP HA H 65 4.408 4.400 0.008 1
1 835 . 3 1 1 A 65 65 ASP C C 65 177.336 179.085 -1.749 1
1 836 . 3 1 1 A 65 65 ASP CA C 65 56.957 56.874 0.083 1
1 837 . 3 1 1 A 65 65 ASP CB C 65 39.602 40.062 -0.460 1
1 838 . 3 1 1 A 65 65 ASP N N 65 122.402 119.814 2.588 1
1 839 . 3 1 1 A 66 66 GLU H H 66 7.703 7.755 -0.052 1
1 840 . 3 1 1 A 66 66 GLU HA H 66 4.213 4.247 -0.034 1
1 845 . 3 1 1 A 66 66 GLU C C 66 176.586 177.325 -0.739 1
1 846 . 3 1 1 A 66 66 GLU CA C 66 56.974 56.440 0.534 1
1 847 . 3 1 1 A 66 66 GLU CB C 66 29.821 29.858 -0.037 1
1 849 . 3 1 1 A 66 66 GLU N N 66 119.076 116.481 2.595 1
1 850 . 3 1 1 A 67 67 GLY H H 67 7.861 7.864 -0.003 1
1 851 . 3 1 1 A 67 67 GLY HA2 H 67 4.269 3.880 0.389 1
1 852 . 3 1 1 A 67 67 GLY HA3 H 67 3.731 3.885 -0.154 1
1 853 . 3 1 1 A 67 67 GLY C C 67 174.614 174.965 -0.351 1
1 854 . 3 1 1 A 67 67 GLY CA C 67 44.608 46.208 -1.600 1
1 855 . 3 1 1 A 67 67 GLY N N 67 105.730 109.388 -3.658 1
1 856 . 3 1 1 A 68 68 LEU H H 68 7.324 7.803 -0.479 1
1 857 . 3 1 1 A 68 68 LEU HA H 68 4.257 4.151 0.106 1
1 867 . 3 1 1 A 68 68 LEU C C 68 176.136 176.753 -0.617 1
1 868 . 3 1 1 A 68 68 LEU CA C 68 55.659 54.794 0.865 1
1 869 . 3 1 1 A 68 68 LEU CB C 68 41.874 41.953 -0.079 1
1 873 . 3 1 1 A 68 68 LEU N N 68 121.062 121.467 -0.405 1
1 874 . 3 1 1 A 69 69 LYS H H 69 8.368 8.461 -0.093 1
1 875 . 3 1 1 A 69 69 LYS HA H 69 4.281 4.240 0.041 1
1 884 . 3 1 1 A 69 69 LYS C C 69 177.940 177.775 0.165 1
1 885 . 3 1 1 A 69 69 LYS CA C 69 55.412 56.413 -1.001 1
1 886 . 3 1 1 A 69 69 LYS CB C 69 32.761 32.952 -0.191 1
1 890 . 3 1 1 A 69 69 LYS N N 69 120.120 123.282 -3.162 1
1 891 . 3 1 1 A 70 70 ARG H H 70 9.095 8.775 0.320 1
1 892 . 3 1 1 A 70 70 ARG HA H 70 3.684 4.080 -0.396 1
1 900 . 3 1 1 A 70 70 ARG C C 70 177.712 178.579 -0.867 1
1 901 . 3 1 1 A 70 70 ARG CA C 70 60.216 58.040 2.176 1
1 902 . 3 1 1 A 70 70 ARG CB C 70 29.539 29.660 -0.121 1
1 905 . 3 1 1 A 70 70 ARG N N 70 123.339 120.422 2.917 1
1 907 . 3 1 1 A 71 71 GLY H H 71 8.985 8.327 0.658 1
1 908 . 3 1 1 A 71 71 GLY HA2 H 71 3.932 3.590 0.342 1
1 909 . 3 1 1 A 71 71 GLY HA3 H 71 3.905 3.594 0.311 1
1 910 . 3 1 1 A 71 71 GLY C C 71 176.324 175.532 0.792 1
1 911 . 3 1 1 A 71 71 GLY CA C 71 46.752 47.409 -0.657 1
1 912 . 3 1 1 A 71 71 GLY N N 71 104.509 109.725 -5.216 1
1 913 . 3 1 1 A 72 72 THR H H 72 7.295 8.145 -0.850 1
1 914 . 3 1 1 A 72 72 THR HA H 72 4.014 3.893 0.121 1
1 919 . 3 1 1 A 72 72 THR C C 72 175.135 176.155 -1.020 1
1 920 . 3 1 1 A 72 72 THR CA C 72 65.848 66.505 -0.657 1
1 921 . 3 1 1 A 72 72 THR CB C 72 68.160 68.222 -0.062 1
1 923 . 3 1 1 A 72 72 THR N N 72 118.617 117.341 1.276 1
1 924 . 3 1 1 A 73 73 ILE H H 73 7.883 7.907 -0.024 1
1 925 . 3 1 1 A 73 73 ILE HA H 73 3.258 3.550 -0.292 1
1 935 . 3 1 1 A 73 73 ILE C C 73 177.060 178.119 -1.059 1
1 936 . 3 1 1 A 73 73 ILE CA C 73 66.561 65.494 1.067 1
1 937 . 3 1 1 A 73 73 ILE CB C 73 37.339 37.495 -0.156 1
1 941 . 3 1 1 A 73 73 ILE N N 73 121.692 121.607 0.085 1
1 942 . 3 1 1 A 74 74 GLU H H 74 8.723 8.005 0.718 1
1 943 . 3 1 1 A 74 74 GLU HA H 74 3.807 3.918 -0.111 1
1 948 . 3 1 1 A 74 74 GLU C C 74 178.319 178.730 -0.411 1
1 949 . 3 1 1 A 74 74 GLU CA C 74 59.637 59.917 -0.280 1
1 950 . 3 1 1 A 74 74 GLU CB C 74 29.257 29.016 0.241 1
1 952 . 3 1 1 A 74 74 GLU N N 74 117.701 120.946 -3.245 1
1 953 . 3 1 1 A 75 75 LYS H H 75 7.361 7.505 -0.144 1
1 954 . 3 1 1 A 75 75 LYS HA H 75 3.958 4.053 -0.095 1
1 963 . 3 1 1 A 75 75 LYS C C 75 178.554 179.381 -0.827 1
1 964 . 3 1 1 A 75 75 LYS CA C 75 59.764 59.316 0.448 1
1 965 . 3 1 1 A 75 75 LYS CB C 75 32.314 32.170 0.144 1
1 969 . 3 1 1 A 75 75 LYS N N 75 118.734 118.826 -0.092 1
1 970 . 3 1 1 A 76 76 ILE H H 76 7.713 7.320 0.393 1
1 971 . 3 1 1 A 76 76 ILE HA H 76 3.221 3.822 -0.601 1
1 981 . 3 1 1 A 76 76 ILE C C 76 177.504 178.332 -0.828 1
1 982 . 3 1 1 A 76 76 ILE CA C 76 65.796 64.603 1.193 1
1 983 . 3 1 1 A 76 76 ILE CB C 76 37.732 36.999 0.733 1
1 987 . 3 1 1 A 76 76 ILE N N 76 120.312 116.551 3.761 1
1 988 . 3 1 1 A 77 77 ILE H H 77 8.587 8.203 0.384 1
1 989 . 3 1 1 A 77 77 ILE HA H 77 3.778 3.635 0.143 1
1 999 . 3 1 1 A 77 77 ILE C C 77 177.074 177.793 -0.719 1
1 1000 . 3 1 1 A 77 77 ILE CA C 77 63.168 65.106 -1.938 1
1 1001 . 3 1 1 A 77 77 ILE CB C 77 36.617 37.160 -0.543 1
1 1005 . 3 1 1 A 77 77 ILE N N 77 118.978 121.263 -2.285 1
1 1006 . 3 1 1 A 78 78 LYS H H 78 8.050 7.867 0.183 1
1 1007 . 3 1 1 A 78 78 LYS HA H 78 3.925 3.983 -0.058 1
1 1016 . 3 1 1 A 78 78 LYS C C 78 178.291 179.194 -0.903 1
1 1017 . 3 1 1 A 78 78 LYS CA C 78 60.192 59.562 0.630 1
1 1018 . 3 1 1 A 78 78 LYS CB C 78 31.886 32.628 -0.742 1
1 1022 . 3 1 1 A 78 78 LYS N N 78 121.618 119.440 2.178 1
1 1023 . 3 1 1 A 79 79 VAL H H 79 7.619 7.589 0.030 1
1 1024 . 3 1 1 A 79 79 VAL HA H 79 3.846 3.702 0.144 1
1 1032 . 3 1 1 A 79 79 VAL C C 79 177.712 178.348 -0.636 1
1 1033 . 3 1 1 A 79 79 VAL CA C 79 66.494 66.409 0.085 1
1 1034 . 3 1 1 A 79 79 VAL CB C 79 31.298 31.665 -0.367 1
1 1037 . 3 1 1 A 79 79 VAL N N 79 120.254 119.587 0.667 1
1 1038 . 3 1 1 A 80 80 ILE H H 80 7.885 8.244 -0.359 1
1 1039 . 3 1 1 A 80 80 ILE HA H 80 3.367 3.792 -0.425 1
1 1049 . 3 1 1 A 80 80 ILE C C 80 179.892 177.716 2.176 1
1 1050 . 3 1 1 A 80 80 ILE CA C 80 65.343 65.230 0.113 1
1 1051 . 3 1 1 A 80 80 ILE CB C 80 38.129 37.370 0.759 1
1 1055 . 3 1 1 A 80 80 ILE N N 80 119.666 120.616 -0.950 1
1 1056 . 3 1 1 A 81 81 ARG H H 81 9.384 8.605 0.779 1
1 1057 . 3 1 1 A 81 81 ARG HA H 81 3.834 3.907 -0.073 1
1 1065 . 3 1 1 A 81 81 ARG C C 81 178.204 179.067 -0.863 1
1 1066 . 3 1 1 A 81 81 ARG CA C 81 60.560 59.904 0.656 1
1 1067 . 3 1 1 A 81 81 ARG CB C 81 30.196 30.052 0.144 1
1 1070 . 3 1 1 A 81 81 ARG N N 81 121.030 119.906 1.124 1
1 1072 . 3 1 1 A 82 82 ASN H H 82 8.773 8.008 0.765 1
1 1073 . 3 1 1 A 82 82 ASN HA H 82 4.587 4.636 -0.049 1
1 1078 . 3 1 1 A 82 82 ASN C C 82 178.300 178.001 0.299 1
1 1079 . 3 1 1 A 82 82 ASN CA C 82 56.160 56.168 -0.008 1
1 1080 . 3 1 1 A 82 82 ASN CB C 82 38.464 38.861 -0.397 1
1 1081 . 3 1 1 A 82 82 ASN N N 82 118.483 118.466 0.017 1
1 1083 . 3 1 1 A 83 83 SER H H 83 8.526 7.682 0.844 1
1 1084 . 3 1 1 A 83 83 SER HA H 83 2.765 3.101 -0.336 1
1 1087 . 3 1 1 A 83 83 SER C C 83 176.386 176.404 -0.018 1
1 1088 . 3 1 1 A 83 83 SER CA C 83 61.245 62.015 -0.770 1
1 1089 . 3 1 1 A 83 83 SER CB C 83 61.287 62.802 -1.515 1
1 1090 . 3 1 1 A 83 83 SER N N 83 118.286 116.174 2.112 1
1 1091 . 3 1 1 A 84 84 LEU H H 84 7.782 8.377 -0.595 1
1 1092 . 3 1 1 A 84 84 LEU HA H 84 4.221 4.047 0.174 1
1 1102 . 3 1 1 A 84 84 LEU C C 84 177.846 179.504 -1.658 1
1 1103 . 3 1 1 A 84 84 LEU CA C 84 57.166 57.868 -0.702 1
1 1104 . 3 1 1 A 84 84 LEU CB C 84 40.520 41.044 -0.524 1
1 1108 . 3 1 1 A 84 84 LEU N N 84 127.445 121.066 6.379 1
1 1109 . 3 1 1 A 85 85 GLU H H 85 8.264 8.461 -0.197 1
1 1110 . 3 1 1 A 85 85 GLU HA H 85 3.981 3.963 0.018 1
1 1115 . 3 1 1 A 85 85 GLU C C 85 179.288 179.246 0.042 1
1 1116 . 3 1 1 A 85 85 GLU CA C 85 59.025 59.763 -0.738 1
1 1117 . 3 1 1 A 85 85 GLU CB C 85 29.182 29.213 -0.031 1
1 1119 . 3 1 1 A 85 85 GLU N N 85 121.538 120.402 1.136 1
1 1120 . 3 1 1 A 86 86 HIS H H 86 7.683 8.092 -0.409 1
1 1121 . 3 1 1 A 86 86 HIS HA H 86 4.573 4.312 0.261 1
1 1125 . 3 1 1 A 86 86 HIS C C 86 175.484 177.636 -2.152 1
1 1126 . 3 1 1 A 86 86 HIS CA C 86 58.940 59.497 -0.557 1
1 1127 . 3 1 1 A 86 86 HIS CB C 86 29.267 30.154 -0.887 1
1 1129 . 3 1 1 A 86 86 HIS N N 86 117.087 120.339 -3.252 1
1 1130 . 3 1 1 A 87 87 ALA H H 87 7.197 8.222 -1.025 1
1 1131 . 3 1 1 A 87 87 ALA HA H 87 3.925 3.856 0.069 1
1 1135 . 3 1 1 A 87 87 ALA C C 87 179.038 180.314 -1.276 1
1 1136 . 3 1 1 A 87 87 ALA CA C 87 54.863 55.006 -0.143 1
1 1137 . 3 1 1 A 87 87 ALA CB C 87 17.034 18.076 -1.042 1
1 1138 . 3 1 1 A 87 87 ALA N N 87 121.510 120.843 0.667 1
1 1139 . 3 1 1 A 88 88 ILE H H 88 7.819 7.563 0.256 1
1 1140 . 3 1 1 A 88 88 ILE HA H 88 4.067 3.900 0.167 1
1 1150 . 3 1 1 A 88 88 ILE C C 88 180.846 177.371 3.475 1
1 1151 . 3 1 1 A 88 88 ILE CA C 88 64.021 65.116 -1.095 1
1 1152 . 3 1 1 A 88 88 ILE CB C 88 37.557 37.207 0.350 1
1 1156 . 3 1 1 A 88 88 ILE N N 88 120.898 119.308 1.590 1
1 1157 . 3 1 1 A 89 89 ASP H H 89 7.808 8.125 -0.317 1
1 1158 . 3 1 1 A 89 89 ASP HA H 89 4.437 4.314 0.123 1
1 1161 . 3 1 1 A 89 89 ASP C C 89 178.033 177.971 0.062 1
1 1162 . 3 1 1 A 89 89 ASP CA C 89 57.343 57.650 -0.307 1
1 1163 . 3 1 1 A 89 89 ASP CB C 89 39.689 41.749 -2.060 1
1 1164 . 3 1 1 A 89 89 ASP N N 89 125.174 121.849 3.325 1
1 1165 . 3 1 1 A 90 90 LEU H H 90 7.607 7.655 -0.048 1
1 1166 . 3 1 1 A 90 90 LEU HA H 90 4.198 4.185 0.013 1
1 1176 . 3 1 1 A 90 90 LEU C C 90 175.416 175.842 -0.426 1
1 1177 . 3 1 1 A 90 90 LEU CA C 90 54.755 54.956 -0.201 1
1 1178 . 3 1 1 A 90 90 LEU CB C 90 42.960 42.214 0.746 1
1 1182 . 3 1 1 A 90 90 LEU N N 90 117.576 117.324 0.252 1
1 1183 . 3 1 1 A 91 91 GLU H H 91 8.143 7.978 0.165 1
1 1184 . 3 1 1 A 91 91 GLU HA H 91 4.005 4.068 -0.063 1
1 1189 . 3 1 1 A 91 91 GLU C C 91 175.792 176.095 -0.303 1
1 1190 . 3 1 1 A 91 91 GLU CA C 91 57.202 57.525 -0.323 1
1 1191 . 3 1 1 A 91 91 GLU CB C 91 26.125 26.804 -0.679 1
1 1193 . 3 1 1 A 91 91 GLU N N 91 113.620 114.954 -1.334 1
1 1194 . 3 1 1 A 92 92 LEU H H 92 8.290 7.987 0.303 1
1 1195 . 3 1 1 A 92 92 LEU HA H 92 4.216 4.052 0.164 1
1 1205 . 3 1 1 A 92 92 LEU C C 92 176.622 176.966 -0.344 1
1 1206 . 3 1 1 A 92 92 LEU CA C 92 56.410 57.001 -0.591 1
1 1207 . 3 1 1 A 92 92 LEU CB C 92 43.378 42.513 0.865 1
1 1211 . 3 1 1 A 92 92 LEU N N 92 116.868 119.754 -2.886 1
1 1212 . 3 1 1 A 93 93 ILE H H 93 6.988 6.915 0.073 1
1 1213 . 3 1 1 A 93 93 ILE HA H 93 4.580 4.650 -0.070 1
1 1223 . 3 1 1 A 93 93 ILE C C 93 175.145 175.337 -0.192 1
1 1224 . 3 1 1 A 93 93 ILE CA C 93 58.707 58.728 -0.021 1
1 1225 . 3 1 1 A 93 93 ILE CB C 93 42.864 41.405 1.459 1
1 1229 . 3 1 1 A 93 93 ILE N N 93 107.565 113.726 -6.161 1
1 1230 . 3 1 1 A 94 94 THR H H 94 8.742 8.465 0.277 1
1 1231 . 3 1 1 A 94 94 THR HA H 94 4.489 4.629 -0.140 1
1 1236 . 3 1 1 A 94 94 THR C C 94 173.875 174.145 -0.270 1
1 1237 . 3 1 1 A 94 94 THR CA C 94 61.842 61.458 0.384 1
1 1238 . 3 1 1 A 94 94 THR CB C 94 69.972 69.739 0.233 1
1 1240 . 3 1 1 A 94 94 THR N N 94 107.904 112.609 -4.705 1
1 1241 . 3 1 1 A 95 95 LYS H H 95 7.294 7.419 -0.125 1
1 1242 . 3 1 1 A 95 95 LYS HA H 95 4.566 4.768 -0.202 1
1 1251 . 3 1 1 A 95 95 LYS C C 95 173.791 173.919 -0.128 1
1 1252 . 3 1 1 A 95 95 LYS CA C 95 54.533 55.857 -1.324 1
1 1253 . 3 1 1 A 95 95 LYS CB C 95 35.123 35.594 -0.471 1
1 1257 . 3 1 1 A 95 95 LYS N N 95 119.458 122.592 -3.134 1
1 1258 . 3 1 1 A 96 96 ASN H H 96 9.157 8.736 0.421 1
1 1259 . 3 1 1 A 96 96 ASN HA H 96 4.408 4.844 -0.436 1
1 1264 . 3 1 1 A 96 96 ASN C C 96 176.653 176.090 0.563 1
1 1265 . 3 1 1 A 96 96 ASN CA C 96 51.088 52.098 -1.010 1
1 1266 . 3 1 1 A 96 96 ASN CB C 96 37.292 38.285 -0.993 1
1 1267 . 3 1 1 A 96 96 ASN N N 96 121.031 124.752 -3.721 1
1 1269 . 3 1 1 A 97 97 VAL H H 97 8.193 8.507 -0.314 1
1 1270 . 3 1 1 A 97 97 VAL HA H 97 4.019 3.818 0.201 1
1 1278 . 3 1 1 A 97 97 VAL C C 97 175.089 177.102 -2.013 1
1 1279 . 3 1 1 A 97 97 VAL CA C 97 63.437 64.160 -0.723 1
1 1280 . 3 1 1 A 97 97 VAL CB C 97 29.934 31.354 -1.420 1
1 1283 . 3 1 1 A 97 97 VAL N N 97 118.839 123.010 -4.171 1
1 1284 . 3 1 1 A 98 98 ALA H H 98 7.994 7.750 0.244 1
1 1285 . 3 1 1 A 98 98 ALA HA H 98 5.108 4.167 0.941 1
1 1289 . 3 1 1 A 98 98 ALA C C 98 178.033 179.948 -1.915 1
1 1290 . 3 1 1 A 98 98 ALA CA C 98 50.342 53.967 -3.625 1
1 1291 . 3 1 1 A 98 98 ALA CB C 98 19.659 18.745 0.914 1
1 1292 . 3 1 1 A 98 98 ALA N N 98 121.031 124.619 -3.588 1
1 1293 . 3 1 1 A 99 99 ALA H H 99 7.347 7.890 -0.543 1
1 1294 . 3 1 1 A 99 99 ALA HA H 99 3.818 4.038 -0.220 1
1 1298 . 3 1 1 A 99 99 ALA C C 99 177.712 179.032 -1.320 1
1 1299 . 3 1 1 A 99 99 ALA CA C 99 55.117 54.761 0.356 1
1 1300 . 3 1 1 A 99 99 ALA CB C 99 18.879 18.443 0.436 1
1 1301 . 3 1 1 A 99 99 ALA N N 99 122.816 119.834 2.982 1
1 1302 . 3 1 1 A 100 100 LYS H H 100 8.190 7.870 0.320 1
1 1303 . 3 1 1 A 100 100 LYS HA H 100 4.483 4.337 0.146 1
1 1312 . 3 1 1 A 100 100 LYS C C 100 175.899 176.929 -1.030 1
1 1313 . 3 1 1 A 100 100 LYS CA C 100 54.231 57.628 -3.397 1
1 1314 . 3 1 1 A 100 100 LYS CB C 100 32.066 32.971 -0.905 1
1 1318 . 3 1 1 A 100 100 LYS N N 100 113.197 115.303 -2.106 1
1 1319 . 3 1 1 A 101 101 THR H H 101 7.128 7.742 -0.614 1
1 1320 . 3 1 1 A 101 101 THR HA H 101 3.834 4.335 -0.501 1
1 1325 . 3 1 1 A 101 101 THR C C 101 173.255 173.650 -0.395 1
1 1326 . 3 1 1 A 101 101 THR CA C 101 64.392 62.126 2.266 1
1 1327 . 3 1 1 A 101 101 THR CB C 101 69.160 68.151 1.009 1
1 1329 . 3 1 1 A 101 101 THR N N 101 118.368 116.236 2.132 1
1 1330 . 3 1 1 A 102 102 LYS H H 102 8.753 8.567 0.186 1
1 1331 . 3 1 1 A 102 102 LYS HA H 102 4.438 4.444 -0.006 1
1 1340 . 3 1 1 A 102 102 LYS C C 102 175.627 176.229 -0.602 1
1 1341 . 3 1 1 A 102 102 LYS CA C 102 55.117 56.130 -1.013 1
1 1342 . 3 1 1 A 102 102 LYS CB C 102 33.901 33.209 0.692 1
1 1346 . 3 1 1 A 102 102 LYS N N 102 126.513 126.672 -0.159 1
1 1347 . 3 1 1 A 103 103 LEU H H 103 8.602 8.141 0.461 1
1 1348 . 3 1 1 A 103 103 LEU HA H 103 4.486 4.405 0.081 1
1 1358 . 3 1 1 A 103 103 LEU CA C 103 52.233 53.152 -0.919 1
1 1359 . 3 1 1 A 103 103 LEU CB C 103 41.028 42.890 -1.862 1
1 1363 . 3 1 1 A 103 103 LEU N N 103 124.466 123.306 1.160 1
1 1364 . 3 1 1 A 104 104 PRO HA H 104 4.437 4.599 -0.162 1
1 1371 . 3 1 1 A 104 104 PRO C C 104 175.779 176.962 -1.183 1
1 1372 . 3 1 1 A 104 104 PRO CA C 104 62.322 62.992 -0.670 1
1 1373 . 3 1 1 A 104 104 PRO CB C 104 31.899 31.669 0.230 1
1 1376 . 3 1 1 A 105 105 LYS H H 105 8.460 8.439 0.021 1
1 1377 . 3 1 1 A 105 105 LYS HA H 105 4.154 4.398 -0.244 1
1 1386 . 3 1 1 A 105 105 LYS C C 105 175.998 177.173 -1.175 1
1 1387 . 3 1 1 A 105 105 LYS CA C 105 56.480 56.761 -0.281 1
1 1388 . 3 1 1 A 105 105 LYS CB C 105 32.909 32.872 0.037 1
1 1392 . 3 1 1 A 105 105 LYS N N 105 122.139 122.355 -0.216 1
1 1393 . 3 1 1 A 106 106 ALA H H 106 8.448 8.584 -0.136 1
1 1394 . 3 1 1 A 106 106 ALA HA H 106 4.309 4.714 -0.405 1
1 1398 . 3 1 1 A 106 106 ALA C C 106 176.828 176.818 0.010 1
1 1399 . 3 1 1 A 106 106 ALA CA C 106 51.862 50.911 0.951 1
1 1400 . 3 1 1 A 106 106 ALA CB C 106 19.323 20.172 -0.849 1
1 1401 . 3 1 1 A 106 106 ALA N N 106 125.278 124.457 0.821 1
1 1402 . 3 1 1 A 107 107 ASP H H 107 8.428 7.715 0.713 1
1 1403 . 3 1 1 A 107 107 ASP HA H 107 4.574 4.983 -0.409 1
1 1406 . 3 1 1 A 107 107 ASP C C 107 175.951 175.092 0.859 1
1 1407 . 3 1 1 A 107 107 ASP CA C 107 54.214 52.923 1.291 1
1 1408 . 3 1 1 A 107 107 ASP CB C 107 41.141 43.294 -2.153 1
1 1409 . 3 1 1 A 107 107 ASP N N 107 120.771 117.465 3.306 1
1 1410 . 3 1 1 A 108 108 LYS H H 108 8.329 8.741 -0.412 1
1 1411 . 3 1 1 A 108 108 LYS HA H 108 4.203 4.952 -0.749 1
1 1420 . 3 1 1 A 108 108 LYS C C 108 176.483 175.567 0.916 1
1 1421 . 3 1 1 A 108 108 LYS CA C 108 56.831 55.304 1.527 1
1 1422 . 3 1 1 A 108 108 LYS CB C 108 32.648 33.990 -1.342 1
1 1426 . 3 1 1 A 108 108 LYS N N 108 120.727 117.644 3.083 1
1 1427 . 3 1 1 A 109 109 GLU H H 109 8.447 8.718 -0.271 1
1 1428 . 3 1 1 A 109 109 GLU HA H 109 4.215 4.363 -0.148 1
1 1433 . 3 1 1 A 109 109 GLU C C 109 176.513 176.733 -0.220 1
1 1434 . 3 1 1 A 109 109 GLU CA C 109 56.936 56.221 0.715 1
1 1435 . 3 1 1 A 109 109 GLU CB C 109 29.833 30.535 -0.702 1
1 1437 . 3 1 1 A 109 109 GLU N N 109 121.471 125.724 -4.253 1
1 1438 . 3 1 1 A 110 110 GLU H H 110 8.352 8.793 -0.441 1
1 1439 . 3 1 1 A 110 110 GLU HA H 110 4.233 4.369 -0.136 1
1 1444 . 3 1 1 A 110 110 GLU C C 110 176.439 176.002 0.437 1
1 1445 . 3 1 1 A 110 110 GLU CA C 110 56.681 55.734 0.947 1
1 1446 . 3 1 1 A 110 110 GLU CB C 110 29.860 28.684 1.176 1
1 1448 . 3 1 1 A 110 110 GLU N N 110 121.559 121.765 -0.206 1
1 1449 . 3 1 1 A 111 111 LEU H H 111 8.145 7.973 0.172 1
1 1450 . 3 1 1 A 111 111 LEU HA H 111 4.251 3.968 0.283 1
1 1460 . 3 1 1 A 111 111 LEU C C 111 177.306 178.749 -1.443 1
1 1461 . 3 1 1 A 111 111 LEU CA C 111 55.277 58.230 -2.953 1
1 1462 . 3 1 1 A 111 111 LEU CB C 111 42.054 41.632 0.422 1
1 1466 . 3 1 1 A 111 111 LEU N N 111 122.181 126.689 -4.508 1
1 1467 . 3 1 1 A 112 112 GLU H H 112 8.212 8.277 -0.065 1
1 1468 . 3 1 1 A 112 112 GLU N N 112 120.291 120.220 0.071 1
1 1469 . 3 1 1 A 114 114 HIS C C 114 176.070 173.882 2.188 1
1 1470 . 3 1 1 A 116 116 HIS H H 116 8.227 8.617 -0.390 1
1 1471 . 3 1 1 A 116 116 HIS C C 116 173.580 174.435 -0.855 1
1 1472 . 3 1 1 A 116 116 HIS N N 116 119.156 120.734 -1.578 1
1 5 . 4 1 1 A 3 3 PRO HA H 3 4.390 4.613 -0.223 1
1 12 . 4 1 1 A 3 3 PRO C C 3 176.847 176.272 0.575 1
1 13 . 4 1 1 A 3 3 PRO CA C 3 63.449 62.338 1.111 1
1 14 . 4 1 1 A 3 3 PRO CB C 3 31.938 33.348 -1.410 1
1 17 . 4 1 1 A 4 4 SER H H 4 8.531 8.594 -0.063 1
1 18 . 4 1 1 A 4 4 SER HA H 4 4.262 4.546 -0.284 1
1 21 . 4 1 1 A 4 4 SER C C 4 175.414 174.233 1.181 1
1 22 . 4 1 1 A 4 4 SER CA C 4 59.163 58.199 0.964 1
1 23 . 4 1 1 A 4 4 SER CB C 4 63.242 62.790 0.452 1
1 24 . 4 1 1 A 4 4 SER N N 4 114.246 115.880 -1.634 1
1 25 . 4 1 1 A 5 5 LYS H H 5 8.468 7.716 0.752 1
1 26 . 4 1 1 A 5 5 LYS HA H 5 4.433 4.504 -0.071 1
1 35 . 4 1 1 A 5 5 LYS C C 5 175.984 175.491 0.493 1
1 36 . 4 1 1 A 5 5 LYS CA C 5 55.724 56.149 -0.425 1
1 37 . 4 1 1 A 5 5 LYS CB C 5 32.881 30.542 2.339 1
1 41 . 4 1 1 A 5 5 LYS N N 5 123.488 122.464 1.024 1
1 42 . 4 1 1 A 6 6 LEU H H 6 7.707 7.818 -0.111 1
1 43 . 4 1 1 A 6 6 LEU HA H 6 4.381 4.601 -0.220 1
1 53 . 4 1 1 A 6 6 LEU C C 6 177.820 174.946 2.874 1
1 54 . 4 1 1 A 6 6 LEU CA C 6 55.507 54.962 0.545 1
1 55 . 4 1 1 A 6 6 LEU CB C 6 43.374 44.499 -1.125 1
1 59 . 4 1 1 A 6 6 LEU N N 6 121.233 125.230 -3.997 1
1 60 . 4 1 1 A 7 7 SER H H 7 9.433 8.944 0.489 1
1 61 . 4 1 1 A 7 7 SER HA H 7 4.638 4.526 0.112 1
1 64 . 4 1 1 A 7 7 SER C C 7 174.120 174.921 -0.801 1
1 65 . 4 1 1 A 7 7 SER CA C 7 57.962 59.285 -1.323 1
1 66 . 4 1 1 A 7 7 SER CB C 7 64.197 63.658 0.539 1
1 67 . 4 1 1 A 7 7 SER N N 7 122.977 123.203 -0.226 1
1 68 . 4 1 1 A 8 8 TYR H H 8 9.764 9.328 0.436 1
1 69 . 4 1 1 A 8 8 TYR HA H 8 4.732 4.246 0.486 1
1 76 . 4 1 1 A 8 8 TYR C C 8 177.206 177.600 -0.394 1
1 77 . 4 1 1 A 8 8 TYR CA C 8 58.762 61.804 -3.042 1
1 78 . 4 1 1 A 8 8 TYR CB C 8 36.605 38.925 -2.320 1
1 83 . 4 1 1 A 8 8 TYR N N 8 123.312 125.415 -2.103 1
1 84 . 4 1 1 A 9 9 GLY H H 9 10.131 8.345 1.786 1
1 85 . 4 1 1 A 9 9 GLY HA2 H 9 3.983 3.556 0.427 1
1 86 . 4 1 1 A 9 9 GLY HA3 H 9 3.423 3.650 -0.227 1
1 87 . 4 1 1 A 9 9 GLY C C 9 175.163 176.054 -0.891 1
1 88 . 4 1 1 A 9 9 GLY CA C 9 47.153 47.160 -0.007 1
1 89 . 4 1 1 A 9 9 GLY N N 9 107.177 105.940 1.237 1
1 90 . 4 1 1 A 10 10 GLU H H 10 7.876 7.791 0.085 1
1 91 . 4 1 1 A 10 10 GLU HA H 10 4.107 4.091 0.016 1
1 96 . 4 1 1 A 10 10 GLU C C 10 179.924 179.015 0.909 1
1 97 . 4 1 1 A 10 10 GLU CA C 10 58.890 59.460 -0.570 1
1 98 . 4 1 1 A 10 10 GLU CB C 10 29.750 29.494 0.256 1
1 100 . 4 1 1 A 10 10 GLU N N 10 122.219 121.749 0.470 1
1 101 . 4 1 1 A 11 11 TYR H H 11 8.384 8.138 0.246 1
1 102 . 4 1 1 A 11 11 TYR HA H 11 4.305 4.171 0.134 1
1 107 . 4 1 1 A 11 11 TYR C C 11 176.854 177.078 -0.224 1
1 108 . 4 1 1 A 11 11 TYR CA C 11 61.040 61.588 -0.548 1
1 109 . 4 1 1 A 11 11 TYR CB C 11 37.593 39.241 -1.648 1
1 112 . 4 1 1 A 11 11 TYR N N 11 120.809 122.663 -1.854 1
1 113 . 4 1 1 A 12 12 LEU H H 12 9.027 8.212 0.815 1
1 114 . 4 1 1 A 12 12 LEU HA H 12 3.778 3.799 -0.021 1
1 124 . 4 1 1 A 12 12 LEU C C 12 178.621 179.494 -0.873 1
1 125 . 4 1 1 A 12 12 LEU CA C 12 57.534 57.525 0.009 1
1 126 . 4 1 1 A 12 12 LEU CB C 12 41.957 40.728 1.229 1
1 130 . 4 1 1 A 12 12 LEU N N 12 121.080 119.009 2.071 1
1 131 . 4 1 1 A 13 13 GLU H H 13 7.614 8.294 -0.680 1
1 132 . 4 1 1 A 13 13 GLU HA H 13 4.102 4.084 0.018 1
1 137 . 4 1 1 A 13 13 GLU C C 13 178.449 179.323 -0.874 1
1 138 . 4 1 1 A 13 13 GLU CA C 13 59.609 59.437 0.172 1
1 139 . 4 1 1 A 13 13 GLU CB C 13 29.124 29.497 -0.373 1
1 141 . 4 1 1 A 13 13 GLU N N 13 118.475 120.912 -2.437 1
1 142 . 4 1 1 A 14 14 SER H H 14 7.329 7.792 -0.463 1
1 143 . 4 1 1 A 14 14 SER HA H 14 4.358 4.247 0.111 1
1 146 . 4 1 1 A 14 14 SER C C 14 176.794 175.966 0.828 1
1 147 . 4 1 1 A 14 14 SER CA C 14 61.064 62.520 -1.456 1
1 148 . 4 1 1 A 14 14 SER CB C 14 62.513 63.299 -0.786 1
1 149 . 4 1 1 A 14 14 SER N N 14 115.209 117.342 -2.133 1
1 150 . 4 1 1 A 15 15 TRP H H 15 8.870 7.944 0.926 1
1 151 . 4 1 1 A 15 15 TRP HA H 15 4.005 4.307 -0.302 1
1 160 . 4 1 1 A 15 15 TRP C C 15 177.547 177.950 -0.403 1
1 161 . 4 1 1 A 15 15 TRP CA C 15 61.210 61.258 -0.048 1
1 162 . 4 1 1 A 15 15 TRP CB C 15 27.341 29.468 -2.127 1
1 168 . 4 1 1 A 15 15 TRP N N 15 124.998 123.712 1.286 1
1 170 . 4 1 1 A 16 16 PHE H H 16 9.087 8.229 0.858 1
1 171 . 4 1 1 A 16 16 PHE HA H 16 3.210 3.805 -0.595 1
1 179 . 4 1 1 A 16 16 PHE C C 16 175.909 177.365 -1.456 1
1 180 . 4 1 1 A 16 16 PHE CA C 16 61.473 61.344 0.129 1
1 181 . 4 1 1 A 16 16 PHE CB C 16 38.506 39.217 -0.711 1
1 187 . 4 1 1 A 16 16 PHE N N 16 119.825 121.082 -1.257 1
1 188 . 4 1 1 A 17 17 ASN H H 17 7.768 8.263 -0.495 1
1 189 . 4 1 1 A 17 17 ASN HA H 17 4.078 4.083 -0.005 1
1 194 . 4 1 1 A 17 17 ASN C C 17 176.604 177.742 -1.138 1
1 195 . 4 1 1 A 17 17 ASN CA C 17 55.621 56.214 -0.593 1
1 196 . 4 1 1 A 17 17 ASN CB C 17 37.830 38.078 -0.248 1
1 197 . 4 1 1 A 17 17 ASN N N 17 115.600 117.294 -1.694 1
1 199 . 4 1 1 A 18 18 THR H H 18 7.454 7.472 -0.018 1
1 200 . 4 1 1 A 18 18 THR HA H 18 4.147 3.915 0.232 1
1 205 . 4 1 1 A 18 18 THR C C 18 175.692 175.996 -0.304 1
1 206 . 4 1 1 A 18 18 THR CA C 18 64.679 67.002 -2.323 1
1 207 . 4 1 1 A 18 18 THR CB C 18 68.940 67.939 1.001 1
1 209 . 4 1 1 A 18 18 THR N N 18 113.049 116.671 -3.622 1
1 210 . 4 1 1 A 19 19 LYS H H 19 7.918 7.382 0.536 1
1 211 . 4 1 1 A 19 19 LYS HA H 19 3.791 3.653 0.138 1
1 220 . 4 1 1 A 19 19 LYS C C 19 178.120 178.954 -0.834 1
1 221 . 4 1 1 A 19 19 LYS CA C 19 55.985 58.779 -2.794 1
1 222 . 4 1 1 A 19 19 LYS CB C 19 31.130 31.066 0.064 1
1 226 . 4 1 1 A 19 19 LYS N N 19 122.614 120.313 2.301 1
1 227 . 4 1 1 A 20 20 ARG H H 20 7.845 7.671 0.174 1
1 228 . 4 1 1 A 20 20 ARG HA H 20 3.396 3.779 -0.383 1
1 236 . 4 1 1 A 20 20 ARG C C 20 175.601 178.789 -3.188 1
1 237 . 4 1 1 A 20 20 ARG CA C 20 58.182 58.380 -0.198 1
1 238 . 4 1 1 A 20 20 ARG CB C 20 28.045 29.926 -1.881 1
1 241 . 4 1 1 A 20 20 ARG N N 20 116.282 118.106 -1.824 1
1 243 . 4 1 1 A 21 21 HIS H H 21 7.163 7.407 -0.244 1
1 244 . 4 1 1 A 21 21 HIS HA H 21 4.500 4.158 0.342 1
1 249 . 4 1 1 A 21 21 HIS C C 21 175.618 177.272 -1.654 1
1 250 . 4 1 1 A 21 21 HIS CA C 21 56.912 59.745 -2.833 1
1 251 . 4 1 1 A 21 21 HIS CB C 21 29.400 30.268 -0.868 1
1 254 . 4 1 1 A 21 21 HIS N N 21 115.452 118.292 -2.840 1
1 255 . 4 1 1 A 22 22 SER H H 22 7.951 7.679 0.272 1
1 256 . 4 1 1 A 22 22 SER HA H 22 4.573 4.193 0.380 1
1 259 . 4 1 1 A 22 22 SER C C 22 173.948 174.875 -0.927 1
1 260 . 4 1 1 A 22 22 SER CA C 22 58.589 62.029 -3.440 1
1 261 . 4 1 1 A 22 22 SER CB C 22 64.228 63.739 0.489 1
1 262 . 4 1 1 A 22 22 SER N N 22 113.209 115.085 -1.876 1
1 263 . 4 1 1 A 23 23 VAL H H 23 7.179 7.506 -0.327 1
1 264 . 4 1 1 A 23 23 VAL HA H 23 4.626 4.179 0.447 1
1 272 . 4 1 1 A 23 23 VAL C C 23 175.397 176.134 -0.737 1
1 273 . 4 1 1 A 23 23 VAL CA C 23 59.556 61.423 -1.867 1
1 274 . 4 1 1 A 23 23 VAL CB C 23 33.810 32.963 0.847 1
1 277 . 4 1 1 A 23 23 VAL N N 23 113.108 117.172 -4.064 1
1 278 . 4 1 1 A 24 24 GLY H H 24 8.189 8.442 -0.253 1
1 279 . 4 1 1 A 24 24 GLY HA2 H 24 4.074 4.046 0.028 1
1 280 . 4 1 1 A 24 24 GLY HA3 H 24 4.195 4.063 0.132 1
1 281 . 4 1 1 A 24 24 GLY C C 24 174.037 174.797 -0.760 1
1 282 . 4 1 1 A 24 24 GLY CA C 24 44.452 44.907 -0.455 1
1 283 . 4 1 1 A 24 24 GLY N N 24 108.374 108.843 -0.469 1
1 284 . 4 1 1 A 25 25 ILE H H 25 8.331 8.652 -0.321 1
1 285 . 4 1 1 A 25 25 ILE HA H 25 3.839 3.652 0.187 1
1 295 . 4 1 1 A 25 25 ILE C C 25 178.042 177.800 0.242 1
1 296 . 4 1 1 A 25 25 ILE CA C 25 64.238 64.609 -0.371 1
1 297 . 4 1 1 A 25 25 ILE CB C 25 37.931 37.619 0.312 1
1 301 . 4 1 1 A 25 25 ILE N N 25 119.895 119.906 -0.011 1
1 302 . 4 1 1 A 26 26 GLN H H 26 8.545 8.532 0.013 1
1 303 . 4 1 1 A 26 26 GLN HA H 26 4.129 4.057 0.072 1
1 310 . 4 1 1 A 26 26 GLN C C 26 178.454 178.372 0.082 1
1 311 . 4 1 1 A 26 26 GLN CA C 26 58.772 58.223 0.549 1
1 312 . 4 1 1 A 26 26 GLN CB C 26 27.346 28.062 -0.716 1
1 314 . 4 1 1 A 26 26 GLN N N 26 120.013 120.034 -0.021 1
1 316 . 4 1 1 A 27 27 THR H H 27 7.944 8.098 -0.154 1
1 317 . 4 1 1 A 27 27 THR HA H 27 3.953 3.906 0.047 1
1 322 . 4 1 1 A 27 27 THR C C 27 175.818 176.216 -0.398 1
1 323 . 4 1 1 A 27 27 THR CA C 27 65.855 66.218 -0.363 1
1 324 . 4 1 1 A 27 27 THR CB C 27 68.127 68.344 -0.217 1
1 326 . 4 1 1 A 27 27 THR N N 27 117.645 116.760 0.885 1
1 327 . 4 1 1 A 28 28 ALA H H 28 8.593 8.237 0.356 1
1 328 . 4 1 1 A 28 28 ALA HA H 28 3.899 4.137 -0.238 1
1 332 . 4 1 1 A 28 28 ALA C C 28 178.515 179.345 -0.830 1
1 333 . 4 1 1 A 28 28 ALA CA C 28 55.742 55.674 0.068 1
1 334 . 4 1 1 A 28 28 ALA CB C 28 17.513 18.556 -1.043 1
1 335 . 4 1 1 A 28 28 ALA N N 28 123.917 123.449 0.468 1
1 336 . 4 1 1 A 29 29 LYS H H 29 7.800 7.764 0.036 1
1 337 . 4 1 1 A 29 29 LYS HA H 29 3.982 3.968 0.014 1
1 346 . 4 1 1 A 29 29 LYS C C 29 179.527 179.153 0.374 1
1 347 . 4 1 1 A 29 29 LYS CA C 29 59.761 59.668 0.093 1
1 348 . 4 1 1 A 29 29 LYS CB C 29 32.223 32.310 -0.087 1
1 352 . 4 1 1 A 29 29 LYS N N 29 117.474 118.977 -1.503 1
1 353 . 4 1 1 A 30 30 VAL H H 30 7.591 7.265 0.326 1
1 354 . 4 1 1 A 30 30 VAL HA H 30 3.503 3.398 0.105 1
1 362 . 4 1 1 A 30 30 VAL C C 30 178.389 177.942 0.447 1
1 363 . 4 1 1 A 30 30 VAL CA C 30 65.640 65.956 -0.316 1
1 364 . 4 1 1 A 30 30 VAL CB C 30 31.644 31.479 0.165 1
1 367 . 4 1 1 A 30 30 VAL N N 30 121.749 120.212 1.537 1
1 368 . 4 1 1 A 31 31 LEU H H 31 8.333 8.285 0.048 1
1 369 . 4 1 1 A 31 31 LEU HA H 31 4.074 4.170 -0.096 1
1 379 . 4 1 1 A 31 31 LEU C C 31 177.780 179.178 -1.398 1
1 380 . 4 1 1 A 31 31 LEU CA C 31 58.157 58.209 -0.052 1
1 381 . 4 1 1 A 31 31 LEU CB C 31 42.230 41.165 1.065 1
1 385 . 4 1 1 A 31 31 LEU N N 31 120.901 120.428 0.473 1
1 386 . 4 1 1 A 32 32 LYS H H 32 8.562 8.029 0.533 1
1 387 . 4 1 1 A 32 32 LYS HA H 32 3.290 3.871 -0.581 1
1 395 . 4 1 1 A 32 32 LYS C C 32 178.037 178.755 -0.718 1
1 396 . 4 1 1 A 32 32 LYS CA C 32 58.911 59.563 -0.652 1
1 397 . 4 1 1 A 32 32 LYS CB C 32 31.605 31.271 0.334 1
1 401 . 4 1 1 A 32 32 LYS N N 32 119.075 119.316 -0.241 1
1 402 . 4 1 1 A 33 33 GLY H H 33 7.694 7.886 -0.192 1
1 403 . 4 1 1 A 33 33 GLY HA2 H 33 3.949 3.596 0.353 1
1 404 . 4 1 1 A 33 33 GLY HA3 H 33 3.826 3.671 0.155 1
1 405 . 4 1 1 A 33 33 GLY C C 33 177.101 176.483 0.618 1
1 406 . 4 1 1 A 33 33 GLY CA C 33 46.928 47.115 -0.187 1
1 407 . 4 1 1 A 33 33 GLY N N 33 105.282 106.754 -1.472 1
1 408 . 4 1 1 A 34 34 TYR H H 34 8.015 7.658 0.357 1
1 409 . 4 1 1 A 34 34 TYR HA H 34 4.558 4.697 -0.139 1
1 416 . 4 1 1 A 34 34 TYR C C 34 179.611 178.101 1.510 1
1 417 . 4 1 1 A 34 34 TYR CA C 34 59.349 60.250 -0.901 1
1 418 . 4 1 1 A 34 34 TYR CB C 34 37.344 38.092 -0.748 1
1 423 . 4 1 1 A 34 34 TYR N N 34 121.781 121.852 -0.071 1
1 424 . 4 1 1 A 35 35 LEU H H 35 8.689 8.146 0.543 1
1 425 . 4 1 1 A 35 35 LEU HA H 35 3.977 3.864 0.113 1
1 435 . 4 1 1 A 35 35 LEU C C 35 177.081 179.122 -2.041 1
1 436 . 4 1 1 A 35 35 LEU CA C 35 59.155 58.505 0.650 1
1 437 . 4 1 1 A 35 35 LEU CB C 35 41.103 41.804 -0.701 1
1 441 . 4 1 1 A 35 35 LEU N N 35 120.392 120.588 -0.196 1
1 442 . 4 1 1 A 36 36 ASN H H 36 8.721 8.313 0.408 1
1 443 . 4 1 1 A 36 36 ASN HA H 36 4.435 4.440 -0.005 1
1 448 . 4 1 1 A 36 36 ASN C C 36 176.792 177.935 -1.143 1
1 449 . 4 1 1 A 36 36 ASN CA C 36 55.642 56.214 -0.572 1
1 450 . 4 1 1 A 36 36 ASN CB C 36 38.319 37.773 0.546 1
1 451 . 4 1 1 A 36 36 ASN N N 36 114.623 116.812 -2.189 1
1 453 . 4 1 1 A 37 37 SER H H 37 8.511 8.007 0.504 1
1 454 . 4 1 1 A 37 37 SER HA H 37 4.642 4.312 0.330 1
1 457 . 4 1 1 A 37 37 SER C C 37 175.039 176.177 -1.138 1
1 458 . 4 1 1 A 37 37 SER CA C 37 59.825 61.270 -1.445 1
1 459 . 4 1 1 A 37 37 SER CB C 37 64.056 63.018 1.038 1
1 460 . 4 1 1 A 37 37 SER N N 37 110.941 115.586 -4.645 1
1 461 . 4 1 1 A 38 38 ARG H H 38 7.242 8.102 -0.860 1
1 462 . 4 1 1 A 38 38 ARG HA H 38 4.919 4.423 0.496 1
1 469 . 4 1 1 A 38 38 ARG C C 38 176.514 178.273 -1.759 1
1 470 . 4 1 1 A 38 38 ARG CA C 38 56.687 57.926 -1.239 1
1 471 . 4 1 1 A 38 38 ARG CB C 38 32.434 31.254 1.180 1
1 474 . 4 1 1 A 38 38 ARG N N 38 117.062 120.505 -3.443 1
1 475 . 4 1 1 A 39 39 ILE H H 39 8.462 7.930 0.532 1
1 476 . 4 1 1 A 39 39 ILE HA H 39 3.618 4.006 -0.388 1
1 486 . 4 1 1 A 39 39 ILE C C 39 176.267 178.587 -2.320 1
1 487 . 4 1 1 A 39 39 ILE CA C 39 66.134 64.783 1.351 1
1 488 . 4 1 1 A 39 39 ILE CB C 39 39.787 37.062 2.725 1
1 492 . 4 1 1 A 39 39 ILE N N 39 121.214 120.309 0.905 1
1 493 . 4 1 1 A 40 40 ILE H H 40 9.339 8.041 1.298 1
1 494 . 4 1 1 A 40 40 ILE HA H 40 3.401 3.746 -0.345 1
1 504 . 4 1 1 A 40 40 ILE CA C 40 67.844 66.290 1.554 1
1 505 . 4 1 1 A 40 40 ILE CB C 40 34.406 35.362 -0.956 1
1 509 . 4 1 1 A 40 40 ILE N N 40 119.695 122.010 -2.315 1
1 510 . 4 1 1 A 41 41 PRO HA H 41 4.314 4.308 0.006 1
1 517 . 4 1 1 A 41 41 PRO C C 41 177.418 179.013 -1.595 1
1 518 . 4 1 1 A 41 41 PRO CA C 41 65.912 66.546 -0.634 1
1 519 . 4 1 1 A 41 41 PRO CB C 41 30.686 30.796 -0.110 1
1 522 . 4 1 1 A 42 42 SER H H 42 6.857 7.892 -1.035 1
1 523 . 4 1 1 A 42 42 SER HA H 42 4.558 4.353 0.205 1
1 526 . 4 1 1 A 42 42 SER C C 42 174.813 175.927 -1.114 1
1 527 . 4 1 1 A 42 42 SER CA C 42 61.279 61.553 -0.274 1
1 528 . 4 1 1 A 42 42 SER CB C 42 64.285 64.017 0.268 1
1 529 . 4 1 1 A 42 42 SER N N 42 108.994 113.927 -4.933 1
1 530 . 4 1 1 A 43 43 LEU H H 43 8.230 8.091 0.139 1
1 531 . 4 1 1 A 43 43 LEU HA H 43 4.572 4.518 0.054 1
1 541 . 4 1 1 A 43 43 LEU C C 43 177.301 178.316 -1.015 1
1 542 . 4 1 1 A 43 43 LEU CA C 43 54.113 54.586 -0.473 1
1 543 . 4 1 1 A 43 43 LEU CB C 43 44.800 42.199 2.601 1
1 547 . 4 1 1 A 43 43 LEU N N 43 118.715 119.587 -0.872 1
1 548 . 4 1 1 A 44 44 GLY H H 44 8.498 8.095 0.403 1
1 549 . 4 1 1 A 44 44 GLY HA2 H 44 4.010 3.717 0.293 1
1 550 . 4 1 1 A 44 44 GLY HA3 H 44 3.613 3.737 -0.124 1
1 551 . 4 1 1 A 44 44 GLY C C 44 174.178 176.065 -1.887 1
1 552 . 4 1 1 A 44 44 GLY CA C 44 46.271 47.254 -0.983 1
1 553 . 4 1 1 A 44 44 GLY N N 44 105.371 108.647 -3.276 1
1 554 . 4 1 1 A 45 45 ASN H H 45 8.385 8.523 -0.138 1
1 555 . 4 1 1 A 45 45 ASN HA H 45 4.789 4.645 0.144 1
1 560 . 4 1 1 A 45 45 ASN C C 45 175.386 175.731 -0.345 1
1 561 . 4 1 1 A 45 45 ASN CA C 45 53.144 55.659 -2.515 1
1 562 . 4 1 1 A 45 45 ASN CB C 45 37.928 39.302 -1.374 1
1 563 . 4 1 1 A 45 45 ASN N N 45 114.387 119.503 -5.116 1
1 565 . 4 1 1 A 46 46 ILE H H 46 7.465 7.565 -0.100 1
1 566 . 4 1 1 A 46 46 ILE HA H 46 3.856 4.023 -0.167 1
1 576 . 4 1 1 A 46 46 ILE C C 46 175.997 176.226 -0.229 1
1 577 . 4 1 1 A 46 46 ILE CA C 46 60.853 62.193 -1.340 1
1 578 . 4 1 1 A 46 46 ILE CB C 46 38.042 38.041 0.001 1
1 582 . 4 1 1 A 46 46 ILE N N 46 123.998 120.992 3.006 1
1 583 . 4 1 1 A 47 47 LYS H H 47 8.717 8.680 0.037 1
1 584 . 4 1 1 A 47 47 LYS HA H 47 4.249 4.327 -0.078 1
1 591 . 4 1 1 A 47 47 LYS C C 47 177.583 177.600 -0.017 1
1 592 . 4 1 1 A 47 47 LYS CA C 47 56.320 56.599 -0.279 1
1 593 . 4 1 1 A 47 47 LYS CB C 47 30.393 32.830 -2.437 1
1 596 . 4 1 1 A 47 47 LYS N N 47 126.114 125.513 0.601 1
1 597 . 4 1 1 A 48 48 LEU H H 48 8.323 8.678 -0.355 1
1 598 . 4 1 1 A 48 48 LEU HA H 48 3.691 3.989 -0.298 1
1 608 . 4 1 1 A 48 48 LEU C C 48 177.274 178.295 -1.021 1
1 609 . 4 1 1 A 48 48 LEU CA C 48 58.443 58.541 -0.098 1
1 610 . 4 1 1 A 48 48 LEU CB C 48 42.282 41.129 1.153 1
1 614 . 4 1 1 A 48 48 LEU N N 48 125.857 126.067 -0.210 1
1 615 . 4 1 1 A 49 49 ALA H H 49 8.929 7.891 1.038 1
1 616 . 4 1 1 A 49 49 ALA HA H 49 4.067 4.008 0.059 1
1 620 . 4 1 1 A 49 49 ALA C C 49 177.468 178.334 -0.866 1
1 621 . 4 1 1 A 49 49 ALA CA C 49 53.092 54.354 -1.262 1
1 622 . 4 1 1 A 49 49 ALA CB C 49 18.562 18.193 0.369 1
1 623 . 4 1 1 A 49 49 ALA N N 49 115.543 120.107 -4.564 1
1 624 . 4 1 1 A 50 50 LYS H H 50 7.684 7.400 0.284 1
1 625 . 4 1 1 A 50 50 LYS HA H 50 4.395 4.203 0.192 1
1 634 . 4 1 1 A 50 50 LYS C C 50 174.958 176.351 -1.393 1
1 635 . 4 1 1 A 50 50 LYS CA C 50 53.977 56.128 -2.151 1
1 636 . 4 1 1 A 50 50 LYS CB C 50 32.645 32.695 -0.050 1
1 640 . 4 1 1 A 50 50 LYS N N 50 114.788 114.920 -0.132 1
1 641 . 4 1 1 A 51 51 LEU H H 51 6.776 6.897 -0.121 1
1 642 . 4 1 1 A 51 51 LEU HA H 51 4.569 4.058 0.511 1
1 652 . 4 1 1 A 51 51 LEU C C 51 177.953 175.557 2.396 1
1 653 . 4 1 1 A 51 51 LEU CA C 51 55.318 54.459 0.859 1
1 654 . 4 1 1 A 51 51 LEU CB C 51 43.182 40.389 2.793 1
1 658 . 4 1 1 A 51 51 LEU N N 51 121.408 121.491 -0.083 1
1 659 . 4 1 1 A 52 52 THR H H 52 10.680 7.680 3.000 1
1 660 . 4 1 1 A 52 52 THR HA H 52 4.938 4.531 0.407 1
1 665 . 4 1 1 A 52 52 THR C C 52 175.553 174.552 1.001 1
1 666 . 4 1 1 A 52 52 THR CA C 52 59.740 60.120 -0.380 1
1 667 . 4 1 1 A 52 52 THR CB C 52 73.557 70.881 2.676 1
1 669 . 4 1 1 A 52 52 THR N N 52 119.481 119.244 0.237 1
1 670 . 4 1 1 A 53 53 SER H H 53 9.278 9.059 0.219 1
1 671 . 4 1 1 A 53 53 SER HA H 53 4.261 4.150 0.111 1
1 674 . 4 1 1 A 53 53 SER C C 53 176.990 176.436 0.554 1
1 675 . 4 1 1 A 53 53 SER CA C 53 61.025 61.023 0.002 1
1 676 . 4 1 1 A 53 53 SER CB C 53 62.312 62.815 -0.503 1
1 677 . 4 1 1 A 53 53 SER N N 53 116.343 121.776 -5.433 1
1 678 . 4 1 1 A 54 54 LEU H H 54 7.808 8.056 -0.248 1
1 679 . 4 1 1 A 54 54 LEU HA H 54 4.229 4.080 0.149 1
1 688 . 4 1 1 A 54 54 LEU C C 54 178.505 178.700 -0.195 1
1 689 . 4 1 1 A 54 54 LEU CA C 54 57.719 57.781 -0.062 1
1 690 . 4 1 1 A 54 54 LEU CB C 54 40.997 41.631 -0.634 1
1 694 . 4 1 1 A 54 54 LEU N N 54 126.055 123.019 3.036 1
1 695 . 4 1 1 A 55 55 HIS H H 55 7.798 8.070 -0.272 1
1 696 . 4 1 1 A 55 55 HIS HA H 55 4.311 4.391 -0.080 1
1 701 . 4 1 1 A 55 55 HIS C C 55 180.044 177.873 2.171 1
1 702 . 4 1 1 A 55 55 HIS CA C 55 60.583 59.461 1.122 1
1 703 . 4 1 1 A 55 55 HIS CB C 55 31.445 29.722 1.723 1
1 706 . 4 1 1 A 55 55 HIS N N 55 118.683 118.603 0.080 1
1 707 . 4 1 1 A 56 56 MET H H 56 7.375 8.303 -0.928 1
1 708 . 4 1 1 A 56 56 MET HA H 56 4.513 4.258 0.255 1
1 716 . 4 1 1 A 56 56 MET C C 56 177.169 178.356 -1.187 1
1 717 . 4 1 1 A 56 56 MET CA C 56 55.823 58.775 -2.952 1
1 718 . 4 1 1 A 56 56 MET CB C 56 31.303 31.746 -0.443 1
1 721 . 4 1 1 A 56 56 MET N N 56 114.530 117.770 -3.240 1
1 722 . 4 1 1 A 57 57 GLN H H 57 8.387 8.307 0.080 1
1 723 . 4 1 1 A 57 57 GLN HA H 57 3.981 3.998 -0.017 1
1 730 . 4 1 1 A 57 57 GLN C C 57 178.033 178.450 -0.417 1
1 731 . 4 1 1 A 57 57 GLN CA C 57 57.922 59.189 -1.267 1
1 732 . 4 1 1 A 57 57 GLN CB C 57 29.012 28.460 0.552 1
1 734 . 4 1 1 A 57 57 GLN N N 57 120.713 120.378 0.335 1
1 736 . 4 1 1 A 58 58 ASN H H 58 8.765 8.251 0.514 1
1 737 . 4 1 1 A 58 58 ASN HA H 58 4.539 4.562 -0.023 1
1 742 . 4 1 1 A 58 58 ASN C C 58 178.084 177.359 0.725 1
1 743 . 4 1 1 A 58 58 ASN CA C 58 55.345 55.877 -0.532 1
1 744 . 4 1 1 A 58 58 ASN CB C 58 36.924 38.655 -1.731 1
1 745 . 4 1 1 A 58 58 ASN N N 58 117.390 117.854 -0.464 1
1 747 . 4 1 1 A 59 59 TYR H H 59 8.239 7.924 0.315 1
1 748 . 4 1 1 A 59 59 TYR HA H 59 4.586 4.191 0.395 1
1 755 . 4 1 1 A 59 59 TYR C C 59 178.015 176.873 1.142 1
1 756 . 4 1 1 A 59 59 TYR CA C 59 60.779 61.570 -0.791 1
1 757 . 4 1 1 A 59 59 TYR CB C 59 38.047 38.715 -0.668 1
1 762 . 4 1 1 A 59 59 TYR N N 59 122.335 123.134 -0.799 1
1 763 . 4 1 1 A 60 60 VAL H H 60 8.416 8.492 -0.076 1
1 764 . 4 1 1 A 60 60 VAL HA H 60 3.244 3.540 -0.296 1
1 772 . 4 1 1 A 60 60 VAL C C 60 177.309 178.256 -0.947 1
1 773 . 4 1 1 A 60 60 VAL CA C 60 67.022 66.390 0.632 1
1 774 . 4 1 1 A 60 60 VAL CB C 60 30.929 31.453 -0.524 1
1 777 . 4 1 1 A 60 60 VAL N N 60 119.842 119.533 0.309 1
1 778 . 4 1 1 A 61 61 ASN H H 61 8.264 8.259 0.005 1
1 779 . 4 1 1 A 61 61 ASN HA H 61 4.305 4.453 -0.148 1
1 784 . 4 1 1 A 61 61 ASN C C 61 177.263 178.177 -0.914 1
1 785 . 4 1 1 A 61 61 ASN CA C 61 55.548 56.317 -0.769 1
1 786 . 4 1 1 A 61 61 ASN CB C 61 36.645 37.412 -0.767 1
1 787 . 4 1 1 A 61 61 ASN N N 61 119.103 119.689 -0.586 1
1 789 . 4 1 1 A 62 62 SER H H 62 8.143 7.870 0.273 1
1 790 . 4 1 1 A 62 62 SER HA H 62 4.343 4.071 0.272 1
1 793 . 4 1 1 A 62 62 SER C C 62 176.409 175.765 0.644 1
1 794 . 4 1 1 A 62 62 SER CA C 62 61.612 62.309 -0.697 1
1 795 . 4 1 1 A 62 62 SER CB C 62 62.219 63.048 -0.829 1
1 796 . 4 1 1 A 62 62 SER N N 62 118.254 116.861 1.393 1
1 797 . 4 1 1 A 63 63 LEU H H 63 7.664 8.212 -0.548 1
1 798 . 4 1 1 A 63 63 LEU HA H 63 4.003 3.827 0.176 1
1 808 . 4 1 1 A 63 63 LEU C C 63 178.748 179.011 -0.263 1
1 809 . 4 1 1 A 63 63 LEU CA C 63 57.171 58.073 -0.902 1
1 810 . 4 1 1 A 63 63 LEU CB C 63 41.134 41.379 -0.245 1
1 814 . 4 1 1 A 63 63 LEU N N 63 123.812 120.794 3.018 1
1 815 . 4 1 1 A 64 64 ARG H H 64 7.969 7.733 0.236 1
1 816 . 4 1 1 A 64 64 ARG HA H 64 4.038 3.965 0.073 1
1 824 . 4 1 1 A 64 64 ARG C C 64 180.797 178.018 2.779 1
1 825 . 4 1 1 A 64 64 ARG CA C 64 58.598 59.035 -0.437 1
1 826 . 4 1 1 A 64 64 ARG CB C 64 28.849 29.757 -0.908 1
1 829 . 4 1 1 A 64 64 ARG N N 64 120.376 119.889 0.487 1
1 831 . 4 1 1 A 65 65 ASP H H 65 8.465 8.011 0.454 1
1 832 . 4 1 1 A 65 65 ASP HA H 65 4.408 4.384 0.024 1
1 835 . 4 1 1 A 65 65 ASP C C 65 177.336 178.521 -1.185 1
1 836 . 4 1 1 A 65 65 ASP CA C 65 56.957 57.129 -0.172 1
1 837 . 4 1 1 A 65 65 ASP CB C 65 39.602 40.790 -1.188 1
1 838 . 4 1 1 A 65 65 ASP N N 65 122.402 120.133 2.269 1
1 839 . 4 1 1 A 66 66 GLU H H 66 7.703 7.942 -0.239 1
1 840 . 4 1 1 A 66 66 GLU HA H 66 4.213 4.288 -0.075 1
1 845 . 4 1 1 A 66 66 GLU C C 66 176.586 177.451 -0.865 1
1 846 . 4 1 1 A 66 66 GLU CA C 66 56.974 56.329 0.645 1
1 847 . 4 1 1 A 66 66 GLU CB C 66 29.821 30.017 -0.196 1
1 849 . 4 1 1 A 66 66 GLU N N 66 119.076 115.846 3.230 1
1 850 . 4 1 1 A 67 67 GLY H H 67 7.861 7.638 0.223 1
1 851 . 4 1 1 A 67 67 GLY HA2 H 67 4.269 3.937 0.332 1
1 852 . 4 1 1 A 67 67 GLY HA3 H 67 3.731 3.941 -0.210 1
1 853 . 4 1 1 A 67 67 GLY C C 67 174.614 175.004 -0.390 1
1 854 . 4 1 1 A 67 67 GLY CA C 67 44.608 46.507 -1.899 1
1 855 . 4 1 1 A 67 67 GLY N N 67 105.730 109.396 -3.666 1
1 856 . 4 1 1 A 68 68 LEU H H 68 7.324 7.838 -0.514 1
1 857 . 4 1 1 A 68 68 LEU HA H 68 4.257 4.239 0.018 1
1 867 . 4 1 1 A 68 68 LEU C C 68 176.136 177.197 -1.061 1
1 868 . 4 1 1 A 68 68 LEU CA C 68 55.659 54.998 0.661 1
1 869 . 4 1 1 A 68 68 LEU CB C 68 41.874 42.361 -0.487 1
1 873 . 4 1 1 A 68 68 LEU N N 68 121.062 120.793 0.269 1
1 874 . 4 1 1 A 69 69 LYS H H 69 8.368 8.515 -0.147 1
1 875 . 4 1 1 A 69 69 LYS HA H 69 4.281 4.332 -0.051 1
1 884 . 4 1 1 A 69 69 LYS C C 69 177.940 177.905 0.035 1
1 885 . 4 1 1 A 69 69 LYS CA C 69 55.412 56.211 -0.799 1
1 886 . 4 1 1 A 69 69 LYS CB C 69 32.761 33.173 -0.412 1
1 890 . 4 1 1 A 69 69 LYS N N 69 120.120 121.581 -1.461 1
1 891 . 4 1 1 A 70 70 ARG H H 70 9.095 8.796 0.299 1
1 892 . 4 1 1 A 70 70 ARG HA H 70 3.684 4.096 -0.412 1
1 900 . 4 1 1 A 70 70 ARG C C 70 177.712 178.707 -0.995 1
1 901 . 4 1 1 A 70 70 ARG CA C 70 60.216 58.254 1.962 1
1 902 . 4 1 1 A 70 70 ARG CB C 70 29.539 29.775 -0.236 1
1 905 . 4 1 1 A 70 70 ARG N N 70 123.339 120.211 3.128 1
1 907 . 4 1 1 A 71 71 GLY H H 71 8.985 8.311 0.674 1
1 908 . 4 1 1 A 71 71 GLY HA2 H 71 3.932 3.658 0.274 1
1 909 . 4 1 1 A 71 71 GLY HA3 H 71 3.905 3.665 0.240 1
1 910 . 4 1 1 A 71 71 GLY C C 71 176.324 175.879 0.445 1
1 911 . 4 1 1 A 71 71 GLY CA C 71 46.752 47.460 -0.708 1
1 912 . 4 1 1 A 71 71 GLY N N 71 104.509 109.087 -4.578 1
1 913 . 4 1 1 A 72 72 THR H H 72 7.295 8.157 -0.862 1
1 914 . 4 1 1 A 72 72 THR HA H 72 4.014 3.783 0.231 1
1 919 . 4 1 1 A 72 72 THR C C 72 175.135 176.058 -0.923 1
1 920 . 4 1 1 A 72 72 THR CA C 72 65.848 66.463 -0.615 1
1 921 . 4 1 1 A 72 72 THR CB C 72 68.160 68.485 -0.325 1
1 923 . 4 1 1 A 72 72 THR N N 72 118.617 117.416 1.201 1
1 924 . 4 1 1 A 73 73 ILE H H 73 7.883 7.877 0.006 1
1 925 . 4 1 1 A 73 73 ILE HA H 73 3.258 3.599 -0.341 1
1 935 . 4 1 1 A 73 73 ILE C C 73 177.060 177.962 -0.902 1
1 936 . 4 1 1 A 73 73 ILE CA C 73 66.561 65.416 1.145 1
1 937 . 4 1 1 A 73 73 ILE CB C 73 37.339 37.779 -0.440 1
1 941 . 4 1 1 A 73 73 ILE N N 73 121.692 121.154 0.538 1
1 942 . 4 1 1 A 74 74 GLU H H 74 8.723 8.019 0.704 1
1 943 . 4 1 1 A 74 74 GLU HA H 74 3.807 3.933 -0.126 1
1 948 . 4 1 1 A 74 74 GLU C C 74 178.319 178.773 -0.454 1
1 949 . 4 1 1 A 74 74 GLU CA C 74 59.637 59.830 -0.193 1
1 950 . 4 1 1 A 74 74 GLU CB C 74 29.257 29.082 0.175 1
1 952 . 4 1 1 A 74 74 GLU N N 74 117.701 121.285 -3.584 1
1 953 . 4 1 1 A 75 75 LYS H H 75 7.361 7.565 -0.204 1
1 954 . 4 1 1 A 75 75 LYS HA H 75 3.958 4.038 -0.080 1
1 963 . 4 1 1 A 75 75 LYS C C 75 178.554 179.358 -0.804 1
1 964 . 4 1 1 A 75 75 LYS CA C 75 59.764 59.448 0.316 1
1 965 . 4 1 1 A 75 75 LYS CB C 75 32.314 32.282 0.032 1
1 969 . 4 1 1 A 75 75 LYS N N 75 118.734 118.011 0.723 1
1 970 . 4 1 1 A 76 76 ILE H H 76 7.713 7.571 0.142 1
1 971 . 4 1 1 A 76 76 ILE HA H 76 3.221 3.837 -0.616 1
1 981 . 4 1 1 A 76 76 ILE C C 76 177.504 178.236 -0.732 1
1 982 . 4 1 1 A 76 76 ILE CA C 76 65.796 64.413 1.383 1
1 983 . 4 1 1 A 76 76 ILE CB C 76 37.732 37.352 0.380 1
1 987 . 4 1 1 A 76 76 ILE N N 76 120.312 116.390 3.922 1
1 988 . 4 1 1 A 77 77 ILE H H 77 8.587 7.703 0.884 1
1 989 . 4 1 1 A 77 77 ILE HA H 77 3.778 3.642 0.136 1
1 999 . 4 1 1 A 77 77 ILE C C 77 177.074 177.897 -0.823 1
1 1000 . 4 1 1 A 77 77 ILE CA C 77 63.168 64.775 -1.607 1
1 1001 . 4 1 1 A 77 77 ILE CB C 77 36.617 37.081 -0.464 1
1 1005 . 4 1 1 A 77 77 ILE N N 77 118.978 121.375 -2.397 1
1 1006 . 4 1 1 A 78 78 LYS H H 78 8.050 7.705 0.345 1
1 1007 . 4 1 1 A 78 78 LYS HA H 78 3.925 4.018 -0.093 1
1 1016 . 4 1 1 A 78 78 LYS C C 78 178.291 179.160 -0.869 1
1 1017 . 4 1 1 A 78 78 LYS CA C 78 60.192 59.376 0.816 1
1 1018 . 4 1 1 A 78 78 LYS CB C 78 31.886 32.256 -0.370 1
1 1022 . 4 1 1 A 78 78 LYS N N 78 121.618 119.433 2.185 1
1 1023 . 4 1 1 A 79 79 VAL H H 79 7.619 7.658 -0.039 1
1 1024 . 4 1 1 A 79 79 VAL HA H 79 3.846 3.661 0.185 1
1 1032 . 4 1 1 A 79 79 VAL C C 79 177.712 178.172 -0.460 1
1 1033 . 4 1 1 A 79 79 VAL CA C 79 66.494 66.124 0.370 1
1 1034 . 4 1 1 A 79 79 VAL CB C 79 31.298 31.581 -0.283 1
1 1037 . 4 1 1 A 79 79 VAL N N 79 120.254 119.229 1.025 1
1 1038 . 4 1 1 A 80 80 ILE H H 80 7.885 8.203 -0.318 1
1 1039 . 4 1 1 A 80 80 ILE HA H 80 3.367 3.643 -0.276 1
1 1049 . 4 1 1 A 80 80 ILE C C 80 179.892 177.866 2.026 1
1 1050 . 4 1 1 A 80 80 ILE CA C 80 65.343 65.299 0.044 1
1 1051 . 4 1 1 A 80 80 ILE CB C 80 38.129 37.375 0.754 1
1 1055 . 4 1 1 A 80 80 ILE N N 80 119.666 120.752 -1.086 1
1 1056 . 4 1 1 A 81 81 ARG H H 81 9.384 8.550 0.834 1
1 1057 . 4 1 1 A 81 81 ARG HA H 81 3.834 3.926 -0.092 1
1 1065 . 4 1 1 A 81 81 ARG C C 81 178.204 179.030 -0.826 1
1 1066 . 4 1 1 A 81 81 ARG CA C 81 60.560 59.940 0.620 1
1 1067 . 4 1 1 A 81 81 ARG CB C 81 30.196 30.147 0.049 1
1 1070 . 4 1 1 A 81 81 ARG N N 81 121.030 119.706 1.324 1
1 1072 . 4 1 1 A 82 82 ASN H H 82 8.773 8.182 0.591 1
1 1073 . 4 1 1 A 82 82 ASN HA H 82 4.587 4.640 -0.053 1
1 1078 . 4 1 1 A 82 82 ASN C C 82 178.300 177.771 0.529 1
1 1079 . 4 1 1 A 82 82 ASN CA C 82 56.160 56.062 0.098 1
1 1080 . 4 1 1 A 82 82 ASN CB C 82 38.464 38.978 -0.514 1
1 1081 . 4 1 1 A 82 82 ASN N N 82 118.483 118.349 0.134 1
1 1083 . 4 1 1 A 83 83 SER H H 83 8.526 7.438 1.088 1
1 1084 . 4 1 1 A 83 83 SER HA H 83 2.765 3.408 -0.643 1
1 1087 . 4 1 1 A 83 83 SER C C 83 176.386 177.493 -1.107 1
1 1088 . 4 1 1 A 83 83 SER CA C 83 61.245 60.868 0.377 1
1 1089 . 4 1 1 A 83 83 SER CB C 83 61.287 62.427 -1.140 1
1 1090 . 4 1 1 A 83 83 SER N N 83 118.286 114.511 3.775 1
1 1091 . 4 1 1 A 84 84 LEU H H 84 7.782 8.385 -0.603 1
1 1092 . 4 1 1 A 84 84 LEU HA H 84 4.221 4.051 0.170 1
1 1102 . 4 1 1 A 84 84 LEU C C 84 177.846 179.520 -1.674 1
1 1103 . 4 1 1 A 84 84 LEU CA C 84 57.166 57.905 -0.739 1
1 1104 . 4 1 1 A 84 84 LEU CB C 84 40.520 41.073 -0.553 1
1 1108 . 4 1 1 A 84 84 LEU N N 84 127.445 121.480 5.965 1
1 1109 . 4 1 1 A 85 85 GLU H H 85 8.264 8.534 -0.270 1
1 1110 . 4 1 1 A 85 85 GLU HA H 85 3.981 3.995 -0.014 1
1 1115 . 4 1 1 A 85 85 GLU C C 85 179.288 179.245 0.043 1
1 1116 . 4 1 1 A 85 85 GLU CA C 85 59.025 59.978 -0.953 1
1 1117 . 4 1 1 A 85 85 GLU CB C 85 29.182 29.416 -0.234 1
1 1119 . 4 1 1 A 85 85 GLU N N 85 121.538 120.363 1.175 1
1 1120 . 4 1 1 A 86 86 HIS H H 86 7.683 8.433 -0.750 1
1 1121 . 4 1 1 A 86 86 HIS HA H 86 4.573 4.346 0.227 1
1 1125 . 4 1 1 A 86 86 HIS C C 86 175.484 177.604 -2.120 1
1 1126 . 4 1 1 A 86 86 HIS CA C 86 58.940 59.527 -0.587 1
1 1127 . 4 1 1 A 86 86 HIS CB C 86 29.267 29.984 -0.717 1
1 1129 . 4 1 1 A 86 86 HIS N N 86 117.087 120.654 -3.567 1
1 1130 . 4 1 1 A 87 87 ALA H H 87 7.197 8.030 -0.833 1
1 1131 . 4 1 1 A 87 87 ALA HA H 87 3.925 3.861 0.064 1
1 1135 . 4 1 1 A 87 87 ALA C C 87 179.038 180.362 -1.324 1
1 1136 . 4 1 1 A 87 87 ALA CA C 87 54.863 54.960 -0.097 1
1 1137 . 4 1 1 A 87 87 ALA CB C 87 17.034 18.422 -1.388 1
1 1138 . 4 1 1 A 87 87 ALA N N 87 121.510 120.835 0.675 1
1 1139 . 4 1 1 A 88 88 ILE H H 88 7.819 7.675 0.144 1
1 1140 . 4 1 1 A 88 88 ILE HA H 88 4.067 3.997 0.070 1
1 1150 . 4 1 1 A 88 88 ILE C C 88 180.846 177.529 3.317 1
1 1151 . 4 1 1 A 88 88 ILE CA C 88 64.021 65.261 -1.240 1
1 1152 . 4 1 1 A 88 88 ILE CB C 88 37.557 37.580 -0.023 1
1 1156 . 4 1 1 A 88 88 ILE N N 88 120.898 119.365 1.533 1
1 1157 . 4 1 1 A 89 89 ASP H H 89 7.808 8.057 -0.249 1
1 1158 . 4 1 1 A 89 89 ASP HA H 89 4.437 4.395 0.042 1
1 1161 . 4 1 1 A 89 89 ASP C C 89 178.033 177.800 0.233 1
1 1162 . 4 1 1 A 89 89 ASP CA C 89 57.343 57.489 -0.146 1
1 1163 . 4 1 1 A 89 89 ASP CB C 89 39.689 41.652 -1.963 1
1 1164 . 4 1 1 A 89 89 ASP N N 89 125.174 121.759 3.415 1
1 1165 . 4 1 1 A 90 90 LEU H H 90 7.607 7.642 -0.035 1
1 1166 . 4 1 1 A 90 90 LEU HA H 90 4.198 4.214 -0.016 1
1 1176 . 4 1 1 A 90 90 LEU C C 90 175.416 175.992 -0.576 1
1 1177 . 4 1 1 A 90 90 LEU CA C 90 54.755 55.060 -0.305 1
1 1178 . 4 1 1 A 90 90 LEU CB C 90 42.960 41.830 1.130 1
1 1182 . 4 1 1 A 90 90 LEU N N 90 117.576 117.237 0.339 1
1 1183 . 4 1 1 A 91 91 GLU H H 91 8.143 7.987 0.156 1
1 1184 . 4 1 1 A 91 91 GLU HA H 91 4.005 4.054 -0.049 1
1 1189 . 4 1 1 A 91 91 GLU C C 91 175.792 176.171 -0.379 1
1 1190 . 4 1 1 A 91 91 GLU CA C 91 57.202 57.524 -0.322 1
1 1191 . 4 1 1 A 91 91 GLU CB C 91 26.125 26.635 -0.510 1
1 1193 . 4 1 1 A 91 91 GLU N N 91 113.620 115.272 -1.652 1
1 1194 . 4 1 1 A 92 92 LEU H H 92 8.290 8.006 0.284 1
1 1195 . 4 1 1 A 92 92 LEU HA H 92 4.216 4.135 0.081 1
1 1205 . 4 1 1 A 92 92 LEU C C 92 176.622 176.989 -0.367 1
1 1206 . 4 1 1 A 92 92 LEU CA C 92 56.410 56.333 0.077 1
1 1207 . 4 1 1 A 92 92 LEU CB C 92 43.378 42.560 0.818 1
1 1211 . 4 1 1 A 92 92 LEU N N 92 116.868 118.544 -1.676 1
1 1212 . 4 1 1 A 93 93 ILE H H 93 6.988 6.880 0.108 1
1 1213 . 4 1 1 A 93 93 ILE HA H 93 4.580 4.553 0.027 1
1 1223 . 4 1 1 A 93 93 ILE C C 93 175.145 175.801 -0.656 1
1 1224 . 4 1 1 A 93 93 ILE CA C 93 58.707 58.551 0.156 1
1 1225 . 4 1 1 A 93 93 ILE CB C 93 42.864 41.459 1.405 1
1 1229 . 4 1 1 A 93 93 ILE N N 93 107.565 113.849 -6.284 1
1 1230 . 4 1 1 A 94 94 THR H H 94 8.742 8.496 0.246 1
1 1231 . 4 1 1 A 94 94 THR HA H 94 4.489 4.299 0.190 1
1 1236 . 4 1 1 A 94 94 THR C C 94 173.875 173.761 0.114 1
1 1237 . 4 1 1 A 94 94 THR CA C 94 61.842 63.499 -1.657 1
1 1238 . 4 1 1 A 94 94 THR CB C 94 69.972 70.092 -0.120 1
1 1240 . 4 1 1 A 94 94 THR N N 94 107.904 115.917 -8.013 1
1 1241 . 4 1 1 A 95 95 LYS H H 95 7.294 7.506 -0.212 1
1 1242 . 4 1 1 A 95 95 LYS HA H 95 4.566 4.775 -0.209 1
1 1251 . 4 1 1 A 95 95 LYS C C 95 173.791 173.966 -0.175 1
1 1252 . 4 1 1 A 95 95 LYS CA C 95 54.533 55.704 -1.171 1
1 1253 . 4 1 1 A 95 95 LYS CB C 95 35.123 36.056 -0.933 1
1 1257 . 4 1 1 A 95 95 LYS N N 95 119.458 120.203 -0.745 1
1 1258 . 4 1 1 A 96 96 ASN H H 96 9.157 8.519 0.638 1
1 1259 . 4 1 1 A 96 96 ASN HA H 96 4.408 5.285 -0.877 1
1 1264 . 4 1 1 A 96 96 ASN C C 96 176.653 175.969 0.684 1
1 1265 . 4 1 1 A 96 96 ASN CA C 96 51.088 51.777 -0.689 1
1 1266 . 4 1 1 A 96 96 ASN CB C 96 37.292 39.707 -2.415 1
1 1267 . 4 1 1 A 96 96 ASN N N 96 121.031 123.608 -2.577 1
1 1269 . 4 1 1 A 97 97 VAL H H 97 8.193 8.529 -0.336 1
1 1270 . 4 1 1 A 97 97 VAL HA H 97 4.019 4.090 -0.071 1
1 1278 . 4 1 1 A 97 97 VAL C C 97 175.089 176.035 -0.946 1
1 1279 . 4 1 1 A 97 97 VAL CA C 97 63.437 62.994 0.443 1
1 1280 . 4 1 1 A 97 97 VAL CB C 97 29.934 31.654 -1.720 1
1 1283 . 4 1 1 A 97 97 VAL N N 97 118.839 120.328 -1.489 1
1 1284 . 4 1 1 A 98 98 ALA H H 98 7.994 7.254 0.740 1
1 1285 . 4 1 1 A 98 98 ALA HA H 98 5.108 4.142 0.966 1
1 1289 . 4 1 1 A 98 98 ALA C C 98 178.033 178.712 -0.679 1
1 1290 . 4 1 1 A 98 98 ALA CA C 98 50.342 52.538 -2.196 1
1 1291 . 4 1 1 A 98 98 ALA CB C 98 19.659 19.002 0.657 1
1 1292 . 4 1 1 A 98 98 ALA N N 98 121.031 124.688 -3.657 1
1 1293 . 4 1 1 A 99 99 ALA H H 99 7.347 7.696 -0.349 1
1 1294 . 4 1 1 A 99 99 ALA HA H 99 3.818 3.981 -0.163 1
1 1298 . 4 1 1 A 99 99 ALA C C 99 177.712 178.685 -0.973 1
1 1299 . 4 1 1 A 99 99 ALA CA C 99 55.117 54.845 0.272 1
1 1300 . 4 1 1 A 99 99 ALA CB C 99 18.879 18.670 0.209 1
1 1301 . 4 1 1 A 99 99 ALA N N 99 122.816 120.608 2.208 1
1 1302 . 4 1 1 A 100 100 LYS H H 100 8.190 7.695 0.495 1
1 1303 . 4 1 1 A 100 100 LYS HA H 100 4.483 4.351 0.132 1
1 1312 . 4 1 1 A 100 100 LYS C C 100 175.899 176.696 -0.797 1
1 1313 . 4 1 1 A 100 100 LYS CA C 100 54.231 57.234 -3.003 1
1 1314 . 4 1 1 A 100 100 LYS CB C 100 32.066 33.023 -0.957 1
1 1318 . 4 1 1 A 100 100 LYS N N 100 113.197 115.062 -1.865 1
1 1319 . 4 1 1 A 101 101 THR H H 101 7.128 7.662 -0.534 1
1 1320 . 4 1 1 A 101 101 THR HA H 101 3.834 4.352 -0.518 1
1 1325 . 4 1 1 A 101 101 THR C C 101 173.255 173.615 -0.360 1
1 1326 . 4 1 1 A 101 101 THR CA C 101 64.392 62.315 2.077 1
1 1327 . 4 1 1 A 101 101 THR CB C 101 69.160 68.556 0.604 1
1 1329 . 4 1 1 A 101 101 THR N N 101 118.368 116.146 2.222 1
1 1330 . 4 1 1 A 102 102 LYS H H 102 8.753 8.890 -0.137 1
1 1331 . 4 1 1 A 102 102 LYS HA H 102 4.438 5.117 -0.679 1
1 1340 . 4 1 1 A 102 102 LYS C C 102 175.627 175.309 0.318 1
1 1341 . 4 1 1 A 102 102 LYS CA C 102 55.117 54.337 0.780 1
1 1342 . 4 1 1 A 102 102 LYS CB C 102 33.901 35.713 -1.812 1
1 1346 . 4 1 1 A 102 102 LYS N N 102 126.513 123.673 2.840 1
1 1347 . 4 1 1 A 103 103 LEU H H 103 8.602 8.310 0.292 1
1 1348 . 4 1 1 A 103 103 LEU HA H 103 4.486 4.401 0.085 1
1 1358 . 4 1 1 A 103 103 LEU CA C 103 52.233 53.167 -0.934 1
1 1359 . 4 1 1 A 103 103 LEU CB C 103 41.028 42.765 -1.737 1
1 1363 . 4 1 1 A 103 103 LEU N N 103 124.466 122.888 1.578 1
1 1364 . 4 1 1 A 104 104 PRO HA H 104 4.437 4.642 -0.205 1
1 1371 . 4 1 1 A 104 104 PRO C C 104 175.779 175.842 -0.063 1
1 1372 . 4 1 1 A 104 104 PRO CA C 104 62.322 62.193 0.129 1
1 1373 . 4 1 1 A 104 104 PRO CB C 104 31.899 32.707 -0.808 1
1 1376 . 4 1 1 A 105 105 LYS H H 105 8.460 8.414 0.046 1
1 1377 . 4 1 1 A 105 105 LYS HA H 105 4.154 4.418 -0.264 1
1 1386 . 4 1 1 A 105 105 LYS C C 105 175.998 175.190 0.808 1
1 1387 . 4 1 1 A 105 105 LYS CA C 105 56.480 55.495 0.985 1
1 1388 . 4 1 1 A 105 105 LYS CB C 105 32.909 31.807 1.102 1
1 1392 . 4 1 1 A 105 105 LYS N N 105 122.139 121.171 0.968 1
1 1393 . 4 1 1 A 106 106 ALA H H 106 8.448 8.083 0.365 1
1 1394 . 4 1 1 A 106 106 ALA HA H 106 4.309 4.612 -0.303 1
1 1398 . 4 1 1 A 106 106 ALA C C 106 176.828 176.780 0.048 1
1 1399 . 4 1 1 A 106 106 ALA CA C 106 51.862 50.602 1.260 1
1 1400 . 4 1 1 A 106 106 ALA CB C 106 19.323 19.285 0.038 1
1 1401 . 4 1 1 A 106 106 ALA N N 106 125.278 129.399 -4.121 1
1 1402 . 4 1 1 A 107 107 ASP H H 107 8.428 8.781 -0.353 1
1 1403 . 4 1 1 A 107 107 ASP HA H 107 4.574 4.245 0.329 1
1 1406 . 4 1 1 A 107 107 ASP C C 107 175.951 175.133 0.818 1
1 1407 . 4 1 1 A 107 107 ASP CA C 107 54.214 56.492 -2.278 1
1 1408 . 4 1 1 A 107 107 ASP CB C 107 41.141 39.451 1.690 1
1 1409 . 4 1 1 A 107 107 ASP N N 107 120.771 118.247 2.524 1
1 1410 . 4 1 1 A 108 108 LYS H H 108 8.329 8.180 0.149 1
1 1411 . 4 1 1 A 108 108 LYS HA H 108 4.203 4.833 -0.630 1
1 1420 . 4 1 1 A 108 108 LYS C C 108 176.483 175.780 0.703 1
1 1421 . 4 1 1 A 108 108 LYS CA C 108 56.831 55.036 1.795 1
1 1422 . 4 1 1 A 108 108 LYS CB C 108 32.648 35.189 -2.541 1
1 1426 . 4 1 1 A 108 108 LYS N N 108 120.727 118.445 2.282 1
1 1427 . 4 1 1 A 109 109 GLU H H 109 8.447 8.844 -0.397 1
1 1428 . 4 1 1 A 109 109 GLU HA H 109 4.215 4.949 -0.734 1
1 1433 . 4 1 1 A 109 109 GLU C C 109 176.513 176.604 -0.091 1
1 1434 . 4 1 1 A 109 109 GLU CA C 109 56.936 54.854 2.082 1
1 1435 . 4 1 1 A 109 109 GLU CB C 109 29.833 33.051 -3.218 1
1 1437 . 4 1 1 A 109 109 GLU N N 109 121.471 122.166 -0.695 1
1 1438 . 4 1 1 A 110 110 GLU H H 110 8.352 9.119 -0.767 1
1 1439 . 4 1 1 A 110 110 GLU HA H 110 4.233 4.142 0.091 1
1 1444 . 4 1 1 A 110 110 GLU C C 110 176.439 176.456 -0.017 1
1 1445 . 4 1 1 A 110 110 GLU CA C 110 56.681 58.292 -1.611 1
1 1446 . 4 1 1 A 110 110 GLU CB C 110 29.860 28.617 1.243 1
1 1448 . 4 1 1 A 110 110 GLU N N 110 121.559 118.751 2.808 1
1 1449 . 4 1 1 A 111 111 LEU H H 111 8.145 7.620 0.525 1
1 1450 . 4 1 1 A 111 111 LEU HA H 111 4.251 4.211 0.040 1
1 1460 . 4 1 1 A 111 111 LEU C C 111 177.306 178.544 -1.238 1
1 1461 . 4 1 1 A 111 111 LEU CA C 111 55.277 55.029 0.248 1
1 1462 . 4 1 1 A 111 111 LEU CB C 111 42.054 42.021 0.033 1
1 1466 . 4 1 1 A 111 111 LEU N N 111 122.181 120.020 2.161 1
1 1467 . 4 1 1 A 112 112 GLU H H 112 8.212 7.453 0.759 1
1 1468 . 4 1 1 A 112 112 GLU N N 112 120.291 120.636 -0.345 1
1 1469 . 4 1 1 A 114 114 HIS C C 114 176.070 174.598 1.472 1
1 1470 . 4 1 1 A 116 116 HIS H H 116 8.227 8.953 -0.726 1
1 1471 . 4 1 1 A 116 116 HIS C C 116 173.580 174.870 -1.290 1
1 1472 . 4 1 1 A 116 116 HIS N N 116 119.156 123.450 -4.294 1
1 5 . 5 1 1 A 3 3 PRO HA H 3 4.390 4.764 -0.374 1
1 12 . 5 1 1 A 3 3 PRO C C 3 176.847 177.399 -0.552 1
1 13 . 5 1 1 A 3 3 PRO CA C 3 63.449 62.255 1.194 1
1 14 . 5 1 1 A 3 3 PRO CB C 3 31.938 31.918 0.020 1
1 17 . 5 1 1 A 4 4 SER H H 4 8.531 8.759 -0.228 1
1 18 . 5 1 1 A 4 4 SER HA H 4 4.262 4.480 -0.218 1
1 21 . 5 1 1 A 4 4 SER C C 4 175.414 174.914 0.500 1
1 22 . 5 1 1 A 4 4 SER CA C 4 59.163 59.437 -0.274 1
1 23 . 5 1 1 A 4 4 SER CB C 4 63.242 63.557 -0.315 1
1 24 . 5 1 1 A 4 4 SER N N 4 114.246 119.036 -4.790 1
1 25 . 5 1 1 A 5 5 LYS H H 5 8.468 7.770 0.698 1
1 26 . 5 1 1 A 5 5 LYS HA H 5 4.433 4.367 0.066 1
1 35 . 5 1 1 A 5 5 LYS C C 5 175.984 177.027 -1.043 1
1 36 . 5 1 1 A 5 5 LYS CA C 5 55.724 57.469 -1.745 1
1 37 . 5 1 1 A 5 5 LYS CB C 5 32.881 33.557 -0.676 1
1 41 . 5 1 1 A 5 5 LYS N N 5 123.488 119.239 4.249 1
1 42 . 5 1 1 A 6 6 LEU H H 6 7.707 7.536 0.171 1
1 43 . 5 1 1 A 6 6 LEU HA H 6 4.381 4.335 0.046 1
1 53 . 5 1 1 A 6 6 LEU C C 6 177.820 176.350 1.470 1
1 54 . 5 1 1 A 6 6 LEU CA C 6 55.507 55.048 0.459 1
1 55 . 5 1 1 A 6 6 LEU CB C 6 43.374 42.669 0.705 1
1 59 . 5 1 1 A 6 6 LEU N N 6 121.233 120.714 0.519 1
1 60 . 5 1 1 A 7 7 SER H H 7 9.433 8.818 0.615 1
1 61 . 5 1 1 A 7 7 SER HA H 7 4.638 4.491 0.147 1
1 64 . 5 1 1 A 7 7 SER C C 7 174.120 174.742 -0.622 1
1 65 . 5 1 1 A 7 7 SER CA C 7 57.962 59.152 -1.190 1
1 66 . 5 1 1 A 7 7 SER CB C 7 64.197 63.685 0.512 1
1 67 . 5 1 1 A 7 7 SER N N 7 122.977 123.201 -0.224 1
1 68 . 5 1 1 A 8 8 TYR H H 8 9.764 9.341 0.423 1
1 69 . 5 1 1 A 8 8 TYR HA H 8 4.732 4.243 0.489 1
1 76 . 5 1 1 A 8 8 TYR C C 8 177.206 177.618 -0.412 1
1 77 . 5 1 1 A 8 8 TYR CA C 8 58.762 61.797 -3.035 1
1 78 . 5 1 1 A 8 8 TYR CB C 8 36.605 38.856 -2.251 1
1 83 . 5 1 1 A 8 8 TYR N N 8 123.312 125.336 -2.024 1
1 84 . 5 1 1 A 9 9 GLY H H 9 10.131 8.486 1.645 1
1 85 . 5 1 1 A 9 9 GLY HA2 H 9 3.983 3.618 0.365 1
1 86 . 5 1 1 A 9 9 GLY HA3 H 9 3.423 3.708 -0.285 1
1 87 . 5 1 1 A 9 9 GLY C C 9 175.163 176.302 -1.139 1
1 88 . 5 1 1 A 9 9 GLY CA C 9 47.153 47.377 -0.224 1
1 89 . 5 1 1 A 9 9 GLY N N 9 107.177 105.916 1.261 1
1 90 . 5 1 1 A 10 10 GLU H H 10 7.876 8.072 -0.196 1
1 91 . 5 1 1 A 10 10 GLU HA H 10 4.107 4.092 0.015 1
1 96 . 5 1 1 A 10 10 GLU C C 10 179.924 179.038 0.886 1
1 97 . 5 1 1 A 10 10 GLU CA C 10 58.890 59.491 -0.601 1
1 98 . 5 1 1 A 10 10 GLU CB C 10 29.750 29.411 0.339 1
1 100 . 5 1 1 A 10 10 GLU N N 10 122.219 121.898 0.321 1
1 101 . 5 1 1 A 11 11 TYR H H 11 8.384 8.126 0.258 1
1 102 . 5 1 1 A 11 11 TYR HA H 11 4.305 4.141 0.164 1
1 107 . 5 1 1 A 11 11 TYR C C 11 176.854 177.109 -0.255 1
1 108 . 5 1 1 A 11 11 TYR CA C 11 61.040 61.821 -0.781 1
1 109 . 5 1 1 A 11 11 TYR CB C 11 37.593 39.386 -1.793 1
1 112 . 5 1 1 A 11 11 TYR N N 11 120.809 122.429 -1.620 1
1 113 . 5 1 1 A 12 12 LEU H H 12 9.027 8.225 0.802 1
1 114 . 5 1 1 A 12 12 LEU HA H 12 3.778 3.735 0.043 1
1 124 . 5 1 1 A 12 12 LEU C C 12 178.621 179.301 -0.680 1
1 125 . 5 1 1 A 12 12 LEU CA C 12 57.534 57.561 -0.027 1
1 126 . 5 1 1 A 12 12 LEU CB C 12 41.957 40.983 0.974 1
1 130 . 5 1 1 A 12 12 LEU N N 12 121.080 119.168 1.912 1
1 131 . 5 1 1 A 13 13 GLU H H 13 7.614 8.055 -0.441 1
1 132 . 5 1 1 A 13 13 GLU HA H 13 4.102 4.057 0.045 1
1 137 . 5 1 1 A 13 13 GLU C C 13 178.449 179.355 -0.906 1
1 138 . 5 1 1 A 13 13 GLU CA C 13 59.609 59.443 0.166 1
1 139 . 5 1 1 A 13 13 GLU CB C 13 29.124 29.674 -0.550 1
1 141 . 5 1 1 A 13 13 GLU N N 13 118.475 120.715 -2.240 1
1 142 . 5 1 1 A 14 14 SER H H 14 7.329 7.928 -0.599 1
1 143 . 5 1 1 A 14 14 SER HA H 14 4.358 4.234 0.124 1
1 146 . 5 1 1 A 14 14 SER C C 14 176.794 175.685 1.109 1
1 147 . 5 1 1 A 14 14 SER CA C 14 61.064 62.472 -1.408 1
1 148 . 5 1 1 A 14 14 SER CB C 14 62.513 63.172 -0.659 1
1 149 . 5 1 1 A 14 14 SER N N 14 115.209 117.354 -2.145 1
1 150 . 5 1 1 A 15 15 TRP H H 15 8.870 8.127 0.743 1
1 151 . 5 1 1 A 15 15 TRP HA H 15 4.005 4.315 -0.310 1
1 160 . 5 1 1 A 15 15 TRP C C 15 177.547 177.933 -0.386 1
1 161 . 5 1 1 A 15 15 TRP CA C 15 61.210 61.092 0.118 1
1 162 . 5 1 1 A 15 15 TRP CB C 15 27.341 29.547 -2.206 1
1 168 . 5 1 1 A 15 15 TRP N N 15 124.998 123.857 1.141 1
1 170 . 5 1 1 A 16 16 PHE H H 16 9.087 8.450 0.637 1
1 171 . 5 1 1 A 16 16 PHE HA H 16 3.210 3.878 -0.668 1
1 179 . 5 1 1 A 16 16 PHE C C 16 175.909 176.784 -0.875 1
1 180 . 5 1 1 A 16 16 PHE CA C 16 61.473 61.822 -0.349 1
1 181 . 5 1 1 A 16 16 PHE CB C 16 38.506 39.320 -0.814 1
1 187 . 5 1 1 A 16 16 PHE N N 16 119.825 121.160 -1.335 1
1 188 . 5 1 1 A 17 17 ASN H H 17 7.768 8.381 -0.613 1
1 189 . 5 1 1 A 17 17 ASN HA H 17 4.078 3.946 0.132 1
1 194 . 5 1 1 A 17 17 ASN C C 17 176.604 177.433 -0.829 1
1 195 . 5 1 1 A 17 17 ASN CA C 17 55.621 55.886 -0.265 1
1 196 . 5 1 1 A 17 17 ASN CB C 17 37.830 37.998 -0.168 1
1 197 . 5 1 1 A 17 17 ASN N N 17 115.600 117.043 -1.443 1
1 199 . 5 1 1 A 18 18 THR H H 18 7.454 7.106 0.348 1
1 200 . 5 1 1 A 18 18 THR HA H 18 4.147 3.976 0.171 1
1 205 . 5 1 1 A 18 18 THR C C 18 175.692 176.147 -0.455 1
1 206 . 5 1 1 A 18 18 THR CA C 18 64.679 64.543 0.136 1
1 207 . 5 1 1 A 18 18 THR CB C 18 68.940 68.684 0.256 1
1 209 . 5 1 1 A 18 18 THR N N 18 113.049 115.192 -2.143 1
1 210 . 5 1 1 A 19 19 LYS H H 19 7.918 7.599 0.319 1
1 211 . 5 1 1 A 19 19 LYS HA H 19 3.791 3.785 0.006 1
1 220 . 5 1 1 A 19 19 LYS C C 19 178.120 178.785 -0.665 1
1 221 . 5 1 1 A 19 19 LYS CA C 19 55.985 58.719 -2.734 1
1 222 . 5 1 1 A 19 19 LYS CB C 19 31.130 31.146 -0.016 1
1 226 . 5 1 1 A 19 19 LYS N N 19 122.614 120.606 2.008 1
1 227 . 5 1 1 A 20 20 ARG H H 20 7.845 7.633 0.212 1
1 228 . 5 1 1 A 20 20 ARG HA H 20 3.396 3.836 -0.440 1
1 236 . 5 1 1 A 20 20 ARG C C 20 175.601 178.702 -3.101 1
1 237 . 5 1 1 A 20 20 ARG CA C 20 58.182 58.642 -0.460 1
1 238 . 5 1 1 A 20 20 ARG CB C 20 28.045 29.786 -1.741 1
1 241 . 5 1 1 A 20 20 ARG N N 20 116.282 117.764 -1.482 1
1 243 . 5 1 1 A 21 21 HIS H H 21 7.163 7.915 -0.752 1
1 244 . 5 1 1 A 21 21 HIS HA H 21 4.500 4.243 0.257 1
1 249 . 5 1 1 A 21 21 HIS C C 21 175.618 175.677 -0.059 1
1 250 . 5 1 1 A 21 21 HIS CA C 21 56.912 59.086 -2.174 1
1 251 . 5 1 1 A 21 21 HIS CB C 21 29.400 30.178 -0.778 1
1 254 . 5 1 1 A 21 21 HIS N N 21 115.452 118.498 -3.046 1
1 255 . 5 1 1 A 22 22 SER H H 22 7.951 7.452 0.499 1
1 256 . 5 1 1 A 22 22 SER HA H 22 4.573 4.462 0.111 1
1 259 . 5 1 1 A 22 22 SER C C 22 173.948 176.280 -2.332 1
1 260 . 5 1 1 A 22 22 SER CA C 22 58.589 59.627 -1.038 1
1 261 . 5 1 1 A 22 22 SER CB C 22 64.228 64.027 0.201 1
1 262 . 5 1 1 A 22 22 SER N N 22 113.209 111.760 1.449 1
1 263 . 5 1 1 A 23 23 VAL H H 23 7.179 7.652 -0.473 1
1 264 . 5 1 1 A 23 23 VAL HA H 23 4.626 4.051 0.575 1
1 272 . 5 1 1 A 23 23 VAL C C 23 175.397 175.865 -0.468 1
1 273 . 5 1 1 A 23 23 VAL CA C 23 59.556 63.931 -4.375 1
1 274 . 5 1 1 A 23 23 VAL CB C 23 33.810 32.814 0.996 1
1 277 . 5 1 1 A 23 23 VAL N N 23 113.108 115.450 -2.342 1
1 278 . 5 1 1 A 24 24 GLY H H 24 8.189 7.502 0.687 1
1 279 . 5 1 1 A 24 24 GLY HA2 H 24 4.074 4.009 0.065 1
1 280 . 5 1 1 A 24 24 GLY HA3 H 24 4.195 4.035 0.160 1
1 281 . 5 1 1 A 24 24 GLY C C 24 174.037 175.034 -0.997 1
1 282 . 5 1 1 A 24 24 GLY CA C 24 44.452 44.252 0.200 1
1 283 . 5 1 1 A 24 24 GLY N N 24 108.374 109.479 -1.105 1
1 284 . 5 1 1 A 25 25 ILE H H 25 8.331 8.703 -0.372 1
1 285 . 5 1 1 A 25 25 ILE HA H 25 3.839 3.732 0.107 1
1 295 . 5 1 1 A 25 25 ILE C C 25 178.042 177.690 0.352 1
1 296 . 5 1 1 A 25 25 ILE CA C 25 64.238 64.192 0.046 1
1 297 . 5 1 1 A 25 25 ILE CB C 25 37.931 37.699 0.232 1
1 301 . 5 1 1 A 25 25 ILE N N 25 119.895 120.692 -0.797 1
1 302 . 5 1 1 A 26 26 GLN H H 26 8.545 8.403 0.142 1
1 303 . 5 1 1 A 26 26 GLN HA H 26 4.129 4.057 0.072 1
1 310 . 5 1 1 A 26 26 GLN C C 26 178.454 178.338 0.116 1
1 311 . 5 1 1 A 26 26 GLN CA C 26 58.772 58.272 0.500 1
1 312 . 5 1 1 A 26 26 GLN CB C 26 27.346 28.091 -0.745 1
1 314 . 5 1 1 A 26 26 GLN N N 26 120.013 120.067 -0.054 1
1 316 . 5 1 1 A 27 27 THR H H 27 7.944 8.157 -0.213 1
1 317 . 5 1 1 A 27 27 THR HA H 27 3.953 3.875 0.078 1
1 322 . 5 1 1 A 27 27 THR C C 27 175.818 176.284 -0.466 1
1 323 . 5 1 1 A 27 27 THR CA C 27 65.855 66.113 -0.258 1
1 324 . 5 1 1 A 27 27 THR CB C 27 68.127 68.301 -0.174 1
1 326 . 5 1 1 A 27 27 THR N N 27 117.645 116.856 0.789 1
1 327 . 5 1 1 A 28 28 ALA H H 28 8.593 8.067 0.526 1
1 328 . 5 1 1 A 28 28 ALA HA H 28 3.899 4.112 -0.213 1
1 332 . 5 1 1 A 28 28 ALA C C 28 178.515 179.723 -1.208 1
1 333 . 5 1 1 A 28 28 ALA CA C 28 55.742 55.676 0.066 1
1 334 . 5 1 1 A 28 28 ALA CB C 28 17.513 18.595 -1.082 1
1 335 . 5 1 1 A 28 28 ALA N N 28 123.917 123.499 0.418 1
1 336 . 5 1 1 A 29 29 LYS H H 29 7.800 7.536 0.264 1
1 337 . 5 1 1 A 29 29 LYS HA H 29 3.982 4.116 -0.134 1
1 346 . 5 1 1 A 29 29 LYS C C 29 179.527 178.921 0.606 1
1 347 . 5 1 1 A 29 29 LYS CA C 29 59.761 59.457 0.304 1
1 348 . 5 1 1 A 29 29 LYS CB C 29 32.223 32.098 0.125 1
1 352 . 5 1 1 A 29 29 LYS N N 29 117.474 118.776 -1.302 1
1 353 . 5 1 1 A 30 30 VAL H H 30 7.591 7.600 -0.009 1
1 354 . 5 1 1 A 30 30 VAL HA H 30 3.503 3.378 0.125 1
1 362 . 5 1 1 A 30 30 VAL C C 30 178.389 177.891 0.498 1
1 363 . 5 1 1 A 30 30 VAL CA C 30 65.640 66.017 -0.377 1
1 364 . 5 1 1 A 30 30 VAL CB C 30 31.644 31.536 0.108 1
1 367 . 5 1 1 A 30 30 VAL N N 30 121.749 120.982 0.767 1
1 368 . 5 1 1 A 31 31 LEU H H 31 8.333 8.233 0.100 1
1 369 . 5 1 1 A 31 31 LEU HA H 31 4.074 4.073 0.001 1
1 379 . 5 1 1 A 31 31 LEU C C 31 177.780 179.365 -1.585 1
1 380 . 5 1 1 A 31 31 LEU CA C 31 58.157 57.951 0.206 1
1 381 . 5 1 1 A 31 31 LEU CB C 31 42.230 41.254 0.976 1
1 385 . 5 1 1 A 31 31 LEU N N 31 120.901 118.782 2.119 1
1 386 . 5 1 1 A 32 32 LYS H H 32 8.562 8.075 0.487 1
1 387 . 5 1 1 A 32 32 LYS HA H 32 3.290 3.678 -0.388 1
1 395 . 5 1 1 A 32 32 LYS C C 32 178.037 178.939 -0.902 1
1 396 . 5 1 1 A 32 32 LYS CA C 32 58.911 59.575 -0.664 1
1 397 . 5 1 1 A 32 32 LYS CB C 32 31.605 31.547 0.058 1
1 401 . 5 1 1 A 32 32 LYS N N 32 119.075 119.933 -0.858 1
1 402 . 5 1 1 A 33 33 GLY H H 33 7.694 7.982 -0.288 1
1 403 . 5 1 1 A 33 33 GLY HA2 H 33 3.949 3.636 0.313 1
1 404 . 5 1 1 A 33 33 GLY HA3 H 33 3.826 3.709 0.117 1
1 405 . 5 1 1 A 33 33 GLY C C 33 177.101 175.983 1.118 1
1 406 . 5 1 1 A 33 33 GLY CA C 33 46.928 46.988 -0.060 1
1 407 . 5 1 1 A 33 33 GLY N N 33 105.282 106.800 -1.518 1
1 408 . 5 1 1 A 34 34 TYR H H 34 8.015 7.571 0.444 1
1 409 . 5 1 1 A 34 34 TYR HA H 34 4.558 4.552 0.006 1
1 416 . 5 1 1 A 34 34 TYR C C 34 179.611 178.216 1.395 1
1 417 . 5 1 1 A 34 34 TYR CA C 34 59.349 60.521 -1.172 1
1 418 . 5 1 1 A 34 34 TYR CB C 34 37.344 38.646 -1.302 1
1 423 . 5 1 1 A 34 34 TYR N N 34 121.781 121.741 0.040 1
1 424 . 5 1 1 A 35 35 LEU H H 35 8.689 8.182 0.507 1
1 425 . 5 1 1 A 35 35 LEU HA H 35 3.977 3.863 0.114 1
1 435 . 5 1 1 A 35 35 LEU C C 35 177.081 179.452 -2.371 1
1 436 . 5 1 1 A 35 35 LEU CA C 35 59.155 58.439 0.716 1
1 437 . 5 1 1 A 35 35 LEU CB C 35 41.103 41.580 -0.477 1
1 441 . 5 1 1 A 35 35 LEU N N 35 120.392 121.294 -0.902 1
1 442 . 5 1 1 A 36 36 ASN H H 36 8.721 8.376 0.345 1
1 443 . 5 1 1 A 36 36 ASN HA H 36 4.435 4.490 -0.055 1
1 448 . 5 1 1 A 36 36 ASN C C 36 176.792 177.585 -0.793 1
1 449 . 5 1 1 A 36 36 ASN CA C 36 55.642 55.243 0.399 1
1 450 . 5 1 1 A 36 36 ASN CB C 36 38.319 36.726 1.593 1
1 451 . 5 1 1 A 36 36 ASN N N 36 114.623 115.778 -1.155 1
1 453 . 5 1 1 A 37 37 SER H H 37 8.511 7.907 0.604 1
1 454 . 5 1 1 A 37 37 SER HA H 37 4.642 4.344 0.298 1
1 457 . 5 1 1 A 37 37 SER C C 37 175.039 176.471 -1.432 1
1 458 . 5 1 1 A 37 37 SER CA C 37 59.825 61.296 -1.471 1
1 459 . 5 1 1 A 37 37 SER CB C 37 64.056 62.943 1.113 1
1 460 . 5 1 1 A 37 37 SER N N 37 110.941 115.541 -4.600 1
1 461 . 5 1 1 A 38 38 ARG H H 38 7.242 8.147 -0.905 1
1 462 . 5 1 1 A 38 38 ARG HA H 38 4.919 4.427 0.492 1
1 469 . 5 1 1 A 38 38 ARG C C 38 176.514 178.168 -1.654 1
1 470 . 5 1 1 A 38 38 ARG CA C 38 56.687 57.941 -1.254 1
1 471 . 5 1 1 A 38 38 ARG CB C 38 32.434 31.210 1.224 1
1 474 . 5 1 1 A 38 38 ARG N N 38 117.062 120.681 -3.619 1
1 475 . 5 1 1 A 39 39 ILE H H 39 8.462 7.886 0.576 1
1 476 . 5 1 1 A 39 39 ILE HA H 39 3.618 4.008 -0.390 1
1 486 . 5 1 1 A 39 39 ILE C C 39 176.267 178.511 -2.244 1
1 487 . 5 1 1 A 39 39 ILE CA C 39 66.134 64.707 1.427 1
1 488 . 5 1 1 A 39 39 ILE CB C 39 39.787 37.353 2.434 1
1 492 . 5 1 1 A 39 39 ILE N N 39 121.214 120.404 0.810 1
1 493 . 5 1 1 A 40 40 ILE H H 40 9.339 8.043 1.296 1
1 494 . 5 1 1 A 40 40 ILE HA H 40 3.401 3.742 -0.341 1
1 504 . 5 1 1 A 40 40 ILE CA C 40 67.844 66.274 1.570 1
1 505 . 5 1 1 A 40 40 ILE CB C 40 34.406 35.370 -0.964 1
1 509 . 5 1 1 A 40 40 ILE N N 40 119.695 121.746 -2.051 1
1 510 . 5 1 1 A 41 41 PRO HA H 41 4.314 4.341 -0.027 1
1 517 . 5 1 1 A 41 41 PRO C C 41 177.418 178.806 -1.388 1
1 518 . 5 1 1 A 41 41 PRO CA C 41 65.912 66.231 -0.319 1
1 519 . 5 1 1 A 41 41 PRO CB C 41 30.686 30.584 0.102 1
1 522 . 5 1 1 A 42 42 SER H H 42 6.857 8.328 -1.471 1
1 523 . 5 1 1 A 42 42 SER HA H 42 4.558 4.309 0.249 1
1 526 . 5 1 1 A 42 42 SER C C 42 174.813 176.098 -1.285 1
1 527 . 5 1 1 A 42 42 SER CA C 42 61.279 61.151 0.128 1
1 528 . 5 1 1 A 42 42 SER CB C 42 64.285 63.667 0.618 1
1 529 . 5 1 1 A 42 42 SER N N 42 108.994 112.440 -3.446 1
1 530 . 5 1 1 A 43 43 LEU H H 43 8.230 8.041 0.189 1
1 531 . 5 1 1 A 43 43 LEU HA H 43 4.572 4.415 0.157 1
1 541 . 5 1 1 A 43 43 LEU C C 43 177.301 178.606 -1.305 1
1 542 . 5 1 1 A 43 43 LEU CA C 43 54.113 54.549 -0.436 1
1 543 . 5 1 1 A 43 43 LEU CB C 43 44.800 42.524 2.276 1
1 547 . 5 1 1 A 43 43 LEU N N 43 118.715 119.928 -1.213 1
1 548 . 5 1 1 A 44 44 GLY H H 44 8.498 8.169 0.329 1
1 549 . 5 1 1 A 44 44 GLY HA2 H 44 4.010 3.828 0.182 1
1 550 . 5 1 1 A 44 44 GLY HA3 H 44 3.613 3.870 -0.257 1
1 551 . 5 1 1 A 44 44 GLY C C 44 174.178 176.155 -1.977 1
1 552 . 5 1 1 A 44 44 GLY CA C 44 46.271 47.343 -1.072 1
1 553 . 5 1 1 A 44 44 GLY N N 44 105.371 108.246 -2.875 1
1 554 . 5 1 1 A 45 45 ASN H H 45 8.385 7.966 0.419 1
1 555 . 5 1 1 A 45 45 ASN HA H 45 4.789 4.691 0.098 1
1 560 . 5 1 1 A 45 45 ASN C C 45 175.386 176.604 -1.218 1
1 561 . 5 1 1 A 45 45 ASN CA C 45 53.144 55.024 -1.880 1
1 562 . 5 1 1 A 45 45 ASN CB C 45 37.928 38.360 -0.432 1
1 563 . 5 1 1 A 45 45 ASN N N 45 114.387 118.909 -4.522 1
1 565 . 5 1 1 A 46 46 ILE H H 46 7.465 7.504 -0.039 1
1 566 . 5 1 1 A 46 46 ILE HA H 46 3.856 4.034 -0.178 1
1 576 . 5 1 1 A 46 46 ILE C C 46 175.997 176.330 -0.333 1
1 577 . 5 1 1 A 46 46 ILE CA C 46 60.853 61.961 -1.108 1
1 578 . 5 1 1 A 46 46 ILE CB C 46 38.042 38.248 -0.206 1
1 582 . 5 1 1 A 46 46 ILE N N 46 123.998 121.209 2.789 1
1 583 . 5 1 1 A 47 47 LYS H H 47 8.717 8.678 0.039 1
1 584 . 5 1 1 A 47 47 LYS HA H 47 4.249 4.321 -0.072 1
1 591 . 5 1 1 A 47 47 LYS C C 47 177.583 177.690 -0.107 1
1 592 . 5 1 1 A 47 47 LYS CA C 47 56.320 56.789 -0.469 1
1 593 . 5 1 1 A 47 47 LYS CB C 47 30.393 32.882 -2.489 1
1 596 . 5 1 1 A 47 47 LYS N N 47 126.114 124.617 1.497 1
1 597 . 5 1 1 A 48 48 LEU H H 48 8.323 8.642 -0.319 1
1 598 . 5 1 1 A 48 48 LEU HA H 48 3.691 3.981 -0.290 1
1 608 . 5 1 1 A 48 48 LEU C C 48 177.274 178.305 -1.031 1
1 609 . 5 1 1 A 48 48 LEU CA C 48 58.443 58.341 0.102 1
1 610 . 5 1 1 A 48 48 LEU CB C 48 42.282 41.263 1.019 1
1 614 . 5 1 1 A 48 48 LEU N N 48 125.857 126.035 -0.178 1
1 615 . 5 1 1 A 49 49 ALA H H 49 8.929 7.976 0.953 1
1 616 . 5 1 1 A 49 49 ALA HA H 49 4.067 3.988 0.079 1
1 620 . 5 1 1 A 49 49 ALA C C 49 177.468 178.919 -1.451 1
1 621 . 5 1 1 A 49 49 ALA CA C 49 53.092 54.645 -1.553 1
1 622 . 5 1 1 A 49 49 ALA CB C 49 18.562 18.139 0.423 1
1 623 . 5 1 1 A 49 49 ALA N N 49 115.543 120.098 -4.555 1
1 624 . 5 1 1 A 50 50 LYS H H 50 7.684 7.348 0.336 1
1 625 . 5 1 1 A 50 50 LYS HA H 50 4.395 4.275 0.120 1
1 634 . 5 1 1 A 50 50 LYS C C 50 174.958 176.667 -1.709 1
1 635 . 5 1 1 A 50 50 LYS CA C 50 53.977 56.653 -2.676 1
1 636 . 5 1 1 A 50 50 LYS CB C 50 32.645 32.683 -0.038 1
1 640 . 5 1 1 A 50 50 LYS N N 50 114.788 114.719 0.069 1
1 641 . 5 1 1 A 51 51 LEU H H 51 6.776 6.904 -0.128 1
1 642 . 5 1 1 A 51 51 LEU HA H 51 4.569 4.420 0.149 1
1 652 . 5 1 1 A 51 51 LEU C C 51 177.953 175.673 2.280 1
1 653 . 5 1 1 A 51 51 LEU CA C 51 55.318 54.864 0.454 1
1 654 . 5 1 1 A 51 51 LEU CB C 51 43.182 40.527 2.655 1
1 658 . 5 1 1 A 51 51 LEU N N 51 121.408 121.970 -0.562 1
1 659 . 5 1 1 A 52 52 THR H H 52 10.680 7.850 2.830 1
1 660 . 5 1 1 A 52 52 THR HA H 52 4.938 4.536 0.402 1
1 665 . 5 1 1 A 52 52 THR C C 52 175.553 174.938 0.615 1
1 666 . 5 1 1 A 52 52 THR CA C 52 59.740 60.225 -0.485 1
1 667 . 5 1 1 A 52 52 THR CB C 52 73.557 70.642 2.915 1
1 669 . 5 1 1 A 52 52 THR N N 52 119.481 119.315 0.166 1
1 670 . 5 1 1 A 53 53 SER H H 53 9.278 9.053 0.225 1
1 671 . 5 1 1 A 53 53 SER HA H 53 4.261 4.118 0.143 1
1 674 . 5 1 1 A 53 53 SER C C 53 176.990 176.284 0.706 1
1 675 . 5 1 1 A 53 53 SER CA C 53 61.025 62.443 -1.418 1
1 676 . 5 1 1 A 53 53 SER CB C 53 62.312 62.944 -0.632 1
1 677 . 5 1 1 A 53 53 SER N N 53 116.343 121.162 -4.819 1
1 678 . 5 1 1 A 54 54 LEU H H 54 7.808 7.908 -0.100 1
1 679 . 5 1 1 A 54 54 LEU HA H 54 4.229 4.021 0.208 1
1 688 . 5 1 1 A 54 54 LEU C C 54 178.505 178.722 -0.217 1
1 689 . 5 1 1 A 54 54 LEU CA C 54 57.719 58.031 -0.312 1
1 690 . 5 1 1 A 54 54 LEU CB C 54 40.997 41.752 -0.755 1
1 694 . 5 1 1 A 54 54 LEU N N 54 126.055 122.559 3.496 1
1 695 . 5 1 1 A 55 55 HIS H H 55 7.798 7.925 -0.127 1
1 696 . 5 1 1 A 55 55 HIS HA H 55 4.311 4.289 0.022 1
1 701 . 5 1 1 A 55 55 HIS C C 55 180.044 177.739 2.305 1
1 702 . 5 1 1 A 55 55 HIS CA C 55 60.583 59.735 0.848 1
1 703 . 5 1 1 A 55 55 HIS CB C 55 31.445 29.391 2.054 1
1 706 . 5 1 1 A 55 55 HIS N N 55 118.683 117.917 0.766 1
1 707 . 5 1 1 A 56 56 MET H H 56 7.375 8.294 -0.919 1
1 708 . 5 1 1 A 56 56 MET HA H 56 4.513 4.036 0.477 1
1 716 . 5 1 1 A 56 56 MET C C 56 177.169 178.403 -1.234 1
1 717 . 5 1 1 A 56 56 MET CA C 56 55.823 59.065 -3.242 1
1 718 . 5 1 1 A 56 56 MET CB C 56 31.303 33.467 -2.164 1
1 721 . 5 1 1 A 56 56 MET N N 56 114.530 118.036 -3.506 1
1 722 . 5 1 1 A 57 57 GLN H H 57 8.387 8.067 0.320 1
1 723 . 5 1 1 A 57 57 GLN HA H 57 3.981 4.000 -0.019 1
1 730 . 5 1 1 A 57 57 GLN C C 57 178.033 178.516 -0.483 1
1 731 . 5 1 1 A 57 57 GLN CA C 57 57.922 59.173 -1.251 1
1 732 . 5 1 1 A 57 57 GLN CB C 57 29.012 28.474 0.538 1
1 734 . 5 1 1 A 57 57 GLN N N 57 120.713 119.727 0.986 1
1 736 . 5 1 1 A 58 58 ASN H H 58 8.765 8.484 0.281 1
1 737 . 5 1 1 A 58 58 ASN HA H 58 4.539 4.411 0.128 1
1 742 . 5 1 1 A 58 58 ASN C C 58 178.084 177.775 0.309 1
1 743 . 5 1 1 A 58 58 ASN CA C 58 55.345 56.420 -1.075 1
1 744 . 5 1 1 A 58 58 ASN CB C 58 36.924 37.701 -0.777 1
1 745 . 5 1 1 A 58 58 ASN N N 58 117.390 117.982 -0.592 1
1 747 . 5 1 1 A 59 59 TYR H H 59 8.239 7.814 0.425 1
1 748 . 5 1 1 A 59 59 TYR HA H 59 4.586 4.151 0.435 1
1 755 . 5 1 1 A 59 59 TYR C C 59 178.015 176.978 1.037 1
1 756 . 5 1 1 A 59 59 TYR CA C 59 60.779 61.568 -0.789 1
1 757 . 5 1 1 A 59 59 TYR CB C 59 38.047 38.736 -0.689 1
1 762 . 5 1 1 A 59 59 TYR N N 59 122.335 122.562 -0.227 1
1 763 . 5 1 1 A 60 60 VAL H H 60 8.416 8.439 -0.023 1
1 764 . 5 1 1 A 60 60 VAL HA H 60 3.244 3.537 -0.293 1
1 772 . 5 1 1 A 60 60 VAL C C 60 177.309 178.374 -1.065 1
1 773 . 5 1 1 A 60 60 VAL CA C 60 67.022 66.523 0.499 1
1 774 . 5 1 1 A 60 60 VAL CB C 60 30.929 31.337 -0.408 1
1 777 . 5 1 1 A 60 60 VAL N N 60 119.842 119.542 0.300 1
1 778 . 5 1 1 A 61 61 ASN H H 61 8.264 8.214 0.050 1
1 779 . 5 1 1 A 61 61 ASN HA H 61 4.305 4.412 -0.107 1
1 784 . 5 1 1 A 61 61 ASN C C 61 177.263 177.686 -0.423 1
1 785 . 5 1 1 A 61 61 ASN CA C 61 55.548 56.575 -1.027 1
1 786 . 5 1 1 A 61 61 ASN CB C 61 36.645 38.411 -1.766 1
1 787 . 5 1 1 A 61 61 ASN N N 61 119.103 119.615 -0.512 1
1 789 . 5 1 1 A 62 62 SER H H 62 8.143 7.833 0.310 1
1 790 . 5 1 1 A 62 62 SER HA H 62 4.343 4.116 0.227 1
1 793 . 5 1 1 A 62 62 SER C C 62 176.409 177.421 -1.012 1
1 794 . 5 1 1 A 62 62 SER CA C 62 61.612 61.392 0.220 1
1 795 . 5 1 1 A 62 62 SER CB C 62 62.219 62.932 -0.713 1
1 796 . 5 1 1 A 62 62 SER N N 62 118.254 114.118 4.136 1
1 797 . 5 1 1 A 63 63 LEU H H 63 7.664 8.013 -0.349 1
1 798 . 5 1 1 A 63 63 LEU HA H 63 4.003 3.845 0.158 1
1 808 . 5 1 1 A 63 63 LEU C C 63 178.748 178.874 -0.126 1
1 809 . 5 1 1 A 63 63 LEU CA C 63 57.171 57.826 -0.655 1
1 810 . 5 1 1 A 63 63 LEU CB C 63 41.134 41.264 -0.130 1
1 814 . 5 1 1 A 63 63 LEU N N 63 123.812 122.115 1.697 1
1 815 . 5 1 1 A 64 64 ARG H H 64 7.969 7.603 0.366 1
1 816 . 5 1 1 A 64 64 ARG HA H 64 4.038 3.968 0.070 1
1 824 . 5 1 1 A 64 64 ARG C C 64 180.797 178.626 2.171 1
1 825 . 5 1 1 A 64 64 ARG CA C 64 58.598 58.916 -0.318 1
1 826 . 5 1 1 A 64 64 ARG CB C 64 28.849 29.552 -0.703 1
1 829 . 5 1 1 A 64 64 ARG N N 64 120.376 120.804 -0.428 1
1 831 . 5 1 1 A 65 65 ASP H H 65 8.465 7.942 0.523 1
1 832 . 5 1 1 A 65 65 ASP HA H 65 4.408 4.420 -0.012 1
1 835 . 5 1 1 A 65 65 ASP C C 65 177.336 178.319 -0.983 1
1 836 . 5 1 1 A 65 65 ASP CA C 65 56.957 56.763 0.194 1
1 837 . 5 1 1 A 65 65 ASP CB C 65 39.602 40.080 -0.478 1
1 838 . 5 1 1 A 65 65 ASP N N 65 122.402 118.964 3.438 1
1 839 . 5 1 1 A 66 66 GLU H H 66 7.703 7.839 -0.136 1
1 840 . 5 1 1 A 66 66 GLU HA H 66 4.213 4.321 -0.108 1
1 845 . 5 1 1 A 66 66 GLU C C 66 176.586 177.161 -0.575 1
1 846 . 5 1 1 A 66 66 GLU CA C 66 56.974 56.307 0.667 1
1 847 . 5 1 1 A 66 66 GLU CB C 66 29.821 30.087 -0.266 1
1 849 . 5 1 1 A 66 66 GLU N N 66 119.076 116.643 2.433 1
1 850 . 5 1 1 A 67 67 GLY H H 67 7.861 7.897 -0.036 1
1 851 . 5 1 1 A 67 67 GLY HA2 H 67 4.269 3.904 0.365 1
1 852 . 5 1 1 A 67 67 GLY HA3 H 67 3.731 3.908 -0.177 1
1 853 . 5 1 1 A 67 67 GLY C C 67 174.614 174.984 -0.370 1
1 854 . 5 1 1 A 67 67 GLY CA C 67 44.608 46.547 -1.939 1
1 855 . 5 1 1 A 67 67 GLY N N 67 105.730 109.920 -4.190 1
1 856 . 5 1 1 A 68 68 LEU H H 68 7.324 7.954 -0.630 1
1 857 . 5 1 1 A 68 68 LEU HA H 68 4.257 4.137 0.120 1
1 867 . 5 1 1 A 68 68 LEU C C 68 176.136 176.804 -0.668 1
1 868 . 5 1 1 A 68 68 LEU CA C 68 55.659 54.767 0.892 1
1 869 . 5 1 1 A 68 68 LEU CB C 68 41.874 41.940 -0.066 1
1 873 . 5 1 1 A 68 68 LEU N N 68 121.062 121.081 -0.019 1
1 874 . 5 1 1 A 69 69 LYS H H 69 8.368 8.499 -0.131 1
1 875 . 5 1 1 A 69 69 LYS HA H 69 4.281 4.448 -0.167 1
1 884 . 5 1 1 A 69 69 LYS C C 69 177.940 177.901 0.039 1
1 885 . 5 1 1 A 69 69 LYS CA C 69 55.412 55.884 -0.472 1
1 886 . 5 1 1 A 69 69 LYS CB C 69 32.761 33.437 -0.676 1
1 890 . 5 1 1 A 69 69 LYS N N 69 120.120 122.539 -2.419 1
1 891 . 5 1 1 A 70 70 ARG H H 70 9.095 8.811 0.284 1
1 892 . 5 1 1 A 70 70 ARG HA H 70 3.684 4.102 -0.418 1
1 900 . 5 1 1 A 70 70 ARG C C 70 177.712 178.606 -0.894 1
1 901 . 5 1 1 A 70 70 ARG CA C 70 60.216 58.375 1.841 1
1 902 . 5 1 1 A 70 70 ARG CB C 70 29.539 29.716 -0.177 1
1 905 . 5 1 1 A 70 70 ARG N N 70 123.339 119.940 3.399 1
1 907 . 5 1 1 A 71 71 GLY H H 71 8.985 8.315 0.670 1
1 908 . 5 1 1 A 71 71 GLY HA2 H 71 3.932 3.618 0.314 1
1 909 . 5 1 1 A 71 71 GLY HA3 H 71 3.905 3.619 0.286 1
1 910 . 5 1 1 A 71 71 GLY C C 71 176.324 175.713 0.611 1
1 911 . 5 1 1 A 71 71 GLY CA C 71 46.752 47.430 -0.678 1
1 912 . 5 1 1 A 71 71 GLY N N 71 104.509 108.751 -4.242 1
1 913 . 5 1 1 A 72 72 THR H H 72 7.295 7.760 -0.465 1
1 914 . 5 1 1 A 72 72 THR HA H 72 4.014 3.922 0.092 1
1 919 . 5 1 1 A 72 72 THR C C 72 175.135 176.136 -1.001 1
1 920 . 5 1 1 A 72 72 THR CA C 72 65.848 66.500 -0.652 1
1 921 . 5 1 1 A 72 72 THR CB C 72 68.160 67.898 0.262 1
1 923 . 5 1 1 A 72 72 THR N N 72 118.617 117.443 1.174 1
1 924 . 5 1 1 A 73 73 ILE H H 73 7.883 7.894 -0.011 1
1 925 . 5 1 1 A 73 73 ILE HA H 73 3.258 3.556 -0.298 1
1 935 . 5 1 1 A 73 73 ILE C C 73 177.060 178.028 -0.968 1
1 936 . 5 1 1 A 73 73 ILE CA C 73 66.561 65.517 1.044 1
1 937 . 5 1 1 A 73 73 ILE CB C 73 37.339 37.682 -0.343 1
1 941 . 5 1 1 A 73 73 ILE N N 73 121.692 121.453 0.239 1
1 942 . 5 1 1 A 74 74 GLU H H 74 8.723 8.453 0.270 1
1 943 . 5 1 1 A 74 74 GLU HA H 74 3.807 3.860 -0.053 1
1 948 . 5 1 1 A 74 74 GLU C C 74 178.319 179.196 -0.877 1
1 949 . 5 1 1 A 74 74 GLU CA C 74 59.637 60.248 -0.611 1
1 950 . 5 1 1 A 74 74 GLU CB C 74 29.257 29.502 -0.245 1
1 952 . 5 1 1 A 74 74 GLU N N 74 117.701 120.491 -2.790 1
1 953 . 5 1 1 A 75 75 LYS H H 75 7.361 7.517 -0.156 1
1 954 . 5 1 1 A 75 75 LYS HA H 75 3.958 4.178 -0.220 1
1 963 . 5 1 1 A 75 75 LYS C C 75 178.554 179.714 -1.160 1
1 964 . 5 1 1 A 75 75 LYS CA C 75 59.764 59.486 0.278 1
1 965 . 5 1 1 A 75 75 LYS CB C 75 32.314 32.475 -0.161 1
1 969 . 5 1 1 A 75 75 LYS N N 75 118.734 118.555 0.179 1
1 970 . 5 1 1 A 76 76 ILE H H 76 7.713 7.431 0.282 1
1 971 . 5 1 1 A 76 76 ILE HA H 76 3.221 3.941 -0.720 1
1 981 . 5 1 1 A 76 76 ILE C C 76 177.504 178.317 -0.813 1
1 982 . 5 1 1 A 76 76 ILE CA C 76 65.796 64.683 1.113 1
1 983 . 5 1 1 A 76 76 ILE CB C 76 37.732 36.766 0.966 1
1 987 . 5 1 1 A 76 76 ILE N N 76 120.312 116.746 3.566 1
1 988 . 5 1 1 A 77 77 ILE H H 77 8.587 8.077 0.510 1
1 989 . 5 1 1 A 77 77 ILE HA H 77 3.778 3.747 0.031 1
1 999 . 5 1 1 A 77 77 ILE C C 77 177.074 177.600 -0.526 1
1 1000 . 5 1 1 A 77 77 ILE CA C 77 63.168 64.660 -1.492 1
1 1001 . 5 1 1 A 77 77 ILE CB C 77 36.617 37.129 -0.512 1
1 1005 . 5 1 1 A 77 77 ILE N N 77 118.978 121.245 -2.267 1
1 1006 . 5 1 1 A 78 78 LYS H H 78 8.050 8.052 -0.002 1
1 1007 . 5 1 1 A 78 78 LYS HA H 78 3.925 4.032 -0.107 1
1 1016 . 5 1 1 A 78 78 LYS C C 78 178.291 179.142 -0.851 1
1 1017 . 5 1 1 A 78 78 LYS CA C 78 60.192 59.614 0.578 1
1 1018 . 5 1 1 A 78 78 LYS CB C 78 31.886 32.535 -0.649 1
1 1022 . 5 1 1 A 78 78 LYS N N 78 121.618 119.399 2.219 1
1 1023 . 5 1 1 A 79 79 VAL H H 79 7.619 7.670 -0.051 1
1 1024 . 5 1 1 A 79 79 VAL HA H 79 3.846 3.803 0.043 1
1 1032 . 5 1 1 A 79 79 VAL C C 79 177.712 178.117 -0.405 1
1 1033 . 5 1 1 A 79 79 VAL CA C 79 66.494 66.504 -0.010 1
1 1034 . 5 1 1 A 79 79 VAL CB C 79 31.298 31.776 -0.478 1
1 1037 . 5 1 1 A 79 79 VAL N N 79 120.254 119.518 0.736 1
1 1038 . 5 1 1 A 80 80 ILE H H 80 7.885 7.914 -0.029 1
1 1039 . 5 1 1 A 80 80 ILE HA H 80 3.367 3.751 -0.384 1
1 1049 . 5 1 1 A 80 80 ILE C C 80 179.892 177.877 2.015 1
1 1050 . 5 1 1 A 80 80 ILE CA C 80 65.343 65.242 0.101 1
1 1051 . 5 1 1 A 80 80 ILE CB C 80 38.129 37.430 0.699 1
1 1055 . 5 1 1 A 80 80 ILE N N 80 119.666 118.909 0.757 1
1 1056 . 5 1 1 A 81 81 ARG H H 81 9.384 8.540 0.844 1
1 1057 . 5 1 1 A 81 81 ARG HA H 81 3.834 3.948 -0.114 1
1 1065 . 5 1 1 A 81 81 ARG C C 81 178.204 179.088 -0.884 1
1 1066 . 5 1 1 A 81 81 ARG CA C 81 60.560 59.996 0.564 1
1 1067 . 5 1 1 A 81 81 ARG CB C 81 30.196 30.229 -0.033 1
1 1070 . 5 1 1 A 81 81 ARG N N 81 121.030 119.855 1.175 1
1 1072 . 5 1 1 A 82 82 ASN H H 82 8.773 8.142 0.631 1
1 1073 . 5 1 1 A 82 82 ASN HA H 82 4.587 4.621 -0.034 1
1 1078 . 5 1 1 A 82 82 ASN C C 82 178.300 178.049 0.251 1
1 1079 . 5 1 1 A 82 82 ASN CA C 82 56.160 56.333 -0.173 1
1 1080 . 5 1 1 A 82 82 ASN CB C 82 38.464 38.910 -0.446 1
1 1081 . 5 1 1 A 82 82 ASN N N 82 118.483 118.468 0.015 1
1 1083 . 5 1 1 A 83 83 SER H H 83 8.526 7.883 0.643 1
1 1084 . 5 1 1 A 83 83 SER HA H 83 2.765 3.527 -0.762 1
1 1087 . 5 1 1 A 83 83 SER C C 83 176.386 176.290 0.096 1
1 1088 . 5 1 1 A 83 83 SER CA C 83 61.245 62.092 -0.847 1
1 1089 . 5 1 1 A 83 83 SER CB C 83 61.287 62.723 -1.436 1
1 1090 . 5 1 1 A 83 83 SER N N 83 118.286 116.561 1.725 1
1 1091 . 5 1 1 A 84 84 LEU H H 84 7.782 8.307 -0.525 1
1 1092 . 5 1 1 A 84 84 LEU HA H 84 4.221 4.059 0.162 1
1 1102 . 5 1 1 A 84 84 LEU C C 84 177.846 179.266 -1.420 1
1 1103 . 5 1 1 A 84 84 LEU CA C 84 57.166 57.498 -0.332 1
1 1104 . 5 1 1 A 84 84 LEU CB C 84 40.520 41.143 -0.623 1
1 1108 . 5 1 1 A 84 84 LEU N N 84 127.445 121.132 6.313 1
1 1109 . 5 1 1 A 85 85 GLU H H 85 8.264 8.398 -0.134 1
1 1110 . 5 1 1 A 85 85 GLU HA H 85 3.981 3.981 0.000 1
1 1115 . 5 1 1 A 85 85 GLU C C 85 179.288 179.210 0.078 1
1 1116 . 5 1 1 A 85 85 GLU CA C 85 59.025 59.919 -0.894 1
1 1117 . 5 1 1 A 85 85 GLU CB C 85 29.182 29.601 -0.419 1
1 1119 . 5 1 1 A 85 85 GLU N N 85 121.538 120.376 1.162 1
1 1120 . 5 1 1 A 86 86 HIS H H 86 7.683 8.141 -0.458 1
1 1121 . 5 1 1 A 86 86 HIS HA H 86 4.573 4.374 0.199 1
1 1125 . 5 1 1 A 86 86 HIS C C 86 175.484 177.603 -2.119 1
1 1126 . 5 1 1 A 86 86 HIS CA C 86 58.940 59.368 -0.428 1
1 1127 . 5 1 1 A 86 86 HIS CB C 86 29.267 30.056 -0.789 1
1 1129 . 5 1 1 A 86 86 HIS N N 86 117.087 120.387 -3.300 1
1 1130 . 5 1 1 A 87 87 ALA H H 87 7.197 8.112 -0.915 1
1 1131 . 5 1 1 A 87 87 ALA HA H 87 3.925 3.852 0.073 1
1 1135 . 5 1 1 A 87 87 ALA C C 87 179.038 180.345 -1.307 1
1 1136 . 5 1 1 A 87 87 ALA CA C 87 54.863 54.969 -0.106 1
1 1137 . 5 1 1 A 87 87 ALA CB C 87 17.034 18.467 -1.433 1
1 1138 . 5 1 1 A 87 87 ALA N N 87 121.510 120.990 0.520 1
1 1139 . 5 1 1 A 88 88 ILE H H 88 7.819 7.590 0.229 1
1 1140 . 5 1 1 A 88 88 ILE HA H 88 4.067 4.026 0.041 1
1 1150 . 5 1 1 A 88 88 ILE C C 88 180.846 177.486 3.360 1
1 1151 . 5 1 1 A 88 88 ILE CA C 88 64.021 65.331 -1.310 1
1 1152 . 5 1 1 A 88 88 ILE CB C 88 37.557 37.528 0.029 1
1 1156 . 5 1 1 A 88 88 ILE N N 88 120.898 119.472 1.426 1
1 1157 . 5 1 1 A 89 89 ASP H H 89 7.808 8.016 -0.208 1
1 1158 . 5 1 1 A 89 89 ASP HA H 89 4.437 4.313 0.124 1
1 1161 . 5 1 1 A 89 89 ASP C C 89 178.033 178.061 -0.028 1
1 1162 . 5 1 1 A 89 89 ASP CA C 89 57.343 57.658 -0.315 1
1 1163 . 5 1 1 A 89 89 ASP CB C 89 39.689 42.045 -2.356 1
1 1164 . 5 1 1 A 89 89 ASP N N 89 125.174 121.731 3.443 1
1 1165 . 5 1 1 A 90 90 LEU H H 90 7.607 7.623 -0.016 1
1 1166 . 5 1 1 A 90 90 LEU HA H 90 4.198 4.204 -0.006 1
1 1176 . 5 1 1 A 90 90 LEU C C 90 175.416 175.869 -0.453 1
1 1177 . 5 1 1 A 90 90 LEU CA C 90 54.755 55.011 -0.256 1
1 1178 . 5 1 1 A 90 90 LEU CB C 90 42.960 42.173 0.787 1
1 1182 . 5 1 1 A 90 90 LEU N N 90 117.576 117.352 0.224 1
1 1183 . 5 1 1 A 91 91 GLU H H 91 8.143 7.848 0.295 1
1 1184 . 5 1 1 A 91 91 GLU HA H 91 4.005 4.058 -0.053 1
1 1189 . 5 1 1 A 91 91 GLU C C 91 175.792 176.097 -0.305 1
1 1190 . 5 1 1 A 91 91 GLU CA C 91 57.202 57.575 -0.373 1
1 1191 . 5 1 1 A 91 91 GLU CB C 91 26.125 27.267 -1.142 1
1 1193 . 5 1 1 A 91 91 GLU N N 91 113.620 115.133 -1.513 1
1 1194 . 5 1 1 A 92 92 LEU H H 92 8.290 7.840 0.450 1
1 1195 . 5 1 1 A 92 92 LEU HA H 92 4.216 4.064 0.152 1
1 1205 . 5 1 1 A 92 92 LEU C C 92 176.622 177.019 -0.397 1
1 1206 . 5 1 1 A 92 92 LEU CA C 92 56.410 57.146 -0.736 1
1 1207 . 5 1 1 A 92 92 LEU CB C 92 43.378 42.490 0.888 1
1 1211 . 5 1 1 A 92 92 LEU N N 92 116.868 119.979 -3.111 1
1 1212 . 5 1 1 A 93 93 ILE H H 93 6.988 6.918 0.070 1
1 1213 . 5 1 1 A 93 93 ILE HA H 93 4.580 4.627 -0.047 1
1 1223 . 5 1 1 A 93 93 ILE C C 93 175.145 175.401 -0.256 1
1 1224 . 5 1 1 A 93 93 ILE CA C 93 58.707 58.622 0.085 1
1 1225 . 5 1 1 A 93 93 ILE CB C 93 42.864 40.870 1.994 1
1 1229 . 5 1 1 A 93 93 ILE N N 93 107.565 114.306 -6.741 1
1 1230 . 5 1 1 A 94 94 THR H H 94 8.742 8.425 0.317 1
1 1231 . 5 1 1 A 94 94 THR HA H 94 4.489 4.495 -0.006 1
1 1236 . 5 1 1 A 94 94 THR C C 94 173.875 173.930 -0.055 1
1 1237 . 5 1 1 A 94 94 THR CA C 94 61.842 62.197 -0.355 1
1 1238 . 5 1 1 A 94 94 THR CB C 94 69.972 69.705 0.267 1
1 1240 . 5 1 1 A 94 94 THR N N 94 107.904 112.957 -5.053 1
1 1241 . 5 1 1 A 95 95 LYS H H 95 7.294 7.653 -0.359 1
1 1242 . 5 1 1 A 95 95 LYS HA H 95 4.566 4.766 -0.200 1
1 1251 . 5 1 1 A 95 95 LYS C C 95 173.791 175.346 -1.555 1
1 1252 . 5 1 1 A 95 95 LYS CA C 95 54.533 54.696 -0.163 1
1 1253 . 5 1 1 A 95 95 LYS CB C 95 35.123 34.644 0.479 1
1 1257 . 5 1 1 A 95 95 LYS N N 95 119.458 122.003 -2.545 1
1 1258 . 5 1 1 A 96 96 ASN H H 96 9.157 8.612 0.545 1
1 1259 . 5 1 1 A 96 96 ASN HA H 96 4.408 4.772 -0.364 1
1 1264 . 5 1 1 A 96 96 ASN C C 96 176.653 176.048 0.605 1
1 1265 . 5 1 1 A 96 96 ASN CA C 96 51.088 52.540 -1.452 1
1 1266 . 5 1 1 A 96 96 ASN CB C 96 37.292 38.232 -0.940 1
1 1267 . 5 1 1 A 96 96 ASN N N 96 121.031 125.132 -4.101 1
1 1269 . 5 1 1 A 97 97 VAL H H 97 8.193 8.356 -0.163 1
1 1270 . 5 1 1 A 97 97 VAL HA H 97 4.019 3.772 0.247 1
1 1278 . 5 1 1 A 97 97 VAL C C 97 175.089 176.321 -1.232 1
1 1279 . 5 1 1 A 97 97 VAL CA C 97 63.437 64.098 -0.661 1
1 1280 . 5 1 1 A 97 97 VAL CB C 97 29.934 31.288 -1.354 1
1 1283 . 5 1 1 A 97 97 VAL N N 97 118.839 123.209 -4.370 1
1 1284 . 5 1 1 A 98 98 ALA H H 98 7.994 7.642 0.352 1
1 1285 . 5 1 1 A 98 98 ALA HA H 98 5.108 4.395 0.713 1
1 1289 . 5 1 1 A 98 98 ALA C C 98 178.033 178.619 -0.586 1
1 1290 . 5 1 1 A 98 98 ALA CA C 98 50.342 52.493 -2.151 1
1 1291 . 5 1 1 A 98 98 ALA CB C 98 19.659 18.991 0.668 1
1 1292 . 5 1 1 A 98 98 ALA N N 98 121.031 124.134 -3.103 1
1 1293 . 5 1 1 A 99 99 ALA H H 99 7.347 7.602 -0.255 1
1 1294 . 5 1 1 A 99 99 ALA HA H 99 3.818 4.002 -0.184 1
1 1298 . 5 1 1 A 99 99 ALA C C 99 177.712 178.829 -1.117 1
1 1299 . 5 1 1 A 99 99 ALA CA C 99 55.117 54.909 0.208 1
1 1300 . 5 1 1 A 99 99 ALA CB C 99 18.879 18.672 0.207 1
1 1301 . 5 1 1 A 99 99 ALA N N 99 122.816 120.877 1.939 1
1 1302 . 5 1 1 A 100 100 LYS H H 100 8.190 7.685 0.505 1
1 1303 . 5 1 1 A 100 100 LYS HA H 100 4.483 4.325 0.158 1
1 1312 . 5 1 1 A 100 100 LYS C C 100 175.899 177.127 -1.228 1
1 1313 . 5 1 1 A 100 100 LYS CA C 100 54.231 57.248 -3.017 1
1 1314 . 5 1 1 A 100 100 LYS CB C 100 32.066 32.753 -0.687 1
1 1318 . 5 1 1 A 100 100 LYS N N 100 113.197 115.585 -2.388 1
1 1319 . 5 1 1 A 101 101 THR H H 101 7.128 7.566 -0.438 1
1 1320 . 5 1 1 A 101 101 THR HA H 101 3.834 4.261 -0.427 1
1 1325 . 5 1 1 A 101 101 THR C C 101 173.255 173.728 -0.473 1
1 1326 . 5 1 1 A 101 101 THR CA C 101 64.392 62.703 1.689 1
1 1327 . 5 1 1 A 101 101 THR CB C 101 69.160 67.925 1.235 1
1 1329 . 5 1 1 A 101 101 THR N N 101 118.368 115.968 2.400 1
1 1330 . 5 1 1 A 102 102 LYS H H 102 8.753 7.838 0.915 1
1 1331 . 5 1 1 A 102 102 LYS HA H 102 4.438 4.711 -0.273 1
1 1340 . 5 1 1 A 102 102 LYS C C 102 175.627 176.070 -0.443 1
1 1341 . 5 1 1 A 102 102 LYS CA C 102 55.117 55.613 -0.496 1
1 1342 . 5 1 1 A 102 102 LYS CB C 102 33.901 33.758 0.143 1
1 1346 . 5 1 1 A 102 102 LYS N N 102 126.513 124.719 1.794 1
1 1347 . 5 1 1 A 103 103 LEU H H 103 8.602 8.285 0.317 1
1 1348 . 5 1 1 A 103 103 LEU HA H 103 4.486 4.410 0.076 1
1 1358 . 5 1 1 A 103 103 LEU CA C 103 52.233 53.108 -0.875 1
1 1359 . 5 1 1 A 103 103 LEU CB C 103 41.028 42.817 -1.789 1
1 1363 . 5 1 1 A 103 103 LEU N N 103 124.466 124.544 -0.078 1
1 1364 . 5 1 1 A 104 104 PRO HA H 104 4.437 4.529 -0.092 1
1 1371 . 5 1 1 A 104 104 PRO C C 104 175.779 176.394 -0.615 1
1 1372 . 5 1 1 A 104 104 PRO CA C 104 62.322 62.924 -0.602 1
1 1373 . 5 1 1 A 104 104 PRO CB C 104 31.899 31.769 0.130 1
1 1376 . 5 1 1 A 105 105 LYS H H 105 8.460 8.446 0.014 1
1 1377 . 5 1 1 A 105 105 LYS HA H 105 4.154 4.432 -0.278 1
1 1386 . 5 1 1 A 105 105 LYS C C 105 175.998 177.240 -1.242 1
1 1387 . 5 1 1 A 105 105 LYS CA C 105 56.480 56.209 0.271 1
1 1388 . 5 1 1 A 105 105 LYS CB C 105 32.909 32.679 0.230 1
1 1392 . 5 1 1 A 105 105 LYS N N 105 122.139 121.943 0.196 1
1 1393 . 5 1 1 A 106 106 ALA H H 106 8.448 8.634 -0.186 1
1 1394 . 5 1 1 A 106 106 ALA HA H 106 4.309 4.641 -0.332 1
1 1398 . 5 1 1 A 106 106 ALA C C 106 176.828 175.920 0.908 1
1 1399 . 5 1 1 A 106 106 ALA CA C 106 51.862 51.508 0.354 1
1 1400 . 5 1 1 A 106 106 ALA CB C 106 19.323 19.701 -0.378 1
1 1401 . 5 1 1 A 106 106 ALA N N 106 125.278 126.843 -1.565 1
1 1402 . 5 1 1 A 107 107 ASP H H 107 8.428 7.797 0.631 1
1 1403 . 5 1 1 A 107 107 ASP HA H 107 4.574 4.882 -0.308 1
1 1406 . 5 1 1 A 107 107 ASP C C 107 175.951 173.906 2.045 1
1 1407 . 5 1 1 A 107 107 ASP CA C 107 54.214 53.474 0.740 1
1 1408 . 5 1 1 A 107 107 ASP CB C 107 41.141 42.144 -1.003 1
1 1409 . 5 1 1 A 107 107 ASP N N 107 120.771 114.786 5.985 1
1 1410 . 5 1 1 A 108 108 LYS H H 108 8.329 8.719 -0.390 1
1 1411 . 5 1 1 A 108 108 LYS HA H 108 4.203 5.067 -0.864 1
1 1420 . 5 1 1 A 108 108 LYS C C 108 176.483 174.772 1.711 1
1 1421 . 5 1 1 A 108 108 LYS CA C 108 56.831 54.633 2.198 1
1 1422 . 5 1 1 A 108 108 LYS CB C 108 32.648 35.812 -3.164 1
1 1426 . 5 1 1 A 108 108 LYS N N 108 120.727 115.827 4.900 1
1 1427 . 5 1 1 A 109 109 GLU H H 109 8.447 8.562 -0.115 1
1 1428 . 5 1 1 A 109 109 GLU HA H 109 4.215 4.403 -0.188 1
1 1433 . 5 1 1 A 109 109 GLU C C 109 176.513 177.632 -1.119 1
1 1434 . 5 1 1 A 109 109 GLU CA C 109 56.936 56.846 0.090 1
1 1435 . 5 1 1 A 109 109 GLU CB C 109 29.833 30.051 -0.218 1
1 1437 . 5 1 1 A 109 109 GLU N N 109 121.471 119.883 1.588 1
1 1438 . 5 1 1 A 110 110 GLU H H 110 8.352 8.771 -0.419 1
1 1439 . 5 1 1 A 110 110 GLU HA H 110 4.233 4.385 -0.152 1
1 1444 . 5 1 1 A 110 110 GLU C C 110 176.439 176.937 -0.498 1
1 1445 . 5 1 1 A 110 110 GLU CA C 110 56.681 56.479 0.202 1
1 1446 . 5 1 1 A 110 110 GLU CB C 110 29.860 29.266 0.594 1
1 1448 . 5 1 1 A 110 110 GLU N N 110 121.559 124.925 -3.366 1
1 1449 . 5 1 1 A 111 111 LEU H H 111 8.145 7.887 0.258 1
1 1450 . 5 1 1 A 111 111 LEU HA H 111 4.251 4.302 -0.051 1
1 1460 . 5 1 1 A 111 111 LEU C C 111 177.306 177.263 0.043 1
1 1461 . 5 1 1 A 111 111 LEU CA C 111 55.277 55.973 -0.696 1
1 1462 . 5 1 1 A 111 111 LEU CB C 111 42.054 42.334 -0.280 1
1 1466 . 5 1 1 A 111 111 LEU N N 111 122.181 120.990 1.191 1
1 1467 . 5 1 1 A 112 112 GLU H H 112 8.212 7.770 0.442 1
1 1468 . 5 1 1 A 112 112 GLU N N 112 120.291 119.897 0.394 1
1 1469 . 5 1 1 A 114 114 HIS C C 114 176.070 175.671 0.399 1
1 1470 . 5 1 1 A 116 116 HIS H H 116 8.227 8.452 -0.225 1
1 1471 . 5 1 1 A 116 116 HIS C C 116 173.580 174.979 -1.399 1
1 1472 . 5 1 1 A 116 116 HIS N N 116 119.156 122.510 -3.354 1
1 5 . 6 1 1 A 3 3 PRO HA H 3 4.390 4.488 -0.098 1
1 12 . 6 1 1 A 3 3 PRO C C 3 176.847 176.666 0.181 1
1 13 . 6 1 1 A 3 3 PRO CA C 3 63.449 62.487 0.962 1
1 14 . 6 1 1 A 3 3 PRO CB C 3 31.938 30.007 1.931 1
1 17 . 6 1 1 A 4 4 SER H H 4 8.531 8.235 0.296 1
1 18 . 6 1 1 A 4 4 SER HA H 4 4.262 4.693 -0.431 1
1 21 . 6 1 1 A 4 4 SER C C 4 175.414 174.348 1.066 1
1 22 . 6 1 1 A 4 4 SER CA C 4 59.163 57.603 1.560 1
1 23 . 6 1 1 A 4 4 SER CB C 4 63.242 62.448 0.794 1
1 24 . 6 1 1 A 4 4 SER N N 4 114.246 118.340 -4.094 1
1 25 . 6 1 1 A 5 5 LYS H H 5 8.468 7.854 0.614 1
1 26 . 6 1 1 A 5 5 LYS HA H 5 4.433 4.204 0.229 1
1 35 . 6 1 1 A 5 5 LYS C C 5 175.984 177.315 -1.331 1
1 36 . 6 1 1 A 5 5 LYS CA C 5 55.724 57.702 -1.978 1
1 37 . 6 1 1 A 5 5 LYS CB C 5 32.881 32.887 -0.006 1
1 41 . 6 1 1 A 5 5 LYS N N 5 123.488 126.894 -3.406 1
1 42 . 6 1 1 A 6 6 LEU H H 6 7.707 7.343 0.364 1
1 43 . 6 1 1 A 6 6 LEU HA H 6 4.381 4.369 0.012 1
1 53 . 6 1 1 A 6 6 LEU C C 6 177.820 176.403 1.417 1
1 54 . 6 1 1 A 6 6 LEU CA C 6 55.507 54.758 0.749 1
1 55 . 6 1 1 A 6 6 LEU CB C 6 43.374 42.928 0.446 1
1 59 . 6 1 1 A 6 6 LEU N N 6 121.233 123.160 -1.927 1
1 60 . 6 1 1 A 7 7 SER H H 7 9.433 8.866 0.567 1
1 61 . 6 1 1 A 7 7 SER HA H 7 4.638 4.550 0.088 1
1 64 . 6 1 1 A 7 7 SER C C 7 174.120 175.094 -0.974 1
1 65 . 6 1 1 A 7 7 SER CA C 7 57.962 58.906 -0.944 1
1 66 . 6 1 1 A 7 7 SER CB C 7 64.197 64.301 -0.104 1
1 67 . 6 1 1 A 7 7 SER N N 7 122.977 122.943 0.034 1
1 68 . 6 1 1 A 8 8 TYR H H 8 9.764 9.061 0.703 1
1 69 . 6 1 1 A 8 8 TYR HA H 8 4.732 4.220 0.512 1
1 76 . 6 1 1 A 8 8 TYR C C 8 177.206 177.862 -0.656 1
1 77 . 6 1 1 A 8 8 TYR CA C 8 58.762 61.780 -3.018 1
1 78 . 6 1 1 A 8 8 TYR CB C 8 36.605 38.806 -2.201 1
1 83 . 6 1 1 A 8 8 TYR N N 8 123.312 124.297 -0.985 1
1 84 . 6 1 1 A 9 9 GLY H H 9 10.131 8.385 1.746 1
1 85 . 6 1 1 A 9 9 GLY HA2 H 9 3.983 3.578 0.405 1
1 86 . 6 1 1 A 9 9 GLY HA3 H 9 3.423 3.689 -0.266 1
1 87 . 6 1 1 A 9 9 GLY C C 9 175.163 176.333 -1.170 1
1 88 . 6 1 1 A 9 9 GLY CA C 9 47.153 47.275 -0.122 1
1 89 . 6 1 1 A 9 9 GLY N N 9 107.177 105.947 1.230 1
1 90 . 6 1 1 A 10 10 GLU H H 10 7.876 7.963 -0.087 1
1 91 . 6 1 1 A 10 10 GLU HA H 10 4.107 4.078 0.029 1
1 96 . 6 1 1 A 10 10 GLU C C 10 179.924 179.036 0.888 1
1 97 . 6 1 1 A 10 10 GLU CA C 10 58.890 59.487 -0.597 1
1 98 . 6 1 1 A 10 10 GLU CB C 10 29.750 29.441 0.309 1
1 100 . 6 1 1 A 10 10 GLU N N 10 122.219 121.952 0.267 1
1 101 . 6 1 1 A 11 11 TYR H H 11 8.384 8.066 0.318 1
1 102 . 6 1 1 A 11 11 TYR HA H 11 4.305 4.175 0.130 1
1 107 . 6 1 1 A 11 11 TYR C C 11 176.854 176.832 0.022 1
1 108 . 6 1 1 A 11 11 TYR CA C 11 61.040 61.562 -0.522 1
1 109 . 6 1 1 A 11 11 TYR CB C 11 37.593 38.881 -1.288 1
1 112 . 6 1 1 A 11 11 TYR N N 11 120.809 122.416 -1.607 1
1 113 . 6 1 1 A 12 12 LEU H H 12 9.027 8.268 0.759 1
1 114 . 6 1 1 A 12 12 LEU HA H 12 3.778 3.741 0.037 1
1 124 . 6 1 1 A 12 12 LEU C C 12 178.621 179.557 -0.936 1
1 125 . 6 1 1 A 12 12 LEU CA C 12 57.534 57.469 0.065 1
1 126 . 6 1 1 A 12 12 LEU CB C 12 41.957 40.933 1.024 1
1 130 . 6 1 1 A 12 12 LEU N N 12 121.080 118.887 2.193 1
1 131 . 6 1 1 A 13 13 GLU H H 13 7.614 7.843 -0.229 1
1 132 . 6 1 1 A 13 13 GLU HA H 13 4.102 4.066 0.036 1
1 137 . 6 1 1 A 13 13 GLU C C 13 178.449 178.902 -0.453 1
1 138 . 6 1 1 A 13 13 GLU CA C 13 59.609 59.745 -0.136 1
1 139 . 6 1 1 A 13 13 GLU CB C 13 29.124 29.490 -0.366 1
1 141 . 6 1 1 A 13 13 GLU N N 13 118.475 120.466 -1.991 1
1 142 . 6 1 1 A 14 14 SER H H 14 7.329 7.405 -0.076 1
1 143 . 6 1 1 A 14 14 SER HA H 14 4.358 4.235 0.123 1
1 146 . 6 1 1 A 14 14 SER C C 14 176.794 176.760 0.034 1
1 147 . 6 1 1 A 14 14 SER CA C 14 61.064 61.378 -0.314 1
1 148 . 6 1 1 A 14 14 SER CB C 14 62.513 62.745 -0.232 1
1 149 . 6 1 1 A 14 14 SER N N 14 115.209 115.115 0.094 1
1 150 . 6 1 1 A 15 15 TRP H H 15 8.870 8.410 0.460 1
1 151 . 6 1 1 A 15 15 TRP HA H 15 4.005 4.546 -0.541 1
1 160 . 6 1 1 A 15 15 TRP C C 15 177.547 177.562 -0.015 1
1 161 . 6 1 1 A 15 15 TRP CA C 15 61.210 61.570 -0.360 1
1 162 . 6 1 1 A 15 15 TRP CB C 15 27.341 28.949 -1.608 1
1 168 . 6 1 1 A 15 15 TRP N N 15 124.998 123.790 1.208 1
1 170 . 6 1 1 A 16 16 PHE H H 16 9.087 8.266 0.821 1
1 171 . 6 1 1 A 16 16 PHE HA H 16 3.210 3.975 -0.765 1
1 179 . 6 1 1 A 16 16 PHE C C 16 175.909 177.394 -1.485 1
1 180 . 6 1 1 A 16 16 PHE CA C 16 61.473 61.494 -0.021 1
1 181 . 6 1 1 A 16 16 PHE CB C 16 38.506 39.236 -0.730 1
1 187 . 6 1 1 A 16 16 PHE N N 16 119.825 121.359 -1.534 1
1 188 . 6 1 1 A 17 17 ASN H H 17 7.768 8.100 -0.332 1
1 189 . 6 1 1 A 17 17 ASN HA H 17 4.078 4.139 -0.061 1
1 194 . 6 1 1 A 17 17 ASN C C 17 176.604 177.630 -1.026 1
1 195 . 6 1 1 A 17 17 ASN CA C 17 55.621 56.290 -0.669 1
1 196 . 6 1 1 A 17 17 ASN CB C 17 37.830 39.299 -1.469 1
1 197 . 6 1 1 A 17 17 ASN N N 17 115.600 117.419 -1.819 1
1 199 . 6 1 1 A 18 18 THR H H 18 7.454 7.748 -0.294 1
1 200 . 6 1 1 A 18 18 THR HA H 18 4.147 3.989 0.158 1
1 205 . 6 1 1 A 18 18 THR C C 18 175.692 175.798 -0.106 1
1 206 . 6 1 1 A 18 18 THR CA C 18 64.679 66.850 -2.171 1
1 207 . 6 1 1 A 18 18 THR CB C 18 68.940 68.143 0.797 1
1 209 . 6 1 1 A 18 18 THR N N 18 113.049 116.028 -2.979 1
1 210 . 6 1 1 A 19 19 LYS H H 19 7.918 7.495 0.423 1
1 211 . 6 1 1 A 19 19 LYS HA H 19 3.791 3.728 0.063 1
1 220 . 6 1 1 A 19 19 LYS C C 19 178.120 178.567 -0.447 1
1 221 . 6 1 1 A 19 19 LYS CA C 19 55.985 58.744 -2.759 1
1 222 . 6 1 1 A 19 19 LYS CB C 19 31.130 31.003 0.127 1
1 226 . 6 1 1 A 19 19 LYS N N 19 122.614 120.398 2.216 1
1 227 . 6 1 1 A 20 20 ARG H H 20 7.845 7.678 0.167 1
1 228 . 6 1 1 A 20 20 ARG HA H 20 3.396 3.665 -0.269 1
1 236 . 6 1 1 A 20 20 ARG C C 20 175.601 178.940 -3.339 1
1 237 . 6 1 1 A 20 20 ARG CA C 20 58.182 59.196 -1.014 1
1 238 . 6 1 1 A 20 20 ARG CB C 20 28.045 29.203 -1.158 1
1 241 . 6 1 1 A 20 20 ARG N N 20 116.282 118.215 -1.933 1
1 243 . 6 1 1 A 21 21 HIS H H 21 7.163 7.209 -0.046 1
1 244 . 6 1 1 A 21 21 HIS HA H 21 4.500 4.289 0.211 1
1 249 . 6 1 1 A 21 21 HIS C C 21 175.618 176.643 -1.025 1
1 250 . 6 1 1 A 21 21 HIS CA C 21 56.912 58.937 -2.025 1
1 251 . 6 1 1 A 21 21 HIS CB C 21 29.400 29.169 0.231 1
1 254 . 6 1 1 A 21 21 HIS N N 21 115.452 119.015 -3.563 1
1 255 . 6 1 1 A 22 22 SER H H 22 7.951 7.645 0.306 1
1 256 . 6 1 1 A 22 22 SER HA H 22 4.573 4.467 0.106 1
1 259 . 6 1 1 A 22 22 SER C C 22 173.948 174.338 -0.390 1
1 260 . 6 1 1 A 22 22 SER CA C 22 58.589 59.961 -1.372 1
1 261 . 6 1 1 A 22 22 SER CB C 22 64.228 64.166 0.062 1
1 262 . 6 1 1 A 22 22 SER N N 22 113.209 112.402 0.807 1
1 263 . 6 1 1 A 23 23 VAL H H 23 7.179 6.979 0.200 1
1 264 . 6 1 1 A 23 23 VAL HA H 23 4.626 4.572 0.054 1
1 272 . 6 1 1 A 23 23 VAL C C 23 175.397 175.913 -0.516 1
1 273 . 6 1 1 A 23 23 VAL CA C 23 59.556 60.027 -0.471 1
1 274 . 6 1 1 A 23 23 VAL CB C 23 33.810 34.276 -0.466 1
1 277 . 6 1 1 A 23 23 VAL N N 23 113.108 115.124 -2.016 1
1 278 . 6 1 1 A 24 24 GLY H H 24 8.189 8.515 -0.326 1
1 279 . 6 1 1 A 24 24 GLY HA2 H 24 4.074 4.050 0.024 1
1 280 . 6 1 1 A 24 24 GLY HA3 H 24 4.195 4.066 0.129 1
1 281 . 6 1 1 A 24 24 GLY C C 24 174.037 174.238 -0.201 1
1 282 . 6 1 1 A 24 24 GLY CA C 24 44.452 44.851 -0.399 1
1 283 . 6 1 1 A 24 24 GLY N N 24 108.374 108.800 -0.426 1
1 284 . 6 1 1 A 25 25 ILE H H 25 8.331 8.594 -0.263 1
1 285 . 6 1 1 A 25 25 ILE HA H 25 3.839 3.606 0.233 1
1 295 . 6 1 1 A 25 25 ILE C C 25 178.042 177.867 0.175 1
1 296 . 6 1 1 A 25 25 ILE CA C 25 64.238 64.521 -0.283 1
1 297 . 6 1 1 A 25 25 ILE CB C 25 37.931 37.843 0.088 1
1 301 . 6 1 1 A 25 25 ILE N N 25 119.895 119.243 0.652 1
1 302 . 6 1 1 A 26 26 GLN H H 26 8.545 8.501 0.044 1
1 303 . 6 1 1 A 26 26 GLN HA H 26 4.129 4.042 0.087 1
1 310 . 6 1 1 A 26 26 GLN C C 26 178.454 178.020 0.434 1
1 311 . 6 1 1 A 26 26 GLN CA C 26 58.772 58.169 0.603 1
1 312 . 6 1 1 A 26 26 GLN CB C 26 27.346 27.761 -0.415 1
1 314 . 6 1 1 A 26 26 GLN N N 26 120.013 120.092 -0.079 1
1 316 . 6 1 1 A 27 27 THR H H 27 7.944 7.997 -0.053 1
1 317 . 6 1 1 A 27 27 THR HA H 27 3.953 3.864 0.089 1
1 322 . 6 1 1 A 27 27 THR C C 27 175.818 176.127 -0.309 1
1 323 . 6 1 1 A 27 27 THR CA C 27 65.855 66.215 -0.360 1
1 324 . 6 1 1 A 27 27 THR CB C 27 68.127 68.434 -0.307 1
1 326 . 6 1 1 A 27 27 THR N N 27 117.645 116.830 0.815 1
1 327 . 6 1 1 A 28 28 ALA H H 28 8.593 8.171 0.422 1
1 328 . 6 1 1 A 28 28 ALA HA H 28 3.899 4.086 -0.187 1
1 332 . 6 1 1 A 28 28 ALA C C 28 178.515 179.380 -0.865 1
1 333 . 6 1 1 A 28 28 ALA CA C 28 55.742 55.551 0.191 1
1 334 . 6 1 1 A 28 28 ALA CB C 28 17.513 18.339 -0.826 1
1 335 . 6 1 1 A 28 28 ALA N N 28 123.917 123.491 0.426 1
1 336 . 6 1 1 A 29 29 LYS H H 29 7.800 7.848 -0.048 1
1 337 . 6 1 1 A 29 29 LYS HA H 29 3.982 3.905 0.077 1
1 346 . 6 1 1 A 29 29 LYS C C 29 179.527 178.938 0.589 1
1 347 . 6 1 1 A 29 29 LYS CA C 29 59.761 59.663 0.098 1
1 348 . 6 1 1 A 29 29 LYS CB C 29 32.223 32.186 0.037 1
1 352 . 6 1 1 A 29 29 LYS N N 29 117.474 118.761 -1.287 1
1 353 . 6 1 1 A 30 30 VAL H H 30 7.591 7.294 0.297 1
1 354 . 6 1 1 A 30 30 VAL HA H 30 3.503 3.341 0.162 1
1 362 . 6 1 1 A 30 30 VAL C C 30 178.389 177.755 0.634 1
1 363 . 6 1 1 A 30 30 VAL CA C 30 65.640 65.844 -0.204 1
1 364 . 6 1 1 A 30 30 VAL CB C 30 31.644 31.605 0.039 1
1 367 . 6 1 1 A 30 30 VAL N N 30 121.749 120.231 1.518 1
1 368 . 6 1 1 A 31 31 LEU H H 31 8.333 8.168 0.165 1
1 369 . 6 1 1 A 31 31 LEU HA H 31 4.074 3.981 0.093 1
1 379 . 6 1 1 A 31 31 LEU C C 31 177.780 179.052 -1.272 1
1 380 . 6 1 1 A 31 31 LEU CA C 31 58.157 57.928 0.229 1
1 381 . 6 1 1 A 31 31 LEU CB C 31 42.230 41.223 1.007 1
1 385 . 6 1 1 A 31 31 LEU N N 31 120.901 118.990 1.911 1
1 386 . 6 1 1 A 32 32 LYS H H 32 8.562 7.897 0.665 1
1 387 . 6 1 1 A 32 32 LYS HA H 32 3.290 3.894 -0.604 1
1 395 . 6 1 1 A 32 32 LYS C C 32 178.037 178.743 -0.706 1
1 396 . 6 1 1 A 32 32 LYS CA C 32 58.911 59.657 -0.746 1
1 397 . 6 1 1 A 32 32 LYS CB C 32 31.605 31.452 0.153 1
1 401 . 6 1 1 A 32 32 LYS N N 32 119.075 120.036 -0.961 1
1 402 . 6 1 1 A 33 33 GLY H H 33 7.694 7.840 -0.146 1
1 403 . 6 1 1 A 33 33 GLY HA2 H 33 3.949 3.606 0.343 1
1 404 . 6 1 1 A 33 33 GLY HA3 H 33 3.826 3.667 0.159 1
1 405 . 6 1 1 A 33 33 GLY C C 33 177.101 176.596 0.505 1
1 406 . 6 1 1 A 33 33 GLY CA C 33 46.928 47.097 -0.169 1
1 407 . 6 1 1 A 33 33 GLY N N 33 105.282 106.657 -1.375 1
1 408 . 6 1 1 A 34 34 TYR H H 34 8.015 7.405 0.610 1
1 409 . 6 1 1 A 34 34 TYR HA H 34 4.558 4.684 -0.126 1
1 416 . 6 1 1 A 34 34 TYR C C 34 179.611 178.161 1.450 1
1 417 . 6 1 1 A 34 34 TYR CA C 34 59.349 59.477 -0.128 1
1 418 . 6 1 1 A 34 34 TYR CB C 34 37.344 37.569 -0.225 1
1 423 . 6 1 1 A 34 34 TYR N N 34 121.781 121.841 -0.060 1
1 424 . 6 1 1 A 35 35 LEU H H 35 8.689 7.903 0.786 1
1 425 . 6 1 1 A 35 35 LEU HA H 35 3.977 3.826 0.151 1
1 435 . 6 1 1 A 35 35 LEU C C 35 177.081 178.708 -1.627 1
1 436 . 6 1 1 A 35 35 LEU CA C 35 59.155 58.330 0.825 1
1 437 . 6 1 1 A 35 35 LEU CB C 35 41.103 41.360 -0.257 1
1 441 . 6 1 1 A 35 35 LEU N N 35 120.392 120.417 -0.025 1
1 442 . 6 1 1 A 36 36 ASN H H 36 8.721 8.720 0.001 1
1 443 . 6 1 1 A 36 36 ASN HA H 36 4.435 4.400 0.035 1
1 448 . 6 1 1 A 36 36 ASN C C 36 176.792 177.420 -0.628 1
1 449 . 6 1 1 A 36 36 ASN CA C 36 55.642 55.782 -0.140 1
1 450 . 6 1 1 A 36 36 ASN CB C 36 38.319 37.339 0.980 1
1 451 . 6 1 1 A 36 36 ASN N N 36 114.623 115.855 -1.232 1
1 453 . 6 1 1 A 37 37 SER H H 37 8.511 7.929 0.582 1
1 454 . 6 1 1 A 37 37 SER HA H 37 4.642 4.391 0.251 1
1 457 . 6 1 1 A 37 37 SER C C 37 175.039 176.233 -1.194 1
1 458 . 6 1 1 A 37 37 SER CA C 37 59.825 61.248 -1.423 1
1 459 . 6 1 1 A 37 37 SER CB C 37 64.056 62.966 1.090 1
1 460 . 6 1 1 A 37 37 SER N N 37 110.941 114.912 -3.971 1
1 461 . 6 1 1 A 38 38 ARG H H 38 7.242 7.743 -0.501 1
1 462 . 6 1 1 A 38 38 ARG HA H 38 4.919 4.448 0.471 1
1 469 . 6 1 1 A 38 38 ARG C C 38 176.514 178.687 -2.173 1
1 470 . 6 1 1 A 38 38 ARG CA C 38 56.687 58.147 -1.460 1
1 471 . 6 1 1 A 38 38 ARG CB C 38 32.434 31.321 1.113 1
1 474 . 6 1 1 A 38 38 ARG N N 38 117.062 120.694 -3.632 1
1 475 . 6 1 1 A 39 39 ILE H H 39 8.462 7.988 0.474 1
1 476 . 6 1 1 A 39 39 ILE HA H 39 3.618 3.714 -0.096 1
1 486 . 6 1 1 A 39 39 ILE C C 39 176.267 177.915 -1.648 1
1 487 . 6 1 1 A 39 39 ILE CA C 39 66.134 65.126 1.008 1
1 488 . 6 1 1 A 39 39 ILE CB C 39 39.787 37.866 1.921 1
1 492 . 6 1 1 A 39 39 ILE N N 39 121.214 120.677 0.537 1
1 493 . 6 1 1 A 40 40 ILE H H 40 9.339 8.240 1.099 1
1 494 . 6 1 1 A 40 40 ILE HA H 40 3.401 3.693 -0.292 1
1 504 . 6 1 1 A 40 40 ILE CA C 40 67.844 66.455 1.389 1
1 505 . 6 1 1 A 40 40 ILE CB C 40 34.406 35.638 -1.232 1
1 509 . 6 1 1 A 40 40 ILE N N 40 119.695 120.941 -1.246 1
1 510 . 6 1 1 A 41 41 PRO HA H 41 4.314 4.421 -0.107 1
1 517 . 6 1 1 A 41 41 PRO C C 41 177.418 177.949 -0.531 1
1 518 . 6 1 1 A 41 41 PRO CA C 41 65.912 65.182 0.730 1
1 519 . 6 1 1 A 41 41 PRO CB C 41 30.686 31.404 -0.718 1
1 522 . 6 1 1 A 42 42 SER H H 42 6.857 8.292 -1.435 1
1 523 . 6 1 1 A 42 42 SER HA H 42 4.558 4.573 -0.015 1
1 526 . 6 1 1 A 42 42 SER C C 42 174.813 175.618 -0.805 1
1 527 . 6 1 1 A 42 42 SER CA C 42 61.279 60.275 1.004 1
1 528 . 6 1 1 A 42 42 SER CB C 42 64.285 64.020 0.265 1
1 529 . 6 1 1 A 42 42 SER N N 42 108.994 112.585 -3.591 1
1 530 . 6 1 1 A 43 43 LEU H H 43 8.230 8.143 0.087 1
1 531 . 6 1 1 A 43 43 LEU HA H 43 4.572 4.285 0.287 1
1 541 . 6 1 1 A 43 43 LEU C C 43 177.301 178.928 -1.627 1
1 542 . 6 1 1 A 43 43 LEU CA C 43 54.113 55.676 -1.563 1
1 543 . 6 1 1 A 43 43 LEU CB C 43 44.800 42.332 2.468 1
1 547 . 6 1 1 A 43 43 LEU N N 43 118.715 120.168 -1.453 1
1 548 . 6 1 1 A 44 44 GLY H H 44 8.498 8.439 0.059 1
1 549 . 6 1 1 A 44 44 GLY HA2 H 44 4.010 3.797 0.213 1
1 550 . 6 1 1 A 44 44 GLY HA3 H 44 3.613 3.833 -0.220 1
1 551 . 6 1 1 A 44 44 GLY C C 44 174.178 176.331 -2.153 1
1 552 . 6 1 1 A 44 44 GLY CA C 44 46.271 47.360 -1.089 1
1 553 . 6 1 1 A 44 44 GLY N N 44 105.371 106.647 -1.276 1
1 554 . 6 1 1 A 45 45 ASN H H 45 8.385 7.456 0.929 1
1 555 . 6 1 1 A 45 45 ASN HA H 45 4.789 4.705 0.084 1
1 560 . 6 1 1 A 45 45 ASN C C 45 175.386 176.441 -1.055 1
1 561 . 6 1 1 A 45 45 ASN CA C 45 53.144 54.780 -1.636 1
1 562 . 6 1 1 A 45 45 ASN CB C 45 37.928 38.409 -0.481 1
1 563 . 6 1 1 A 45 45 ASN N N 45 114.387 117.958 -3.571 1
1 565 . 6 1 1 A 46 46 ILE H H 46 7.465 7.422 0.043 1
1 566 . 6 1 1 A 46 46 ILE HA H 46 3.856 4.004 -0.148 1
1 576 . 6 1 1 A 46 46 ILE C C 46 175.997 176.134 -0.137 1
1 577 . 6 1 1 A 46 46 ILE CA C 46 60.853 62.175 -1.322 1
1 578 . 6 1 1 A 46 46 ILE CB C 46 38.042 38.130 -0.088 1
1 582 . 6 1 1 A 46 46 ILE N N 46 123.998 121.031 2.967 1
1 583 . 6 1 1 A 47 47 LYS H H 47 8.717 8.648 0.069 1
1 584 . 6 1 1 A 47 47 LYS HA H 47 4.249 4.323 -0.074 1
1 591 . 6 1 1 A 47 47 LYS C C 47 177.583 177.669 -0.086 1
1 592 . 6 1 1 A 47 47 LYS CA C 47 56.320 57.001 -0.681 1
1 593 . 6 1 1 A 47 47 LYS CB C 47 30.393 32.814 -2.421 1
1 596 . 6 1 1 A 47 47 LYS N N 47 126.114 124.809 1.305 1
1 597 . 6 1 1 A 48 48 LEU H H 48 8.323 8.273 0.050 1
1 598 . 6 1 1 A 48 48 LEU HA H 48 3.691 4.014 -0.323 1
1 608 . 6 1 1 A 48 48 LEU C C 48 177.274 178.261 -0.987 1
1 609 . 6 1 1 A 48 48 LEU CA C 48 58.443 58.561 -0.118 1
1 610 . 6 1 1 A 48 48 LEU CB C 48 42.282 41.380 0.902 1
1 614 . 6 1 1 A 48 48 LEU N N 48 125.857 126.330 -0.473 1
1 615 . 6 1 1 A 49 49 ALA H H 49 8.929 7.915 1.014 1
1 616 . 6 1 1 A 49 49 ALA HA H 49 4.067 4.040 0.027 1
1 620 . 6 1 1 A 49 49 ALA C C 49 177.468 178.709 -1.241 1
1 621 . 6 1 1 A 49 49 ALA CA C 49 53.092 54.643 -1.551 1
1 622 . 6 1 1 A 49 49 ALA CB C 49 18.562 18.361 0.201 1
1 623 . 6 1 1 A 49 49 ALA N N 49 115.543 120.332 -4.789 1
1 624 . 6 1 1 A 50 50 LYS H H 50 7.684 7.522 0.162 1
1 625 . 6 1 1 A 50 50 LYS HA H 50 4.395 4.294 0.101 1
1 634 . 6 1 1 A 50 50 LYS C C 50 174.958 176.790 -1.832 1
1 635 . 6 1 1 A 50 50 LYS CA C 50 53.977 56.948 -2.971 1
1 636 . 6 1 1 A 50 50 LYS CB C 50 32.645 32.647 -0.002 1
1 640 . 6 1 1 A 50 50 LYS N N 50 114.788 114.902 -0.114 1
1 641 . 6 1 1 A 51 51 LEU H H 51 6.776 6.888 -0.112 1
1 642 . 6 1 1 A 51 51 LEU HA H 51 4.569 4.416 0.153 1
1 652 . 6 1 1 A 51 51 LEU C C 51 177.953 175.803 2.150 1
1 653 . 6 1 1 A 51 51 LEU CA C 51 55.318 55.151 0.167 1
1 654 . 6 1 1 A 51 51 LEU CB C 51 43.182 40.929 2.253 1
1 658 . 6 1 1 A 51 51 LEU N N 51 121.408 122.274 -0.866 1
1 659 . 6 1 1 A 52 52 THR H H 52 10.680 8.028 2.652 1
1 660 . 6 1 1 A 52 52 THR HA H 52 4.938 4.516 0.422 1
1 665 . 6 1 1 A 52 52 THR C C 52 175.553 174.630 0.923 1
1 666 . 6 1 1 A 52 52 THR CA C 52 59.740 60.570 -0.830 1
1 667 . 6 1 1 A 52 52 THR CB C 52 73.557 70.237 3.320 1
1 669 . 6 1 1 A 52 52 THR N N 52 119.481 119.522 -0.041 1
1 670 . 6 1 1 A 53 53 SER H H 53 9.278 9.000 0.278 1
1 671 . 6 1 1 A 53 53 SER HA H 53 4.261 4.137 0.124 1
1 674 . 6 1 1 A 53 53 SER C C 53 176.990 176.297 0.693 1
1 675 . 6 1 1 A 53 53 SER CA C 53 61.025 61.115 -0.090 1
1 676 . 6 1 1 A 53 53 SER CB C 53 62.312 62.936 -0.624 1
1 677 . 6 1 1 A 53 53 SER N N 53 116.343 121.379 -5.036 1
1 678 . 6 1 1 A 54 54 LEU H H 54 7.808 8.068 -0.260 1
1 679 . 6 1 1 A 54 54 LEU HA H 54 4.229 4.033 0.196 1
1 688 . 6 1 1 A 54 54 LEU C C 54 178.505 178.798 -0.293 1
1 689 . 6 1 1 A 54 54 LEU CA C 54 57.719 57.863 -0.144 1
1 690 . 6 1 1 A 54 54 LEU CB C 54 40.997 41.702 -0.705 1
1 694 . 6 1 1 A 54 54 LEU N N 54 126.055 123.245 2.810 1
1 695 . 6 1 1 A 55 55 HIS H H 55 7.798 8.048 -0.250 1
1 696 . 6 1 1 A 55 55 HIS HA H 55 4.311 4.367 -0.056 1
1 701 . 6 1 1 A 55 55 HIS C C 55 180.044 177.696 2.348 1
1 702 . 6 1 1 A 55 55 HIS CA C 55 60.583 59.552 1.031 1
1 703 . 6 1 1 A 55 55 HIS CB C 55 31.445 29.747 1.698 1
1 706 . 6 1 1 A 55 55 HIS N N 55 118.683 118.088 0.595 1
1 707 . 6 1 1 A 56 56 MET H H 56 7.375 7.850 -0.475 1
1 708 . 6 1 1 A 56 56 MET HA H 56 4.513 3.976 0.537 1
1 716 . 6 1 1 A 56 56 MET C C 56 177.169 178.556 -1.387 1
1 717 . 6 1 1 A 56 56 MET CA C 56 55.823 59.200 -3.377 1
1 718 . 6 1 1 A 56 56 MET CB C 56 31.303 32.976 -1.673 1
1 721 . 6 1 1 A 56 56 MET N N 56 114.530 117.442 -2.912 1
1 722 . 6 1 1 A 57 57 GLN H H 57 8.387 8.199 0.188 1
1 723 . 6 1 1 A 57 57 GLN HA H 57 3.981 4.000 -0.019 1
1 730 . 6 1 1 A 57 57 GLN C C 57 178.033 178.330 -0.297 1
1 731 . 6 1 1 A 57 57 GLN CA C 57 57.922 59.329 -1.407 1
1 732 . 6 1 1 A 57 57 GLN CB C 57 29.012 28.466 0.546 1
1 734 . 6 1 1 A 57 57 GLN N N 57 120.713 119.624 1.089 1
1 736 . 6 1 1 A 58 58 ASN H H 58 8.765 8.429 0.336 1
1 737 . 6 1 1 A 58 58 ASN HA H 58 4.539 4.478 0.061 1
1 742 . 6 1 1 A 58 58 ASN C C 58 178.084 177.669 0.415 1
1 743 . 6 1 1 A 58 58 ASN CA C 58 55.345 56.332 -0.987 1
1 744 . 6 1 1 A 58 58 ASN CB C 58 36.924 37.845 -0.921 1
1 745 . 6 1 1 A 58 58 ASN N N 58 117.390 117.811 -0.421 1
1 747 . 6 1 1 A 59 59 TYR H H 59 8.239 8.005 0.234 1
1 748 . 6 1 1 A 59 59 TYR HA H 59 4.586 4.134 0.452 1
1 755 . 6 1 1 A 59 59 TYR C C 59 178.015 176.892 1.123 1
1 756 . 6 1 1 A 59 59 TYR CA C 59 60.779 61.505 -0.726 1
1 757 . 6 1 1 A 59 59 TYR CB C 59 38.047 38.727 -0.680 1
1 762 . 6 1 1 A 59 59 TYR N N 59 122.335 122.760 -0.425 1
1 763 . 6 1 1 A 60 60 VAL H H 60 8.416 8.541 -0.125 1
1 764 . 6 1 1 A 60 60 VAL HA H 60 3.244 3.538 -0.294 1
1 772 . 6 1 1 A 60 60 VAL C C 60 177.309 178.297 -0.988 1
1 773 . 6 1 1 A 60 60 VAL CA C 60 67.022 66.508 0.514 1
1 774 . 6 1 1 A 60 60 VAL CB C 60 30.929 31.420 -0.491 1
1 777 . 6 1 1 A 60 60 VAL N N 60 119.842 119.533 0.309 1
1 778 . 6 1 1 A 61 61 ASN H H 61 8.264 8.251 0.013 1
1 779 . 6 1 1 A 61 61 ASN HA H 61 4.305 4.469 -0.164 1
1 784 . 6 1 1 A 61 61 ASN C C 61 177.263 177.874 -0.611 1
1 785 . 6 1 1 A 61 61 ASN CA C 61 55.548 56.169 -0.621 1
1 786 . 6 1 1 A 61 61 ASN CB C 61 36.645 37.495 -0.850 1
1 787 . 6 1 1 A 61 61 ASN N N 61 119.103 120.202 -1.099 1
1 789 . 6 1 1 A 62 62 SER H H 62 8.143 7.832 0.311 1
1 790 . 6 1 1 A 62 62 SER HA H 62 4.343 4.166 0.177 1
1 793 . 6 1 1 A 62 62 SER C C 62 176.409 176.581 -0.172 1
1 794 . 6 1 1 A 62 62 SER CA C 62 61.612 61.986 -0.374 1
1 795 . 6 1 1 A 62 62 SER CB C 62 62.219 62.799 -0.580 1
1 796 . 6 1 1 A 62 62 SER N N 62 118.254 116.861 1.393 1
1 797 . 6 1 1 A 63 63 LEU H H 63 7.664 7.913 -0.249 1
1 798 . 6 1 1 A 63 63 LEU HA H 63 4.003 3.837 0.166 1
1 808 . 6 1 1 A 63 63 LEU C C 63 178.748 178.831 -0.083 1
1 809 . 6 1 1 A 63 63 LEU CA C 63 57.171 58.055 -0.884 1
1 810 . 6 1 1 A 63 63 LEU CB C 63 41.134 41.173 -0.039 1
1 814 . 6 1 1 A 63 63 LEU N N 63 123.812 121.634 2.178 1
1 815 . 6 1 1 A 64 64 ARG H H 64 7.969 7.413 0.556 1
1 816 . 6 1 1 A 64 64 ARG HA H 64 4.038 3.936 0.102 1
1 824 . 6 1 1 A 64 64 ARG C C 64 180.797 178.198 2.599 1
1 825 . 6 1 1 A 64 64 ARG CA C 64 58.598 59.282 -0.684 1
1 826 . 6 1 1 A 64 64 ARG CB C 64 28.849 28.629 0.220 1
1 829 . 6 1 1 A 64 64 ARG N N 64 120.376 119.410 0.966 1
1 831 . 6 1 1 A 65 65 ASP H H 65 8.465 8.091 0.374 1
1 832 . 6 1 1 A 65 65 ASP HA H 65 4.408 4.369 0.039 1
1 835 . 6 1 1 A 65 65 ASP C C 65 177.336 178.171 -0.835 1
1 836 . 6 1 1 A 65 65 ASP CA C 65 56.957 57.570 -0.613 1
1 837 . 6 1 1 A 65 65 ASP CB C 65 39.602 40.968 -1.366 1
1 838 . 6 1 1 A 65 65 ASP N N 65 122.402 119.994 2.408 1
1 839 . 6 1 1 A 66 66 GLU H H 66 7.703 7.822 -0.119 1
1 840 . 6 1 1 A 66 66 GLU HA H 66 4.213 4.344 -0.131 1
1 845 . 6 1 1 A 66 66 GLU C C 66 176.586 176.990 -0.404 1
1 846 . 6 1 1 A 66 66 GLU CA C 66 56.974 56.254 0.720 1
1 847 . 6 1 1 A 66 66 GLU CB C 66 29.821 30.061 -0.240 1
1 849 . 6 1 1 A 66 66 GLU N N 66 119.076 115.832 3.244 1
1 850 . 6 1 1 A 67 67 GLY H H 67 7.861 7.945 -0.084 1
1 851 . 6 1 1 A 67 67 GLY HA2 H 67 4.269 3.925 0.344 1
1 852 . 6 1 1 A 67 67 GLY HA3 H 67 3.731 3.929 -0.198 1
1 853 . 6 1 1 A 67 67 GLY C C 67 174.614 175.061 -0.447 1
1 854 . 6 1 1 A 67 67 GLY CA C 67 44.608 46.353 -1.745 1
1 855 . 6 1 1 A 67 67 GLY N N 67 105.730 109.556 -3.826 1
1 856 . 6 1 1 A 68 68 LEU H H 68 7.324 7.690 -0.366 1
1 857 . 6 1 1 A 68 68 LEU HA H 68 4.257 4.190 0.067 1
1 867 . 6 1 1 A 68 68 LEU C C 68 176.136 177.012 -0.876 1
1 868 . 6 1 1 A 68 68 LEU CA C 68 55.659 55.138 0.521 1
1 869 . 6 1 1 A 68 68 LEU CB C 68 41.874 41.357 0.517 1
1 873 . 6 1 1 A 68 68 LEU N N 68 121.062 121.056 0.006 1
1 874 . 6 1 1 A 69 69 LYS H H 69 8.368 8.458 -0.090 1
1 875 . 6 1 1 A 69 69 LYS HA H 69 4.281 4.404 -0.123 1
1 884 . 6 1 1 A 69 69 LYS C C 69 177.940 177.623 0.317 1
1 885 . 6 1 1 A 69 69 LYS CA C 69 55.412 56.172 -0.760 1
1 886 . 6 1 1 A 69 69 LYS CB C 69 32.761 33.287 -0.526 1
1 890 . 6 1 1 A 69 69 LYS N N 69 120.120 121.655 -1.535 1
1 891 . 6 1 1 A 70 70 ARG H H 70 9.095 8.713 0.382 1
1 892 . 6 1 1 A 70 70 ARG HA H 70 3.684 4.075 -0.391 1
1 900 . 6 1 1 A 70 70 ARG C C 70 177.712 178.627 -0.915 1
1 901 . 6 1 1 A 70 70 ARG CA C 70 60.216 57.974 2.242 1
1 902 . 6 1 1 A 70 70 ARG CB C 70 29.539 29.707 -0.168 1
1 905 . 6 1 1 A 70 70 ARG N N 70 123.339 120.796 2.543 1
1 907 . 6 1 1 A 71 71 GLY H H 71 8.985 7.975 1.010 1
1 908 . 6 1 1 A 71 71 GLY HA2 H 71 3.932 3.633 0.299 1
1 909 . 6 1 1 A 71 71 GLY HA3 H 71 3.905 3.638 0.267 1
1 910 . 6 1 1 A 71 71 GLY C C 71 176.324 175.804 0.520 1
1 911 . 6 1 1 A 71 71 GLY CA C 71 46.752 47.459 -0.707 1
1 912 . 6 1 1 A 71 71 GLY N N 71 104.509 109.469 -4.960 1
1 913 . 6 1 1 A 72 72 THR H H 72 7.295 7.769 -0.474 1
1 914 . 6 1 1 A 72 72 THR HA H 72 4.014 3.972 0.042 1
1 919 . 6 1 1 A 72 72 THR C C 72 175.135 176.136 -1.001 1
1 920 . 6 1 1 A 72 72 THR CA C 72 65.848 66.340 -0.492 1
1 921 . 6 1 1 A 72 72 THR CB C 72 68.160 67.799 0.361 1
1 923 . 6 1 1 A 72 72 THR N N 72 118.617 117.255 1.362 1
1 924 . 6 1 1 A 73 73 ILE H H 73 7.883 7.923 -0.040 1
1 925 . 6 1 1 A 73 73 ILE HA H 73 3.258 3.579 -0.321 1
1 935 . 6 1 1 A 73 73 ILE C C 73 177.060 177.927 -0.867 1
1 936 . 6 1 1 A 73 73 ILE CA C 73 66.561 65.475 1.086 1
1 937 . 6 1 1 A 73 73 ILE CB C 73 37.339 37.704 -0.365 1
1 941 . 6 1 1 A 73 73 ILE N N 73 121.692 121.278 0.414 1
1 942 . 6 1 1 A 74 74 GLU H H 74 8.723 8.178 0.545 1
1 943 . 6 1 1 A 74 74 GLU HA H 74 3.807 3.885 -0.078 1
1 948 . 6 1 1 A 74 74 GLU C C 74 178.319 179.237 -0.918 1
1 949 . 6 1 1 A 74 74 GLU CA C 74 59.637 60.045 -0.408 1
1 950 . 6 1 1 A 74 74 GLU CB C 74 29.257 29.149 0.108 1
1 952 . 6 1 1 A 74 74 GLU N N 74 117.701 121.125 -3.424 1
1 953 . 6 1 1 A 75 75 LYS H H 75 7.361 7.476 -0.115 1
1 954 . 6 1 1 A 75 75 LYS HA H 75 3.958 4.013 -0.055 1
1 963 . 6 1 1 A 75 75 LYS C C 75 178.554 179.529 -0.975 1
1 964 . 6 1 1 A 75 75 LYS CA C 75 59.764 59.270 0.494 1
1 965 . 6 1 1 A 75 75 LYS CB C 75 32.314 32.371 -0.057 1
1 969 . 6 1 1 A 75 75 LYS N N 75 118.734 117.786 0.948 1
1 970 . 6 1 1 A 76 76 ILE H H 76 7.713 7.484 0.229 1
1 971 . 6 1 1 A 76 76 ILE HA H 76 3.221 3.729 -0.508 1
1 981 . 6 1 1 A 76 76 ILE C C 76 177.504 178.314 -0.810 1
1 982 . 6 1 1 A 76 76 ILE CA C 76 65.796 64.449 1.347 1
1 983 . 6 1 1 A 76 76 ILE CB C 76 37.732 37.382 0.350 1
1 987 . 6 1 1 A 76 76 ILE N N 76 120.312 116.420 3.892 1
1 988 . 6 1 1 A 77 77 ILE H H 77 8.587 7.976 0.611 1
1 989 . 6 1 1 A 77 77 ILE HA H 77 3.778 3.645 0.133 1
1 999 . 6 1 1 A 77 77 ILE C C 77 177.074 177.808 -0.734 1
1 1000 . 6 1 1 A 77 77 ILE CA C 77 63.168 65.082 -1.914 1
1 1001 . 6 1 1 A 77 77 ILE CB C 77 36.617 37.122 -0.505 1
1 1005 . 6 1 1 A 77 77 ILE N N 77 118.978 122.079 -3.101 1
1 1006 . 6 1 1 A 78 78 LYS H H 78 8.050 7.789 0.261 1
1 1007 . 6 1 1 A 78 78 LYS HA H 78 3.925 4.062 -0.137 1
1 1016 . 6 1 1 A 78 78 LYS C C 78 178.291 179.318 -1.027 1
1 1017 . 6 1 1 A 78 78 LYS CA C 78 60.192 59.894 0.298 1
1 1018 . 6 1 1 A 78 78 LYS CB C 78 31.886 32.604 -0.718 1
1 1022 . 6 1 1 A 78 78 LYS N N 78 121.618 119.643 1.975 1
1 1023 . 6 1 1 A 79 79 VAL H H 79 7.619 7.545 0.074 1
1 1024 . 6 1 1 A 79 79 VAL HA H 79 3.846 3.662 0.184 1
1 1032 . 6 1 1 A 79 79 VAL C C 79 177.712 178.118 -0.406 1
1 1033 . 6 1 1 A 79 79 VAL CA C 79 66.494 66.385 0.109 1
1 1034 . 6 1 1 A 79 79 VAL CB C 79 31.298 31.649 -0.351 1
1 1037 . 6 1 1 A 79 79 VAL N N 79 120.254 119.649 0.605 1
1 1038 . 6 1 1 A 80 80 ILE H H 80 7.885 8.222 -0.337 1
1 1039 . 6 1 1 A 80 80 ILE HA H 80 3.367 3.749 -0.382 1
1 1049 . 6 1 1 A 80 80 ILE C C 80 179.892 177.864 2.028 1
1 1050 . 6 1 1 A 80 80 ILE CA C 80 65.343 65.632 -0.289 1
1 1051 . 6 1 1 A 80 80 ILE CB C 80 38.129 37.742 0.387 1
1 1055 . 6 1 1 A 80 80 ILE N N 80 119.666 120.714 -1.048 1
1 1056 . 6 1 1 A 81 81 ARG H H 81 9.384 8.522 0.862 1
1 1057 . 6 1 1 A 81 81 ARG HA H 81 3.834 3.936 -0.102 1
1 1065 . 6 1 1 A 81 81 ARG C C 81 178.204 179.231 -1.027 1
1 1066 . 6 1 1 A 81 81 ARG CA C 81 60.560 59.711 0.849 1
1 1067 . 6 1 1 A 81 81 ARG CB C 81 30.196 30.184 0.012 1
1 1070 . 6 1 1 A 81 81 ARG N N 81 121.030 119.804 1.226 1
1 1072 . 6 1 1 A 82 82 ASN H H 82 8.773 8.172 0.601 1
1 1073 . 6 1 1 A 82 82 ASN HA H 82 4.587 4.611 -0.024 1
1 1078 . 6 1 1 A 82 82 ASN C C 82 178.300 178.007 0.293 1
1 1079 . 6 1 1 A 82 82 ASN CA C 82 56.160 56.251 -0.091 1
1 1080 . 6 1 1 A 82 82 ASN CB C 82 38.464 38.836 -0.372 1
1 1081 . 6 1 1 A 82 82 ASN N N 82 118.483 119.062 -0.579 1
1 1083 . 6 1 1 A 83 83 SER H H 83 8.526 7.928 0.598 1
1 1084 . 6 1 1 A 83 83 SER HA H 83 2.765 3.353 -0.588 1
1 1087 . 6 1 1 A 83 83 SER C C 83 176.386 176.418 -0.032 1
1 1088 . 6 1 1 A 83 83 SER CA C 83 61.245 62.082 -0.837 1
1 1089 . 6 1 1 A 83 83 SER CB C 83 61.287 62.709 -1.422 1
1 1090 . 6 1 1 A 83 83 SER N N 83 118.286 116.408 1.878 1
1 1091 . 6 1 1 A 84 84 LEU H H 84 7.782 8.425 -0.643 1
1 1092 . 6 1 1 A 84 84 LEU HA H 84 4.221 4.031 0.190 1
1 1102 . 6 1 1 A 84 84 LEU C C 84 177.846 179.362 -1.516 1
1 1103 . 6 1 1 A 84 84 LEU CA C 84 57.166 57.756 -0.590 1
1 1104 . 6 1 1 A 84 84 LEU CB C 84 40.520 40.974 -0.454 1
1 1108 . 6 1 1 A 84 84 LEU N N 84 127.445 121.155 6.290 1
1 1109 . 6 1 1 A 85 85 GLU H H 85 8.264 8.465 -0.201 1
1 1110 . 6 1 1 A 85 85 GLU HA H 85 3.981 3.979 0.002 1
1 1115 . 6 1 1 A 85 85 GLU C C 85 179.288 179.256 0.032 1
1 1116 . 6 1 1 A 85 85 GLU CA C 85 59.025 59.880 -0.855 1
1 1117 . 6 1 1 A 85 85 GLU CB C 85 29.182 29.512 -0.330 1
1 1119 . 6 1 1 A 85 85 GLU N N 85 121.538 120.208 1.330 1
1 1120 . 6 1 1 A 86 86 HIS H H 86 7.683 8.020 -0.337 1
1 1121 . 6 1 1 A 86 86 HIS HA H 86 4.573 4.375 0.198 1
1 1125 . 6 1 1 A 86 86 HIS C C 86 175.484 177.586 -2.102 1
1 1126 . 6 1 1 A 86 86 HIS CA C 86 58.940 59.160 -0.220 1
1 1127 . 6 1 1 A 86 86 HIS CB C 86 29.267 30.367 -1.100 1
1 1129 . 6 1 1 A 86 86 HIS N N 86 117.087 120.548 -3.461 1
1 1130 . 6 1 1 A 87 87 ALA H H 87 7.197 8.147 -0.950 1
1 1131 . 6 1 1 A 87 87 ALA HA H 87 3.925 3.778 0.147 1
1 1135 . 6 1 1 A 87 87 ALA C C 87 179.038 180.041 -1.003 1
1 1136 . 6 1 1 A 87 87 ALA CA C 87 54.863 54.898 -0.035 1
1 1137 . 6 1 1 A 87 87 ALA CB C 87 17.034 18.250 -1.216 1
1 1138 . 6 1 1 A 87 87 ALA N N 87 121.510 121.030 0.480 1
1 1139 . 6 1 1 A 88 88 ILE H H 88 7.819 7.486 0.333 1
1 1140 . 6 1 1 A 88 88 ILE HA H 88 4.067 3.962 0.105 1
1 1150 . 6 1 1 A 88 88 ILE C C 88 180.846 177.570 3.276 1
1 1151 . 6 1 1 A 88 88 ILE CA C 88 64.021 65.371 -1.350 1
1 1152 . 6 1 1 A 88 88 ILE CB C 88 37.557 37.756 -0.199 1
1 1156 . 6 1 1 A 88 88 ILE N N 88 120.898 119.146 1.752 1
1 1157 . 6 1 1 A 89 89 ASP H H 89 7.808 8.196 -0.388 1
1 1158 . 6 1 1 A 89 89 ASP HA H 89 4.437 4.344 0.093 1
1 1161 . 6 1 1 A 89 89 ASP C C 89 178.033 178.166 -0.133 1
1 1162 . 6 1 1 A 89 89 ASP CA C 89 57.343 57.705 -0.362 1
1 1163 . 6 1 1 A 89 89 ASP CB C 89 39.689 41.813 -2.124 1
1 1164 . 6 1 1 A 89 89 ASP N N 89 125.174 120.584 4.590 1
1 1165 . 6 1 1 A 90 90 LEU H H 90 7.607 7.673 -0.066 1
1 1166 . 6 1 1 A 90 90 LEU HA H 90 4.198 4.207 -0.009 1
1 1176 . 6 1 1 A 90 90 LEU C C 90 175.416 175.866 -0.450 1
1 1177 . 6 1 1 A 90 90 LEU CA C 90 54.755 55.065 -0.310 1
1 1178 . 6 1 1 A 90 90 LEU CB C 90 42.960 42.071 0.889 1
1 1182 . 6 1 1 A 90 90 LEU N N 90 117.576 117.230 0.346 1
1 1183 . 6 1 1 A 91 91 GLU H H 91 8.143 7.867 0.276 1
1 1184 . 6 1 1 A 91 91 GLU HA H 91 4.005 4.062 -0.057 1
1 1189 . 6 1 1 A 91 91 GLU C C 91 175.792 176.156 -0.364 1
1 1190 . 6 1 1 A 91 91 GLU CA C 91 57.202 57.483 -0.281 1
1 1191 . 6 1 1 A 91 91 GLU CB C 91 26.125 26.656 -0.531 1
1 1193 . 6 1 1 A 91 91 GLU N N 91 113.620 115.171 -1.551 1
1 1194 . 6 1 1 A 92 92 LEU H H 92 8.290 7.837 0.453 1
1 1195 . 6 1 1 A 92 92 LEU HA H 92 4.216 4.094 0.122 1
1 1205 . 6 1 1 A 92 92 LEU C C 92 176.622 177.014 -0.392 1
1 1206 . 6 1 1 A 92 92 LEU CA C 92 56.410 56.476 -0.066 1
1 1207 . 6 1 1 A 92 92 LEU CB C 92 43.378 42.631 0.747 1
1 1211 . 6 1 1 A 92 92 LEU N N 92 116.868 119.009 -2.141 1
1 1212 . 6 1 1 A 93 93 ILE H H 93 6.988 6.960 0.028 1
1 1213 . 6 1 1 A 93 93 ILE HA H 93 4.580 4.612 -0.032 1
1 1223 . 6 1 1 A 93 93 ILE C C 93 175.145 175.583 -0.438 1
1 1224 . 6 1 1 A 93 93 ILE CA C 93 58.707 58.503 0.204 1
1 1225 . 6 1 1 A 93 93 ILE CB C 93 42.864 41.284 1.580 1
1 1229 . 6 1 1 A 93 93 ILE N N 93 107.565 114.245 -6.680 1
1 1230 . 6 1 1 A 94 94 THR H H 94 8.742 8.637 0.105 1
1 1231 . 6 1 1 A 94 94 THR HA H 94 4.489 4.351 0.138 1
1 1236 . 6 1 1 A 94 94 THR C C 94 173.875 174.577 -0.702 1
1 1237 . 6 1 1 A 94 94 THR CA C 94 61.842 62.810 -0.968 1
1 1238 . 6 1 1 A 94 94 THR CB C 94 69.972 69.129 0.843 1
1 1240 . 6 1 1 A 94 94 THR N N 94 107.904 113.460 -5.556 1
1 1241 . 6 1 1 A 95 95 LYS H H 95 7.294 7.577 -0.283 1
1 1242 . 6 1 1 A 95 95 LYS HA H 95 4.566 4.831 -0.265 1
1 1251 . 6 1 1 A 95 95 LYS C C 95 173.791 174.066 -0.275 1
1 1252 . 6 1 1 A 95 95 LYS CA C 95 54.533 55.611 -1.078 1
1 1253 . 6 1 1 A 95 95 LYS CB C 95 35.123 36.116 -0.993 1
1 1257 . 6 1 1 A 95 95 LYS N N 95 119.458 120.453 -0.995 1
1 1258 . 6 1 1 A 96 96 ASN H H 96 9.157 8.391 0.766 1
1 1259 . 6 1 1 A 96 96 ASN HA H 96 4.408 5.227 -0.819 1
1 1264 . 6 1 1 A 96 96 ASN C C 96 176.653 175.559 1.094 1
1 1265 . 6 1 1 A 96 96 ASN CA C 96 51.088 51.497 -0.409 1
1 1266 . 6 1 1 A 96 96 ASN CB C 96 37.292 41.195 -3.903 1
1 1267 . 6 1 1 A 96 96 ASN N N 96 121.031 123.193 -2.162 1
1 1269 . 6 1 1 A 97 97 VAL H H 97 8.193 8.324 -0.131 1
1 1270 . 6 1 1 A 97 97 VAL HA H 97 4.019 4.356 -0.337 1
1 1278 . 6 1 1 A 97 97 VAL C C 97 175.089 176.166 -1.077 1
1 1279 . 6 1 1 A 97 97 VAL CA C 97 63.437 61.580 1.857 1
1 1280 . 6 1 1 A 97 97 VAL CB C 97 29.934 32.094 -2.160 1
1 1283 . 6 1 1 A 97 97 VAL N N 97 118.839 116.533 2.306 1
1 1284 . 6 1 1 A 98 98 ALA H H 98 7.994 7.605 0.389 1
1 1285 . 6 1 1 A 98 98 ALA HA H 98 5.108 4.187 0.921 1
1 1289 . 6 1 1 A 98 98 ALA C C 98 178.033 179.708 -1.675 1
1 1290 . 6 1 1 A 98 98 ALA CA C 98 50.342 53.883 -3.541 1
1 1291 . 6 1 1 A 98 98 ALA CB C 98 19.659 18.942 0.717 1
1 1292 . 6 1 1 A 98 98 ALA N N 98 121.031 124.811 -3.780 1
1 1293 . 6 1 1 A 99 99 ALA H H 99 7.347 7.875 -0.528 1
1 1294 . 6 1 1 A 99 99 ALA HA H 99 3.818 4.159 -0.341 1
1 1298 . 6 1 1 A 99 99 ALA C C 99 177.712 177.996 -0.284 1
1 1299 . 6 1 1 A 99 99 ALA CA C 99 55.117 53.707 1.410 1
1 1300 . 6 1 1 A 99 99 ALA CB C 99 18.879 18.305 0.574 1
1 1301 . 6 1 1 A 99 99 ALA N N 99 122.816 119.678 3.138 1
1 1302 . 6 1 1 A 100 100 LYS H H 100 8.190 7.820 0.370 1
1 1303 . 6 1 1 A 100 100 LYS HA H 100 4.483 4.307 0.176 1
1 1312 . 6 1 1 A 100 100 LYS C C 100 175.899 175.875 0.024 1
1 1313 . 6 1 1 A 100 100 LYS CA C 100 54.231 57.555 -3.324 1
1 1314 . 6 1 1 A 100 100 LYS CB C 100 32.066 33.039 -0.973 1
1 1318 . 6 1 1 A 100 100 LYS N N 100 113.197 115.423 -2.226 1
1 1319 . 6 1 1 A 101 101 THR H H 101 7.128 7.624 -0.496 1
1 1320 . 6 1 1 A 101 101 THR HA H 101 3.834 4.682 -0.848 1
1 1325 . 6 1 1 A 101 101 THR C C 101 173.255 174.254 -0.999 1
1 1326 . 6 1 1 A 101 101 THR CA C 101 64.392 62.152 2.240 1
1 1327 . 6 1 1 A 101 101 THR CB C 101 69.160 69.644 -0.484 1
1 1329 . 6 1 1 A 101 101 THR N N 101 118.368 114.836 3.532 1
1 1330 . 6 1 1 A 102 102 LYS H H 102 8.753 8.715 0.038 1
1 1331 . 6 1 1 A 102 102 LYS HA H 102 4.438 4.583 -0.145 1
1 1340 . 6 1 1 A 102 102 LYS C C 102 175.627 176.184 -0.557 1
1 1341 . 6 1 1 A 102 102 LYS CA C 102 55.117 55.577 -0.460 1
1 1342 . 6 1 1 A 102 102 LYS CB C 102 33.901 33.510 0.391 1
1 1346 . 6 1 1 A 102 102 LYS N N 102 126.513 125.493 1.020 1
1 1347 . 6 1 1 A 103 103 LEU H H 103 8.602 8.112 0.490 1
1 1348 . 6 1 1 A 103 103 LEU HA H 103 4.486 4.366 0.120 1
1 1358 . 6 1 1 A 103 103 LEU CA C 103 52.233 53.093 -0.860 1
1 1359 . 6 1 1 A 103 103 LEU CB C 103 41.028 42.802 -1.774 1
1 1363 . 6 1 1 A 103 103 LEU N N 103 124.466 122.749 1.717 1
1 1364 . 6 1 1 A 104 104 PRO HA H 104 4.437 4.513 -0.076 1
1 1371 . 6 1 1 A 104 104 PRO C C 104 175.779 176.223 -0.444 1
1 1372 . 6 1 1 A 104 104 PRO CA C 104 62.322 62.852 -0.530 1
1 1373 . 6 1 1 A 104 104 PRO CB C 104 31.899 31.780 0.119 1
1 1376 . 6 1 1 A 105 105 LYS H H 105 8.460 8.360 0.100 1
1 1377 . 6 1 1 A 105 105 LYS HA H 105 4.154 4.570 -0.416 1
1 1386 . 6 1 1 A 105 105 LYS C C 105 175.998 175.980 0.018 1
1 1387 . 6 1 1 A 105 105 LYS CA C 105 56.480 55.653 0.827 1
1 1388 . 6 1 1 A 105 105 LYS CB C 105 32.909 32.584 0.325 1
1 1392 . 6 1 1 A 105 105 LYS N N 105 122.139 122.165 -0.026 1
1 1393 . 6 1 1 A 106 106 ALA H H 106 8.448 8.634 -0.186 1
1 1394 . 6 1 1 A 106 106 ALA HA H 106 4.309 4.655 -0.346 1
1 1398 . 6 1 1 A 106 106 ALA C C 106 176.828 176.390 0.438 1
1 1399 . 6 1 1 A 106 106 ALA CA C 106 51.862 50.201 1.661 1
1 1400 . 6 1 1 A 106 106 ALA CB C 106 19.323 21.451 -2.128 1
1 1401 . 6 1 1 A 106 106 ALA N N 106 125.278 127.883 -2.605 1
1 1402 . 6 1 1 A 107 107 ASP H H 107 8.428 8.560 -0.132 1
1 1403 . 6 1 1 A 107 107 ASP HA H 107 4.574 4.526 0.048 1
1 1406 . 6 1 1 A 107 107 ASP C C 107 175.951 175.985 -0.034 1
1 1407 . 6 1 1 A 107 107 ASP CA C 107 54.214 54.610 -0.396 1
1 1408 . 6 1 1 A 107 107 ASP CB C 107 41.141 40.908 0.233 1
1 1409 . 6 1 1 A 107 107 ASP N N 107 120.771 118.643 2.128 1
1 1410 . 6 1 1 A 108 108 LYS H H 108 8.329 8.594 -0.265 1
1 1411 . 6 1 1 A 108 108 LYS HA H 108 4.203 4.391 -0.188 1
1 1420 . 6 1 1 A 108 108 LYS C C 108 176.483 176.623 -0.140 1
1 1421 . 6 1 1 A 108 108 LYS CA C 108 56.831 56.542 0.289 1
1 1422 . 6 1 1 A 108 108 LYS CB C 108 32.648 32.626 0.022 1
1 1426 . 6 1 1 A 108 108 LYS N N 108 120.727 122.467 -1.740 1
1 1427 . 6 1 1 A 109 109 GLU H H 109 8.447 8.716 -0.269 1
1 1428 . 6 1 1 A 109 109 GLU HA H 109 4.215 4.672 -0.457 1
1 1433 . 6 1 1 A 109 109 GLU C C 109 176.513 176.208 0.305 1
1 1434 . 6 1 1 A 109 109 GLU CA C 109 56.936 55.586 1.350 1
1 1435 . 6 1 1 A 109 109 GLU CB C 109 29.833 30.211 -0.378 1
1 1437 . 6 1 1 A 109 109 GLU N N 109 121.471 124.874 -3.403 1
1 1438 . 6 1 1 A 110 110 GLU H H 110 8.352 8.406 -0.054 1
1 1439 . 6 1 1 A 110 110 GLU HA H 110 4.233 4.030 0.203 1
1 1444 . 6 1 1 A 110 110 GLU C C 110 176.439 176.062 0.377 1
1 1445 . 6 1 1 A 110 110 GLU CA C 110 56.681 58.880 -2.199 1
1 1446 . 6 1 1 A 110 110 GLU CB C 110 29.860 28.412 1.448 1
1 1448 . 6 1 1 A 110 110 GLU N N 110 121.559 116.710 4.849 1
1 1449 . 6 1 1 A 111 111 LEU H H 111 8.145 8.263 -0.118 1
1 1450 . 6 1 1 A 111 111 LEU HA H 111 4.251 3.868 0.383 1
1 1460 . 6 1 1 A 111 111 LEU C C 111 177.306 175.724 1.582 1
1 1461 . 6 1 1 A 111 111 LEU CA C 111 55.277 57.547 -2.270 1
1 1462 . 6 1 1 A 111 111 LEU CB C 111 42.054 39.899 2.155 1
1 1466 . 6 1 1 A 111 111 LEU N N 111 122.181 120.568 1.613 1
1 1467 . 6 1 1 A 112 112 GLU H H 112 8.212 8.181 0.031 1
1 1468 . 6 1 1 A 112 112 GLU N N 112 120.291 118.076 2.215 1
1 1469 . 6 1 1 A 114 114 HIS C C 114 176.070 176.224 -0.154 1
1 1470 . 6 1 1 A 116 116 HIS H H 116 8.227 9.073 -0.846 1
1 1471 . 6 1 1 A 116 116 HIS C C 116 173.580 174.142 -0.562 1
1 1472 . 6 1 1 A 116 116 HIS N N 116 119.156 126.884 -7.728 1
1 5 . 7 1 1 A 3 3 PRO HA H 3 4.390 4.647 -0.257 1
1 12 . 7 1 1 A 3 3 PRO C C 3 176.847 177.756 -0.909 1
1 13 . 7 1 1 A 3 3 PRO CA C 3 63.449 62.825 0.624 1
1 14 . 7 1 1 A 3 3 PRO CB C 3 31.938 31.727 0.211 1
1 17 . 7 1 1 A 4 4 SER H H 4 8.531 8.827 -0.296 1
1 18 . 7 1 1 A 4 4 SER HA H 4 4.262 4.261 0.001 1
1 21 . 7 1 1 A 4 4 SER C C 4 175.414 173.592 1.822 1
1 22 . 7 1 1 A 4 4 SER CA C 4 59.163 59.490 -0.327 1
1 23 . 7 1 1 A 4 4 SER CB C 4 63.242 63.159 0.083 1
1 24 . 7 1 1 A 4 4 SER N N 4 114.246 118.817 -4.571 1
1 25 . 7 1 1 A 5 5 LYS H H 5 8.468 7.862 0.606 1
1 26 . 7 1 1 A 5 5 LYS HA H 5 4.433 3.826 0.607 1
1 35 . 7 1 1 A 5 5 LYS C C 5 175.984 175.113 0.871 1
1 36 . 7 1 1 A 5 5 LYS CA C 5 55.724 57.151 -1.427 1
1 37 . 7 1 1 A 5 5 LYS CB C 5 32.881 29.643 3.238 1
1 41 . 7 1 1 A 5 5 LYS N N 5 123.488 117.944 5.544 1
1 42 . 7 1 1 A 6 6 LEU H H 6 7.707 7.913 -0.206 1
1 43 . 7 1 1 A 6 6 LEU HA H 6 4.381 4.453 -0.072 1
1 53 . 7 1 1 A 6 6 LEU C C 6 177.820 175.916 1.904 1
1 54 . 7 1 1 A 6 6 LEU CA C 6 55.507 55.400 0.107 1
1 55 . 7 1 1 A 6 6 LEU CB C 6 43.374 42.664 0.710 1
1 59 . 7 1 1 A 6 6 LEU N N 6 121.233 120.490 0.743 1
1 60 . 7 1 1 A 7 7 SER H H 7 9.433 8.789 0.644 1
1 61 . 7 1 1 A 7 7 SER HA H 7 4.638 4.916 -0.278 1
1 64 . 7 1 1 A 7 7 SER C C 7 174.120 174.977 -0.857 1
1 65 . 7 1 1 A 7 7 SER CA C 7 57.962 57.346 0.616 1
1 66 . 7 1 1 A 7 7 SER CB C 7 64.197 64.591 -0.394 1
1 67 . 7 1 1 A 7 7 SER N N 7 122.977 118.326 4.651 1
1 68 . 7 1 1 A 8 8 TYR H H 8 9.764 9.159 0.605 1
1 69 . 7 1 1 A 8 8 TYR HA H 8 4.732 4.252 0.480 1
1 76 . 7 1 1 A 8 8 TYR C C 8 177.206 177.495 -0.289 1
1 77 . 7 1 1 A 8 8 TYR CA C 8 58.762 61.789 -3.027 1
1 78 . 7 1 1 A 8 8 TYR CB C 8 36.605 38.819 -2.214 1
1 83 . 7 1 1 A 8 8 TYR N N 8 123.312 122.646 0.666 1
1 84 . 7 1 1 A 9 9 GLY H H 9 10.131 8.457 1.674 1
1 85 . 7 1 1 A 9 9 GLY HA2 H 9 3.983 3.581 0.402 1
1 86 . 7 1 1 A 9 9 GLY HA3 H 9 3.423 3.667 -0.244 1
1 87 . 7 1 1 A 9 9 GLY C C 9 175.163 175.964 -0.801 1
1 88 . 7 1 1 A 9 9 GLY CA C 9 47.153 47.312 -0.159 1
1 89 . 7 1 1 A 9 9 GLY N N 9 107.177 106.113 1.064 1
1 90 . 7 1 1 A 10 10 GLU H H 10 7.876 8.037 -0.161 1
1 91 . 7 1 1 A 10 10 GLU HA H 10 4.107 4.093 0.014 1
1 96 . 7 1 1 A 10 10 GLU C C 10 179.924 178.766 1.158 1
1 97 . 7 1 1 A 10 10 GLU CA C 10 58.890 59.414 -0.524 1
1 98 . 7 1 1 A 10 10 GLU CB C 10 29.750 29.372 0.378 1
1 100 . 7 1 1 A 10 10 GLU N N 10 122.219 121.715 0.504 1
1 101 . 7 1 1 A 11 11 TYR H H 11 8.384 7.706 0.678 1
1 102 . 7 1 1 A 11 11 TYR HA H 11 4.305 4.270 0.035 1
1 107 . 7 1 1 A 11 11 TYR C C 11 176.854 176.949 -0.095 1
1 108 . 7 1 1 A 11 11 TYR CA C 11 61.040 61.514 -0.474 1
1 109 . 7 1 1 A 11 11 TYR CB C 11 37.593 38.796 -1.203 1
1 112 . 7 1 1 A 11 11 TYR N N 11 120.809 122.610 -1.801 1
1 113 . 7 1 1 A 12 12 LEU H H 12 9.027 8.429 0.598 1
1 114 . 7 1 1 A 12 12 LEU HA H 12 3.778 3.780 -0.002 1
1 124 . 7 1 1 A 12 12 LEU C C 12 178.621 179.475 -0.854 1
1 125 . 7 1 1 A 12 12 LEU CA C 12 57.534 57.691 -0.157 1
1 126 . 7 1 1 A 12 12 LEU CB C 12 41.957 40.705 1.252 1
1 130 . 7 1 1 A 12 12 LEU N N 12 121.080 119.236 1.844 1
1 131 . 7 1 1 A 13 13 GLU H H 13 7.614 8.234 -0.620 1
1 132 . 7 1 1 A 13 13 GLU HA H 13 4.102 4.071 0.031 1
1 137 . 7 1 1 A 13 13 GLU C C 13 178.449 178.959 -0.510 1
1 138 . 7 1 1 A 13 13 GLU CA C 13 59.609 59.599 0.010 1
1 139 . 7 1 1 A 13 13 GLU CB C 13 29.124 29.634 -0.510 1
1 141 . 7 1 1 A 13 13 GLU N N 13 118.475 120.514 -2.039 1
1 142 . 7 1 1 A 14 14 SER H H 14 7.329 8.027 -0.698 1
1 143 . 7 1 1 A 14 14 SER HA H 14 4.358 4.273 0.085 1
1 146 . 7 1 1 A 14 14 SER C C 14 176.794 176.455 0.339 1
1 147 . 7 1 1 A 14 14 SER CA C 14 61.064 61.392 -0.328 1
1 148 . 7 1 1 A 14 14 SER CB C 14 62.513 62.406 0.107 1
1 149 . 7 1 1 A 14 14 SER N N 14 115.209 114.257 0.952 1
1 150 . 7 1 1 A 15 15 TRP H H 15 8.870 8.119 0.751 1
1 151 . 7 1 1 A 15 15 TRP HA H 15 4.005 4.202 -0.197 1
1 160 . 7 1 1 A 15 15 TRP C C 15 177.547 177.935 -0.388 1
1 161 . 7 1 1 A 15 15 TRP CA C 15 61.210 61.097 0.113 1
1 162 . 7 1 1 A 15 15 TRP CB C 15 27.341 29.205 -1.864 1
1 168 . 7 1 1 A 15 15 TRP N N 15 124.998 124.136 0.862 1
1 170 . 7 1 1 A 16 16 PHE H H 16 9.087 8.252 0.835 1
1 171 . 7 1 1 A 16 16 PHE HA H 16 3.210 3.697 -0.487 1
1 179 . 7 1 1 A 16 16 PHE C C 16 175.909 177.621 -1.712 1
1 180 . 7 1 1 A 16 16 PHE CA C 16 61.473 61.266 0.207 1
1 181 . 7 1 1 A 16 16 PHE CB C 16 38.506 39.016 -0.510 1
1 187 . 7 1 1 A 16 16 PHE N N 16 119.825 120.888 -1.063 1
1 188 . 7 1 1 A 17 17 ASN H H 17 7.768 7.911 -0.143 1
1 189 . 7 1 1 A 17 17 ASN HA H 17 4.078 4.109 -0.031 1
1 194 . 7 1 1 A 17 17 ASN C C 17 176.604 177.581 -0.977 1
1 195 . 7 1 1 A 17 17 ASN CA C 17 55.621 56.285 -0.664 1
1 196 . 7 1 1 A 17 17 ASN CB C 17 37.830 38.027 -0.197 1
1 197 . 7 1 1 A 17 17 ASN N N 17 115.600 117.255 -1.655 1
1 199 . 7 1 1 A 18 18 THR H H 18 7.454 7.398 0.056 1
1 200 . 7 1 1 A 18 18 THR HA H 18 4.147 4.138 0.009 1
1 205 . 7 1 1 A 18 18 THR C C 18 175.692 176.227 -0.535 1
1 206 . 7 1 1 A 18 18 THR CA C 18 64.679 64.748 -0.069 1
1 207 . 7 1 1 A 18 18 THR CB C 18 68.940 68.688 0.252 1
1 209 . 7 1 1 A 18 18 THR N N 18 113.049 115.468 -2.419 1
1 210 . 7 1 1 A 19 19 LYS H H 19 7.918 7.571 0.347 1
1 211 . 7 1 1 A 19 19 LYS HA H 19 3.791 3.598 0.193 1
1 220 . 7 1 1 A 19 19 LYS C C 19 178.120 179.101 -0.981 1
1 221 . 7 1 1 A 19 19 LYS CA C 19 55.985 58.901 -2.916 1
1 222 . 7 1 1 A 19 19 LYS CB C 19 31.130 31.209 -0.079 1
1 226 . 7 1 1 A 19 19 LYS N N 19 122.614 120.809 1.805 1
1 227 . 7 1 1 A 20 20 ARG H H 20 7.845 7.500 0.345 1
1 228 . 7 1 1 A 20 20 ARG HA H 20 3.396 3.811 -0.415 1
1 236 . 7 1 1 A 20 20 ARG C C 20 175.601 178.786 -3.185 1
1 237 . 7 1 1 A 20 20 ARG CA C 20 58.182 58.212 -0.030 1
1 238 . 7 1 1 A 20 20 ARG CB C 20 28.045 29.845 -1.800 1
1 241 . 7 1 1 A 20 20 ARG N N 20 116.282 118.345 -2.063 1
1 243 . 7 1 1 A 21 21 HIS H H 21 7.163 7.608 -0.445 1
1 244 . 7 1 1 A 21 21 HIS HA H 21 4.500 4.210 0.290 1
1 249 . 7 1 1 A 21 21 HIS C C 21 175.618 176.834 -1.216 1
1 250 . 7 1 1 A 21 21 HIS CA C 21 56.912 59.324 -2.412 1
1 251 . 7 1 1 A 21 21 HIS CB C 21 29.400 29.897 -0.497 1
1 254 . 7 1 1 A 21 21 HIS N N 21 115.452 118.329 -2.877 1
1 255 . 7 1 1 A 22 22 SER H H 22 7.951 7.647 0.304 1
1 256 . 7 1 1 A 22 22 SER HA H 22 4.573 4.381 0.192 1
1 259 . 7 1 1 A 22 22 SER C C 22 173.948 174.669 -0.721 1
1 260 . 7 1 1 A 22 22 SER CA C 22 58.589 60.716 -2.127 1
1 261 . 7 1 1 A 22 22 SER CB C 22 64.228 64.368 -0.140 1
1 262 . 7 1 1 A 22 22 SER N N 22 113.209 112.462 0.747 1
1 263 . 7 1 1 A 23 23 VAL H H 23 7.179 7.566 -0.387 1
1 264 . 7 1 1 A 23 23 VAL HA H 23 4.626 4.199 0.427 1
1 272 . 7 1 1 A 23 23 VAL C C 23 175.397 176.186 -0.789 1
1 273 . 7 1 1 A 23 23 VAL CA C 23 59.556 61.579 -2.023 1
1 274 . 7 1 1 A 23 23 VAL CB C 23 33.810 32.889 0.921 1
1 277 . 7 1 1 A 23 23 VAL N N 23 113.108 117.148 -4.040 1
1 278 . 7 1 1 A 24 24 GLY H H 24 8.189 8.480 -0.291 1
1 279 . 7 1 1 A 24 24 GLY HA2 H 24 4.074 4.045 0.029 1
1 280 . 7 1 1 A 24 24 GLY HA3 H 24 4.195 4.069 0.126 1
1 281 . 7 1 1 A 24 24 GLY C C 24 174.037 174.887 -0.850 1
1 282 . 7 1 1 A 24 24 GLY CA C 24 44.452 45.541 -1.089 1
1 283 . 7 1 1 A 24 24 GLY N N 24 108.374 109.745 -1.371 1
1 284 . 7 1 1 A 25 25 ILE H H 25 8.331 8.594 -0.263 1
1 285 . 7 1 1 A 25 25 ILE HA H 25 3.839 3.621 0.218 1
1 295 . 7 1 1 A 25 25 ILE C C 25 178.042 177.733 0.309 1
1 296 . 7 1 1 A 25 25 ILE CA C 25 64.238 64.432 -0.194 1
1 297 . 7 1 1 A 25 25 ILE CB C 25 37.931 37.393 0.538 1
1 301 . 7 1 1 A 25 25 ILE N N 25 119.895 122.254 -2.359 1
1 302 . 7 1 1 A 26 26 GLN H H 26 8.545 8.499 0.046 1
1 303 . 7 1 1 A 26 26 GLN HA H 26 4.129 4.073 0.056 1
1 310 . 7 1 1 A 26 26 GLN C C 26 178.454 178.270 0.184 1
1 311 . 7 1 1 A 26 26 GLN CA C 26 58.772 58.204 0.568 1
1 312 . 7 1 1 A 26 26 GLN CB C 26 27.346 28.298 -0.952 1
1 314 . 7 1 1 A 26 26 GLN N N 26 120.013 119.924 0.089 1
1 316 . 7 1 1 A 27 27 THR H H 27 7.944 8.069 -0.125 1
1 317 . 7 1 1 A 27 27 THR HA H 27 3.953 3.889 0.064 1
1 322 . 7 1 1 A 27 27 THR C C 27 175.818 176.048 -0.230 1
1 323 . 7 1 1 A 27 27 THR CA C 27 65.855 66.596 -0.741 1
1 324 . 7 1 1 A 27 27 THR CB C 27 68.127 68.711 -0.584 1
1 326 . 7 1 1 A 27 27 THR N N 27 117.645 116.554 1.091 1
1 327 . 7 1 1 A 28 28 ALA H H 28 8.593 8.384 0.209 1
1 328 . 7 1 1 A 28 28 ALA HA H 28 3.899 4.128 -0.229 1
1 332 . 7 1 1 A 28 28 ALA C C 28 178.515 179.615 -1.100 1
1 333 . 7 1 1 A 28 28 ALA CA C 28 55.742 55.585 0.157 1
1 334 . 7 1 1 A 28 28 ALA CB C 28 17.513 18.377 -0.864 1
1 335 . 7 1 1 A 28 28 ALA N N 28 123.917 123.510 0.407 1
1 336 . 7 1 1 A 29 29 LYS H H 29 7.800 7.889 -0.089 1
1 337 . 7 1 1 A 29 29 LYS HA H 29 3.982 3.964 0.018 1
1 346 . 7 1 1 A 29 29 LYS C C 29 179.527 179.098 0.429 1
1 347 . 7 1 1 A 29 29 LYS CA C 29 59.761 59.132 0.629 1
1 348 . 7 1 1 A 29 29 LYS CB C 29 32.223 32.247 -0.024 1
1 352 . 7 1 1 A 29 29 LYS N N 29 117.474 118.662 -1.188 1
1 353 . 7 1 1 A 30 30 VAL H H 30 7.591 7.677 -0.086 1
1 354 . 7 1 1 A 30 30 VAL HA H 30 3.503 3.293 0.210 1
1 362 . 7 1 1 A 30 30 VAL C C 30 178.389 177.619 0.770 1
1 363 . 7 1 1 A 30 30 VAL CA C 30 65.640 65.742 -0.102 1
1 364 . 7 1 1 A 30 30 VAL CB C 30 31.644 31.475 0.169 1
1 367 . 7 1 1 A 30 30 VAL N N 30 121.749 120.476 1.273 1
1 368 . 7 1 1 A 31 31 LEU H H 31 8.333 8.101 0.232 1
1 369 . 7 1 1 A 31 31 LEU HA H 31 4.074 4.130 -0.056 1
1 379 . 7 1 1 A 31 31 LEU C C 31 177.780 179.352 -1.572 1
1 380 . 7 1 1 A 31 31 LEU CA C 31 58.157 58.032 0.125 1
1 381 . 7 1 1 A 31 31 LEU CB C 31 42.230 41.121 1.109 1
1 385 . 7 1 1 A 31 31 LEU N N 31 120.901 120.221 0.680 1
1 386 . 7 1 1 A 32 32 LYS H H 32 8.562 8.043 0.519 1
1 387 . 7 1 1 A 32 32 LYS HA H 32 3.290 3.946 -0.656 1
1 395 . 7 1 1 A 32 32 LYS C C 32 178.037 178.653 -0.616 1
1 396 . 7 1 1 A 32 32 LYS CA C 32 58.911 59.743 -0.832 1
1 397 . 7 1 1 A 32 32 LYS CB C 32 31.605 31.563 0.042 1
1 401 . 7 1 1 A 32 32 LYS N N 32 119.075 119.668 -0.593 1
1 402 . 7 1 1 A 33 33 GLY H H 33 7.694 7.962 -0.268 1
1 403 . 7 1 1 A 33 33 GLY HA2 H 33 3.949 3.582 0.367 1
1 404 . 7 1 1 A 33 33 GLY HA3 H 33 3.826 3.671 0.155 1
1 405 . 7 1 1 A 33 33 GLY C C 33 177.101 176.530 0.571 1
1 406 . 7 1 1 A 33 33 GLY CA C 33 46.928 46.862 0.066 1
1 407 . 7 1 1 A 33 33 GLY N N 33 105.282 106.450 -1.168 1
1 408 . 7 1 1 A 34 34 TYR H H 34 8.015 7.473 0.542 1
1 409 . 7 1 1 A 34 34 TYR HA H 34 4.558 4.704 -0.146 1
1 416 . 7 1 1 A 34 34 TYR C C 34 179.611 178.069 1.542 1
1 417 . 7 1 1 A 34 34 TYR CA C 34 59.349 60.270 -0.921 1
1 418 . 7 1 1 A 34 34 TYR CB C 34 37.344 38.292 -0.948 1
1 423 . 7 1 1 A 34 34 TYR N N 34 121.781 121.740 0.041 1
1 424 . 7 1 1 A 35 35 LEU H H 35 8.689 8.091 0.598 1
1 425 . 7 1 1 A 35 35 LEU HA H 35 3.977 3.887 0.090 1
1 435 . 7 1 1 A 35 35 LEU C C 35 177.081 179.141 -2.060 1
1 436 . 7 1 1 A 35 35 LEU CA C 35 59.155 58.414 0.741 1
1 437 . 7 1 1 A 35 35 LEU CB C 35 41.103 41.786 -0.683 1
1 441 . 7 1 1 A 35 35 LEU N N 35 120.392 120.569 -0.177 1
1 442 . 7 1 1 A 36 36 ASN H H 36 8.721 8.404 0.317 1
1 443 . 7 1 1 A 36 36 ASN HA H 36 4.435 4.419 0.016 1
1 448 . 7 1 1 A 36 36 ASN C C 36 176.792 177.684 -0.892 1
1 449 . 7 1 1 A 36 36 ASN CA C 36 55.642 55.756 -0.114 1
1 450 . 7 1 1 A 36 36 ASN CB C 36 38.319 37.242 1.077 1
1 451 . 7 1 1 A 36 36 ASN N N 36 114.623 116.053 -1.430 1
1 453 . 7 1 1 A 37 37 SER H H 37 8.511 7.925 0.586 1
1 454 . 7 1 1 A 37 37 SER HA H 37 4.642 4.305 0.337 1
1 457 . 7 1 1 A 37 37 SER C C 37 175.039 176.293 -1.254 1
1 458 . 7 1 1 A 37 37 SER CA C 37 59.825 61.286 -1.461 1
1 459 . 7 1 1 A 37 37 SER CB C 37 64.056 63.093 0.963 1
1 460 . 7 1 1 A 37 37 SER N N 37 110.941 114.926 -3.985 1
1 461 . 7 1 1 A 38 38 ARG H H 38 7.242 8.053 -0.811 1
1 462 . 7 1 1 A 38 38 ARG HA H 38 4.919 4.464 0.455 1
1 469 . 7 1 1 A 38 38 ARG C C 38 176.514 178.275 -1.761 1
1 470 . 7 1 1 A 38 38 ARG CA C 38 56.687 58.057 -1.370 1
1 471 . 7 1 1 A 38 38 ARG CB C 38 32.434 31.377 1.057 1
1 474 . 7 1 1 A 38 38 ARG N N 38 117.062 120.792 -3.730 1
1 475 . 7 1 1 A 39 39 ILE H H 39 8.462 7.941 0.521 1
1 476 . 7 1 1 A 39 39 ILE HA H 39 3.618 3.779 -0.161 1
1 486 . 7 1 1 A 39 39 ILE C C 39 176.267 178.371 -2.104 1
1 487 . 7 1 1 A 39 39 ILE CA C 39 66.134 64.734 1.400 1
1 488 . 7 1 1 A 39 39 ILE CB C 39 39.787 37.508 2.279 1
1 492 . 7 1 1 A 39 39 ILE N N 39 121.214 120.467 0.747 1
1 493 . 7 1 1 A 40 40 ILE H H 40 9.339 8.016 1.323 1
1 494 . 7 1 1 A 40 40 ILE HA H 40 3.401 3.735 -0.334 1
1 504 . 7 1 1 A 40 40 ILE CA C 40 67.844 66.309 1.535 1
1 505 . 7 1 1 A 40 40 ILE CB C 40 34.406 35.353 -0.947 1
1 509 . 7 1 1 A 40 40 ILE N N 40 119.695 121.586 -1.891 1
1 510 . 7 1 1 A 41 41 PRO HA H 41 4.314 4.410 -0.096 1
1 517 . 7 1 1 A 41 41 PRO C C 41 177.418 178.152 -0.734 1
1 518 . 7 1 1 A 41 41 PRO CA C 41 65.912 65.166 0.746 1
1 519 . 7 1 1 A 41 41 PRO CB C 41 30.686 31.376 -0.690 1
1 522 . 7 1 1 A 42 42 SER H H 42 6.857 8.220 -1.363 1
1 523 . 7 1 1 A 42 42 SER HA H 42 4.558 4.511 0.047 1
1 526 . 7 1 1 A 42 42 SER C C 42 174.813 175.808 -0.995 1
1 527 . 7 1 1 A 42 42 SER CA C 42 61.279 60.959 0.320 1
1 528 . 7 1 1 A 42 42 SER CB C 42 64.285 64.152 0.133 1
1 529 . 7 1 1 A 42 42 SER N N 42 108.994 112.848 -3.854 1
1 530 . 7 1 1 A 43 43 LEU H H 43 8.230 8.053 0.177 1
1 531 . 7 1 1 A 43 43 LEU HA H 43 4.572 4.328 0.244 1
1 541 . 7 1 1 A 43 43 LEU C C 43 177.301 178.592 -1.291 1
1 542 . 7 1 1 A 43 43 LEU CA C 43 54.113 55.002 -0.889 1
1 543 . 7 1 1 A 43 43 LEU CB C 43 44.800 42.451 2.349 1
1 547 . 7 1 1 A 43 43 LEU N N 43 118.715 119.870 -1.155 1
1 548 . 7 1 1 A 44 44 GLY H H 44 8.498 8.092 0.406 1
1 549 . 7 1 1 A 44 44 GLY HA2 H 44 4.010 3.830 0.180 1
1 550 . 7 1 1 A 44 44 GLY HA3 H 44 3.613 3.867 -0.254 1
1 551 . 7 1 1 A 44 44 GLY C C 44 174.178 176.162 -1.984 1
1 552 . 7 1 1 A 44 44 GLY CA C 44 46.271 47.296 -1.025 1
1 553 . 7 1 1 A 44 44 GLY N N 44 105.371 107.190 -1.819 1
1 554 . 7 1 1 A 45 45 ASN H H 45 8.385 7.915 0.470 1
1 555 . 7 1 1 A 45 45 ASN HA H 45 4.789 4.742 0.047 1
1 560 . 7 1 1 A 45 45 ASN C C 45 175.386 176.321 -0.935 1
1 561 . 7 1 1 A 45 45 ASN CA C 45 53.144 54.531 -1.387 1
1 562 . 7 1 1 A 45 45 ASN CB C 45 37.928 38.673 -0.745 1
1 563 . 7 1 1 A 45 45 ASN N N 45 114.387 118.397 -4.010 1
1 565 . 7 1 1 A 46 46 ILE H H 46 7.465 7.384 0.081 1
1 566 . 7 1 1 A 46 46 ILE HA H 46 3.856 3.978 -0.122 1
1 576 . 7 1 1 A 46 46 ILE C C 46 175.997 176.139 -0.142 1
1 577 . 7 1 1 A 46 46 ILE CA C 46 60.853 62.071 -1.218 1
1 578 . 7 1 1 A 46 46 ILE CB C 46 38.042 38.016 0.026 1
1 582 . 7 1 1 A 46 46 ILE N N 46 123.998 121.690 2.308 1
1 583 . 7 1 1 A 47 47 LYS H H 47 8.717 8.636 0.081 1
1 584 . 7 1 1 A 47 47 LYS HA H 47 4.249 4.303 -0.054 1
1 591 . 7 1 1 A 47 47 LYS C C 47 177.583 177.645 -0.062 1
1 592 . 7 1 1 A 47 47 LYS CA C 47 56.320 57.041 -0.721 1
1 593 . 7 1 1 A 47 47 LYS CB C 47 30.393 32.709 -2.316 1
1 596 . 7 1 1 A 47 47 LYS N N 47 126.114 125.303 0.811 1
1 597 . 7 1 1 A 48 48 LEU H H 48 8.323 8.603 -0.280 1
1 598 . 7 1 1 A 48 48 LEU HA H 48 3.691 3.975 -0.284 1
1 608 . 7 1 1 A 48 48 LEU C C 48 177.274 178.306 -1.032 1
1 609 . 7 1 1 A 48 48 LEU CA C 48 58.443 58.343 0.100 1
1 610 . 7 1 1 A 48 48 LEU CB C 48 42.282 41.203 1.079 1
1 614 . 7 1 1 A 48 48 LEU N N 48 125.857 125.892 -0.035 1
1 615 . 7 1 1 A 49 49 ALA H H 49 8.929 8.120 0.809 1
1 616 . 7 1 1 A 49 49 ALA HA H 49 4.067 3.972 0.095 1
1 620 . 7 1 1 A 49 49 ALA C C 49 177.468 178.856 -1.388 1
1 621 . 7 1 1 A 49 49 ALA CA C 49 53.092 54.681 -1.589 1
1 622 . 7 1 1 A 49 49 ALA CB C 49 18.562 18.091 0.471 1
1 623 . 7 1 1 A 49 49 ALA N N 49 115.543 120.143 -4.600 1
1 624 . 7 1 1 A 50 50 LYS H H 50 7.684 7.511 0.173 1
1 625 . 7 1 1 A 50 50 LYS HA H 50 4.395 4.316 0.079 1
1 634 . 7 1 1 A 50 50 LYS C C 50 174.958 176.867 -1.909 1
1 635 . 7 1 1 A 50 50 LYS CA C 50 53.977 57.002 -3.025 1
1 636 . 7 1 1 A 50 50 LYS CB C 50 32.645 32.744 -0.099 1
1 640 . 7 1 1 A 50 50 LYS N N 50 114.788 114.947 -0.159 1
1 641 . 7 1 1 A 51 51 LEU H H 51 6.776 6.939 -0.163 1
1 642 . 7 1 1 A 51 51 LEU HA H 51 4.569 4.368 0.201 1
1 652 . 7 1 1 A 51 51 LEU C C 51 177.953 175.825 2.128 1
1 653 . 7 1 1 A 51 51 LEU CA C 51 55.318 55.452 -0.134 1
1 654 . 7 1 1 A 51 51 LEU CB C 51 43.182 41.305 1.877 1
1 658 . 7 1 1 A 51 51 LEU N N 51 121.408 122.369 -0.961 1
1 659 . 7 1 1 A 52 52 THR H H 52 10.680 7.701 2.979 1
1 660 . 7 1 1 A 52 52 THR HA H 52 4.938 4.619 0.319 1
1 665 . 7 1 1 A 52 52 THR C C 52 175.553 174.385 1.168 1
1 666 . 7 1 1 A 52 52 THR CA C 52 59.740 59.675 0.065 1
1 667 . 7 1 1 A 52 52 THR CB C 52 73.557 71.295 2.262 1
1 669 . 7 1 1 A 52 52 THR N N 52 119.481 119.695 -0.214 1
1 670 . 7 1 1 A 53 53 SER H H 53 9.278 8.951 0.327 1
1 671 . 7 1 1 A 53 53 SER HA H 53 4.261 4.154 0.107 1
1 674 . 7 1 1 A 53 53 SER C C 53 176.990 176.201 0.789 1
1 675 . 7 1 1 A 53 53 SER CA C 53 61.025 61.098 -0.073 1
1 676 . 7 1 1 A 53 53 SER CB C 53 62.312 62.855 -0.543 1
1 677 . 7 1 1 A 53 53 SER N N 53 116.343 121.824 -5.481 1
1 678 . 7 1 1 A 54 54 LEU H H 54 7.808 8.025 -0.217 1
1 679 . 7 1 1 A 54 54 LEU HA H 54 4.229 4.048 0.181 1
1 688 . 7 1 1 A 54 54 LEU C C 54 178.505 178.769 -0.264 1
1 689 . 7 1 1 A 54 54 LEU CA C 54 57.719 57.956 -0.237 1
1 690 . 7 1 1 A 54 54 LEU CB C 54 40.997 41.651 -0.654 1
1 694 . 7 1 1 A 54 54 LEU N N 54 126.055 123.297 2.758 1
1 695 . 7 1 1 A 55 55 HIS H H 55 7.798 8.314 -0.516 1
1 696 . 7 1 1 A 55 55 HIS HA H 55 4.311 4.375 -0.064 1
1 701 . 7 1 1 A 55 55 HIS C C 55 180.044 177.847 2.197 1
1 702 . 7 1 1 A 55 55 HIS CA C 55 60.583 59.489 1.094 1
1 703 . 7 1 1 A 55 55 HIS CB C 55 31.445 29.691 1.754 1
1 706 . 7 1 1 A 55 55 HIS N N 55 118.683 118.132 0.551 1
1 707 . 7 1 1 A 56 56 MET H H 56 7.375 7.948 -0.573 1
1 708 . 7 1 1 A 56 56 MET HA H 56 4.513 4.071 0.442 1
1 716 . 7 1 1 A 56 56 MET C C 56 177.169 178.440 -1.271 1
1 717 . 7 1 1 A 56 56 MET CA C 56 55.823 59.105 -3.282 1
1 718 . 7 1 1 A 56 56 MET CB C 56 31.303 32.476 -1.173 1
1 721 . 7 1 1 A 56 56 MET N N 56 114.530 117.545 -3.015 1
1 722 . 7 1 1 A 57 57 GLN H H 57 8.387 8.325 0.062 1
1 723 . 7 1 1 A 57 57 GLN HA H 57 3.981 4.043 -0.062 1
1 730 . 7 1 1 A 57 57 GLN C C 57 178.033 178.507 -0.474 1
1 731 . 7 1 1 A 57 57 GLN CA C 57 57.922 59.211 -1.289 1
1 732 . 7 1 1 A 57 57 GLN CB C 57 29.012 28.509 0.503 1
1 734 . 7 1 1 A 57 57 GLN N N 57 120.713 120.385 0.328 1
1 736 . 7 1 1 A 58 58 ASN H H 58 8.765 8.423 0.342 1
1 737 . 7 1 1 A 58 58 ASN HA H 58 4.539 4.541 -0.002 1
1 742 . 7 1 1 A 58 58 ASN C C 58 178.084 177.362 0.722 1
1 743 . 7 1 1 A 58 58 ASN CA C 58 55.345 56.044 -0.699 1
1 744 . 7 1 1 A 58 58 ASN CB C 58 36.924 38.589 -1.665 1
1 745 . 7 1 1 A 58 58 ASN N N 58 117.390 117.877 -0.487 1
1 747 . 7 1 1 A 59 59 TYR H H 59 8.239 8.004 0.235 1
1 748 . 7 1 1 A 59 59 TYR HA H 59 4.586 4.191 0.395 1
1 755 . 7 1 1 A 59 59 TYR C C 59 178.015 176.839 1.176 1
1 756 . 7 1 1 A 59 59 TYR CA C 59 60.779 61.434 -0.655 1
1 757 . 7 1 1 A 59 59 TYR CB C 59 38.047 38.704 -0.657 1
1 762 . 7 1 1 A 59 59 TYR N N 59 122.335 123.261 -0.926 1
1 763 . 7 1 1 A 60 60 VAL H H 60 8.416 8.289 0.127 1
1 764 . 7 1 1 A 60 60 VAL HA H 60 3.244 3.433 -0.189 1
1 772 . 7 1 1 A 60 60 VAL C C 60 177.309 178.290 -0.981 1
1 773 . 7 1 1 A 60 60 VAL CA C 60 67.022 66.293 0.729 1
1 774 . 7 1 1 A 60 60 VAL CB C 60 30.929 31.371 -0.442 1
1 777 . 7 1 1 A 60 60 VAL N N 60 119.842 119.220 0.622 1
1 778 . 7 1 1 A 61 61 ASN H H 61 8.264 8.303 -0.039 1
1 779 . 7 1 1 A 61 61 ASN HA H 61 4.305 4.443 -0.138 1
1 784 . 7 1 1 A 61 61 ASN C C 61 177.263 178.083 -0.820 1
1 785 . 7 1 1 A 61 61 ASN CA C 61 55.548 56.485 -0.937 1
1 786 . 7 1 1 A 61 61 ASN CB C 61 36.645 38.166 -1.521 1
1 787 . 7 1 1 A 61 61 ASN N N 61 119.103 119.785 -0.682 1
1 789 . 7 1 1 A 62 62 SER H H 62 8.143 7.821 0.322 1
1 790 . 7 1 1 A 62 62 SER HA H 62 4.343 4.102 0.241 1
1 793 . 7 1 1 A 62 62 SER C C 62 176.409 175.895 0.514 1
1 794 . 7 1 1 A 62 62 SER CA C 62 61.612 62.295 -0.683 1
1 795 . 7 1 1 A 62 62 SER CB C 62 62.219 62.952 -0.733 1
1 796 . 7 1 1 A 62 62 SER N N 62 118.254 115.533 2.721 1
1 797 . 7 1 1 A 63 63 LEU H H 63 7.664 8.191 -0.527 1
1 798 . 7 1 1 A 63 63 LEU HA H 63 4.003 3.840 0.163 1
1 808 . 7 1 1 A 63 63 LEU C C 63 178.748 178.907 -0.159 1
1 809 . 7 1 1 A 63 63 LEU CA C 63 57.171 57.954 -0.783 1
1 810 . 7 1 1 A 63 63 LEU CB C 63 41.134 41.404 -0.270 1
1 814 . 7 1 1 A 63 63 LEU N N 63 123.812 120.869 2.943 1
1 815 . 7 1 1 A 64 64 ARG H H 64 7.969 7.778 0.191 1
1 816 . 7 1 1 A 64 64 ARG HA H 64 4.038 3.837 0.201 1
1 824 . 7 1 1 A 64 64 ARG C C 64 180.797 179.069 1.728 1
1 825 . 7 1 1 A 64 64 ARG CA C 64 58.598 59.792 -1.194 1
1 826 . 7 1 1 A 64 64 ARG CB C 64 28.849 29.872 -1.023 1
1 829 . 7 1 1 A 64 64 ARG N N 64 120.376 120.276 0.100 1
1 831 . 7 1 1 A 65 65 ASP H H 65 8.465 8.040 0.425 1
1 832 . 7 1 1 A 65 65 ASP HA H 65 4.408 4.422 -0.014 1
1 835 . 7 1 1 A 65 65 ASP C C 65 177.336 178.106 -0.770 1
1 836 . 7 1 1 A 65 65 ASP CA C 65 56.957 56.761 0.196 1
1 837 . 7 1 1 A 65 65 ASP CB C 65 39.602 40.178 -0.576 1
1 838 . 7 1 1 A 65 65 ASP N N 65 122.402 119.585 2.817 1
1 839 . 7 1 1 A 66 66 GLU H H 66 7.703 7.805 -0.102 1
1 840 . 7 1 1 A 66 66 GLU HA H 66 4.213 4.341 -0.128 1
1 845 . 7 1 1 A 66 66 GLU C C 66 176.586 177.058 -0.472 1
1 846 . 7 1 1 A 66 66 GLU CA C 66 56.974 56.320 0.654 1
1 847 . 7 1 1 A 66 66 GLU CB C 66 29.821 29.920 -0.099 1
1 849 . 7 1 1 A 66 66 GLU N N 66 119.076 117.214 1.862 1
1 850 . 7 1 1 A 67 67 GLY H H 67 7.861 7.818 0.043 1
1 851 . 7 1 1 A 67 67 GLY HA2 H 67 4.269 3.901 0.368 1
1 852 . 7 1 1 A 67 67 GLY HA3 H 67 3.731 3.905 -0.174 1
1 853 . 7 1 1 A 67 67 GLY C C 67 174.614 174.771 -0.157 1
1 854 . 7 1 1 A 67 67 GLY CA C 67 44.608 46.244 -1.636 1
1 855 . 7 1 1 A 67 67 GLY N N 67 105.730 109.503 -3.773 1
1 856 . 7 1 1 A 68 68 LEU H H 68 7.324 7.901 -0.577 1
1 857 . 7 1 1 A 68 68 LEU HA H 68 4.257 4.195 0.062 1
1 867 . 7 1 1 A 68 68 LEU C C 68 176.136 176.684 -0.548 1
1 868 . 7 1 1 A 68 68 LEU CA C 68 55.659 54.133 1.526 1
1 869 . 7 1 1 A 68 68 LEU CB C 68 41.874 41.651 0.223 1
1 873 . 7 1 1 A 68 68 LEU N N 68 121.062 122.335 -1.273 1
1 874 . 7 1 1 A 69 69 LYS H H 69 8.368 8.434 -0.066 1
1 875 . 7 1 1 A 69 69 LYS HA H 69 4.281 4.374 -0.093 1
1 884 . 7 1 1 A 69 69 LYS C C 69 177.940 177.882 0.058 1
1 885 . 7 1 1 A 69 69 LYS CA C 69 55.412 56.125 -0.713 1
1 886 . 7 1 1 A 69 69 LYS CB C 69 32.761 33.245 -0.484 1
1 890 . 7 1 1 A 69 69 LYS N N 69 120.120 123.388 -3.268 1
1 891 . 7 1 1 A 70 70 ARG H H 70 9.095 8.845 0.250 1
1 892 . 7 1 1 A 70 70 ARG HA H 70 3.684 4.080 -0.396 1
1 900 . 7 1 1 A 70 70 ARG C C 70 177.712 178.770 -1.058 1
1 901 . 7 1 1 A 70 70 ARG CA C 70 60.216 58.261 1.955 1
1 902 . 7 1 1 A 70 70 ARG CB C 70 29.539 29.747 -0.208 1
1 905 . 7 1 1 A 70 70 ARG N N 70 123.339 119.263 4.076 1
1 907 . 7 1 1 A 71 71 GLY H H 71 8.985 8.271 0.714 1
1 908 . 7 1 1 A 71 71 GLY HA2 H 71 3.932 3.651 0.281 1
1 909 . 7 1 1 A 71 71 GLY HA3 H 71 3.905 3.653 0.252 1
1 910 . 7 1 1 A 71 71 GLY C C 71 176.324 175.802 0.522 1
1 911 . 7 1 1 A 71 71 GLY CA C 71 46.752 47.432 -0.680 1
1 912 . 7 1 1 A 71 71 GLY N N 71 104.509 109.006 -4.497 1
1 913 . 7 1 1 A 72 72 THR H H 72 7.295 8.044 -0.749 1
1 914 . 7 1 1 A 72 72 THR HA H 72 4.014 3.883 0.131 1
1 919 . 7 1 1 A 72 72 THR C C 72 175.135 176.094 -0.959 1
1 920 . 7 1 1 A 72 72 THR CA C 72 65.848 66.538 -0.690 1
1 921 . 7 1 1 A 72 72 THR CB C 72 68.160 68.311 -0.151 1
1 923 . 7 1 1 A 72 72 THR N N 72 118.617 117.474 1.143 1
1 924 . 7 1 1 A 73 73 ILE H H 73 7.883 7.866 0.017 1
1 925 . 7 1 1 A 73 73 ILE HA H 73 3.258 3.533 -0.275 1
1 935 . 7 1 1 A 73 73 ILE C C 73 177.060 177.886 -0.826 1
1 936 . 7 1 1 A 73 73 ILE CA C 73 66.561 65.391 1.170 1
1 937 . 7 1 1 A 73 73 ILE CB C 73 37.339 37.592 -0.253 1
1 941 . 7 1 1 A 73 73 ILE N N 73 121.692 121.345 0.347 1
1 942 . 7 1 1 A 74 74 GLU H H 74 8.723 8.171 0.552 1
1 943 . 7 1 1 A 74 74 GLU HA H 74 3.807 3.902 -0.095 1
1 948 . 7 1 1 A 74 74 GLU C C 74 178.319 178.819 -0.500 1
1 949 . 7 1 1 A 74 74 GLU CA C 74 59.637 59.869 -0.232 1
1 950 . 7 1 1 A 74 74 GLU CB C 74 29.257 29.019 0.238 1
1 952 . 7 1 1 A 74 74 GLU N N 74 117.701 121.125 -3.424 1
1 953 . 7 1 1 A 75 75 LYS H H 75 7.361 7.411 -0.050 1
1 954 . 7 1 1 A 75 75 LYS HA H 75 3.958 4.081 -0.123 1
1 963 . 7 1 1 A 75 75 LYS C C 75 178.554 179.443 -0.889 1
1 964 . 7 1 1 A 75 75 LYS CA C 75 59.764 59.239 0.525 1
1 965 . 7 1 1 A 75 75 LYS CB C 75 32.314 32.298 0.016 1
1 969 . 7 1 1 A 75 75 LYS N N 75 118.734 117.942 0.792 1
1 970 . 7 1 1 A 76 76 ILE H H 76 7.713 7.206 0.507 1
1 971 . 7 1 1 A 76 76 ILE HA H 76 3.221 3.862 -0.641 1
1 981 . 7 1 1 A 76 76 ILE C C 76 177.504 178.309 -0.805 1
1 982 . 7 1 1 A 76 76 ILE CA C 76 65.796 64.547 1.249 1
1 983 . 7 1 1 A 76 76 ILE CB C 76 37.732 37.016 0.716 1
1 987 . 7 1 1 A 76 76 ILE N N 76 120.312 117.118 3.194 1
1 988 . 7 1 1 A 77 77 ILE H H 77 8.587 8.018 0.569 1
1 989 . 7 1 1 A 77 77 ILE HA H 77 3.778 3.719 0.059 1
1 999 . 7 1 1 A 77 77 ILE C C 77 177.074 177.954 -0.880 1
1 1000 . 7 1 1 A 77 77 ILE CA C 77 63.168 64.772 -1.604 1
1 1001 . 7 1 1 A 77 77 ILE CB C 77 36.617 37.386 -0.769 1
1 1005 . 7 1 1 A 77 77 ILE N N 77 118.978 121.305 -2.327 1
1 1006 . 7 1 1 A 78 78 LYS H H 78 8.050 8.017 0.033 1
1 1007 . 7 1 1 A 78 78 LYS HA H 78 3.925 4.034 -0.109 1
1 1016 . 7 1 1 A 78 78 LYS C C 78 178.291 179.329 -1.038 1
1 1017 . 7 1 1 A 78 78 LYS CA C 78 60.192 59.464 0.728 1
1 1018 . 7 1 1 A 78 78 LYS CB C 78 31.886 32.153 -0.267 1
1 1022 . 7 1 1 A 78 78 LYS N N 78 121.618 119.393 2.225 1
1 1023 . 7 1 1 A 79 79 VAL H H 79 7.619 7.878 -0.259 1
1 1024 . 7 1 1 A 79 79 VAL HA H 79 3.846 3.794 0.052 1
1 1032 . 7 1 1 A 79 79 VAL C C 79 177.712 178.370 -0.658 1
1 1033 . 7 1 1 A 79 79 VAL CA C 79 66.494 66.429 0.065 1
1 1034 . 7 1 1 A 79 79 VAL CB C 79 31.298 31.752 -0.454 1
1 1037 . 7 1 1 A 79 79 VAL N N 79 120.254 119.784 0.470 1
1 1038 . 7 1 1 A 80 80 ILE H H 80 7.885 7.983 -0.098 1
1 1039 . 7 1 1 A 80 80 ILE HA H 80 3.367 3.883 -0.516 1
1 1049 . 7 1 1 A 80 80 ILE C C 80 179.892 177.762 2.130 1
1 1050 . 7 1 1 A 80 80 ILE CA C 80 65.343 65.149 0.194 1
1 1051 . 7 1 1 A 80 80 ILE CB C 80 38.129 36.983 1.146 1
1 1055 . 7 1 1 A 80 80 ILE N N 80 119.666 120.662 -0.996 1
1 1056 . 7 1 1 A 81 81 ARG H H 81 9.384 8.316 1.068 1
1 1057 . 7 1 1 A 81 81 ARG HA H 81 3.834 4.012 -0.178 1
1 1065 . 7 1 1 A 81 81 ARG C C 81 178.204 178.876 -0.672 1
1 1066 . 7 1 1 A 81 81 ARG CA C 81 60.560 59.559 1.001 1
1 1067 . 7 1 1 A 81 81 ARG CB C 81 30.196 29.755 0.441 1
1 1070 . 7 1 1 A 81 81 ARG N N 81 121.030 120.966 0.064 1
1 1072 . 7 1 1 A 82 82 ASN H H 82 8.773 8.056 0.717 1
1 1073 . 7 1 1 A 82 82 ASN HA H 82 4.587 4.611 -0.024 1
1 1078 . 7 1 1 A 82 82 ASN C C 82 178.300 177.734 0.566 1
1 1079 . 7 1 1 A 82 82 ASN CA C 82 56.160 56.396 -0.236 1
1 1080 . 7 1 1 A 82 82 ASN CB C 82 38.464 38.653 -0.189 1
1 1081 . 7 1 1 A 82 82 ASN N N 82 118.483 118.343 0.140 1
1 1083 . 7 1 1 A 83 83 SER H H 83 8.526 8.030 0.496 1
1 1084 . 7 1 1 A 83 83 SER HA H 83 2.765 3.447 -0.682 1
1 1087 . 7 1 1 A 83 83 SER C C 83 176.386 177.784 -1.398 1
1 1088 . 7 1 1 A 83 83 SER CA C 83 61.245 60.938 0.307 1
1 1089 . 7 1 1 A 83 83 SER CB C 83 61.287 61.617 -0.330 1
1 1090 . 7 1 1 A 83 83 SER N N 83 118.286 115.503 2.783 1
1 1091 . 7 1 1 A 84 84 LEU H H 84 7.782 8.252 -0.470 1
1 1092 . 7 1 1 A 84 84 LEU HA H 84 4.221 3.978 0.243 1
1 1102 . 7 1 1 A 84 84 LEU C C 84 177.846 179.460 -1.614 1
1 1103 . 7 1 1 A 84 84 LEU CA C 84 57.166 57.817 -0.651 1
1 1104 . 7 1 1 A 84 84 LEU CB C 84 40.520 41.069 -0.549 1
1 1108 . 7 1 1 A 84 84 LEU N N 84 127.445 122.497 4.948 1
1 1109 . 7 1 1 A 85 85 GLU H H 85 8.264 8.168 0.096 1
1 1110 . 7 1 1 A 85 85 GLU HA H 85 3.981 3.971 0.010 1
1 1115 . 7 1 1 A 85 85 GLU C C 85 179.288 179.029 0.259 1
1 1116 . 7 1 1 A 85 85 GLU CA C 85 59.025 60.381 -1.356 1
1 1117 . 7 1 1 A 85 85 GLU CB C 85 29.182 29.370 -0.188 1
1 1119 . 7 1 1 A 85 85 GLU N N 85 121.538 120.370 1.168 1
1 1120 . 7 1 1 A 86 86 HIS H H 86 7.683 7.974 -0.291 1
1 1121 . 7 1 1 A 86 86 HIS HA H 86 4.573 4.342 0.231 1
1 1125 . 7 1 1 A 86 86 HIS C C 86 175.484 177.675 -2.191 1
1 1126 . 7 1 1 A 86 86 HIS CA C 86 58.940 59.530 -0.590 1
1 1127 . 7 1 1 A 86 86 HIS CB C 86 29.267 29.733 -0.466 1
1 1129 . 7 1 1 A 86 86 HIS N N 86 117.087 120.632 -3.545 1
1 1130 . 7 1 1 A 87 87 ALA H H 87 7.197 8.293 -1.096 1
1 1131 . 7 1 1 A 87 87 ALA HA H 87 3.925 3.891 0.034 1
1 1135 . 7 1 1 A 87 87 ALA C C 87 179.038 179.991 -0.953 1
1 1136 . 7 1 1 A 87 87 ALA CA C 87 54.863 54.975 -0.112 1
1 1137 . 7 1 1 A 87 87 ALA CB C 87 17.034 18.016 -0.982 1
1 1138 . 7 1 1 A 87 87 ALA N N 87 121.510 120.751 0.759 1
1 1139 . 7 1 1 A 88 88 ILE H H 88 7.819 7.745 0.074 1
1 1140 . 7 1 1 A 88 88 ILE HA H 88 4.067 3.881 0.186 1
1 1150 . 7 1 1 A 88 88 ILE C C 88 180.846 177.296 3.550 1
1 1151 . 7 1 1 A 88 88 ILE CA C 88 64.021 65.270 -1.249 1
1 1152 . 7 1 1 A 88 88 ILE CB C 88 37.557 37.769 -0.212 1
1 1156 . 7 1 1 A 88 88 ILE N N 88 120.898 119.379 1.519 1
1 1157 . 7 1 1 A 89 89 ASP H H 89 7.808 7.734 0.074 1
1 1158 . 7 1 1 A 89 89 ASP HA H 89 4.437 4.395 0.042 1
1 1161 . 7 1 1 A 89 89 ASP C C 89 178.033 177.052 0.981 1
1 1162 . 7 1 1 A 89 89 ASP CA C 89 57.343 56.257 1.086 1
1 1163 . 7 1 1 A 89 89 ASP CB C 89 39.689 40.771 -1.082 1
1 1164 . 7 1 1 A 89 89 ASP N N 89 125.174 120.652 4.522 1
1 1165 . 7 1 1 A 90 90 LEU H H 90 7.607 7.320 0.287 1
1 1166 . 7 1 1 A 90 90 LEU HA H 90 4.198 4.240 -0.042 1
1 1176 . 7 1 1 A 90 90 LEU C C 90 175.416 176.053 -0.637 1
1 1177 . 7 1 1 A 90 90 LEU CA C 90 54.755 54.938 -0.183 1
1 1178 . 7 1 1 A 90 90 LEU CB C 90 42.960 41.662 1.298 1
1 1182 . 7 1 1 A 90 90 LEU N N 90 117.576 117.130 0.446 1
1 1183 . 7 1 1 A 91 91 GLU H H 91 8.143 7.843 0.300 1
1 1184 . 7 1 1 A 91 91 GLU HA H 91 4.005 4.046 -0.041 1
1 1189 . 7 1 1 A 91 91 GLU C C 91 175.792 176.117 -0.325 1
1 1190 . 7 1 1 A 91 91 GLU CA C 91 57.202 57.539 -0.337 1
1 1191 . 7 1 1 A 91 91 GLU CB C 91 26.125 27.019 -0.894 1
1 1193 . 7 1 1 A 91 91 GLU N N 91 113.620 115.037 -1.417 1
1 1194 . 7 1 1 A 92 92 LEU H H 92 8.290 7.975 0.315 1
1 1195 . 7 1 1 A 92 92 LEU HA H 92 4.216 4.168 0.048 1
1 1205 . 7 1 1 A 92 92 LEU C C 92 176.622 177.039 -0.417 1
1 1206 . 7 1 1 A 92 92 LEU CA C 92 56.410 56.291 0.119 1
1 1207 . 7 1 1 A 92 92 LEU CB C 92 43.378 42.724 0.654 1
1 1211 . 7 1 1 A 92 92 LEU N N 92 116.868 119.259 -2.391 1
1 1212 . 7 1 1 A 93 93 ILE H H 93 6.988 6.931 0.057 1
1 1213 . 7 1 1 A 93 93 ILE HA H 93 4.580 4.548 0.032 1
1 1223 . 7 1 1 A 93 93 ILE C C 93 175.145 175.683 -0.538 1
1 1224 . 7 1 1 A 93 93 ILE CA C 93 58.707 58.603 0.104 1
1 1225 . 7 1 1 A 93 93 ILE CB C 93 42.864 41.365 1.499 1
1 1229 . 7 1 1 A 93 93 ILE N N 93 107.565 114.368 -6.803 1
1 1230 . 7 1 1 A 94 94 THR H H 94 8.742 8.609 0.133 1
1 1231 . 7 1 1 A 94 94 THR HA H 94 4.489 4.265 0.224 1
1 1236 . 7 1 1 A 94 94 THR C C 94 173.875 174.383 -0.508 1
1 1237 . 7 1 1 A 94 94 THR CA C 94 61.842 63.632 -1.790 1
1 1238 . 7 1 1 A 94 94 THR CB C 94 69.972 69.112 0.860 1
1 1240 . 7 1 1 A 94 94 THR N N 94 107.904 114.284 -6.380 1
1 1241 . 7 1 1 A 95 95 LYS H H 95 7.294 7.675 -0.381 1
1 1242 . 7 1 1 A 95 95 LYS HA H 95 4.566 4.817 -0.251 1
1 1251 . 7 1 1 A 95 95 LYS C C 95 173.791 173.939 -0.148 1
1 1252 . 7 1 1 A 95 95 LYS CA C 95 54.533 55.148 -0.615 1
1 1253 . 7 1 1 A 95 95 LYS CB C 95 35.123 36.048 -0.925 1
1 1257 . 7 1 1 A 95 95 LYS N N 95 119.458 120.400 -0.942 1
1 1258 . 7 1 1 A 96 96 ASN H H 96 9.157 8.712 0.445 1
1 1259 . 7 1 1 A 96 96 ASN HA H 96 4.408 4.792 -0.384 1
1 1264 . 7 1 1 A 96 96 ASN C C 96 176.653 176.137 0.516 1
1 1265 . 7 1 1 A 96 96 ASN CA C 96 51.088 52.286 -1.198 1
1 1266 . 7 1 1 A 96 96 ASN CB C 96 37.292 38.546 -1.254 1
1 1267 . 7 1 1 A 96 96 ASN N N 96 121.031 123.427 -2.396 1
1 1269 . 7 1 1 A 97 97 VAL H H 97 8.193 8.492 -0.299 1
1 1270 . 7 1 1 A 97 97 VAL HA H 97 4.019 3.881 0.138 1
1 1278 . 7 1 1 A 97 97 VAL C C 97 175.089 176.455 -1.366 1
1 1279 . 7 1 1 A 97 97 VAL CA C 97 63.437 63.917 -0.480 1
1 1280 . 7 1 1 A 97 97 VAL CB C 97 29.934 31.566 -1.632 1
1 1283 . 7 1 1 A 97 97 VAL N N 97 118.839 122.536 -3.697 1
1 1284 . 7 1 1 A 98 98 ALA H H 98 7.994 7.686 0.308 1
1 1285 . 7 1 1 A 98 98 ALA HA H 98 5.108 4.345 0.763 1
1 1289 . 7 1 1 A 98 98 ALA C C 98 178.033 179.596 -1.563 1
1 1290 . 7 1 1 A 98 98 ALA CA C 98 50.342 52.933 -2.591 1
1 1291 . 7 1 1 A 98 98 ALA CB C 98 19.659 19.266 0.393 1
1 1292 . 7 1 1 A 98 98 ALA N N 98 121.031 124.592 -3.561 1
1 1293 . 7 1 1 A 99 99 ALA H H 99 7.347 7.882 -0.535 1
1 1294 . 7 1 1 A 99 99 ALA HA H 99 3.818 4.017 -0.199 1
1 1298 . 7 1 1 A 99 99 ALA C C 99 177.712 179.052 -1.340 1
1 1299 . 7 1 1 A 99 99 ALA CA C 99 55.117 55.119 -0.002 1
1 1300 . 7 1 1 A 99 99 ALA CB C 99 18.879 18.485 0.394 1
1 1301 . 7 1 1 A 99 99 ALA N N 99 122.816 120.571 2.245 1
1 1302 . 7 1 1 A 100 100 LYS H H 100 8.190 7.852 0.338 1
1 1303 . 7 1 1 A 100 100 LYS HA H 100 4.483 4.339 0.144 1
1 1312 . 7 1 1 A 100 100 LYS C C 100 175.899 177.238 -1.339 1
1 1313 . 7 1 1 A 100 100 LYS CA C 100 54.231 57.563 -3.332 1
1 1314 . 7 1 1 A 100 100 LYS CB C 100 32.066 32.886 -0.820 1
1 1318 . 7 1 1 A 100 100 LYS N N 100 113.197 115.746 -2.549 1
1 1319 . 7 1 1 A 101 101 THR H H 101 7.128 7.677 -0.549 1
1 1320 . 7 1 1 A 101 101 THR HA H 101 3.834 4.301 -0.467 1
1 1325 . 7 1 1 A 101 101 THR C C 101 173.255 173.751 -0.496 1
1 1326 . 7 1 1 A 101 101 THR CA C 101 64.392 62.863 1.529 1
1 1327 . 7 1 1 A 101 101 THR CB C 101 69.160 68.236 0.924 1
1 1329 . 7 1 1 A 101 101 THR N N 101 118.368 116.483 1.885 1
1 1330 . 7 1 1 A 102 102 LYS H H 102 8.753 7.853 0.900 1
1 1331 . 7 1 1 A 102 102 LYS HA H 102 4.438 4.468 -0.030 1
1 1340 . 7 1 1 A 102 102 LYS C C 102 175.627 175.730 -0.103 1
1 1341 . 7 1 1 A 102 102 LYS CA C 102 55.117 55.937 -0.820 1
1 1342 . 7 1 1 A 102 102 LYS CB C 102 33.901 33.301 0.600 1
1 1346 . 7 1 1 A 102 102 LYS N N 102 126.513 125.371 1.142 1
1 1347 . 7 1 1 A 103 103 LEU H H 103 8.602 8.263 0.339 1
1 1348 . 7 1 1 A 103 103 LEU HA H 103 4.486 4.581 -0.095 1
1 1358 . 7 1 1 A 103 103 LEU CA C 103 52.233 52.752 -0.519 1
1 1359 . 7 1 1 A 103 103 LEU CB C 103 41.028 43.103 -2.075 1
1 1363 . 7 1 1 A 103 103 LEU N N 103 124.466 123.691 0.775 1
1 1364 . 7 1 1 A 104 104 PRO HA H 104 4.437 4.431 0.006 1
1 1371 . 7 1 1 A 104 104 PRO C C 104 175.779 176.703 -0.924 1
1 1372 . 7 1 1 A 104 104 PRO CA C 104 62.322 63.272 -0.950 1
1 1373 . 7 1 1 A 104 104 PRO CB C 104 31.899 31.736 0.163 1
1 1376 . 7 1 1 A 105 105 LYS H H 105 8.460 8.538 -0.078 1
1 1377 . 7 1 1 A 105 105 LYS HA H 105 4.154 4.299 -0.145 1
1 1386 . 7 1 1 A 105 105 LYS C C 105 175.998 176.629 -0.631 1
1 1387 . 7 1 1 A 105 105 LYS CA C 105 56.480 55.512 0.968 1
1 1388 . 7 1 1 A 105 105 LYS CB C 105 32.909 31.507 1.402 1
1 1392 . 7 1 1 A 105 105 LYS N N 105 122.139 122.678 -0.539 1
1 1393 . 7 1 1 A 106 106 ALA H H 106 8.448 8.704 -0.256 1
1 1394 . 7 1 1 A 106 106 ALA HA H 106 4.309 4.520 -0.211 1
1 1398 . 7 1 1 A 106 106 ALA C C 106 176.828 177.326 -0.498 1
1 1399 . 7 1 1 A 106 106 ALA CA C 106 51.862 52.918 -1.056 1
1 1400 . 7 1 1 A 106 106 ALA CB C 106 19.323 21.043 -1.720 1
1 1401 . 7 1 1 A 106 106 ALA N N 106 125.278 127.813 -2.535 1
1 1402 . 7 1 1 A 107 107 ASP H H 107 8.428 7.892 0.536 1
1 1403 . 7 1 1 A 107 107 ASP HA H 107 4.574 5.064 -0.490 1
1 1406 . 7 1 1 A 107 107 ASP C C 107 175.951 174.242 1.709 1
1 1407 . 7 1 1 A 107 107 ASP CA C 107 54.214 53.701 0.513 1
1 1408 . 7 1 1 A 107 107 ASP CB C 107 41.141 43.384 -2.243 1
1 1409 . 7 1 1 A 107 107 ASP N N 107 120.771 114.490 6.281 1
1 1410 . 7 1 1 A 108 108 LYS H H 108 8.329 8.549 -0.220 1
1 1411 . 7 1 1 A 108 108 LYS HA H 108 4.203 4.542 -0.339 1
1 1420 . 7 1 1 A 108 108 LYS C C 108 176.483 176.163 0.320 1
1 1421 . 7 1 1 A 108 108 LYS CA C 108 56.831 56.006 0.825 1
1 1422 . 7 1 1 A 108 108 LYS CB C 108 32.648 35.058 -2.410 1
1 1426 . 7 1 1 A 108 108 LYS N N 108 120.727 123.877 -3.150 1
1 1427 . 7 1 1 A 109 109 GLU H H 109 8.447 8.626 -0.179 1
1 1428 . 7 1 1 A 109 109 GLU HA H 109 4.215 4.165 0.050 1
1 1433 . 7 1 1 A 109 109 GLU C C 109 176.513 176.670 -0.157 1
1 1434 . 7 1 1 A 109 109 GLU CA C 109 56.936 57.749 -0.813 1
1 1435 . 7 1 1 A 109 109 GLU CB C 109 29.833 29.605 0.228 1
1 1437 . 7 1 1 A 109 109 GLU N N 109 121.471 125.739 -4.268 1
1 1438 . 7 1 1 A 110 110 GLU H H 110 8.352 7.527 0.825 1
1 1439 . 7 1 1 A 110 110 GLU HA H 110 4.233 4.101 0.132 1
1 1444 . 7 1 1 A 110 110 GLU C C 110 176.439 176.614 -0.175 1
1 1445 . 7 1 1 A 110 110 GLU CA C 110 56.681 57.337 -0.656 1
1 1446 . 7 1 1 A 110 110 GLU CB C 110 29.860 26.456 3.404 1
1 1448 . 7 1 1 A 110 110 GLU N N 110 121.559 115.577 5.982 1
1 1449 . 7 1 1 A 111 111 LEU H H 111 8.145 8.250 -0.105 1
1 1450 . 7 1 1 A 111 111 LEU HA H 111 4.251 4.515 -0.264 1
1 1460 . 7 1 1 A 111 111 LEU C C 111 177.306 177.133 0.173 1
1 1461 . 7 1 1 A 111 111 LEU CA C 111 55.277 54.586 0.691 1
1 1462 . 7 1 1 A 111 111 LEU CB C 111 42.054 42.324 -0.270 1
1 1466 . 7 1 1 A 111 111 LEU N N 111 122.181 117.717 4.464 1
1 1467 . 7 1 1 A 112 112 GLU H H 112 8.212 8.315 -0.103 1
1 1468 . 7 1 1 A 112 112 GLU N N 112 120.291 115.973 4.318 1
1 1469 . 7 1 1 A 114 114 HIS C C 114 176.070 173.413 2.657 1
1 1470 . 7 1 1 A 116 116 HIS H H 116 8.227 8.265 -0.038 1
1 1471 . 7 1 1 A 116 116 HIS C C 116 173.580 174.496 -0.916 1
1 1472 . 7 1 1 A 116 116 HIS N N 116 119.156 117.123 2.033 1
1 5 . 8 1 1 A 3 3 PRO HA H 3 4.390 4.391 -0.001 1
1 12 . 8 1 1 A 3 3 PRO C C 3 176.847 176.980 -0.133 1
1 13 . 8 1 1 A 3 3 PRO CA C 3 63.449 63.219 0.230 1
1 14 . 8 1 1 A 3 3 PRO CB C 3 31.938 32.174 -0.236 1
1 17 . 8 1 1 A 4 4 SER H H 4 8.531 8.400 0.131 1
1 18 . 8 1 1 A 4 4 SER HA H 4 4.262 4.577 -0.315 1
1 21 . 8 1 1 A 4 4 SER C C 4 175.414 173.898 1.516 1
1 22 . 8 1 1 A 4 4 SER CA C 4 59.163 57.873 1.290 1
1 23 . 8 1 1 A 4 4 SER CB C 4 63.242 62.187 1.055 1
1 24 . 8 1 1 A 4 4 SER N N 4 114.246 116.365 -2.119 1
1 25 . 8 1 1 A 5 5 LYS H H 5 8.468 8.558 -0.090 1
1 26 . 8 1 1 A 5 5 LYS HA H 5 4.433 4.480 -0.047 1
1 35 . 8 1 1 A 5 5 LYS C C 5 175.984 175.080 0.904 1
1 36 . 8 1 1 A 5 5 LYS CA C 5 55.724 56.147 -0.423 1
1 37 . 8 1 1 A 5 5 LYS CB C 5 32.881 30.582 2.299 1
1 41 . 8 1 1 A 5 5 LYS N N 5 123.488 126.879 -3.391 1
1 42 . 8 1 1 A 6 6 LEU H H 6 7.707 7.584 0.123 1
1 43 . 8 1 1 A 6 6 LEU HA H 6 4.381 4.662 -0.281 1
1 53 . 8 1 1 A 6 6 LEU C C 6 177.820 174.625 3.195 1
1 54 . 8 1 1 A 6 6 LEU CA C 6 55.507 54.558 0.949 1
1 55 . 8 1 1 A 6 6 LEU CB C 6 43.374 45.757 -2.383 1
1 59 . 8 1 1 A 6 6 LEU N N 6 121.233 123.713 -2.480 1
1 60 . 8 1 1 A 7 7 SER H H 7 9.433 8.636 0.797 1
1 61 . 8 1 1 A 7 7 SER HA H 7 4.638 4.795 -0.157 1
1 64 . 8 1 1 A 7 7 SER C C 7 174.120 175.141 -1.021 1
1 65 . 8 1 1 A 7 7 SER CA C 7 57.962 57.289 0.673 1
1 66 . 8 1 1 A 7 7 SER CB C 7 64.197 64.572 -0.375 1
1 67 . 8 1 1 A 7 7 SER N N 7 122.977 117.452 5.525 1
1 68 . 8 1 1 A 8 8 TYR H H 8 9.764 9.313 0.451 1
1 69 . 8 1 1 A 8 8 TYR HA H 8 4.732 4.232 0.500 1
1 76 . 8 1 1 A 8 8 TYR C C 8 177.206 177.504 -0.298 1
1 77 . 8 1 1 A 8 8 TYR CA C 8 58.762 61.697 -2.935 1
1 78 . 8 1 1 A 8 8 TYR CB C 8 36.605 38.887 -2.282 1
1 83 . 8 1 1 A 8 8 TYR N N 8 123.312 122.641 0.671 1
1 84 . 8 1 1 A 9 9 GLY H H 9 10.131 8.389 1.742 1
1 85 . 8 1 1 A 9 9 GLY HA2 H 9 3.983 3.599 0.384 1
1 86 . 8 1 1 A 9 9 GLY HA3 H 9 3.423 3.685 -0.262 1
1 87 . 8 1 1 A 9 9 GLY C C 9 175.163 175.982 -0.819 1
1 88 . 8 1 1 A 9 9 GLY CA C 9 47.153 47.302 -0.149 1
1 89 . 8 1 1 A 9 9 GLY N N 9 107.177 106.238 0.939 1
1 90 . 8 1 1 A 10 10 GLU H H 10 7.876 7.702 0.174 1
1 91 . 8 1 1 A 10 10 GLU HA H 10 4.107 4.094 0.013 1
1 96 . 8 1 1 A 10 10 GLU C C 10 179.924 178.853 1.071 1
1 97 . 8 1 1 A 10 10 GLU CA C 10 58.890 59.356 -0.466 1
1 98 . 8 1 1 A 10 10 GLU CB C 10 29.750 29.382 0.368 1
1 100 . 8 1 1 A 10 10 GLU N N 10 122.219 121.717 0.502 1
1 101 . 8 1 1 A 11 11 TYR H H 11 8.384 8.275 0.109 1
1 102 . 8 1 1 A 11 11 TYR HA H 11 4.305 4.278 0.027 1
1 107 . 8 1 1 A 11 11 TYR C C 11 176.854 177.009 -0.155 1
1 108 . 8 1 1 A 11 11 TYR CA C 11 61.040 61.358 -0.318 1
1 109 . 8 1 1 A 11 11 TYR CB C 11 37.593 39.116 -1.523 1
1 112 . 8 1 1 A 11 11 TYR N N 11 120.809 123.589 -2.780 1
1 113 . 8 1 1 A 12 12 LEU H H 12 9.027 8.416 0.611 1
1 114 . 8 1 1 A 12 12 LEU HA H 12 3.778 3.870 -0.092 1
1 124 . 8 1 1 A 12 12 LEU C C 12 178.621 179.398 -0.777 1
1 125 . 8 1 1 A 12 12 LEU CA C 12 57.534 57.762 -0.228 1
1 126 . 8 1 1 A 12 12 LEU CB C 12 41.957 41.020 0.937 1
1 130 . 8 1 1 A 12 12 LEU N N 12 121.080 119.405 1.675 1
1 131 . 8 1 1 A 13 13 GLU H H 13 7.614 8.159 -0.545 1
1 132 . 8 1 1 A 13 13 GLU HA H 13 4.102 4.047 0.055 1
1 137 . 8 1 1 A 13 13 GLU C C 13 178.449 178.932 -0.483 1
1 138 . 8 1 1 A 13 13 GLU CA C 13 59.609 59.622 -0.013 1
1 139 . 8 1 1 A 13 13 GLU CB C 13 29.124 29.701 -0.577 1
1 141 . 8 1 1 A 13 13 GLU N N 13 118.475 120.311 -1.836 1
1 142 . 8 1 1 A 14 14 SER H H 14 7.329 7.704 -0.375 1
1 143 . 8 1 1 A 14 14 SER HA H 14 4.358 4.235 0.123 1
1 146 . 8 1 1 A 14 14 SER C C 14 176.794 176.847 -0.053 1
1 147 . 8 1 1 A 14 14 SER CA C 14 61.064 61.276 -0.212 1
1 148 . 8 1 1 A 14 14 SER CB C 14 62.513 62.653 -0.140 1
1 149 . 8 1 1 A 14 14 SER N N 14 115.209 114.809 0.400 1
1 150 . 8 1 1 A 15 15 TRP H H 15 8.870 8.066 0.804 1
1 151 . 8 1 1 A 15 15 TRP HA H 15 4.005 4.205 -0.200 1
1 160 . 8 1 1 A 15 15 TRP C C 15 177.547 178.022 -0.475 1
1 161 . 8 1 1 A 15 15 TRP CA C 15 61.210 61.136 0.074 1
1 162 . 8 1 1 A 15 15 TRP CB C 15 27.341 29.173 -1.832 1
1 168 . 8 1 1 A 15 15 TRP N N 15 124.998 123.502 1.496 1
1 170 . 8 1 1 A 16 16 PHE H H 16 9.087 8.309 0.778 1
1 171 . 8 1 1 A 16 16 PHE HA H 16 3.210 3.855 -0.645 1
1 179 . 8 1 1 A 16 16 PHE C C 16 175.909 177.689 -1.780 1
1 180 . 8 1 1 A 16 16 PHE CA C 16 61.473 61.460 0.013 1
1 181 . 8 1 1 A 16 16 PHE CB C 16 38.506 39.009 -0.503 1
1 187 . 8 1 1 A 16 16 PHE N N 16 119.825 120.789 -0.964 1
1 188 . 8 1 1 A 17 17 ASN H H 17 7.768 7.840 -0.072 1
1 189 . 8 1 1 A 17 17 ASN HA H 17 4.078 4.156 -0.078 1
1 194 . 8 1 1 A 17 17 ASN C C 17 176.604 177.824 -1.220 1
1 195 . 8 1 1 A 17 17 ASN CA C 17 55.621 56.152 -0.531 1
1 196 . 8 1 1 A 17 17 ASN CB C 17 37.830 38.150 -0.320 1
1 197 . 8 1 1 A 17 17 ASN N N 17 115.600 116.873 -1.273 1
1 199 . 8 1 1 A 18 18 THR H H 18 7.454 7.376 0.078 1
1 200 . 8 1 1 A 18 18 THR HA H 18 4.147 3.720 0.427 1
1 205 . 8 1 1 A 18 18 THR C C 18 175.692 175.924 -0.232 1
1 206 . 8 1 1 A 18 18 THR CA C 18 64.679 66.776 -2.097 1
1 207 . 8 1 1 A 18 18 THR CB C 18 68.940 67.811 1.129 1
1 209 . 8 1 1 A 18 18 THR N N 18 113.049 116.529 -3.480 1
1 210 . 8 1 1 A 19 19 LYS H H 19 7.918 7.772 0.146 1
1 211 . 8 1 1 A 19 19 LYS HA H 19 3.791 3.477 0.314 1
1 220 . 8 1 1 A 19 19 LYS C C 19 178.120 178.642 -0.522 1
1 221 . 8 1 1 A 19 19 LYS CA C 19 55.985 59.081 -3.096 1
1 222 . 8 1 1 A 19 19 LYS CB C 19 31.130 31.319 -0.189 1
1 226 . 8 1 1 A 19 19 LYS N N 19 122.614 120.486 2.128 1
1 227 . 8 1 1 A 20 20 ARG H H 20 7.845 7.389 0.456 1
1 228 . 8 1 1 A 20 20 ARG HA H 20 3.396 3.847 -0.451 1
1 236 . 8 1 1 A 20 20 ARG C C 20 175.601 177.575 -1.974 1
1 237 . 8 1 1 A 20 20 ARG CA C 20 58.182 58.311 -0.129 1
1 238 . 8 1 1 A 20 20 ARG CB C 20 28.045 29.915 -1.870 1
1 241 . 8 1 1 A 20 20 ARG N N 20 116.282 118.470 -2.188 1
1 243 . 8 1 1 A 21 21 HIS H H 21 7.163 7.601 -0.438 1
1 244 . 8 1 1 A 21 21 HIS HA H 21 4.500 4.312 0.188 1
1 249 . 8 1 1 A 21 21 HIS C C 21 175.618 176.713 -1.095 1
1 250 . 8 1 1 A 21 21 HIS CA C 21 56.912 58.884 -1.972 1
1 251 . 8 1 1 A 21 21 HIS CB C 21 29.400 29.538 -0.138 1
1 254 . 8 1 1 A 21 21 HIS N N 21 115.452 117.863 -2.411 1
1 255 . 8 1 1 A 22 22 SER H H 22 7.951 7.584 0.367 1
1 256 . 8 1 1 A 22 22 SER HA H 22 4.573 4.425 0.148 1
1 259 . 8 1 1 A 22 22 SER C C 22 173.948 174.332 -0.384 1
1 260 . 8 1 1 A 22 22 SER CA C 22 58.589 60.600 -2.011 1
1 261 . 8 1 1 A 22 22 SER CB C 22 64.228 64.168 0.060 1
1 262 . 8 1 1 A 22 22 SER N N 22 113.209 112.696 0.513 1
1 263 . 8 1 1 A 23 23 VAL H H 23 7.179 7.339 -0.160 1
1 264 . 8 1 1 A 23 23 VAL HA H 23 4.626 4.514 0.112 1
1 272 . 8 1 1 A 23 23 VAL C C 23 175.397 176.098 -0.701 1
1 273 . 8 1 1 A 23 23 VAL CA C 23 59.556 60.251 -0.695 1
1 274 . 8 1 1 A 23 23 VAL CB C 23 33.810 34.386 -0.576 1
1 277 . 8 1 1 A 23 23 VAL N N 23 113.108 116.163 -3.055 1
1 278 . 8 1 1 A 24 24 GLY H H 24 8.189 8.439 -0.250 1
1 279 . 8 1 1 A 24 24 GLY HA2 H 24 4.074 4.038 0.036 1
1 280 . 8 1 1 A 24 24 GLY HA3 H 24 4.195 4.060 0.135 1
1 281 . 8 1 1 A 24 24 GLY C C 24 174.037 174.552 -0.515 1
1 282 . 8 1 1 A 24 24 GLY CA C 24 44.452 44.731 -0.279 1
1 283 . 8 1 1 A 24 24 GLY N N 24 108.374 109.131 -0.757 1
1 284 . 8 1 1 A 25 25 ILE H H 25 8.331 8.626 -0.295 1
1 285 . 8 1 1 A 25 25 ILE HA H 25 3.839 3.672 0.167 1
1 295 . 8 1 1 A 25 25 ILE C C 25 178.042 177.838 0.204 1
1 296 . 8 1 1 A 25 25 ILE CA C 25 64.238 64.474 -0.236 1
1 297 . 8 1 1 A 25 25 ILE CB C 25 37.931 37.485 0.446 1
1 301 . 8 1 1 A 25 25 ILE N N 25 119.895 119.209 0.686 1
1 302 . 8 1 1 A 26 26 GLN H H 26 8.545 8.521 0.024 1
1 303 . 8 1 1 A 26 26 GLN HA H 26 4.129 4.070 0.059 1
1 310 . 8 1 1 A 26 26 GLN C C 26 178.454 178.396 0.058 1
1 311 . 8 1 1 A 26 26 GLN CA C 26 58.772 58.240 0.532 1
1 312 . 8 1 1 A 26 26 GLN CB C 26 27.346 28.395 -1.049 1
1 314 . 8 1 1 A 26 26 GLN N N 26 120.013 119.838 0.175 1
1 316 . 8 1 1 A 27 27 THR H H 27 7.944 8.216 -0.272 1
1 317 . 8 1 1 A 27 27 THR HA H 27 3.953 3.868 0.085 1
1 322 . 8 1 1 A 27 27 THR C C 27 175.818 176.379 -0.561 1
1 323 . 8 1 1 A 27 27 THR CA C 27 65.855 66.591 -0.736 1
1 324 . 8 1 1 A 27 27 THR CB C 27 68.127 68.385 -0.258 1
1 326 . 8 1 1 A 27 27 THR N N 27 117.645 116.729 0.916 1
1 327 . 8 1 1 A 28 28 ALA H H 28 8.593 8.232 0.361 1
1 328 . 8 1 1 A 28 28 ALA HA H 28 3.899 4.248 -0.349 1
1 332 . 8 1 1 A 28 28 ALA C C 28 178.515 179.643 -1.128 1
1 333 . 8 1 1 A 28 28 ALA CA C 28 55.742 55.775 -0.033 1
1 334 . 8 1 1 A 28 28 ALA CB C 28 17.513 18.351 -0.838 1
1 335 . 8 1 1 A 28 28 ALA N N 28 123.917 123.417 0.500 1
1 336 . 8 1 1 A 29 29 LYS H H 29 7.800 7.671 0.129 1
1 337 . 8 1 1 A 29 29 LYS HA H 29 3.982 4.010 -0.028 1
1 346 . 8 1 1 A 29 29 LYS C C 29 179.527 178.987 0.540 1
1 347 . 8 1 1 A 29 29 LYS CA C 29 59.761 59.466 0.295 1
1 348 . 8 1 1 A 29 29 LYS CB C 29 32.223 32.295 -0.072 1
1 352 . 8 1 1 A 29 29 LYS N N 29 117.474 118.764 -1.290 1
1 353 . 8 1 1 A 30 30 VAL H H 30 7.591 7.596 -0.005 1
1 354 . 8 1 1 A 30 30 VAL HA H 30 3.503 3.479 0.024 1
1 362 . 8 1 1 A 30 30 VAL C C 30 178.389 178.035 0.354 1
1 363 . 8 1 1 A 30 30 VAL CA C 30 65.640 66.171 -0.531 1
1 364 . 8 1 1 A 30 30 VAL CB C 30 31.644 31.737 -0.093 1
1 367 . 8 1 1 A 30 30 VAL N N 30 121.749 120.600 1.149 1
1 368 . 8 1 1 A 31 31 LEU H H 31 8.333 8.331 0.002 1
1 369 . 8 1 1 A 31 31 LEU HA H 31 4.074 4.112 -0.038 1
1 379 . 8 1 1 A 31 31 LEU C C 31 177.780 179.588 -1.808 1
1 380 . 8 1 1 A 31 31 LEU CA C 31 58.157 58.428 -0.271 1
1 381 . 8 1 1 A 31 31 LEU CB C 31 42.230 41.618 0.612 1
1 385 . 8 1 1 A 31 31 LEU N N 31 120.901 119.110 1.791 1
1 386 . 8 1 1 A 32 32 LYS H H 32 8.562 7.996 0.566 1
1 387 . 8 1 1 A 32 32 LYS HA H 32 3.290 3.914 -0.624 1
1 395 . 8 1 1 A 32 32 LYS C C 32 178.037 178.675 -0.638 1
1 396 . 8 1 1 A 32 32 LYS CA C 32 58.911 59.844 -0.933 1
1 397 . 8 1 1 A 32 32 LYS CB C 32 31.605 31.746 -0.141 1
1 401 . 8 1 1 A 32 32 LYS N N 32 119.075 119.198 -0.123 1
1 402 . 8 1 1 A 33 33 GLY H H 33 7.694 7.811 -0.117 1
1 403 . 8 1 1 A 33 33 GLY HA2 H 33 3.949 3.525 0.424 1
1 404 . 8 1 1 A 33 33 GLY HA3 H 33 3.826 3.603 0.223 1
1 405 . 8 1 1 A 33 33 GLY C C 33 177.101 176.559 0.542 1
1 406 . 8 1 1 A 33 33 GLY CA C 33 46.928 47.099 -0.171 1
1 407 . 8 1 1 A 33 33 GLY N N 33 105.282 106.497 -1.215 1
1 408 . 8 1 1 A 34 34 TYR H H 34 8.015 7.616 0.399 1
1 409 . 8 1 1 A 34 34 TYR HA H 34 4.558 4.691 -0.133 1
1 416 . 8 1 1 A 34 34 TYR C C 34 179.611 178.190 1.421 1
1 417 . 8 1 1 A 34 34 TYR CA C 34 59.349 59.786 -0.437 1
1 418 . 8 1 1 A 34 34 TYR CB C 34 37.344 37.934 -0.590 1
1 423 . 8 1 1 A 34 34 TYR N N 34 121.781 121.944 -0.163 1
1 424 . 8 1 1 A 35 35 LEU H H 35 8.689 8.390 0.299 1
1 425 . 8 1 1 A 35 35 LEU HA H 35 3.977 3.879 0.098 1
1 435 . 8 1 1 A 35 35 LEU C C 35 177.081 179.028 -1.947 1
1 436 . 8 1 1 A 35 35 LEU CA C 35 59.155 58.416 0.739 1
1 437 . 8 1 1 A 35 35 LEU CB C 35 41.103 41.734 -0.631 1
1 441 . 8 1 1 A 35 35 LEU N N 35 120.392 120.541 -0.149 1
1 442 . 8 1 1 A 36 36 ASN H H 36 8.721 8.202 0.519 1
1 443 . 8 1 1 A 36 36 ASN HA H 36 4.435 4.500 -0.065 1
1 448 . 8 1 1 A 36 36 ASN C C 36 176.792 177.995 -1.203 1
1 449 . 8 1 1 A 36 36 ASN CA C 36 55.642 55.775 -0.133 1
1 450 . 8 1 1 A 36 36 ASN CB C 36 38.319 38.200 0.119 1
1 451 . 8 1 1 A 36 36 ASN N N 36 114.623 116.739 -2.116 1
1 453 . 8 1 1 A 37 37 SER H H 37 8.511 7.405 1.106 1
1 454 . 8 1 1 A 37 37 SER HA H 37 4.642 4.287 0.355 1
1 457 . 8 1 1 A 37 37 SER C C 37 175.039 176.507 -1.468 1
1 458 . 8 1 1 A 37 37 SER CA C 37 59.825 61.334 -1.509 1
1 459 . 8 1 1 A 37 37 SER CB C 37 64.056 62.919 1.137 1
1 460 . 8 1 1 A 37 37 SER N N 37 110.941 115.577 -4.636 1
1 461 . 8 1 1 A 38 38 ARG H H 38 7.242 7.983 -0.741 1
1 462 . 8 1 1 A 38 38 ARG HA H 38 4.919 4.466 0.453 1
1 469 . 8 1 1 A 38 38 ARG C C 38 176.514 178.570 -2.056 1
1 470 . 8 1 1 A 38 38 ARG CA C 38 56.687 57.947 -1.260 1
1 471 . 8 1 1 A 38 38 ARG CB C 38 32.434 31.415 1.019 1
1 474 . 8 1 1 A 38 38 ARG N N 38 117.062 120.305 -3.243 1
1 475 . 8 1 1 A 39 39 ILE H H 39 8.462 7.986 0.476 1
1 476 . 8 1 1 A 39 39 ILE HA H 39 3.618 3.718 -0.100 1
1 486 . 8 1 1 A 39 39 ILE C C 39 176.267 178.092 -1.825 1
1 487 . 8 1 1 A 39 39 ILE CA C 39 66.134 64.991 1.143 1
1 488 . 8 1 1 A 39 39 ILE CB C 39 39.787 37.832 1.955 1
1 492 . 8 1 1 A 39 39 ILE N N 39 121.214 120.481 0.733 1
1 493 . 8 1 1 A 40 40 ILE H H 40 9.339 8.267 1.072 1
1 494 . 8 1 1 A 40 40 ILE HA H 40 3.401 3.705 -0.304 1
1 504 . 8 1 1 A 40 40 ILE CA C 40 67.844 66.475 1.369 1
1 505 . 8 1 1 A 40 40 ILE CB C 40 34.406 35.699 -1.293 1
1 509 . 8 1 1 A 40 40 ILE N N 40 119.695 121.302 -1.607 1
1 510 . 8 1 1 A 41 41 PRO HA H 41 4.314 4.419 -0.105 1
1 517 . 8 1 1 A 41 41 PRO C C 41 177.418 178.246 -0.828 1
1 518 . 8 1 1 A 41 41 PRO CA C 41 65.912 65.322 0.590 1
1 519 . 8 1 1 A 41 41 PRO CB C 41 30.686 31.361 -0.675 1
1 522 . 8 1 1 A 42 42 SER H H 42 6.857 8.150 -1.293 1
1 523 . 8 1 1 A 42 42 SER HA H 42 4.558 4.508 0.050 1
1 526 . 8 1 1 A 42 42 SER C C 42 174.813 175.746 -0.933 1
1 527 . 8 1 1 A 42 42 SER CA C 42 61.279 61.249 0.030 1
1 528 . 8 1 1 A 42 42 SER CB C 42 64.285 63.906 0.379 1
1 529 . 8 1 1 A 42 42 SER N N 42 108.994 113.737 -4.743 1
1 530 . 8 1 1 A 43 43 LEU H H 43 8.230 8.035 0.195 1
1 531 . 8 1 1 A 43 43 LEU HA H 43 4.572 4.310 0.262 1
1 541 . 8 1 1 A 43 43 LEU C C 43 177.301 178.753 -1.452 1
1 542 . 8 1 1 A 43 43 LEU CA C 43 54.113 55.265 -1.152 1
1 543 . 8 1 1 A 43 43 LEU CB C 43 44.800 42.376 2.424 1
1 547 . 8 1 1 A 43 43 LEU N N 43 118.715 120.503 -1.788 1
1 548 . 8 1 1 A 44 44 GLY H H 44 8.498 8.541 -0.043 1
1 549 . 8 1 1 A 44 44 GLY HA2 H 44 4.010 3.738 0.272 1
1 550 . 8 1 1 A 44 44 GLY HA3 H 44 3.613 3.807 -0.194 1
1 551 . 8 1 1 A 44 44 GLY C C 44 174.178 176.148 -1.970 1
1 552 . 8 1 1 A 44 44 GLY CA C 44 46.271 47.381 -1.110 1
1 553 . 8 1 1 A 44 44 GLY N N 44 105.371 107.266 -1.895 1
1 554 . 8 1 1 A 45 45 ASN H H 45 8.385 7.569 0.816 1
1 555 . 8 1 1 A 45 45 ASN HA H 45 4.789 4.557 0.232 1
1 560 . 8 1 1 A 45 45 ASN C C 45 175.386 176.537 -1.151 1
1 561 . 8 1 1 A 45 45 ASN CA C 45 53.144 55.156 -2.012 1
1 562 . 8 1 1 A 45 45 ASN CB C 45 37.928 38.310 -0.382 1
1 563 . 8 1 1 A 45 45 ASN N N 45 114.387 118.007 -3.620 1
1 565 . 8 1 1 A 46 46 ILE H H 46 7.465 7.484 -0.019 1
1 566 . 8 1 1 A 46 46 ILE HA H 46 3.856 4.002 -0.146 1
1 576 . 8 1 1 A 46 46 ILE C C 46 175.997 176.125 -0.128 1
1 577 . 8 1 1 A 46 46 ILE CA C 46 60.853 62.075 -1.222 1
1 578 . 8 1 1 A 46 46 ILE CB C 46 38.042 38.316 -0.274 1
1 582 . 8 1 1 A 46 46 ILE N N 46 123.998 121.328 2.670 1
1 583 . 8 1 1 A 47 47 LYS H H 47 8.717 8.592 0.125 1
1 584 . 8 1 1 A 47 47 LYS HA H 47 4.249 4.280 -0.031 1
1 591 . 8 1 1 A 47 47 LYS C C 47 177.583 177.665 -0.082 1
1 592 . 8 1 1 A 47 47 LYS CA C 47 56.320 57.035 -0.715 1
1 593 . 8 1 1 A 47 47 LYS CB C 47 30.393 32.850 -2.457 1
1 596 . 8 1 1 A 47 47 LYS N N 47 126.114 124.769 1.345 1
1 597 . 8 1 1 A 48 48 LEU H H 48 8.323 8.383 -0.060 1
1 598 . 8 1 1 A 48 48 LEU HA H 48 3.691 3.925 -0.234 1
1 608 . 8 1 1 A 48 48 LEU C C 48 177.274 178.161 -0.887 1
1 609 . 8 1 1 A 48 48 LEU CA C 48 58.443 58.480 -0.037 1
1 610 . 8 1 1 A 48 48 LEU CB C 48 42.282 41.123 1.159 1
1 614 . 8 1 1 A 48 48 LEU N N 48 125.857 126.117 -0.260 1
1 615 . 8 1 1 A 49 49 ALA H H 49 8.929 7.893 1.036 1
1 616 . 8 1 1 A 49 49 ALA HA H 49 4.067 4.014 0.053 1
1 620 . 8 1 1 A 49 49 ALA C C 49 177.468 179.150 -1.682 1
1 621 . 8 1 1 A 49 49 ALA CA C 49 53.092 54.802 -1.710 1
1 622 . 8 1 1 A 49 49 ALA CB C 49 18.562 18.080 0.482 1
1 623 . 8 1 1 A 49 49 ALA N N 49 115.543 120.566 -5.023 1
1 624 . 8 1 1 A 50 50 LYS H H 50 7.684 7.531 0.153 1
1 625 . 8 1 1 A 50 50 LYS HA H 50 4.395 4.309 0.086 1
1 634 . 8 1 1 A 50 50 LYS C C 50 174.958 176.812 -1.854 1
1 635 . 8 1 1 A 50 50 LYS CA C 50 53.977 57.241 -3.264 1
1 636 . 8 1 1 A 50 50 LYS CB C 50 32.645 32.588 0.057 1
1 640 . 8 1 1 A 50 50 LYS N N 50 114.788 115.364 -0.576 1
1 641 . 8 1 1 A 51 51 LEU H H 51 6.776 7.308 -0.532 1
1 642 . 8 1 1 A 51 51 LEU HA H 51 4.569 4.366 0.203 1
1 652 . 8 1 1 A 51 51 LEU C C 51 177.953 175.902 2.051 1
1 653 . 8 1 1 A 51 51 LEU CA C 51 55.318 55.068 0.250 1
1 654 . 8 1 1 A 51 51 LEU CB C 51 43.182 41.280 1.902 1
1 658 . 8 1 1 A 51 51 LEU N N 51 121.408 121.948 -0.540 1
1 659 . 8 1 1 A 52 52 THR H H 52 10.680 7.842 2.838 1
1 660 . 8 1 1 A 52 52 THR HA H 52 4.938 4.593 0.345 1
1 665 . 8 1 1 A 52 52 THR C C 52 175.553 174.539 1.014 1
1 666 . 8 1 1 A 52 52 THR CA C 52 59.740 59.951 -0.211 1
1 667 . 8 1 1 A 52 52 THR CB C 52 73.557 70.980 2.577 1
1 669 . 8 1 1 A 52 52 THR N N 52 119.481 119.606 -0.125 1
1 670 . 8 1 1 A 53 53 SER H H 53 9.278 9.006 0.272 1
1 671 . 8 1 1 A 53 53 SER HA H 53 4.261 4.148 0.113 1
1 674 . 8 1 1 A 53 53 SER C C 53 176.990 176.348 0.642 1
1 675 . 8 1 1 A 53 53 SER CA C 53 61.025 61.058 -0.033 1
1 676 . 8 1 1 A 53 53 SER CB C 53 62.312 62.906 -0.594 1
1 677 . 8 1 1 A 53 53 SER N N 53 116.343 121.780 -5.437 1
1 678 . 8 1 1 A 54 54 LEU H H 54 7.808 8.040 -0.232 1
1 679 . 8 1 1 A 54 54 LEU HA H 54 4.229 4.025 0.204 1
1 688 . 8 1 1 A 54 54 LEU C C 54 178.505 178.583 -0.078 1
1 689 . 8 1 1 A 54 54 LEU CA C 54 57.719 57.884 -0.165 1
1 690 . 8 1 1 A 54 54 LEU CB C 54 40.997 41.651 -0.654 1
1 694 . 8 1 1 A 54 54 LEU N N 54 126.055 122.800 3.255 1
1 695 . 8 1 1 A 55 55 HIS H H 55 7.798 8.158 -0.360 1
1 696 . 8 1 1 A 55 55 HIS HA H 55 4.311 4.380 -0.069 1
1 701 . 8 1 1 A 55 55 HIS C C 55 180.044 177.797 2.247 1
1 702 . 8 1 1 A 55 55 HIS CA C 55 60.583 59.473 1.110 1
1 703 . 8 1 1 A 55 55 HIS CB C 55 31.445 29.562 1.883 1
1 706 . 8 1 1 A 55 55 HIS N N 55 118.683 118.004 0.679 1
1 707 . 8 1 1 A 56 56 MET H H 56 7.375 7.892 -0.517 1
1 708 . 8 1 1 A 56 56 MET HA H 56 4.513 4.042 0.471 1
1 716 . 8 1 1 A 56 56 MET C C 56 177.169 178.425 -1.256 1
1 717 . 8 1 1 A 56 56 MET CA C 56 55.823 59.163 -3.340 1
1 718 . 8 1 1 A 56 56 MET CB C 56 31.303 32.720 -1.417 1
1 721 . 8 1 1 A 56 56 MET N N 56 114.530 117.539 -3.009 1
1 722 . 8 1 1 A 57 57 GLN H H 57 8.387 8.337 0.050 1
1 723 . 8 1 1 A 57 57 GLN HA H 57 3.981 3.989 -0.008 1
1 730 . 8 1 1 A 57 57 GLN C C 57 178.033 178.506 -0.473 1
1 731 . 8 1 1 A 57 57 GLN CA C 57 57.922 59.194 -1.272 1
1 732 . 8 1 1 A 57 57 GLN CB C 57 29.012 28.397 0.615 1
1 734 . 8 1 1 A 57 57 GLN N N 57 120.713 120.134 0.579 1
1 736 . 8 1 1 A 58 58 ASN H H 58 8.765 8.433 0.332 1
1 737 . 8 1 1 A 58 58 ASN HA H 58 4.539 4.516 0.023 1
1 742 . 8 1 1 A 58 58 ASN C C 58 178.084 177.571 0.513 1
1 743 . 8 1 1 A 58 58 ASN CA C 58 55.345 56.232 -0.887 1
1 744 . 8 1 1 A 58 58 ASN CB C 58 36.924 38.291 -1.367 1
1 745 . 8 1 1 A 58 58 ASN N N 58 117.390 117.725 -0.335 1
1 747 . 8 1 1 A 59 59 TYR H H 59 8.239 7.941 0.298 1
1 748 . 8 1 1 A 59 59 TYR HA H 59 4.586 4.182 0.404 1
1 755 . 8 1 1 A 59 59 TYR C C 59 178.015 176.959 1.056 1
1 756 . 8 1 1 A 59 59 TYR CA C 59 60.779 61.572 -0.793 1
1 757 . 8 1 1 A 59 59 TYR CB C 59 38.047 38.727 -0.680 1
1 762 . 8 1 1 A 59 59 TYR N N 59 122.335 123.061 -0.726 1
1 763 . 8 1 1 A 60 60 VAL H H 60 8.416 8.525 -0.109 1
1 764 . 8 1 1 A 60 60 VAL HA H 60 3.244 3.466 -0.222 1
1 772 . 8 1 1 A 60 60 VAL C C 60 177.309 178.179 -0.870 1
1 773 . 8 1 1 A 60 60 VAL CA C 60 67.022 66.490 0.532 1
1 774 . 8 1 1 A 60 60 VAL CB C 60 30.929 31.462 -0.533 1
1 777 . 8 1 1 A 60 60 VAL N N 60 119.842 119.493 0.349 1
1 778 . 8 1 1 A 61 61 ASN H H 61 8.264 8.155 0.109 1
1 779 . 8 1 1 A 61 61 ASN HA H 61 4.305 4.478 -0.173 1
1 784 . 8 1 1 A 61 61 ASN C C 61 177.263 177.543 -0.280 1
1 785 . 8 1 1 A 61 61 ASN CA C 61 55.548 56.506 -0.958 1
1 786 . 8 1 1 A 61 61 ASN CB C 61 36.645 38.166 -1.521 1
1 787 . 8 1 1 A 61 61 ASN N N 61 119.103 119.593 -0.490 1
1 789 . 8 1 1 A 62 62 SER H H 62 8.143 7.463 0.680 1
1 790 . 8 1 1 A 62 62 SER HA H 62 4.343 4.293 0.050 1
1 793 . 8 1 1 A 62 62 SER C C 62 176.409 177.482 -1.073 1
1 794 . 8 1 1 A 62 62 SER CA C 62 61.612 61.106 0.506 1
1 795 . 8 1 1 A 62 62 SER CB C 62 62.219 62.906 -0.687 1
1 796 . 8 1 1 A 62 62 SER N N 62 118.254 113.381 4.873 1
1 797 . 8 1 1 A 63 63 LEU H H 63 7.664 8.094 -0.430 1
1 798 . 8 1 1 A 63 63 LEU HA H 63 4.003 3.839 0.164 1
1 808 . 8 1 1 A 63 63 LEU C C 63 178.748 178.975 -0.227 1
1 809 . 8 1 1 A 63 63 LEU CA C 63 57.171 58.030 -0.859 1
1 810 . 8 1 1 A 63 63 LEU CB C 63 41.134 41.402 -0.268 1
1 814 . 8 1 1 A 63 63 LEU N N 63 123.812 122.168 1.644 1
1 815 . 8 1 1 A 64 64 ARG H H 64 7.969 7.599 0.370 1
1 816 . 8 1 1 A 64 64 ARG HA H 64 4.038 3.903 0.135 1
1 824 . 8 1 1 A 64 64 ARG C C 64 180.797 178.656 2.141 1
1 825 . 8 1 1 A 64 64 ARG CA C 64 58.598 59.514 -0.916 1
1 826 . 8 1 1 A 64 64 ARG CB C 64 28.849 29.820 -0.971 1
1 829 . 8 1 1 A 64 64 ARG N N 64 120.376 120.155 0.221 1
1 831 . 8 1 1 A 65 65 ASP H H 65 8.465 7.958 0.507 1
1 832 . 8 1 1 A 65 65 ASP HA H 65 4.408 4.406 0.002 1
1 835 . 8 1 1 A 65 65 ASP C C 65 177.336 178.064 -0.728 1
1 836 . 8 1 1 A 65 65 ASP CA C 65 56.957 56.767 0.190 1
1 837 . 8 1 1 A 65 65 ASP CB C 65 39.602 40.096 -0.494 1
1 838 . 8 1 1 A 65 65 ASP N N 65 122.402 119.249 3.153 1
1 839 . 8 1 1 A 66 66 GLU H H 66 7.703 7.779 -0.076 1
1 840 . 8 1 1 A 66 66 GLU HA H 66 4.213 4.358 -0.145 1
1 845 . 8 1 1 A 66 66 GLU C C 66 176.586 176.889 -0.303 1
1 846 . 8 1 1 A 66 66 GLU CA C 66 56.974 56.203 0.771 1
1 847 . 8 1 1 A 66 66 GLU CB C 66 29.821 30.247 -0.426 1
1 849 . 8 1 1 A 66 66 GLU N N 66 119.076 116.824 2.252 1
1 850 . 8 1 1 A 67 67 GLY H H 67 7.861 7.762 0.099 1
1 851 . 8 1 1 A 67 67 GLY HA2 H 67 4.269 3.952 0.317 1
1 852 . 8 1 1 A 67 67 GLY HA3 H 67 3.731 3.957 -0.226 1
1 853 . 8 1 1 A 67 67 GLY C C 67 174.614 174.922 -0.308 1
1 854 . 8 1 1 A 67 67 GLY CA C 67 44.608 46.476 -1.868 1
1 855 . 8 1 1 A 67 67 GLY N N 67 105.730 109.792 -4.062 1
1 856 . 8 1 1 A 68 68 LEU H H 68 7.324 8.134 -0.810 1
1 857 . 8 1 1 A 68 68 LEU HA H 68 4.257 4.313 -0.056 1
1 867 . 8 1 1 A 68 68 LEU C C 68 176.136 176.617 -0.481 1
1 868 . 8 1 1 A 68 68 LEU CA C 68 55.659 54.031 1.628 1
1 869 . 8 1 1 A 68 68 LEU CB C 68 41.874 41.478 0.396 1
1 873 . 8 1 1 A 68 68 LEU N N 68 121.062 122.198 -1.136 1
1 874 . 8 1 1 A 69 69 LYS H H 69 8.368 8.496 -0.128 1
1 875 . 8 1 1 A 69 69 LYS HA H 69 4.281 4.328 -0.047 1
1 884 . 8 1 1 A 69 69 LYS C C 69 177.940 177.910 0.030 1
1 885 . 8 1 1 A 69 69 LYS CA C 69 55.412 56.277 -0.865 1
1 886 . 8 1 1 A 69 69 LYS CB C 69 32.761 33.162 -0.401 1
1 890 . 8 1 1 A 69 69 LYS N N 69 120.120 123.322 -3.202 1
1 891 . 8 1 1 A 70 70 ARG H H 70 9.095 8.858 0.237 1
1 892 . 8 1 1 A 70 70 ARG HA H 70 3.684 4.080 -0.396 1
1 900 . 8 1 1 A 70 70 ARG C C 70 177.712 178.802 -1.090 1
1 901 . 8 1 1 A 70 70 ARG CA C 70 60.216 58.306 1.910 1
1 902 . 8 1 1 A 70 70 ARG CB C 70 29.539 29.723 -0.184 1
1 905 . 8 1 1 A 70 70 ARG N N 70 123.339 119.253 4.086 1
1 907 . 8 1 1 A 71 71 GLY H H 71 8.985 8.224 0.761 1
1 908 . 8 1 1 A 71 71 GLY HA2 H 71 3.932 3.629 0.303 1
1 909 . 8 1 1 A 71 71 GLY HA3 H 71 3.905 3.634 0.271 1
1 910 . 8 1 1 A 71 71 GLY C C 71 176.324 175.988 0.336 1
1 911 . 8 1 1 A 71 71 GLY CA C 71 46.752 47.453 -0.701 1
1 912 . 8 1 1 A 71 71 GLY N N 71 104.509 109.097 -4.588 1
1 913 . 8 1 1 A 72 72 THR H H 72 7.295 7.662 -0.367 1
1 914 . 8 1 1 A 72 72 THR HA H 72 4.014 3.914 0.100 1
1 919 . 8 1 1 A 72 72 THR C C 72 175.135 175.961 -0.826 1
1 920 . 8 1 1 A 72 72 THR CA C 72 65.848 66.365 -0.517 1
1 921 . 8 1 1 A 72 72 THR CB C 72 68.160 68.273 -0.113 1
1 923 . 8 1 1 A 72 72 THR N N 72 118.617 117.914 0.703 1
1 924 . 8 1 1 A 73 73 ILE H H 73 7.883 7.853 0.030 1
1 925 . 8 1 1 A 73 73 ILE HA H 73 3.258 3.583 -0.325 1
1 935 . 8 1 1 A 73 73 ILE C C 73 177.060 177.847 -0.787 1
1 936 . 8 1 1 A 73 73 ILE CA C 73 66.561 65.284 1.277 1
1 937 . 8 1 1 A 73 73 ILE CB C 73 37.339 37.586 -0.247 1
1 941 . 8 1 1 A 73 73 ILE N N 73 121.692 121.063 0.629 1
1 942 . 8 1 1 A 74 74 GLU H H 74 8.723 8.228 0.495 1
1 943 . 8 1 1 A 74 74 GLU HA H 74 3.807 3.919 -0.112 1
1 948 . 8 1 1 A 74 74 GLU C C 74 178.319 178.817 -0.498 1
1 949 . 8 1 1 A 74 74 GLU CA C 74 59.637 60.017 -0.380 1
1 950 . 8 1 1 A 74 74 GLU CB C 74 29.257 29.101 0.156 1
1 952 . 8 1 1 A 74 74 GLU N N 74 117.701 121.321 -3.620 1
1 953 . 8 1 1 A 75 75 LYS H H 75 7.361 7.541 -0.180 1
1 954 . 8 1 1 A 75 75 LYS HA H 75 3.958 4.018 -0.060 1
1 963 . 8 1 1 A 75 75 LYS C C 75 178.554 179.382 -0.828 1
1 964 . 8 1 1 A 75 75 LYS CA C 75 59.764 59.411 0.353 1
1 965 . 8 1 1 A 75 75 LYS CB C 75 32.314 32.279 0.035 1
1 969 . 8 1 1 A 75 75 LYS N N 75 118.734 117.834 0.900 1
1 970 . 8 1 1 A 76 76 ILE H H 76 7.713 7.426 0.287 1
1 971 . 8 1 1 A 76 76 ILE HA H 76 3.221 3.831 -0.610 1
1 981 . 8 1 1 A 76 76 ILE C C 76 177.504 178.367 -0.863 1
1 982 . 8 1 1 A 76 76 ILE CA C 76 65.796 64.490 1.306 1
1 983 . 8 1 1 A 76 76 ILE CB C 76 37.732 37.263 0.469 1
1 987 . 8 1 1 A 76 76 ILE N N 76 120.312 116.311 4.001 1
1 988 . 8 1 1 A 77 77 ILE H H 77 8.587 8.093 0.494 1
1 989 . 8 1 1 A 77 77 ILE HA H 77 3.778 3.624 0.154 1
1 999 . 8 1 1 A 77 77 ILE C C 77 177.074 178.045 -0.971 1
1 1000 . 8 1 1 A 77 77 ILE CA C 77 63.168 65.171 -2.003 1
1 1001 . 8 1 1 A 77 77 ILE CB C 77 36.617 37.277 -0.660 1
1 1005 . 8 1 1 A 77 77 ILE N N 77 118.978 121.925 -2.947 1
1 1006 . 8 1 1 A 78 78 LYS H H 78 8.050 7.563 0.487 1
1 1007 . 8 1 1 A 78 78 LYS HA H 78 3.925 4.003 -0.078 1
1 1016 . 8 1 1 A 78 78 LYS C C 78 178.291 179.333 -1.042 1
1 1017 . 8 1 1 A 78 78 LYS CA C 78 60.192 59.489 0.703 1
1 1018 . 8 1 1 A 78 78 LYS CB C 78 31.886 32.607 -0.721 1
1 1022 . 8 1 1 A 78 78 LYS N N 78 121.618 119.714 1.904 1
1 1023 . 8 1 1 A 79 79 VAL H H 79 7.619 7.665 -0.046 1
1 1024 . 8 1 1 A 79 79 VAL HA H 79 3.846 3.712 0.134 1
1 1032 . 8 1 1 A 79 79 VAL C C 79 177.712 178.443 -0.731 1
1 1033 . 8 1 1 A 79 79 VAL CA C 79 66.494 66.359 0.135 1
1 1034 . 8 1 1 A 79 79 VAL CB C 79 31.298 31.676 -0.378 1
1 1037 . 8 1 1 A 79 79 VAL N N 79 120.254 119.681 0.573 1
1 1038 . 8 1 1 A 80 80 ILE H H 80 7.885 8.332 -0.447 1
1 1039 . 8 1 1 A 80 80 ILE HA H 80 3.367 3.781 -0.414 1
1 1049 . 8 1 1 A 80 80 ILE C C 80 179.892 177.844 2.048 1
1 1050 . 8 1 1 A 80 80 ILE CA C 80 65.343 65.370 -0.027 1
1 1051 . 8 1 1 A 80 80 ILE CB C 80 38.129 37.402 0.727 1
1 1055 . 8 1 1 A 80 80 ILE N N 80 119.666 120.945 -1.279 1
1 1056 . 8 1 1 A 81 81 ARG H H 81 9.384 8.658 0.726 1
1 1057 . 8 1 1 A 81 81 ARG HA H 81 3.834 3.942 -0.108 1
1 1065 . 8 1 1 A 81 81 ARG C C 81 178.204 179.082 -0.878 1
1 1066 . 8 1 1 A 81 81 ARG CA C 81 60.560 60.019 0.541 1
1 1067 . 8 1 1 A 81 81 ARG CB C 81 30.196 30.198 -0.002 1
1 1070 . 8 1 1 A 81 81 ARG N N 81 121.030 119.683 1.347 1
1 1072 . 8 1 1 A 82 82 ASN H H 82 8.773 8.348 0.425 1
1 1073 . 8 1 1 A 82 82 ASN HA H 82 4.587 4.608 -0.021 1
1 1078 . 8 1 1 A 82 82 ASN C C 82 178.300 177.614 0.686 1
1 1079 . 8 1 1 A 82 82 ASN CA C 82 56.160 56.274 -0.114 1
1 1080 . 8 1 1 A 82 82 ASN CB C 82 38.464 39.091 -0.627 1
1 1081 . 8 1 1 A 82 82 ASN N N 82 118.483 118.392 0.091 1
1 1083 . 8 1 1 A 83 83 SER H H 83 8.526 7.432 1.094 1
1 1084 . 8 1 1 A 83 83 SER HA H 83 2.765 3.402 -0.637 1
1 1087 . 8 1 1 A 83 83 SER C C 83 176.386 177.379 -0.993 1
1 1088 . 8 1 1 A 83 83 SER CA C 83 61.245 60.831 0.414 1
1 1089 . 8 1 1 A 83 83 SER CB C 83 61.287 62.314 -1.027 1
1 1090 . 8 1 1 A 83 83 SER N N 83 118.286 114.253 4.033 1
1 1091 . 8 1 1 A 84 84 LEU H H 84 7.782 8.406 -0.624 1
1 1092 . 8 1 1 A 84 84 LEU HA H 84 4.221 3.953 0.268 1
1 1102 . 8 1 1 A 84 84 LEU C C 84 177.846 179.517 -1.671 1
1 1103 . 8 1 1 A 84 84 LEU CA C 84 57.166 57.832 -0.666 1
1 1104 . 8 1 1 A 84 84 LEU CB C 84 40.520 40.925 -0.405 1
1 1108 . 8 1 1 A 84 84 LEU N N 84 127.445 121.907 5.538 1
1 1109 . 8 1 1 A 85 85 GLU H H 85 8.264 8.456 -0.192 1
1 1110 . 8 1 1 A 85 85 GLU HA H 85 3.981 3.963 0.018 1
1 1115 . 8 1 1 A 85 85 GLU C C 85 179.288 179.232 0.056 1
1 1116 . 8 1 1 A 85 85 GLU CA C 85 59.025 60.395 -1.370 1
1 1117 . 8 1 1 A 85 85 GLU CB C 85 29.182 29.543 -0.361 1
1 1119 . 8 1 1 A 85 85 GLU N N 85 121.538 120.282 1.256 1
1 1120 . 8 1 1 A 86 86 HIS H H 86 7.683 7.868 -0.185 1
1 1121 . 8 1 1 A 86 86 HIS HA H 86 4.573 4.365 0.208 1
1 1125 . 8 1 1 A 86 86 HIS C C 86 175.484 177.553 -2.069 1
1 1126 . 8 1 1 A 86 86 HIS CA C 86 58.940 58.954 -0.014 1
1 1127 . 8 1 1 A 86 86 HIS CB C 86 29.267 30.281 -1.014 1
1 1129 . 8 1 1 A 86 86 HIS N N 86 117.087 120.655 -3.568 1
1 1130 . 8 1 1 A 87 87 ALA H H 87 7.197 8.006 -0.809 1
1 1131 . 8 1 1 A 87 87 ALA HA H 87 3.925 3.824 0.101 1
1 1135 . 8 1 1 A 87 87 ALA C C 87 179.038 180.367 -1.329 1
1 1136 . 8 1 1 A 87 87 ALA CA C 87 54.863 54.905 -0.042 1
1 1137 . 8 1 1 A 87 87 ALA CB C 87 17.034 18.275 -1.241 1
1 1138 . 8 1 1 A 87 87 ALA N N 87 121.510 120.958 0.552 1
1 1139 . 8 1 1 A 88 88 ILE H H 88 7.819 7.711 0.108 1
1 1140 . 8 1 1 A 88 88 ILE HA H 88 4.067 3.906 0.161 1
1 1150 . 8 1 1 A 88 88 ILE C C 88 180.846 177.400 3.446 1
1 1151 . 8 1 1 A 88 88 ILE CA C 88 64.021 65.194 -1.173 1
1 1152 . 8 1 1 A 88 88 ILE CB C 88 37.557 37.434 0.123 1
1 1156 . 8 1 1 A 88 88 ILE N N 88 120.898 119.668 1.230 1
1 1157 . 8 1 1 A 89 89 ASP H H 89 7.808 7.968 -0.160 1
1 1158 . 8 1 1 A 89 89 ASP HA H 89 4.437 4.325 0.112 1
1 1161 . 8 1 1 A 89 89 ASP C C 89 178.033 178.266 -0.233 1
1 1162 . 8 1 1 A 89 89 ASP CA C 89 57.343 57.849 -0.506 1
1 1163 . 8 1 1 A 89 89 ASP CB C 89 39.689 41.703 -2.014 1
1 1164 . 8 1 1 A 89 89 ASP N N 89 125.174 121.881 3.293 1
1 1165 . 8 1 1 A 90 90 LEU H H 90 7.607 7.599 0.008 1
1 1166 . 8 1 1 A 90 90 LEU HA H 90 4.198 4.189 0.009 1
1 1176 . 8 1 1 A 90 90 LEU C C 90 175.416 175.941 -0.525 1
1 1177 . 8 1 1 A 90 90 LEU CA C 90 54.755 54.940 -0.185 1
1 1178 . 8 1 1 A 90 90 LEU CB C 90 42.960 42.123 0.837 1
1 1182 . 8 1 1 A 90 90 LEU N N 90 117.576 117.241 0.335 1
1 1183 . 8 1 1 A 91 91 GLU H H 91 8.143 7.969 0.174 1
1 1184 . 8 1 1 A 91 91 GLU HA H 91 4.005 4.063 -0.058 1
1 1189 . 8 1 1 A 91 91 GLU C C 91 175.792 176.189 -0.397 1
1 1190 . 8 1 1 A 91 91 GLU CA C 91 57.202 57.480 -0.278 1
1 1191 . 8 1 1 A 91 91 GLU CB C 91 26.125 26.600 -0.475 1
1 1193 . 8 1 1 A 91 91 GLU N N 91 113.620 114.920 -1.300 1
1 1194 . 8 1 1 A 92 92 LEU H H 92 8.290 7.911 0.379 1
1 1195 . 8 1 1 A 92 92 LEU HA H 92 4.216 4.216 0.000 1
1 1205 . 8 1 1 A 92 92 LEU C C 92 176.622 177.013 -0.391 1
1 1206 . 8 1 1 A 92 92 LEU CA C 92 56.410 56.090 0.320 1
1 1207 . 8 1 1 A 92 92 LEU CB C 92 43.378 42.521 0.857 1
1 1211 . 8 1 1 A 92 92 LEU N N 92 116.868 118.515 -1.647 1
1 1212 . 8 1 1 A 93 93 ILE H H 93 6.988 7.007 -0.019 1
1 1213 . 8 1 1 A 93 93 ILE HA H 93 4.580 4.655 -0.075 1
1 1223 . 8 1 1 A 93 93 ILE C C 93 175.145 175.380 -0.235 1
1 1224 . 8 1 1 A 93 93 ILE CA C 93 58.707 58.768 -0.061 1
1 1225 . 8 1 1 A 93 93 ILE CB C 93 42.864 41.231 1.633 1
1 1229 . 8 1 1 A 93 93 ILE N N 93 107.565 113.539 -5.974 1
1 1230 . 8 1 1 A 94 94 THR H H 94 8.742 8.647 0.095 1
1 1231 . 8 1 1 A 94 94 THR HA H 94 4.489 4.613 -0.124 1
1 1236 . 8 1 1 A 94 94 THR C C 94 173.875 174.091 -0.216 1
1 1237 . 8 1 1 A 94 94 THR CA C 94 61.842 61.531 0.311 1
1 1238 . 8 1 1 A 94 94 THR CB C 94 69.972 69.695 0.277 1
1 1240 . 8 1 1 A 94 94 THR N N 94 107.904 112.789 -4.885 1
1 1241 . 8 1 1 A 95 95 LYS H H 95 7.294 7.410 -0.116 1
1 1242 . 8 1 1 A 95 95 LYS HA H 95 4.566 4.692 -0.126 1
1 1251 . 8 1 1 A 95 95 LYS C C 95 173.791 174.031 -0.240 1
1 1252 . 8 1 1 A 95 95 LYS CA C 95 54.533 55.914 -1.381 1
1 1253 . 8 1 1 A 95 95 LYS CB C 95 35.123 35.450 -0.327 1
1 1257 . 8 1 1 A 95 95 LYS N N 95 119.458 122.492 -3.034 1
1 1258 . 8 1 1 A 96 96 ASN H H 96 9.157 8.744 0.413 1
1 1259 . 8 1 1 A 96 96 ASN HA H 96 4.408 4.778 -0.370 1
1 1264 . 8 1 1 A 96 96 ASN C C 96 176.653 175.894 0.759 1
1 1265 . 8 1 1 A 96 96 ASN CA C 96 51.088 52.104 -1.016 1
1 1266 . 8 1 1 A 96 96 ASN CB C 96 37.292 37.993 -0.701 1
1 1267 . 8 1 1 A 96 96 ASN N N 96 121.031 124.575 -3.544 1
1 1269 . 8 1 1 A 97 97 VAL H H 97 8.193 8.374 -0.181 1
1 1270 . 8 1 1 A 97 97 VAL HA H 97 4.019 3.853 0.166 1
1 1278 . 8 1 1 A 97 97 VAL C C 97 175.089 176.875 -1.786 1
1 1279 . 8 1 1 A 97 97 VAL CA C 97 63.437 64.081 -0.644 1
1 1280 . 8 1 1 A 97 97 VAL CB C 97 29.934 31.361 -1.427 1
1 1283 . 8 1 1 A 97 97 VAL N N 97 118.839 122.942 -4.103 1
1 1284 . 8 1 1 A 98 98 ALA H H 98 7.994 7.473 0.521 1
1 1285 . 8 1 1 A 98 98 ALA HA H 98 5.108 4.194 0.914 1
1 1289 . 8 1 1 A 98 98 ALA C C 98 178.033 179.621 -1.588 1
1 1290 . 8 1 1 A 98 98 ALA CA C 98 50.342 53.964 -3.622 1
1 1291 . 8 1 1 A 98 98 ALA CB C 98 19.659 18.972 0.687 1
1 1292 . 8 1 1 A 98 98 ALA N N 98 121.031 124.618 -3.587 1
1 1293 . 8 1 1 A 99 99 ALA H H 99 7.347 7.860 -0.513 1
1 1294 . 8 1 1 A 99 99 ALA HA H 99 3.818 4.049 -0.231 1
1 1298 . 8 1 1 A 99 99 ALA C C 99 177.712 179.137 -1.425 1
1 1299 . 8 1 1 A 99 99 ALA CA C 99 55.117 54.837 0.280 1
1 1300 . 8 1 1 A 99 99 ALA CB C 99 18.879 18.427 0.452 1
1 1301 . 8 1 1 A 99 99 ALA N N 99 122.816 120.163 2.653 1
1 1302 . 8 1 1 A 100 100 LYS H H 100 8.190 7.354 0.836 1
1 1303 . 8 1 1 A 100 100 LYS HA H 100 4.483 4.342 0.141 1
1 1312 . 8 1 1 A 100 100 LYS C C 100 175.899 175.988 -0.089 1
1 1313 . 8 1 1 A 100 100 LYS CA C 100 54.231 57.319 -3.088 1
1 1314 . 8 1 1 A 100 100 LYS CB C 100 32.066 32.660 -0.594 1
1 1318 . 8 1 1 A 100 100 LYS N N 100 113.197 114.842 -1.645 1
1 1319 . 8 1 1 A 101 101 THR H H 101 7.128 7.659 -0.531 1
1 1320 . 8 1 1 A 101 101 THR HA H 101 3.834 4.546 -0.712 1
1 1325 . 8 1 1 A 101 101 THR C C 101 173.255 174.448 -1.193 1
1 1326 . 8 1 1 A 101 101 THR CA C 101 64.392 62.170 2.222 1
1 1327 . 8 1 1 A 101 101 THR CB C 101 69.160 69.542 -0.382 1
1 1329 . 8 1 1 A 101 101 THR N N 101 118.368 114.771 3.597 1
1 1330 . 8 1 1 A 102 102 LYS H H 102 8.753 8.424 0.329 1
1 1331 . 8 1 1 A 102 102 LYS HA H 102 4.438 4.418 0.020 1
1 1340 . 8 1 1 A 102 102 LYS C C 102 175.627 176.042 -0.415 1
1 1341 . 8 1 1 A 102 102 LYS CA C 102 55.117 55.725 -0.608 1
1 1342 . 8 1 1 A 102 102 LYS CB C 102 33.901 33.370 0.531 1
1 1346 . 8 1 1 A 102 102 LYS N N 102 126.513 125.872 0.641 1
1 1347 . 8 1 1 A 103 103 LEU H H 103 8.602 8.309 0.293 1
1 1348 . 8 1 1 A 103 103 LEU HA H 103 4.486 4.448 0.038 1
1 1358 . 8 1 1 A 103 103 LEU CA C 103 52.233 52.825 -0.592 1
1 1359 . 8 1 1 A 103 103 LEU CB C 103 41.028 42.693 -1.665 1
1 1363 . 8 1 1 A 103 103 LEU N N 103 124.466 122.699 1.767 1
1 1364 . 8 1 1 A 104 104 PRO HA H 104 4.437 4.749 -0.312 1
1 1371 . 8 1 1 A 104 104 PRO C C 104 175.779 175.868 -0.089 1
1 1372 . 8 1 1 A 104 104 PRO CA C 104 62.322 62.219 0.103 1
1 1373 . 8 1 1 A 104 104 PRO CB C 104 31.899 32.306 -0.407 1
1 1376 . 8 1 1 A 105 105 LYS H H 105 8.460 8.400 0.060 1
1 1377 . 8 1 1 A 105 105 LYS HA H 105 4.154 4.441 -0.287 1
1 1386 . 8 1 1 A 105 105 LYS C C 105 175.998 175.477 0.521 1
1 1387 . 8 1 1 A 105 105 LYS CA C 105 56.480 55.527 0.953 1
1 1388 . 8 1 1 A 105 105 LYS CB C 105 32.909 32.768 0.141 1
1 1392 . 8 1 1 A 105 105 LYS N N 105 122.139 121.069 1.070 1
1 1393 . 8 1 1 A 106 106 ALA H H 106 8.448 8.711 -0.263 1
1 1394 . 8 1 1 A 106 106 ALA HA H 106 4.309 4.360 -0.051 1
1 1398 . 8 1 1 A 106 106 ALA C C 106 176.828 175.564 1.264 1
1 1399 . 8 1 1 A 106 106 ALA CA C 106 51.862 51.804 0.058 1
1 1400 . 8 1 1 A 106 106 ALA CB C 106 19.323 17.439 1.884 1
1 1401 . 8 1 1 A 106 106 ALA N N 106 125.278 129.777 -4.499 1
1 1402 . 8 1 1 A 107 107 ASP H H 107 8.428 7.739 0.689 1
1 1403 . 8 1 1 A 107 107 ASP HA H 107 4.574 5.227 -0.653 1
1 1406 . 8 1 1 A 107 107 ASP C C 107 175.951 175.681 0.270 1
1 1407 . 8 1 1 A 107 107 ASP CA C 107 54.214 51.973 2.241 1
1 1408 . 8 1 1 A 107 107 ASP CB C 107 41.141 42.831 -1.690 1
1 1409 . 8 1 1 A 107 107 ASP N N 107 120.771 117.521 3.250 1
1 1410 . 8 1 1 A 108 108 LYS H H 108 8.329 8.618 -0.289 1
1 1411 . 8 1 1 A 108 108 LYS HA H 108 4.203 4.734 -0.531 1
1 1420 . 8 1 1 A 108 108 LYS C C 108 176.483 176.984 -0.501 1
1 1421 . 8 1 1 A 108 108 LYS CA C 108 56.831 55.438 1.393 1
1 1422 . 8 1 1 A 108 108 LYS CB C 108 32.648 32.964 -0.316 1
1 1426 . 8 1 1 A 108 108 LYS N N 108 120.727 118.332 2.395 1
1 1427 . 8 1 1 A 109 109 GLU H H 109 8.447 7.849 0.598 1
1 1428 . 8 1 1 A 109 109 GLU HA H 109 4.215 4.431 -0.216 1
1 1433 . 8 1 1 A 109 109 GLU C C 109 176.513 177.505 -0.992 1
1 1434 . 8 1 1 A 109 109 GLU CA C 109 56.936 56.493 0.443 1
1 1435 . 8 1 1 A 109 109 GLU CB C 109 29.833 30.073 -0.240 1
1 1437 . 8 1 1 A 109 109 GLU N N 109 121.471 120.098 1.373 1
1 1438 . 8 1 1 A 110 110 GLU H H 110 8.352 8.453 -0.101 1
1 1439 . 8 1 1 A 110 110 GLU HA H 110 4.233 4.222 0.011 1
1 1444 . 8 1 1 A 110 110 GLU C C 110 176.439 176.793 -0.354 1
1 1445 . 8 1 1 A 110 110 GLU CA C 110 56.681 56.780 -0.099 1
1 1446 . 8 1 1 A 110 110 GLU CB C 110 29.860 29.128 0.732 1
1 1448 . 8 1 1 A 110 110 GLU N N 110 121.559 119.002 2.557 1
1 1449 . 8 1 1 A 111 111 LEU H H 111 8.145 7.748 0.397 1
1 1450 . 8 1 1 A 111 111 LEU HA H 111 4.251 4.533 -0.282 1
1 1460 . 8 1 1 A 111 111 LEU C C 111 177.306 175.247 2.059 1
1 1461 . 8 1 1 A 111 111 LEU CA C 111 55.277 54.431 0.846 1
1 1462 . 8 1 1 A 111 111 LEU CB C 111 42.054 39.632 2.422 1
1 1466 . 8 1 1 A 111 111 LEU N N 111 122.181 122.781 -0.600 1
1 1467 . 8 1 1 A 112 112 GLU H H 112 8.212 7.726 0.486 1
1 1468 . 8 1 1 A 112 112 GLU N N 112 120.291 123.408 -3.117 1
1 1469 . 8 1 1 A 114 114 HIS C C 114 176.070 175.268 0.802 1
1 1470 . 8 1 1 A 116 116 HIS H H 116 8.227 8.533 -0.306 1
1 1471 . 8 1 1 A 116 116 HIS C C 116 173.580 174.989 -1.409 1
1 1472 . 8 1 1 A 116 116 HIS N N 116 119.156 127.630 -8.474 1
1 5 . 9 1 1 A 3 3 PRO HA H 3 4.390 4.507 -0.117 1
1 12 . 9 1 1 A 3 3 PRO C C 3 176.847 176.477 0.370 1
1 13 . 9 1 1 A 3 3 PRO CA C 3 63.449 62.750 0.699 1
1 14 . 9 1 1 A 3 3 PRO CB C 3 31.938 32.600 -0.662 1
1 17 . 9 1 1 A 4 4 SER H H 4 8.531 8.590 -0.059 1
1 18 . 9 1 1 A 4 4 SER HA H 4 4.262 4.288 -0.026 1
1 21 . 9 1 1 A 4 4 SER C C 4 175.414 174.423 0.991 1
1 22 . 9 1 1 A 4 4 SER CA C 4 59.163 58.399 0.764 1
1 23 . 9 1 1 A 4 4 SER CB C 4 63.242 62.759 0.483 1
1 24 . 9 1 1 A 4 4 SER N N 4 114.246 117.060 -2.814 1
1 25 . 9 1 1 A 5 5 LYS H H 5 8.468 7.856 0.612 1
1 26 . 9 1 1 A 5 5 LYS HA H 5 4.433 4.322 0.111 1
1 35 . 9 1 1 A 5 5 LYS C C 5 175.984 176.528 -0.544 1
1 36 . 9 1 1 A 5 5 LYS CA C 5 55.724 56.847 -1.123 1
1 37 . 9 1 1 A 5 5 LYS CB C 5 32.881 32.726 0.155 1
1 41 . 9 1 1 A 5 5 LYS N N 5 123.488 119.951 3.537 1
1 42 . 9 1 1 A 6 6 LEU H H 6 7.707 7.413 0.294 1
1 43 . 9 1 1 A 6 6 LEU HA H 6 4.381 4.338 0.043 1
1 53 . 9 1 1 A 6 6 LEU C C 6 177.820 176.109 1.711 1
1 54 . 9 1 1 A 6 6 LEU CA C 6 55.507 54.983 0.524 1
1 55 . 9 1 1 A 6 6 LEU CB C 6 43.374 42.371 1.003 1
1 59 . 9 1 1 A 6 6 LEU N N 6 121.233 123.301 -2.068 1
1 60 . 9 1 1 A 7 7 SER H H 7 9.433 8.665 0.768 1
1 61 . 9 1 1 A 7 7 SER HA H 7 4.638 4.707 -0.069 1
1 64 . 9 1 1 A 7 7 SER C C 7 174.120 175.104 -0.984 1
1 65 . 9 1 1 A 7 7 SER CA C 7 57.962 57.697 0.265 1
1 66 . 9 1 1 A 7 7 SER CB C 7 64.197 64.653 -0.456 1
1 67 . 9 1 1 A 7 7 SER N N 7 122.977 118.300 4.677 1
1 68 . 9 1 1 A 8 8 TYR H H 8 9.764 9.157 0.607 1
1 69 . 9 1 1 A 8 8 TYR HA H 8 4.732 4.231 0.501 1
1 76 . 9 1 1 A 8 8 TYR C C 8 177.206 177.653 -0.447 1
1 77 . 9 1 1 A 8 8 TYR CA C 8 58.762 61.781 -3.019 1
1 78 . 9 1 1 A 8 8 TYR CB C 8 36.605 38.923 -2.318 1
1 83 . 9 1 1 A 8 8 TYR N N 8 123.312 122.629 0.683 1
1 84 . 9 1 1 A 9 9 GLY H H 9 10.131 8.303 1.828 1
1 85 . 9 1 1 A 9 9 GLY HA2 H 9 3.983 3.582 0.401 1
1 86 . 9 1 1 A 9 9 GLY HA3 H 9 3.423 3.671 -0.248 1
1 87 . 9 1 1 A 9 9 GLY C C 9 175.163 176.020 -0.857 1
1 88 . 9 1 1 A 9 9 GLY CA C 9 47.153 47.268 -0.115 1
1 89 . 9 1 1 A 9 9 GLY N N 9 107.177 105.645 1.532 1
1 90 . 9 1 1 A 10 10 GLU H H 10 7.876 8.042 -0.166 1
1 91 . 9 1 1 A 10 10 GLU HA H 10 4.107 4.095 0.012 1
1 96 . 9 1 1 A 10 10 GLU C C 10 179.924 178.852 1.072 1
1 97 . 9 1 1 A 10 10 GLU CA C 10 58.890 59.378 -0.488 1
1 98 . 9 1 1 A 10 10 GLU CB C 10 29.750 29.412 0.338 1
1 100 . 9 1 1 A 10 10 GLU N N 10 122.219 121.678 0.541 1
1 101 . 9 1 1 A 11 11 TYR H H 11 8.384 8.241 0.143 1
1 102 . 9 1 1 A 11 11 TYR HA H 11 4.305 4.264 0.041 1
1 107 . 9 1 1 A 11 11 TYR C C 11 176.854 177.046 -0.192 1
1 108 . 9 1 1 A 11 11 TYR CA C 11 61.040 61.417 -0.377 1
1 109 . 9 1 1 A 11 11 TYR CB C 11 37.593 38.992 -1.399 1
1 112 . 9 1 1 A 11 11 TYR N N 11 120.809 123.203 -2.394 1
1 113 . 9 1 1 A 12 12 LEU H H 12 9.027 8.321 0.706 1
1 114 . 9 1 1 A 12 12 LEU HA H 12 3.778 3.830 -0.052 1
1 124 . 9 1 1 A 12 12 LEU C C 12 178.621 179.436 -0.815 1
1 125 . 9 1 1 A 12 12 LEU CA C 12 57.534 57.314 0.220 1
1 126 . 9 1 1 A 12 12 LEU CB C 12 41.957 40.992 0.965 1
1 130 . 9 1 1 A 12 12 LEU N N 12 121.080 119.171 1.909 1
1 131 . 9 1 1 A 13 13 GLU H H 13 7.614 7.918 -0.304 1
1 132 . 9 1 1 A 13 13 GLU HA H 13 4.102 4.023 0.079 1
1 137 . 9 1 1 A 13 13 GLU C C 13 178.449 178.925 -0.476 1
1 138 . 9 1 1 A 13 13 GLU CA C 13 59.609 59.473 0.136 1
1 139 . 9 1 1 A 13 13 GLU CB C 13 29.124 29.584 -0.460 1
1 141 . 9 1 1 A 13 13 GLU N N 13 118.475 120.991 -2.516 1
1 142 . 9 1 1 A 14 14 SER H H 14 7.329 7.399 -0.070 1
1 143 . 9 1 1 A 14 14 SER HA H 14 4.358 4.252 0.106 1
1 146 . 9 1 1 A 14 14 SER C C 14 176.794 176.710 0.084 1
1 147 . 9 1 1 A 14 14 SER CA C 14 61.064 61.447 -0.383 1
1 148 . 9 1 1 A 14 14 SER CB C 14 62.513 63.007 -0.494 1
1 149 . 9 1 1 A 14 14 SER N N 14 115.209 114.711 0.498 1
1 150 . 9 1 1 A 15 15 TRP H H 15 8.870 8.297 0.573 1
1 151 . 9 1 1 A 15 15 TRP HA H 15 4.005 4.511 -0.506 1
1 160 . 9 1 1 A 15 15 TRP C C 15 177.547 177.778 -0.231 1
1 161 . 9 1 1 A 15 15 TRP CA C 15 61.210 61.657 -0.447 1
1 162 . 9 1 1 A 15 15 TRP CB C 15 27.341 29.040 -1.699 1
1 168 . 9 1 1 A 15 15 TRP N N 15 124.998 123.870 1.128 1
1 170 . 9 1 1 A 16 16 PHE H H 16 9.087 8.322 0.765 1
1 171 . 9 1 1 A 16 16 PHE HA H 16 3.210 4.010 -0.800 1
1 179 . 9 1 1 A 16 16 PHE C C 16 175.909 176.682 -0.773 1
1 180 . 9 1 1 A 16 16 PHE CA C 16 61.473 61.620 -0.147 1
1 181 . 9 1 1 A 16 16 PHE CB C 16 38.506 39.087 -0.581 1
1 187 . 9 1 1 A 16 16 PHE N N 16 119.825 121.329 -1.504 1
1 188 . 9 1 1 A 17 17 ASN H H 17 7.768 8.122 -0.354 1
1 189 . 9 1 1 A 17 17 ASN HA H 17 4.078 4.046 0.032 1
1 194 . 9 1 1 A 17 17 ASN C C 17 176.604 177.519 -0.915 1
1 195 . 9 1 1 A 17 17 ASN CA C 17 55.621 55.962 -0.341 1
1 196 . 9 1 1 A 17 17 ASN CB C 17 37.830 38.424 -0.594 1
1 197 . 9 1 1 A 17 17 ASN N N 17 115.600 117.126 -1.526 1
1 199 . 9 1 1 A 18 18 THR H H 18 7.454 7.193 0.261 1
1 200 . 9 1 1 A 18 18 THR HA H 18 4.147 4.064 0.083 1
1 205 . 9 1 1 A 18 18 THR C C 18 175.692 176.183 -0.491 1
1 206 . 9 1 1 A 18 18 THR CA C 18 64.679 64.439 0.240 1
1 207 . 9 1 1 A 18 18 THR CB C 18 68.940 68.809 0.131 1
1 209 . 9 1 1 A 18 18 THR N N 18 113.049 114.857 -1.808 1
1 210 . 9 1 1 A 19 19 LYS H H 19 7.918 7.596 0.322 1
1 211 . 9 1 1 A 19 19 LYS HA H 19 3.791 3.668 0.123 1
1 220 . 9 1 1 A 19 19 LYS C C 19 178.120 178.733 -0.613 1
1 221 . 9 1 1 A 19 19 LYS CA C 19 55.985 58.789 -2.804 1
1 222 . 9 1 1 A 19 19 LYS CB C 19 31.130 30.944 0.186 1
1 226 . 9 1 1 A 19 19 LYS N N 19 122.614 120.591 2.023 1
1 227 . 9 1 1 A 20 20 ARG H H 20 7.845 7.694 0.151 1
1 228 . 9 1 1 A 20 20 ARG HA H 20 3.396 3.793 -0.397 1
1 236 . 9 1 1 A 20 20 ARG C C 20 175.601 178.857 -3.256 1
1 237 . 9 1 1 A 20 20 ARG CA C 20 58.182 59.013 -0.831 1
1 238 . 9 1 1 A 20 20 ARG CB C 20 28.045 29.680 -1.635 1
1 241 . 9 1 1 A 20 20 ARG N N 20 116.282 118.624 -2.342 1
1 243 . 9 1 1 A 21 21 HIS H H 21 7.163 7.857 -0.694 1
1 244 . 9 1 1 A 21 21 HIS HA H 21 4.500 4.180 0.320 1
1 249 . 9 1 1 A 21 21 HIS C C 21 175.618 177.179 -1.561 1
1 250 . 9 1 1 A 21 21 HIS CA C 21 56.912 59.231 -2.319 1
1 251 . 9 1 1 A 21 21 HIS CB C 21 29.400 29.634 -0.234 1
1 254 . 9 1 1 A 21 21 HIS N N 21 115.452 118.979 -3.527 1
1 255 . 9 1 1 A 22 22 SER H H 22 7.951 7.746 0.205 1
1 256 . 9 1 1 A 22 22 SER HA H 22 4.573 4.383 0.190 1
1 259 . 9 1 1 A 22 22 SER C C 22 173.948 176.276 -2.328 1
1 260 . 9 1 1 A 22 22 SER CA C 22 58.589 61.039 -2.450 1
1 261 . 9 1 1 A 22 22 SER CB C 22 64.228 63.653 0.575 1
1 262 . 9 1 1 A 22 22 SER N N 22 113.209 115.527 -2.318 1
1 263 . 9 1 1 A 23 23 VAL H H 23 7.179 7.582 -0.403 1
1 264 . 9 1 1 A 23 23 VAL HA H 23 4.626 4.064 0.562 1
1 272 . 9 1 1 A 23 23 VAL C C 23 175.397 175.904 -0.507 1
1 273 . 9 1 1 A 23 23 VAL CA C 23 59.556 63.648 -4.092 1
1 274 . 9 1 1 A 23 23 VAL CB C 23 33.810 32.828 0.982 1
1 277 . 9 1 1 A 23 23 VAL N N 23 113.108 114.778 -1.670 1
1 278 . 9 1 1 A 24 24 GLY H H 24 8.189 7.596 0.593 1
1 279 . 9 1 1 A 24 24 GLY HA2 H 24 4.074 3.998 0.076 1
1 280 . 9 1 1 A 24 24 GLY HA3 H 24 4.195 4.039 0.156 1
1 281 . 9 1 1 A 24 24 GLY C C 24 174.037 175.037 -1.000 1
1 282 . 9 1 1 A 24 24 GLY CA C 24 44.452 44.412 0.040 1
1 283 . 9 1 1 A 24 24 GLY N N 24 108.374 109.845 -1.471 1
1 284 . 9 1 1 A 25 25 ILE H H 25 8.331 8.674 -0.343 1
1 285 . 9 1 1 A 25 25 ILE HA H 25 3.839 3.711 0.128 1
1 295 . 9 1 1 A 25 25 ILE C C 25 178.042 177.610 0.432 1
1 296 . 9 1 1 A 25 25 ILE CA C 25 64.238 64.335 -0.097 1
1 297 . 9 1 1 A 25 25 ILE CB C 25 37.931 37.650 0.281 1
1 301 . 9 1 1 A 25 25 ILE N N 25 119.895 120.873 -0.978 1
1 302 . 9 1 1 A 26 26 GLN H H 26 8.545 8.459 0.086 1
1 303 . 9 1 1 A 26 26 GLN HA H 26 4.129 4.051 0.078 1
1 310 . 9 1 1 A 26 26 GLN C C 26 178.454 178.426 0.028 1
1 311 . 9 1 1 A 26 26 GLN CA C 26 58.772 58.299 0.473 1
1 312 . 9 1 1 A 26 26 GLN CB C 26 27.346 28.094 -0.748 1
1 314 . 9 1 1 A 26 26 GLN N N 26 120.013 120.036 -0.023 1
1 316 . 9 1 1 A 27 27 THR H H 27 7.944 8.159 -0.215 1
1 317 . 9 1 1 A 27 27 THR HA H 27 3.953 3.914 0.039 1
1 322 . 9 1 1 A 27 27 THR C C 27 175.818 176.569 -0.751 1
1 323 . 9 1 1 A 27 27 THR CA C 27 65.855 66.347 -0.492 1
1 324 . 9 1 1 A 27 27 THR CB C 27 68.127 68.405 -0.278 1
1 326 . 9 1 1 A 27 27 THR N N 27 117.645 116.996 0.649 1
1 327 . 9 1 1 A 28 28 ALA H H 28 8.593 8.093 0.500 1
1 328 . 9 1 1 A 28 28 ALA HA H 28 3.899 4.034 -0.135 1
1 332 . 9 1 1 A 28 28 ALA C C 28 178.515 179.586 -1.071 1
1 333 . 9 1 1 A 28 28 ALA CA C 28 55.742 55.554 0.188 1
1 334 . 9 1 1 A 28 28 ALA CB C 28 17.513 18.011 -0.498 1
1 335 . 9 1 1 A 28 28 ALA N N 28 123.917 123.505 0.412 1
1 336 . 9 1 1 A 29 29 LYS H H 29 7.800 7.977 -0.177 1
1 337 . 9 1 1 A 29 29 LYS HA H 29 3.982 4.011 -0.029 1
1 346 . 9 1 1 A 29 29 LYS C C 29 179.527 179.123 0.404 1
1 347 . 9 1 1 A 29 29 LYS CA C 29 59.761 59.802 -0.041 1
1 348 . 9 1 1 A 29 29 LYS CB C 29 32.223 32.327 -0.104 1
1 352 . 9 1 1 A 29 29 LYS N N 29 117.474 119.025 -1.551 1
1 353 . 9 1 1 A 30 30 VAL H H 30 7.591 7.193 0.398 1
1 354 . 9 1 1 A 30 30 VAL HA H 30 3.503 3.309 0.194 1
1 362 . 9 1 1 A 30 30 VAL C C 30 178.389 177.081 1.308 1
1 363 . 9 1 1 A 30 30 VAL CA C 30 65.640 65.740 -0.100 1
1 364 . 9 1 1 A 30 30 VAL CB C 30 31.644 31.538 0.106 1
1 367 . 9 1 1 A 30 30 VAL N N 30 121.749 120.147 1.602 1
1 368 . 9 1 1 A 31 31 LEU H H 31 8.333 8.170 0.163 1
1 369 . 9 1 1 A 31 31 LEU HA H 31 4.074 4.169 -0.095 1
1 379 . 9 1 1 A 31 31 LEU C C 31 177.780 179.098 -1.318 1
1 380 . 9 1 1 A 31 31 LEU CA C 31 58.157 58.343 -0.186 1
1 381 . 9 1 1 A 31 31 LEU CB C 31 42.230 41.519 0.711 1
1 385 . 9 1 1 A 31 31 LEU N N 31 120.901 120.373 0.528 1
1 386 . 9 1 1 A 32 32 LYS H H 32 8.562 8.090 0.472 1
1 387 . 9 1 1 A 32 32 LYS HA H 32 3.290 3.989 -0.699 1
1 395 . 9 1 1 A 32 32 LYS C C 32 178.037 178.873 -0.836 1
1 396 . 9 1 1 A 32 32 LYS CA C 32 58.911 59.573 -0.662 1
1 397 . 9 1 1 A 32 32 LYS CB C 32 31.605 31.210 0.395 1
1 401 . 9 1 1 A 32 32 LYS N N 32 119.075 119.431 -0.356 1
1 402 . 9 1 1 A 33 33 GLY H H 33 7.694 8.001 -0.307 1
1 403 . 9 1 1 A 33 33 GLY HA2 H 33 3.949 3.571 0.378 1
1 404 . 9 1 1 A 33 33 GLY HA3 H 33 3.826 3.656 0.170 1
1 405 . 9 1 1 A 33 33 GLY C C 33 177.101 176.468 0.633 1
1 406 . 9 1 1 A 33 33 GLY CA C 33 46.928 47.176 -0.248 1
1 407 . 9 1 1 A 33 33 GLY N N 33 105.282 106.912 -1.630 1
1 408 . 9 1 1 A 34 34 TYR H H 34 8.015 7.595 0.420 1
1 409 . 9 1 1 A 34 34 TYR HA H 34 4.558 4.700 -0.142 1
1 416 . 9 1 1 A 34 34 TYR C C 34 179.611 178.085 1.526 1
1 417 . 9 1 1 A 34 34 TYR CA C 34 59.349 60.214 -0.865 1
1 418 . 9 1 1 A 34 34 TYR CB C 34 37.344 38.208 -0.864 1
1 423 . 9 1 1 A 34 34 TYR N N 34 121.781 121.818 -0.037 1
1 424 . 9 1 1 A 35 35 LEU H H 35 8.689 8.067 0.622 1
1 425 . 9 1 1 A 35 35 LEU HA H 35 3.977 3.874 0.103 1
1 435 . 9 1 1 A 35 35 LEU C C 35 177.081 179.160 -2.079 1
1 436 . 9 1 1 A 35 35 LEU CA C 35 59.155 58.427 0.728 1
1 437 . 9 1 1 A 35 35 LEU CB C 35 41.103 41.643 -0.540 1
1 441 . 9 1 1 A 35 35 LEU N N 35 120.392 120.601 -0.209 1
1 442 . 9 1 1 A 36 36 ASN H H 36 8.721 8.684 0.037 1
1 443 . 9 1 1 A 36 36 ASN HA H 36 4.435 4.457 -0.022 1
1 448 . 9 1 1 A 36 36 ASN C C 36 176.792 177.576 -0.784 1
1 449 . 9 1 1 A 36 36 ASN CA C 36 55.642 55.264 0.378 1
1 450 . 9 1 1 A 36 36 ASN CB C 36 38.319 36.736 1.583 1
1 451 . 9 1 1 A 36 36 ASN N N 36 114.623 115.723 -1.100 1
1 453 . 9 1 1 A 37 37 SER H H 37 8.511 7.960 0.551 1
1 454 . 9 1 1 A 37 37 SER HA H 37 4.642 4.284 0.358 1
1 457 . 9 1 1 A 37 37 SER C C 37 175.039 176.426 -1.387 1
1 458 . 9 1 1 A 37 37 SER CA C 37 59.825 61.272 -1.447 1
1 459 . 9 1 1 A 37 37 SER CB C 37 64.056 62.963 1.093 1
1 460 . 9 1 1 A 37 37 SER N N 37 110.941 115.251 -4.310 1
1 461 . 9 1 1 A 38 38 ARG H H 38 7.242 8.077 -0.835 1
1 462 . 9 1 1 A 38 38 ARG HA H 38 4.919 4.432 0.487 1
1 469 . 9 1 1 A 38 38 ARG C C 38 176.514 178.557 -2.043 1
1 470 . 9 1 1 A 38 38 ARG CA C 38 56.687 57.928 -1.241 1
1 471 . 9 1 1 A 38 38 ARG CB C 38 32.434 31.185 1.249 1
1 474 . 9 1 1 A 38 38 ARG N N 38 117.062 120.592 -3.530 1
1 475 . 9 1 1 A 39 39 ILE H H 39 8.462 8.042 0.420 1
1 476 . 9 1 1 A 39 39 ILE HA H 39 3.618 3.812 -0.194 1
1 486 . 9 1 1 A 39 39 ILE C C 39 176.267 178.178 -1.911 1
1 487 . 9 1 1 A 39 39 ILE CA C 39 66.134 65.127 1.007 1
1 488 . 9 1 1 A 39 39 ILE CB C 39 39.787 37.832 1.955 1
1 492 . 9 1 1 A 39 39 ILE N N 39 121.214 120.495 0.719 1
1 493 . 9 1 1 A 40 40 ILE H H 40 9.339 8.294 1.045 1
1 494 . 9 1 1 A 40 40 ILE HA H 40 3.401 3.737 -0.336 1
1 504 . 9 1 1 A 40 40 ILE CA C 40 67.844 66.382 1.462 1
1 505 . 9 1 1 A 40 40 ILE CB C 40 34.406 35.496 -1.090 1
1 509 . 9 1 1 A 40 40 ILE N N 40 119.695 121.054 -1.359 1
1 510 . 9 1 1 A 41 41 PRO HA H 41 4.314 4.411 -0.097 1
1 517 . 9 1 1 A 41 41 PRO C C 41 177.418 178.226 -0.808 1
1 518 . 9 1 1 A 41 41 PRO CA C 41 65.912 65.311 0.601 1
1 519 . 9 1 1 A 41 41 PRO CB C 41 30.686 31.368 -0.682 1
1 522 . 9 1 1 A 42 42 SER H H 42 6.857 8.267 -1.410 1
1 523 . 9 1 1 A 42 42 SER HA H 42 4.558 4.563 -0.005 1
1 526 . 9 1 1 A 42 42 SER C C 42 174.813 175.855 -1.042 1
1 527 . 9 1 1 A 42 42 SER CA C 42 61.279 60.871 0.408 1
1 528 . 9 1 1 A 42 42 SER CB C 42 64.285 64.117 0.168 1
1 529 . 9 1 1 A 42 42 SER N N 42 108.994 113.025 -4.031 1
1 530 . 9 1 1 A 43 43 LEU H H 43 8.230 8.203 0.027 1
1 531 . 9 1 1 A 43 43 LEU HA H 43 4.572 4.292 0.280 1
1 541 . 9 1 1 A 43 43 LEU C C 43 177.301 178.937 -1.636 1
1 542 . 9 1 1 A 43 43 LEU CA C 43 54.113 55.833 -1.720 1
1 543 . 9 1 1 A 43 43 LEU CB C 43 44.800 42.332 2.468 1
1 547 . 9 1 1 A 43 43 LEU N N 43 118.715 120.378 -1.663 1
1 548 . 9 1 1 A 44 44 GLY H H 44 8.498 8.362 0.136 1
1 549 . 9 1 1 A 44 44 GLY HA2 H 44 4.010 3.814 0.196 1
1 550 . 9 1 1 A 44 44 GLY HA3 H 44 3.613 3.848 -0.235 1
1 551 . 9 1 1 A 44 44 GLY C C 44 174.178 175.384 -1.206 1
1 552 . 9 1 1 A 44 44 GLY CA C 44 46.271 47.364 -1.093 1
1 553 . 9 1 1 A 44 44 GLY N N 44 105.371 106.902 -1.531 1
1 554 . 9 1 1 A 45 45 ASN H H 45 8.385 7.998 0.387 1
1 555 . 9 1 1 A 45 45 ASN HA H 45 4.789 4.875 -0.086 1
1 560 . 9 1 1 A 45 45 ASN C C 45 175.386 175.489 -0.103 1
1 561 . 9 1 1 A 45 45 ASN CA C 45 53.144 53.947 -0.803 1
1 562 . 9 1 1 A 45 45 ASN CB C 45 37.928 38.791 -0.863 1
1 563 . 9 1 1 A 45 45 ASN N N 45 114.387 117.412 -3.025 1
1 565 . 9 1 1 A 46 46 ILE H H 46 7.465 7.218 0.247 1
1 566 . 9 1 1 A 46 46 ILE HA H 46 3.856 4.237 -0.381 1
1 576 . 9 1 1 A 46 46 ILE C C 46 175.997 176.172 -0.175 1
1 577 . 9 1 1 A 46 46 ILE CA C 46 60.853 60.717 0.136 1
1 578 . 9 1 1 A 46 46 ILE CB C 46 38.042 39.059 -1.017 1
1 582 . 9 1 1 A 46 46 ILE N N 46 123.998 120.359 3.639 1
1 583 . 9 1 1 A 47 47 LYS H H 47 8.717 8.596 0.121 1
1 584 . 9 1 1 A 47 47 LYS HA H 47 4.249 4.279 -0.030 1
1 591 . 9 1 1 A 47 47 LYS C C 47 177.583 177.552 0.031 1
1 592 . 9 1 1 A 47 47 LYS CA C 47 56.320 57.023 -0.703 1
1 593 . 9 1 1 A 47 47 LYS CB C 47 30.393 32.854 -2.461 1
1 596 . 9 1 1 A 47 47 LYS N N 47 126.114 124.332 1.782 1
1 597 . 9 1 1 A 48 48 LEU H H 48 8.323 8.665 -0.342 1
1 598 . 9 1 1 A 48 48 LEU HA H 48 3.691 4.033 -0.342 1
1 608 . 9 1 1 A 48 48 LEU C C 48 177.274 178.496 -1.222 1
1 609 . 9 1 1 A 48 48 LEU CA C 48 58.443 58.044 0.399 1
1 610 . 9 1 1 A 48 48 LEU CB C 48 42.282 41.220 1.062 1
1 614 . 9 1 1 A 48 48 LEU N N 48 125.857 125.717 0.140 1
1 615 . 9 1 1 A 49 49 ALA H H 49 8.929 7.682 1.247 1
1 616 . 9 1 1 A 49 49 ALA HA H 49 4.067 3.913 0.154 1
1 620 . 9 1 1 A 49 49 ALA C C 49 177.468 179.139 -1.671 1
1 621 . 9 1 1 A 49 49 ALA CA C 49 53.092 55.238 -2.146 1
1 622 . 9 1 1 A 49 49 ALA CB C 49 18.562 18.061 0.501 1
1 623 . 9 1 1 A 49 49 ALA N N 49 115.543 120.518 -4.975 1
1 624 . 9 1 1 A 50 50 LYS H H 50 7.684 7.332 0.352 1
1 625 . 9 1 1 A 50 50 LYS HA H 50 4.395 4.224 0.171 1
1 634 . 9 1 1 A 50 50 LYS C C 50 174.958 176.593 -1.635 1
1 635 . 9 1 1 A 50 50 LYS CA C 50 53.977 56.852 -2.875 1
1 636 . 9 1 1 A 50 50 LYS CB C 50 32.645 32.556 0.089 1
1 640 . 9 1 1 A 50 50 LYS N N 50 114.788 115.077 -0.289 1
1 641 . 9 1 1 A 51 51 LEU H H 51 6.776 7.247 -0.471 1
1 642 . 9 1 1 A 51 51 LEU HA H 51 4.569 3.985 0.584 1
1 652 . 9 1 1 A 51 51 LEU C C 51 177.953 175.518 2.435 1
1 653 . 9 1 1 A 51 51 LEU CA C 51 55.318 54.874 0.444 1
1 654 . 9 1 1 A 51 51 LEU CB C 51 43.182 41.053 2.129 1
1 658 . 9 1 1 A 51 51 LEU N N 51 121.408 121.820 -0.412 1
1 659 . 9 1 1 A 52 52 THR H H 52 10.680 7.349 3.331 1
1 660 . 9 1 1 A 52 52 THR HA H 52 4.938 4.644 0.294 1
1 665 . 9 1 1 A 52 52 THR C C 52 175.553 174.330 1.223 1
1 666 . 9 1 1 A 52 52 THR CA C 52 59.740 59.464 0.276 1
1 667 . 9 1 1 A 52 52 THR CB C 52 73.557 71.080 2.477 1
1 669 . 9 1 1 A 52 52 THR N N 52 119.481 119.250 0.231 1
1 670 . 9 1 1 A 53 53 SER H H 53 9.278 9.011 0.267 1
1 671 . 9 1 1 A 53 53 SER HA H 53 4.261 4.174 0.087 1
1 674 . 9 1 1 A 53 53 SER C C 53 176.990 176.314 0.676 1
1 675 . 9 1 1 A 53 53 SER CA C 53 61.025 61.020 0.005 1
1 676 . 9 1 1 A 53 53 SER CB C 53 62.312 62.856 -0.544 1
1 677 . 9 1 1 A 53 53 SER N N 53 116.343 121.748 -5.405 1
1 678 . 9 1 1 A 54 54 LEU H H 54 7.808 8.086 -0.278 1
1 679 . 9 1 1 A 54 54 LEU HA H 54 4.229 4.091 0.138 1
1 688 . 9 1 1 A 54 54 LEU C C 54 178.505 178.751 -0.246 1
1 689 . 9 1 1 A 54 54 LEU CA C 54 57.719 58.039 -0.320 1
1 690 . 9 1 1 A 54 54 LEU CB C 54 40.997 41.657 -0.660 1
1 694 . 9 1 1 A 54 54 LEU N N 54 126.055 123.341 2.714 1
1 695 . 9 1 1 A 55 55 HIS H H 55 7.798 8.327 -0.529 1
1 696 . 9 1 1 A 55 55 HIS HA H 55 4.311 4.381 -0.070 1
1 701 . 9 1 1 A 55 55 HIS C C 55 180.044 177.648 2.396 1
1 702 . 9 1 1 A 55 55 HIS CA C 55 60.583 59.580 1.003 1
1 703 . 9 1 1 A 55 55 HIS CB C 55 31.445 29.886 1.559 1
1 706 . 9 1 1 A 55 55 HIS N N 55 118.683 118.045 0.638 1
1 707 . 9 1 1 A 56 56 MET H H 56 7.375 7.957 -0.582 1
1 708 . 9 1 1 A 56 56 MET HA H 56 4.513 4.007 0.506 1
1 716 . 9 1 1 A 56 56 MET C C 56 177.169 178.519 -1.350 1
1 717 . 9 1 1 A 56 56 MET CA C 56 55.823 59.287 -3.464 1
1 718 . 9 1 1 A 56 56 MET CB C 56 31.303 33.312 -2.009 1
1 721 . 9 1 1 A 56 56 MET N N 56 114.530 117.633 -3.103 1
1 722 . 9 1 1 A 57 57 GLN H H 57 8.387 8.321 0.066 1
1 723 . 9 1 1 A 57 57 GLN HA H 57 3.981 4.006 -0.025 1
1 730 . 9 1 1 A 57 57 GLN C C 57 178.033 178.711 -0.678 1
1 731 . 9 1 1 A 57 57 GLN CA C 57 57.922 58.952 -1.030 1
1 732 . 9 1 1 A 57 57 GLN CB C 57 29.012 28.325 0.687 1
1 734 . 9 1 1 A 57 57 GLN N N 57 120.713 119.499 1.214 1
1 736 . 9 1 1 A 58 58 ASN H H 58 8.765 8.290 0.475 1
1 737 . 9 1 1 A 58 58 ASN HA H 58 4.539 4.534 0.005 1
1 742 . 9 1 1 A 58 58 ASN C C 58 178.084 177.437 0.647 1
1 743 . 9 1 1 A 58 58 ASN CA C 58 55.345 56.001 -0.656 1
1 744 . 9 1 1 A 58 58 ASN CB C 58 36.924 38.707 -1.783 1
1 745 . 9 1 1 A 58 58 ASN N N 58 117.390 117.773 -0.383 1
1 747 . 9 1 1 A 59 59 TYR H H 59 8.239 7.860 0.379 1
1 748 . 9 1 1 A 59 59 TYR HA H 59 4.586 4.190 0.396 1
1 755 . 9 1 1 A 59 59 TYR C C 59 178.015 176.925 1.090 1
1 756 . 9 1 1 A 59 59 TYR CA C 59 60.779 61.527 -0.748 1
1 757 . 9 1 1 A 59 59 TYR CB C 59 38.047 38.703 -0.656 1
1 762 . 9 1 1 A 59 59 TYR N N 59 122.335 123.222 -0.887 1
1 763 . 9 1 1 A 60 60 VAL H H 60 8.416 8.389 0.027 1
1 764 . 9 1 1 A 60 60 VAL HA H 60 3.244 3.526 -0.282 1
1 772 . 9 1 1 A 60 60 VAL C C 60 177.309 178.118 -0.809 1
1 773 . 9 1 1 A 60 60 VAL CA C 60 67.022 66.404 0.618 1
1 774 . 9 1 1 A 60 60 VAL CB C 60 30.929 31.390 -0.461 1
1 777 . 9 1 1 A 60 60 VAL N N 60 119.842 119.540 0.302 1
1 778 . 9 1 1 A 61 61 ASN H H 61 8.264 7.991 0.273 1
1 779 . 9 1 1 A 61 61 ASN HA H 61 4.305 4.440 -0.135 1
1 784 . 9 1 1 A 61 61 ASN C C 61 177.263 177.841 -0.578 1
1 785 . 9 1 1 A 61 61 ASN CA C 61 55.548 56.221 -0.673 1
1 786 . 9 1 1 A 61 61 ASN CB C 61 36.645 37.315 -0.670 1
1 787 . 9 1 1 A 61 61 ASN N N 61 119.103 120.189 -1.086 1
1 789 . 9 1 1 A 62 62 SER H H 62 8.143 7.533 0.610 1
1 790 . 9 1 1 A 62 62 SER HA H 62 4.343 4.202 0.141 1
1 793 . 9 1 1 A 62 62 SER C C 62 176.409 177.567 -1.158 1
1 794 . 9 1 1 A 62 62 SER CA C 62 61.612 60.918 0.694 1
1 795 . 9 1 1 A 62 62 SER CB C 62 62.219 63.129 -0.910 1
1 796 . 9 1 1 A 62 62 SER N N 62 118.254 115.261 2.993 1
1 797 . 9 1 1 A 63 63 LEU H H 63 7.664 8.235 -0.571 1
1 798 . 9 1 1 A 63 63 LEU HA H 63 4.003 3.901 0.102 1
1 808 . 9 1 1 A 63 63 LEU C C 63 178.748 178.914 -0.166 1
1 809 . 9 1 1 A 63 63 LEU CA C 63 57.171 58.008 -0.837 1
1 810 . 9 1 1 A 63 63 LEU CB C 63 41.134 41.356 -0.222 1
1 814 . 9 1 1 A 63 63 LEU N N 63 123.812 122.803 1.009 1
1 815 . 9 1 1 A 64 64 ARG H H 64 7.969 7.721 0.248 1
1 816 . 9 1 1 A 64 64 ARG HA H 64 4.038 3.909 0.129 1
1 824 . 9 1 1 A 64 64 ARG C C 64 180.797 177.728 3.069 1
1 825 . 9 1 1 A 64 64 ARG CA C 64 58.598 59.418 -0.820 1
1 826 . 9 1 1 A 64 64 ARG CB C 64 28.849 29.823 -0.974 1
1 829 . 9 1 1 A 64 64 ARG N N 64 120.376 120.404 -0.028 1
1 831 . 9 1 1 A 65 65 ASP H H 65 8.465 7.821 0.644 1
1 832 . 9 1 1 A 65 65 ASP HA H 65 4.408 4.373 0.035 1
1 835 . 9 1 1 A 65 65 ASP C C 65 177.336 178.482 -1.146 1
1 836 . 9 1 1 A 65 65 ASP CA C 65 56.957 56.577 0.380 1
1 837 . 9 1 1 A 65 65 ASP CB C 65 39.602 40.748 -1.146 1
1 838 . 9 1 1 A 65 65 ASP N N 65 122.402 120.187 2.215 1
1 839 . 9 1 1 A 66 66 GLU H H 66 7.703 7.823 -0.120 1
1 840 . 9 1 1 A 66 66 GLU HA H 66 4.213 4.265 -0.052 1
1 845 . 9 1 1 A 66 66 GLU C C 66 176.586 177.245 -0.659 1
1 846 . 9 1 1 A 66 66 GLU CA C 66 56.974 56.324 0.650 1
1 847 . 9 1 1 A 66 66 GLU CB C 66 29.821 29.881 -0.060 1
1 849 . 9 1 1 A 66 66 GLU N N 66 119.076 116.183 2.893 1
1 850 . 9 1 1 A 67 67 GLY H H 67 7.861 7.895 -0.034 1
1 851 . 9 1 1 A 67 67 GLY HA2 H 67 4.269 3.906 0.363 1
1 852 . 9 1 1 A 67 67 GLY HA3 H 67 3.731 3.910 -0.179 1
1 853 . 9 1 1 A 67 67 GLY C C 67 174.614 174.967 -0.353 1
1 854 . 9 1 1 A 67 67 GLY CA C 67 44.608 46.269 -1.661 1
1 855 . 9 1 1 A 67 67 GLY N N 67 105.730 109.484 -3.754 1
1 856 . 9 1 1 A 68 68 LEU H H 68 7.324 7.620 -0.296 1
1 857 . 9 1 1 A 68 68 LEU HA H 68 4.257 4.195 0.062 1
1 867 . 9 1 1 A 68 68 LEU C C 68 176.136 176.936 -0.800 1
1 868 . 9 1 1 A 68 68 LEU CA C 68 55.659 54.841 0.818 1
1 869 . 9 1 1 A 68 68 LEU CB C 68 41.874 41.984 -0.110 1
1 873 . 9 1 1 A 68 68 LEU N N 68 121.062 121.211 -0.149 1
1 874 . 9 1 1 A 69 69 LYS H H 69 8.368 8.477 -0.109 1
1 875 . 9 1 1 A 69 69 LYS HA H 69 4.281 4.397 -0.116 1
1 884 . 9 1 1 A 69 69 LYS C C 69 177.940 177.655 0.285 1
1 885 . 9 1 1 A 69 69 LYS CA C 69 55.412 56.114 -0.702 1
1 886 . 9 1 1 A 69 69 LYS CB C 69 32.761 33.346 -0.585 1
1 890 . 9 1 1 A 69 69 LYS N N 69 120.120 122.247 -2.127 1
1 891 . 9 1 1 A 70 70 ARG H H 70 9.095 8.788 0.307 1
1 892 . 9 1 1 A 70 70 ARG HA H 70 3.684 4.098 -0.414 1
1 900 . 9 1 1 A 70 70 ARG C C 70 177.712 178.640 -0.928 1
1 901 . 9 1 1 A 70 70 ARG CA C 70 60.216 58.373 1.843 1
1 902 . 9 1 1 A 70 70 ARG CB C 70 29.539 29.716 -0.177 1
1 905 . 9 1 1 A 70 70 ARG N N 70 123.339 120.560 2.779 1
1 907 . 9 1 1 A 71 71 GLY H H 71 8.985 8.336 0.649 1
1 908 . 9 1 1 A 71 71 GLY HA2 H 71 3.932 3.657 0.275 1
1 909 . 9 1 1 A 71 71 GLY HA3 H 71 3.905 3.664 0.241 1
1 910 . 9 1 1 A 71 71 GLY C C 71 176.324 175.808 0.516 1
1 911 . 9 1 1 A 71 71 GLY CA C 71 46.752 47.422 -0.670 1
1 912 . 9 1 1 A 71 71 GLY N N 71 104.509 108.830 -4.321 1
1 913 . 9 1 1 A 72 72 THR H H 72 7.295 8.003 -0.708 1
1 914 . 9 1 1 A 72 72 THR HA H 72 4.014 3.854 0.160 1
1 919 . 9 1 1 A 72 72 THR C C 72 175.135 176.170 -1.035 1
1 920 . 9 1 1 A 72 72 THR CA C 72 65.848 66.519 -0.671 1
1 921 . 9 1 1 A 72 72 THR CB C 72 68.160 68.517 -0.357 1
1 923 . 9 1 1 A 72 72 THR N N 72 118.617 117.594 1.023 1
1 924 . 9 1 1 A 73 73 ILE H H 73 7.883 7.898 -0.015 1
1 925 . 9 1 1 A 73 73 ILE HA H 73 3.258 3.559 -0.301 1
1 935 . 9 1 1 A 73 73 ILE C C 73 177.060 178.137 -1.077 1
1 936 . 9 1 1 A 73 73 ILE CA C 73 66.561 65.310 1.251 1
1 937 . 9 1 1 A 73 73 ILE CB C 73 37.339 37.604 -0.265 1
1 941 . 9 1 1 A 73 73 ILE N N 73 121.692 121.201 0.491 1
1 942 . 9 1 1 A 74 74 GLU H H 74 8.723 8.073 0.650 1
1 943 . 9 1 1 A 74 74 GLU HA H 74 3.807 3.946 -0.139 1
1 948 . 9 1 1 A 74 74 GLU C C 74 178.319 179.196 -0.877 1
1 949 . 9 1 1 A 74 74 GLU CA C 74 59.637 59.702 -0.065 1
1 950 . 9 1 1 A 74 74 GLU CB C 74 29.257 28.940 0.317 1
1 952 . 9 1 1 A 74 74 GLU N N 74 117.701 121.430 -3.729 1
1 953 . 9 1 1 A 75 75 LYS H H 75 7.361 7.599 -0.238 1
1 954 . 9 1 1 A 75 75 LYS HA H 75 3.958 4.049 -0.091 1
1 963 . 9 1 1 A 75 75 LYS C C 75 178.554 179.617 -1.063 1
1 964 . 9 1 1 A 75 75 LYS CA C 75 59.764 59.433 0.331 1
1 965 . 9 1 1 A 75 75 LYS CB C 75 32.314 32.288 0.026 1
1 969 . 9 1 1 A 75 75 LYS N N 75 118.734 118.899 -0.165 1
1 970 . 9 1 1 A 76 76 ILE H H 76 7.713 7.370 0.343 1
1 971 . 9 1 1 A 76 76 ILE HA H 76 3.221 3.849 -0.628 1
1 981 . 9 1 1 A 76 76 ILE C C 76 177.504 178.233 -0.729 1
1 982 . 9 1 1 A 76 76 ILE CA C 76 65.796 64.558 1.238 1
1 983 . 9 1 1 A 76 76 ILE CB C 76 37.732 37.163 0.569 1
1 987 . 9 1 1 A 76 76 ILE N N 76 120.312 116.631 3.681 1
1 988 . 9 1 1 A 77 77 ILE H H 77 8.587 7.967 0.620 1
1 989 . 9 1 1 A 77 77 ILE HA H 77 3.778 3.581 0.197 1
1 999 . 9 1 1 A 77 77 ILE C C 77 177.074 178.082 -1.008 1
1 1000 . 9 1 1 A 77 77 ILE CA C 77 63.168 65.586 -2.418 1
1 1001 . 9 1 1 A 77 77 ILE CB C 77 36.617 37.720 -1.103 1
1 1005 . 9 1 1 A 77 77 ILE N N 77 118.978 121.792 -2.814 1
1 1006 . 9 1 1 A 78 78 LYS H H 78 8.050 7.647 0.403 1
1 1007 . 9 1 1 A 78 78 LYS HA H 78 3.925 4.070 -0.145 1
1 1016 . 9 1 1 A 78 78 LYS C C 78 178.291 179.782 -1.491 1
1 1017 . 9 1 1 A 78 78 LYS CA C 78 60.192 59.143 1.049 1
1 1018 . 9 1 1 A 78 78 LYS CB C 78 31.886 32.417 -0.531 1
1 1022 . 9 1 1 A 78 78 LYS N N 78 121.618 119.385 2.233 1
1 1023 . 9 1 1 A 79 79 VAL H H 79 7.619 7.645 -0.026 1
1 1024 . 9 1 1 A 79 79 VAL HA H 79 3.846 3.809 0.037 1
1 1032 . 9 1 1 A 79 79 VAL C C 79 177.712 178.501 -0.789 1
1 1033 . 9 1 1 A 79 79 VAL CA C 79 66.494 66.499 -0.005 1
1 1034 . 9 1 1 A 79 79 VAL CB C 79 31.298 31.637 -0.339 1
1 1037 . 9 1 1 A 79 79 VAL N N 79 120.254 119.248 1.006 1
1 1038 . 9 1 1 A 80 80 ILE H H 80 7.885 8.258 -0.373 1
1 1039 . 9 1 1 A 80 80 ILE HA H 80 3.367 3.844 -0.477 1
1 1049 . 9 1 1 A 80 80 ILE C C 80 179.892 177.943 1.949 1
1 1050 . 9 1 1 A 80 80 ILE CA C 80 65.343 65.287 0.056 1
1 1051 . 9 1 1 A 80 80 ILE CB C 80 38.129 37.442 0.687 1
1 1055 . 9 1 1 A 80 80 ILE N N 80 119.666 120.834 -1.168 1
1 1056 . 9 1 1 A 81 81 ARG H H 81 9.384 8.555 0.829 1
1 1057 . 9 1 1 A 81 81 ARG HA H 81 3.834 3.935 -0.101 1
1 1065 . 9 1 1 A 81 81 ARG C C 81 178.204 179.151 -0.947 1
1 1066 . 9 1 1 A 81 81 ARG CA C 81 60.560 60.032 0.528 1
1 1067 . 9 1 1 A 81 81 ARG CB C 81 30.196 30.122 0.074 1
1 1070 . 9 1 1 A 81 81 ARG N N 81 121.030 119.389 1.641 1
1 1072 . 9 1 1 A 82 82 ASN H H 82 8.773 8.179 0.594 1
1 1073 . 9 1 1 A 82 82 ASN HA H 82 4.587 4.611 -0.024 1
1 1078 . 9 1 1 A 82 82 ASN C C 82 178.300 178.004 0.296 1
1 1079 . 9 1 1 A 82 82 ASN CA C 82 56.160 56.356 -0.196 1
1 1080 . 9 1 1 A 82 82 ASN CB C 82 38.464 37.883 0.581 1
1 1081 . 9 1 1 A 82 82 ASN N N 82 118.483 118.753 -0.270 1
1 1083 . 9 1 1 A 83 83 SER H H 83 8.526 7.840 0.686 1
1 1084 . 9 1 1 A 83 83 SER HA H 83 2.765 3.368 -0.603 1
1 1087 . 9 1 1 A 83 83 SER C C 83 176.386 176.440 -0.054 1
1 1088 . 9 1 1 A 83 83 SER CA C 83 61.245 62.055 -0.810 1
1 1089 . 9 1 1 A 83 83 SER CB C 83 61.287 62.495 -1.208 1
1 1090 . 9 1 1 A 83 83 SER N N 83 118.286 116.793 1.493 1
1 1091 . 9 1 1 A 84 84 LEU H H 84 7.782 8.315 -0.533 1
1 1092 . 9 1 1 A 84 84 LEU HA H 84 4.221 3.982 0.239 1
1 1102 . 9 1 1 A 84 84 LEU C C 84 177.846 179.339 -1.493 1
1 1103 . 9 1 1 A 84 84 LEU CA C 84 57.166 57.567 -0.401 1
1 1104 . 9 1 1 A 84 84 LEU CB C 84 40.520 41.045 -0.525 1
1 1108 . 9 1 1 A 84 84 LEU N N 84 127.445 121.142 6.303 1
1 1109 . 9 1 1 A 85 85 GLU H H 85 8.264 8.476 -0.212 1
1 1110 . 9 1 1 A 85 85 GLU HA H 85 3.981 3.986 -0.005 1
1 1115 . 9 1 1 A 85 85 GLU C C 85 179.288 179.327 -0.039 1
1 1116 . 9 1 1 A 85 85 GLU CA C 85 59.025 59.924 -0.899 1
1 1117 . 9 1 1 A 85 85 GLU CB C 85 29.182 29.164 0.018 1
1 1119 . 9 1 1 A 85 85 GLU N N 85 121.538 120.348 1.190 1
1 1120 . 9 1 1 A 86 86 HIS H H 86 7.683 8.164 -0.481 1
1 1121 . 9 1 1 A 86 86 HIS HA H 86 4.573 4.401 0.172 1
1 1125 . 9 1 1 A 86 86 HIS C C 86 175.484 177.597 -2.113 1
1 1126 . 9 1 1 A 86 86 HIS CA C 86 58.940 59.100 -0.160 1
1 1127 . 9 1 1 A 86 86 HIS CB C 86 29.267 30.247 -0.980 1
1 1129 . 9 1 1 A 86 86 HIS N N 86 117.087 120.655 -3.568 1
1 1130 . 9 1 1 A 87 87 ALA H H 87 7.197 8.227 -1.030 1
1 1131 . 9 1 1 A 87 87 ALA HA H 87 3.925 3.750 0.175 1
1 1135 . 9 1 1 A 87 87 ALA C C 87 179.038 179.992 -0.954 1
1 1136 . 9 1 1 A 87 87 ALA CA C 87 54.863 54.907 -0.044 1
1 1137 . 9 1 1 A 87 87 ALA CB C 87 17.034 18.267 -1.233 1
1 1138 . 9 1 1 A 87 87 ALA N N 87 121.510 120.965 0.545 1
1 1139 . 9 1 1 A 88 88 ILE H H 88 7.819 7.674 0.145 1
1 1140 . 9 1 1 A 88 88 ILE HA H 88 4.067 3.748 0.319 1
1 1150 . 9 1 1 A 88 88 ILE C C 88 180.846 177.368 3.478 1
1 1151 . 9 1 1 A 88 88 ILE CA C 88 64.021 65.400 -1.379 1
1 1152 . 9 1 1 A 88 88 ILE CB C 88 37.557 37.567 -0.010 1
1 1156 . 9 1 1 A 88 88 ILE N N 88 120.898 119.251 1.647 1
1 1157 . 9 1 1 A 89 89 ASP H H 89 7.808 7.990 -0.182 1
1 1158 . 9 1 1 A 89 89 ASP HA H 89 4.437 4.397 0.040 1
1 1161 . 9 1 1 A 89 89 ASP C C 89 178.033 177.603 0.430 1
1 1162 . 9 1 1 A 89 89 ASP CA C 89 57.343 57.389 -0.046 1
1 1163 . 9 1 1 A 89 89 ASP CB C 89 39.689 41.946 -2.257 1
1 1164 . 9 1 1 A 89 89 ASP N N 89 125.174 121.146 4.028 1
1 1165 . 9 1 1 A 90 90 LEU H H 90 7.607 7.494 0.113 1
1 1166 . 9 1 1 A 90 90 LEU HA H 90 4.198 4.234 -0.036 1
1 1176 . 9 1 1 A 90 90 LEU C C 90 175.416 176.049 -0.633 1
1 1177 . 9 1 1 A 90 90 LEU CA C 90 54.755 54.931 -0.176 1
1 1178 . 9 1 1 A 90 90 LEU CB C 90 42.960 41.635 1.325 1
1 1182 . 9 1 1 A 90 90 LEU N N 90 117.576 117.246 0.330 1
1 1183 . 9 1 1 A 91 91 GLU H H 91 8.143 7.892 0.251 1
1 1184 . 9 1 1 A 91 91 GLU HA H 91 4.005 4.038 -0.033 1
1 1189 . 9 1 1 A 91 91 GLU C C 91 175.792 176.156 -0.364 1
1 1190 . 9 1 1 A 91 91 GLU CA C 91 57.202 57.526 -0.324 1
1 1191 . 9 1 1 A 91 91 GLU CB C 91 26.125 27.148 -1.023 1
1 1193 . 9 1 1 A 91 91 GLU N N 91 113.620 115.348 -1.728 1
1 1194 . 9 1 1 A 92 92 LEU H H 92 8.290 8.007 0.283 1
1 1195 . 9 1 1 A 92 92 LEU HA H 92 4.216 4.165 0.051 1
1 1205 . 9 1 1 A 92 92 LEU C C 92 176.622 176.826 -0.204 1
1 1206 . 9 1 1 A 92 92 LEU CA C 92 56.410 56.471 -0.061 1
1 1207 . 9 1 1 A 92 92 LEU CB C 92 43.378 42.200 1.178 1
1 1211 . 9 1 1 A 92 92 LEU N N 92 116.868 119.734 -2.866 1
1 1212 . 9 1 1 A 93 93 ILE H H 93 6.988 6.957 0.031 1
1 1213 . 9 1 1 A 93 93 ILE HA H 93 4.580 4.559 0.021 1
1 1223 . 9 1 1 A 93 93 ILE C C 93 175.145 175.396 -0.251 1
1 1224 . 9 1 1 A 93 93 ILE CA C 93 58.707 58.843 -0.136 1
1 1225 . 9 1 1 A 93 93 ILE CB C 93 42.864 41.861 1.003 1
1 1229 . 9 1 1 A 93 93 ILE N N 93 107.565 113.618 -6.053 1
1 1230 . 9 1 1 A 94 94 THR H H 94 8.742 8.539 0.203 1
1 1231 . 9 1 1 A 94 94 THR HA H 94 4.489 4.538 -0.049 1
1 1236 . 9 1 1 A 94 94 THR C C 94 173.875 174.015 -0.140 1
1 1237 . 9 1 1 A 94 94 THR CA C 94 61.842 61.681 0.161 1
1 1238 . 9 1 1 A 94 94 THR CB C 94 69.972 69.288 0.684 1
1 1240 . 9 1 1 A 94 94 THR N N 94 107.904 112.600 -4.696 1
1 1241 . 9 1 1 A 95 95 LYS H H 95 7.294 7.382 -0.088 1
1 1242 . 9 1 1 A 95 95 LYS HA H 95 4.566 4.651 -0.085 1
1 1251 . 9 1 1 A 95 95 LYS C C 95 173.791 174.067 -0.276 1
1 1252 . 9 1 1 A 95 95 LYS CA C 95 54.533 55.988 -1.455 1
1 1253 . 9 1 1 A 95 95 LYS CB C 95 35.123 35.371 -0.248 1
1 1257 . 9 1 1 A 95 95 LYS N N 95 119.458 122.214 -2.756 1
1 1258 . 9 1 1 A 96 96 ASN H H 96 9.157 8.742 0.415 1
1 1259 . 9 1 1 A 96 96 ASN HA H 96 4.408 4.831 -0.423 1
1 1264 . 9 1 1 A 96 96 ASN C C 96 176.653 175.936 0.717 1
1 1265 . 9 1 1 A 96 96 ASN CA C 96 51.088 52.376 -1.288 1
1 1266 . 9 1 1 A 96 96 ASN CB C 96 37.292 38.021 -0.729 1
1 1267 . 9 1 1 A 96 96 ASN N N 96 121.031 124.877 -3.846 1
1 1269 . 9 1 1 A 97 97 VAL H H 97 8.193 8.317 -0.124 1
1 1270 . 9 1 1 A 97 97 VAL HA H 97 4.019 3.829 0.190 1
1 1278 . 9 1 1 A 97 97 VAL C C 97 175.089 176.493 -1.404 1
1 1279 . 9 1 1 A 97 97 VAL CA C 97 63.437 64.120 -0.683 1
1 1280 . 9 1 1 A 97 97 VAL CB C 97 29.934 31.359 -1.425 1
1 1283 . 9 1 1 A 97 97 VAL N N 97 118.839 122.792 -3.953 1
1 1284 . 9 1 1 A 98 98 ALA H H 98 7.994 7.563 0.431 1
1 1285 . 9 1 1 A 98 98 ALA HA H 98 5.108 4.135 0.973 1
1 1289 . 9 1 1 A 98 98 ALA C C 98 178.033 179.743 -1.710 1
1 1290 . 9 1 1 A 98 98 ALA CA C 98 50.342 52.959 -2.617 1
1 1291 . 9 1 1 A 98 98 ALA CB C 98 19.659 19.210 0.449 1
1 1292 . 9 1 1 A 98 98 ALA N N 98 121.031 123.971 -2.940 1
1 1293 . 9 1 1 A 99 99 ALA H H 99 7.347 7.737 -0.390 1
1 1294 . 9 1 1 A 99 99 ALA HA H 99 3.818 4.020 -0.202 1
1 1298 . 9 1 1 A 99 99 ALA C C 99 177.712 179.114 -1.402 1
1 1299 . 9 1 1 A 99 99 ALA CA C 99 55.117 54.936 0.181 1
1 1300 . 9 1 1 A 99 99 ALA CB C 99 18.879 18.549 0.330 1
1 1301 . 9 1 1 A 99 99 ALA N N 99 122.816 120.139 2.677 1
1 1302 . 9 1 1 A 100 100 LYS H H 100 8.190 7.761 0.429 1
1 1303 . 9 1 1 A 100 100 LYS HA H 100 4.483 4.348 0.135 1
1 1312 . 9 1 1 A 100 100 LYS C C 100 175.899 175.806 0.093 1
1 1313 . 9 1 1 A 100 100 LYS CA C 100 54.231 57.400 -3.169 1
1 1314 . 9 1 1 A 100 100 LYS CB C 100 32.066 32.741 -0.675 1
1 1318 . 9 1 1 A 100 100 LYS N N 100 113.197 115.031 -1.834 1
1 1319 . 9 1 1 A 101 101 THR H H 101 7.128 7.741 -0.613 1
1 1320 . 9 1 1 A 101 101 THR HA H 101 3.834 4.491 -0.657 1
1 1325 . 9 1 1 A 101 101 THR C C 101 173.255 173.844 -0.589 1
1 1326 . 9 1 1 A 101 101 THR CA C 101 64.392 61.959 2.433 1
1 1327 . 9 1 1 A 101 101 THR CB C 101 69.160 68.505 0.655 1
1 1329 . 9 1 1 A 101 101 THR N N 101 118.368 114.939 3.429 1
1 1330 . 9 1 1 A 102 102 LYS H H 102 8.753 8.722 0.031 1
1 1331 . 9 1 1 A 102 102 LYS HA H 102 4.438 4.678 -0.240 1
1 1340 . 9 1 1 A 102 102 LYS C C 102 175.627 176.040 -0.413 1
1 1341 . 9 1 1 A 102 102 LYS CA C 102 55.117 54.885 0.232 1
1 1342 . 9 1 1 A 102 102 LYS CB C 102 33.901 33.289 0.612 1
1 1346 . 9 1 1 A 102 102 LYS N N 102 126.513 126.449 0.064 1
1 1347 . 9 1 1 A 103 103 LEU H H 103 8.602 8.266 0.336 1
1 1348 . 9 1 1 A 103 103 LEU HA H 103 4.486 4.469 0.017 1
1 1358 . 9 1 1 A 103 103 LEU CA C 103 52.233 53.149 -0.916 1
1 1359 . 9 1 1 A 103 103 LEU CB C 103 41.028 43.139 -2.111 1
1 1363 . 9 1 1 A 103 103 LEU N N 103 124.466 123.113 1.353 1
1 1364 . 9 1 1 A 104 104 PRO HA H 104 4.437 4.433 0.004 1
1 1371 . 9 1 1 A 104 104 PRO C C 104 175.779 176.670 -0.891 1
1 1372 . 9 1 1 A 104 104 PRO CA C 104 62.322 65.627 -3.305 1
1 1373 . 9 1 1 A 104 104 PRO CB C 104 31.899 31.392 0.507 1
1 1376 . 9 1 1 A 105 105 LYS H H 105 8.460 7.802 0.658 1
1 1377 . 9 1 1 A 105 105 LYS HA H 105 4.154 4.768 -0.614 1
1 1386 . 9 1 1 A 105 105 LYS C C 105 175.998 174.919 1.079 1
1 1387 . 9 1 1 A 105 105 LYS CA C 105 56.480 54.879 1.601 1
1 1388 . 9 1 1 A 105 105 LYS CB C 105 32.909 35.655 -2.746 1
1 1392 . 9 1 1 A 105 105 LYS N N 105 122.139 117.109 5.030 1
1 1393 . 9 1 1 A 106 106 ALA H H 106 8.448 8.957 -0.509 1
1 1394 . 9 1 1 A 106 106 ALA HA H 106 4.309 5.473 -1.164 1
1 1398 . 9 1 1 A 106 106 ALA C C 106 176.828 175.931 0.897 1
1 1399 . 9 1 1 A 106 106 ALA CA C 106 51.862 50.066 1.796 1
1 1400 . 9 1 1 A 106 106 ALA CB C 106 19.323 22.931 -3.608 1
1 1401 . 9 1 1 A 106 106 ALA N N 106 125.278 127.838 -2.560 1
1 1402 . 9 1 1 A 107 107 ASP H H 107 8.428 8.690 -0.262 1
1 1403 . 9 1 1 A 107 107 ASP HA H 107 4.574 5.119 -0.545 1
1 1406 . 9 1 1 A 107 107 ASP C C 107 175.951 174.402 1.549 1
1 1407 . 9 1 1 A 107 107 ASP CA C 107 54.214 53.767 0.447 1
1 1408 . 9 1 1 A 107 107 ASP CB C 107 41.141 40.541 0.600 1
1 1409 . 9 1 1 A 107 107 ASP N N 107 120.771 121.910 -1.139 1
1 1410 . 9 1 1 A 108 108 LYS H H 108 8.329 8.657 -0.328 1
1 1411 . 9 1 1 A 108 108 LYS HA H 108 4.203 4.804 -0.601 1
1 1420 . 9 1 1 A 108 108 LYS C C 108 176.483 174.106 2.377 1
1 1421 . 9 1 1 A 108 108 LYS CA C 108 56.831 54.779 2.052 1
1 1422 . 9 1 1 A 108 108 LYS CB C 108 32.648 34.357 -1.709 1
1 1426 . 9 1 1 A 108 108 LYS N N 108 120.727 120.722 0.005 1
1 1427 . 9 1 1 A 109 109 GLU H H 109 8.447 8.227 0.220 1
1 1428 . 9 1 1 A 109 109 GLU HA H 109 4.215 4.886 -0.671 1
1 1433 . 9 1 1 A 109 109 GLU C C 109 176.513 176.502 0.011 1
1 1434 . 9 1 1 A 109 109 GLU CA C 109 56.936 55.003 1.933 1
1 1435 . 9 1 1 A 109 109 GLU CB C 109 29.833 31.515 -1.682 1
1 1437 . 9 1 1 A 109 109 GLU N N 109 121.471 119.272 2.199 1
1 1438 . 9 1 1 A 110 110 GLU H H 110 8.352 9.093 -0.741 1
1 1439 . 9 1 1 A 110 110 GLU HA H 110 4.233 4.215 0.018 1
1 1444 . 9 1 1 A 110 110 GLU C C 110 176.439 177.790 -1.351 1
1 1445 . 9 1 1 A 110 110 GLU CA C 110 56.681 58.455 -1.774 1
1 1446 . 9 1 1 A 110 110 GLU CB C 110 29.860 29.276 0.584 1
1 1448 . 9 1 1 A 110 110 GLU N N 110 121.559 124.672 -3.113 1
1 1449 . 9 1 1 A 111 111 LEU H H 111 8.145 7.636 0.509 1
1 1450 . 9 1 1 A 111 111 LEU HA H 111 4.251 4.034 0.217 1
1 1460 . 9 1 1 A 111 111 LEU C C 111 177.306 176.390 0.916 1
1 1461 . 9 1 1 A 111 111 LEU CA C 111 55.277 55.111 0.166 1
1 1462 . 9 1 1 A 111 111 LEU CB C 111 42.054 41.252 0.802 1
1 1466 . 9 1 1 A 111 111 LEU N N 111 122.181 117.929 4.252 1
1 1467 . 9 1 1 A 112 112 GLU H H 112 8.212 7.332 0.880 1
1 1468 . 9 1 1 A 112 112 GLU N N 112 120.291 120.209 0.082 1
1 1469 . 9 1 1 A 114 114 HIS C C 114 176.070 175.159 0.911 1
1 1470 . 9 1 1 A 116 116 HIS H H 116 8.227 8.564 -0.337 1
1 1471 . 9 1 1 A 116 116 HIS C C 116 173.580 174.954 -1.374 1
1 1472 . 9 1 1 A 116 116 HIS N N 116 119.156 124.346 -5.190 1
1 5 . 10 1 1 A 3 3 PRO HA H 3 4.390 4.724 -0.334 1
1 12 . 10 1 1 A 3 3 PRO C C 3 176.847 177.244 -0.397 1
1 13 . 10 1 1 A 3 3 PRO CA C 3 63.449 62.319 1.130 1
1 14 . 10 1 1 A 3 3 PRO CB C 3 31.938 31.497 0.441 1
1 17 . 10 1 1 A 4 4 SER H H 4 8.531 8.769 -0.238 1
1 18 . 10 1 1 A 4 4 SER HA H 4 4.262 4.673 -0.411 1
1 21 . 10 1 1 A 4 4 SER C C 4 175.414 174.420 0.994 1
1 22 . 10 1 1 A 4 4 SER CA C 4 59.163 58.014 1.149 1
1 23 . 10 1 1 A 4 4 SER CB C 4 63.242 62.751 0.491 1
1 24 . 10 1 1 A 4 4 SER N N 4 114.246 120.001 -5.755 1
1 25 . 10 1 1 A 5 5 LYS H H 5 8.468 7.856 0.612 1
1 26 . 10 1 1 A 5 5 LYS HA H 5 4.433 4.422 0.011 1
1 35 . 10 1 1 A 5 5 LYS C C 5 175.984 176.214 -0.230 1
1 36 . 10 1 1 A 5 5 LYS CA C 5 55.724 55.733 -0.009 1
1 37 . 10 1 1 A 5 5 LYS CB C 5 32.881 33.298 -0.417 1
1 41 . 10 1 1 A 5 5 LYS N N 5 123.488 120.058 3.430 1
1 42 . 10 1 1 A 6 6 LEU H H 6 7.707 7.445 0.262 1
1 43 . 10 1 1 A 6 6 LEU HA H 6 4.381 4.354 0.027 1
1 53 . 10 1 1 A 6 6 LEU C C 6 177.820 176.528 1.292 1
1 54 . 10 1 1 A 6 6 LEU CA C 6 55.507 55.194 0.313 1
1 55 . 10 1 1 A 6 6 LEU CB C 6 43.374 42.500 0.874 1
1 59 . 10 1 1 A 6 6 LEU N N 6 121.233 123.608 -2.375 1
1 60 . 10 1 1 A 7 7 SER H H 7 9.433 8.791 0.642 1
1 61 . 10 1 1 A 7 7 SER HA H 7 4.638 4.486 0.152 1
1 64 . 10 1 1 A 7 7 SER C C 7 174.120 174.845 -0.725 1
1 65 . 10 1 1 A 7 7 SER CA C 7 57.962 59.436 -1.474 1
1 66 . 10 1 1 A 7 7 SER CB C 7 64.197 63.607 0.590 1
1 67 . 10 1 1 A 7 7 SER N N 7 122.977 122.312 0.665 1
1 68 . 10 1 1 A 8 8 TYR H H 8 9.764 9.246 0.518 1
1 69 . 10 1 1 A 8 8 TYR HA H 8 4.732 4.259 0.473 1
1 76 . 10 1 1 A 8 8 TYR C C 8 177.206 177.516 -0.310 1
1 77 . 10 1 1 A 8 8 TYR CA C 8 58.762 61.807 -3.045 1
1 78 . 10 1 1 A 8 8 TYR CB C 8 36.605 38.853 -2.248 1
1 83 . 10 1 1 A 8 8 TYR N N 8 123.312 125.679 -2.367 1
1 84 . 10 1 1 A 9 9 GLY H H 9 10.131 8.372 1.759 1
1 85 . 10 1 1 A 9 9 GLY HA2 H 9 3.983 3.641 0.342 1
1 86 . 10 1 1 A 9 9 GLY HA3 H 9 3.423 3.726 -0.303 1
1 87 . 10 1 1 A 9 9 GLY C C 9 175.163 176.201 -1.038 1
1 88 . 10 1 1 A 9 9 GLY CA C 9 47.153 47.440 -0.287 1
1 89 . 10 1 1 A 9 9 GLY N N 9 107.177 105.896 1.281 1
1 90 . 10 1 1 A 10 10 GLU H H 10 7.876 7.973 -0.097 1
1 91 . 10 1 1 A 10 10 GLU HA H 10 4.107 4.081 0.026 1
1 96 . 10 1 1 A 10 10 GLU C C 10 179.924 179.010 0.914 1
1 97 . 10 1 1 A 10 10 GLU CA C 10 58.890 59.501 -0.611 1
1 98 . 10 1 1 A 10 10 GLU CB C 10 29.750 29.440 0.310 1
1 100 . 10 1 1 A 10 10 GLU N N 10 122.219 121.930 0.289 1
1 101 . 10 1 1 A 11 11 TYR H H 11 8.384 8.037 0.347 1
1 102 . 10 1 1 A 11 11 TYR HA H 11 4.305 4.167 0.138 1
1 107 . 10 1 1 A 11 11 TYR C C 11 176.854 176.757 0.097 1
1 108 . 10 1 1 A 11 11 TYR CA C 11 61.040 61.561 -0.521 1
1 109 . 10 1 1 A 11 11 TYR CB C 11 37.593 38.859 -1.266 1
1 112 . 10 1 1 A 11 11 TYR N N 11 120.809 122.479 -1.670 1
1 113 . 10 1 1 A 12 12 LEU H H 12 9.027 8.248 0.779 1
1 114 . 10 1 1 A 12 12 LEU HA H 12 3.778 3.764 0.014 1
1 124 . 10 1 1 A 12 12 LEU C C 12 178.621 179.591 -0.970 1
1 125 . 10 1 1 A 12 12 LEU CA C 12 57.534 57.525 0.009 1
1 126 . 10 1 1 A 12 12 LEU CB C 12 41.957 40.906 1.051 1
1 130 . 10 1 1 A 12 12 LEU N N 12 121.080 118.857 2.223 1
1 131 . 10 1 1 A 13 13 GLU H H 13 7.614 7.716 -0.102 1
1 132 . 10 1 1 A 13 13 GLU HA H 13 4.102 4.078 0.024 1
1 137 . 10 1 1 A 13 13 GLU C C 13 178.449 179.129 -0.680 1
1 138 . 10 1 1 A 13 13 GLU CA C 13 59.609 59.736 -0.127 1
1 139 . 10 1 1 A 13 13 GLU CB C 13 29.124 29.161 -0.037 1
1 141 . 10 1 1 A 13 13 GLU N N 13 118.475 120.326 -1.851 1
1 142 . 10 1 1 A 14 14 SER H H 14 7.329 7.504 -0.175 1
1 143 . 10 1 1 A 14 14 SER HA H 14 4.358 4.215 0.143 1
1 146 . 10 1 1 A 14 14 SER C C 14 176.794 176.714 0.080 1
1 147 . 10 1 1 A 14 14 SER CA C 14 61.064 61.431 -0.367 1
1 148 . 10 1 1 A 14 14 SER CB C 14 62.513 62.992 -0.479 1
1 149 . 10 1 1 A 14 14 SER N N 14 115.209 115.268 -0.059 1
1 150 . 10 1 1 A 15 15 TRP H H 15 8.870 8.107 0.763 1
1 151 . 10 1 1 A 15 15 TRP HA H 15 4.005 4.138 -0.133 1
1 160 . 10 1 1 A 15 15 TRP C C 15 177.547 177.774 -0.227 1
1 161 . 10 1 1 A 15 15 TRP CA C 15 61.210 61.191 0.019 1
1 162 . 10 1 1 A 15 15 TRP CB C 15 27.341 29.170 -1.829 1
1 168 . 10 1 1 A 15 15 TRP N N 15 124.998 123.750 1.248 1
1 170 . 10 1 1 A 16 16 PHE H H 16 9.087 8.197 0.890 1
1 171 . 10 1 1 A 16 16 PHE HA H 16 3.210 3.733 -0.523 1
1 179 . 10 1 1 A 16 16 PHE C C 16 175.909 177.310 -1.401 1
1 180 . 10 1 1 A 16 16 PHE CA C 16 61.473 61.416 0.057 1
1 181 . 10 1 1 A 16 16 PHE CB C 16 38.506 39.078 -0.572 1
1 187 . 10 1 1 A 16 16 PHE N N 16 119.825 121.158 -1.333 1
1 188 . 10 1 1 A 17 17 ASN H H 17 7.768 8.045 -0.277 1
1 189 . 10 1 1 A 17 17 ASN HA H 17 4.078 4.046 0.032 1
1 194 . 10 1 1 A 17 17 ASN C C 17 176.604 177.791 -1.187 1
1 195 . 10 1 1 A 17 17 ASN CA C 17 55.621 56.213 -0.592 1
1 196 . 10 1 1 A 17 17 ASN CB C 17 37.830 38.077 -0.247 1
1 197 . 10 1 1 A 17 17 ASN N N 17 115.600 117.181 -1.581 1
1 199 . 10 1 1 A 18 18 THR H H 18 7.454 7.454 0.000 1
1 200 . 10 1 1 A 18 18 THR HA H 18 4.147 3.787 0.360 1
1 205 . 10 1 1 A 18 18 THR C C 18 175.692 175.995 -0.303 1
1 206 . 10 1 1 A 18 18 THR CA C 18 64.679 66.856 -2.177 1
1 207 . 10 1 1 A 18 18 THR CB C 18 68.940 67.868 1.072 1
1 209 . 10 1 1 A 18 18 THR N N 18 113.049 116.929 -3.880 1
1 210 . 10 1 1 A 19 19 LYS H H 19 7.918 7.757 0.161 1
1 211 . 10 1 1 A 19 19 LYS HA H 19 3.791 3.544 0.247 1
1 220 . 10 1 1 A 19 19 LYS C C 19 178.120 178.318 -0.198 1
1 221 . 10 1 1 A 19 19 LYS CA C 19 55.985 58.992 -3.007 1
1 222 . 10 1 1 A 19 19 LYS CB C 19 31.130 31.260 -0.130 1
1 226 . 10 1 1 A 19 19 LYS N N 19 122.614 120.498 2.116 1
1 227 . 10 1 1 A 20 20 ARG H H 20 7.845 7.642 0.203 1
1 228 . 10 1 1 A 20 20 ARG HA H 20 3.396 3.817 -0.421 1
1 236 . 10 1 1 A 20 20 ARG C C 20 175.601 178.427 -2.826 1
1 237 . 10 1 1 A 20 20 ARG CA C 20 58.182 59.027 -0.845 1
1 238 . 10 1 1 A 20 20 ARG CB C 20 28.045 29.834 -1.789 1
1 241 . 10 1 1 A 20 20 ARG N N 20 116.282 118.136 -1.854 1
1 243 . 10 1 1 A 21 21 HIS H H 21 7.163 7.420 -0.257 1
1 244 . 10 1 1 A 21 21 HIS HA H 21 4.500 4.366 0.134 1
1 249 . 10 1 1 A 21 21 HIS C C 21 175.618 176.088 -0.470 1
1 250 . 10 1 1 A 21 21 HIS CA C 21 56.912 58.874 -1.962 1
1 251 . 10 1 1 A 21 21 HIS CB C 21 29.400 30.169 -0.769 1
1 254 . 10 1 1 A 21 21 HIS N N 21 115.452 118.312 -2.860 1
1 255 . 10 1 1 A 22 22 SER H H 22 7.951 7.670 0.281 1
1 256 . 10 1 1 A 22 22 SER HA H 22 4.573 4.394 0.179 1
1 259 . 10 1 1 A 22 22 SER C C 22 173.948 174.073 -0.125 1
1 260 . 10 1 1 A 22 22 SER CA C 22 58.589 58.817 -0.228 1
1 261 . 10 1 1 A 22 22 SER CB C 22 64.228 64.157 0.071 1
1 262 . 10 1 1 A 22 22 SER N N 22 113.209 112.550 0.659 1
1 263 . 10 1 1 A 23 23 VAL H H 23 7.179 7.126 0.053 1
1 264 . 10 1 1 A 23 23 VAL HA H 23 4.626 4.700 -0.074 1
1 272 . 10 1 1 A 23 23 VAL C C 23 175.397 175.271 0.126 1
1 273 . 10 1 1 A 23 23 VAL CA C 23 59.556 59.795 -0.239 1
1 274 . 10 1 1 A 23 23 VAL CB C 23 33.810 34.958 -1.148 1
1 277 . 10 1 1 A 23 23 VAL N N 23 113.108 117.206 -4.098 1
1 278 . 10 1 1 A 24 24 GLY H H 24 8.189 8.485 -0.296 1
1 279 . 10 1 1 A 24 24 GLY HA2 H 24 4.074 4.042 0.032 1
1 280 . 10 1 1 A 24 24 GLY HA3 H 24 4.195 4.060 0.135 1
1 281 . 10 1 1 A 24 24 GLY C C 24 174.037 174.863 -0.826 1
1 282 . 10 1 1 A 24 24 GLY CA C 24 44.452 45.584 -1.132 1
1 283 . 10 1 1 A 24 24 GLY N N 24 108.374 108.482 -0.108 1
1 284 . 10 1 1 A 25 25 ILE H H 25 8.331 8.590 -0.259 1
1 285 . 10 1 1 A 25 25 ILE HA H 25 3.839 3.582 0.257 1
1 295 . 10 1 1 A 25 25 ILE C C 25 178.042 177.643 0.399 1
1 296 . 10 1 1 A 25 25 ILE CA C 25 64.238 64.399 -0.161 1
1 297 . 10 1 1 A 25 25 ILE CB C 25 37.931 37.411 0.520 1
1 301 . 10 1 1 A 25 25 ILE N N 25 119.895 122.867 -2.972 1
1 302 . 10 1 1 A 26 26 GLN H H 26 8.545 8.593 -0.048 1
1 303 . 10 1 1 A 26 26 GLN HA H 26 4.129 4.039 0.090 1
1 310 . 10 1 1 A 26 26 GLN C C 26 178.454 177.556 0.898 1
1 311 . 10 1 1 A 26 26 GLN CA C 26 58.772 58.061 0.711 1
1 312 . 10 1 1 A 26 26 GLN CB C 26 27.346 27.651 -0.305 1
1 314 . 10 1 1 A 26 26 GLN N N 26 120.013 119.984 0.029 1
1 316 . 10 1 1 A 27 27 THR H H 27 7.944 7.862 0.082 1
1 317 . 10 1 1 A 27 27 THR HA H 27 3.953 3.932 0.021 1
1 322 . 10 1 1 A 27 27 THR C C 27 175.818 175.932 -0.114 1
1 323 . 10 1 1 A 27 27 THR CA C 27 65.855 66.323 -0.468 1
1 324 . 10 1 1 A 27 27 THR CB C 27 68.127 68.678 -0.551 1
1 326 . 10 1 1 A 27 27 THR N N 27 117.645 116.878 0.767 1
1 327 . 10 1 1 A 28 28 ALA H H 28 8.593 8.229 0.364 1
1 328 . 10 1 1 A 28 28 ALA HA H 28 3.899 4.009 -0.110 1
1 332 . 10 1 1 A 28 28 ALA C C 28 178.515 179.724 -1.209 1
1 333 . 10 1 1 A 28 28 ALA CA C 28 55.742 55.513 0.229 1
1 334 . 10 1 1 A 28 28 ALA CB C 28 17.513 18.086 -0.573 1
1 335 . 10 1 1 A 28 28 ALA N N 28 123.917 123.678 0.239 1
1 336 . 10 1 1 A 29 29 LYS H H 29 7.800 7.903 -0.103 1
1 337 . 10 1 1 A 29 29 LYS HA H 29 3.982 3.953 0.029 1
1 346 . 10 1 1 A 29 29 LYS C C 29 179.527 178.798 0.729 1
1 347 . 10 1 1 A 29 29 LYS CA C 29 59.761 59.745 0.016 1
1 348 . 10 1 1 A 29 29 LYS CB C 29 32.223 32.316 -0.093 1
1 352 . 10 1 1 A 29 29 LYS N N 29 117.474 118.997 -1.523 1
1 353 . 10 1 1 A 30 30 VAL H H 30 7.591 7.694 -0.103 1
1 354 . 10 1 1 A 30 30 VAL HA H 30 3.503 3.361 0.142 1
1 362 . 10 1 1 A 30 30 VAL C C 30 178.389 177.929 0.460 1
1 363 . 10 1 1 A 30 30 VAL CA C 30 65.640 65.580 0.060 1
1 364 . 10 1 1 A 30 30 VAL CB C 30 31.644 31.642 0.002 1
1 367 . 10 1 1 A 30 30 VAL N N 30 121.749 120.320 1.429 1
1 368 . 10 1 1 A 31 31 LEU H H 31 8.333 7.968 0.365 1
1 369 . 10 1 1 A 31 31 LEU HA H 31 4.074 4.059 0.015 1
1 379 . 10 1 1 A 31 31 LEU C C 31 177.780 179.117 -1.337 1
1 380 . 10 1 1 A 31 31 LEU CA C 31 58.157 58.026 0.131 1
1 381 . 10 1 1 A 31 31 LEU CB C 31 42.230 41.103 1.127 1
1 385 . 10 1 1 A 31 31 LEU N N 31 120.901 120.000 0.901 1
1 386 . 10 1 1 A 32 32 LYS H H 32 8.562 8.048 0.514 1
1 387 . 10 1 1 A 32 32 LYS HA H 32 3.290 3.849 -0.559 1
1 395 . 10 1 1 A 32 32 LYS C C 32 178.037 178.621 -0.584 1
1 396 . 10 1 1 A 32 32 LYS CA C 32 58.911 59.567 -0.656 1
1 397 . 10 1 1 A 32 32 LYS CB C 32 31.605 31.384 0.221 1
1 401 . 10 1 1 A 32 32 LYS N N 32 119.075 119.474 -0.399 1
1 402 . 10 1 1 A 33 33 GLY H H 33 7.694 7.903 -0.209 1
1 403 . 10 1 1 A 33 33 GLY HA2 H 33 3.949 3.552 0.397 1
1 404 . 10 1 1 A 33 33 GLY HA3 H 33 3.826 3.640 0.186 1
1 405 . 10 1 1 A 33 33 GLY C C 33 177.101 176.575 0.526 1
1 406 . 10 1 1 A 33 33 GLY CA C 33 46.928 47.064 -0.136 1
1 407 . 10 1 1 A 33 33 GLY N N 33 105.282 106.691 -1.409 1
1 408 . 10 1 1 A 34 34 TYR H H 34 8.015 7.499 0.516 1
1 409 . 10 1 1 A 34 34 TYR HA H 34 4.558 4.697 -0.139 1
1 416 . 10 1 1 A 34 34 TYR C C 34 179.611 178.168 1.443 1
1 417 . 10 1 1 A 34 34 TYR CA C 34 59.349 59.833 -0.484 1
1 418 . 10 1 1 A 34 34 TYR CB C 34 37.344 38.008 -0.664 1
1 423 . 10 1 1 A 34 34 TYR N N 34 121.781 121.843 -0.062 1
1 424 . 10 1 1 A 35 35 LEU H H 35 8.689 8.353 0.336 1
1 425 . 10 1 1 A 35 35 LEU HA H 35 3.977 3.911 0.066 1
1 435 . 10 1 1 A 35 35 LEU C C 35 177.081 178.953 -1.872 1
1 436 . 10 1 1 A 35 35 LEU CA C 35 59.155 58.432 0.723 1
1 437 . 10 1 1 A 35 35 LEU CB C 35 41.103 41.855 -0.752 1
1 441 . 10 1 1 A 35 35 LEU N N 35 120.392 120.496 -0.104 1
1 442 . 10 1 1 A 36 36 ASN H H 36 8.721 8.269 0.452 1
1 443 . 10 1 1 A 36 36 ASN HA H 36 4.435 4.517 -0.082 1
1 448 . 10 1 1 A 36 36 ASN C C 36 176.792 177.232 -0.440 1
1 449 . 10 1 1 A 36 36 ASN CA C 36 55.642 55.758 -0.116 1
1 450 . 10 1 1 A 36 36 ASN CB C 36 38.319 38.531 -0.212 1
1 451 . 10 1 1 A 36 36 ASN N N 36 114.623 116.296 -1.673 1
1 453 . 10 1 1 A 37 37 SER H H 37 8.511 7.909 0.602 1
1 454 . 10 1 1 A 37 37 SER HA H 37 4.642 4.410 0.232 1
1 457 . 10 1 1 A 37 37 SER C C 37 175.039 176.288 -1.249 1
1 458 . 10 1 1 A 37 37 SER CA C 37 59.825 61.239 -1.414 1
1 459 . 10 1 1 A 37 37 SER CB C 37 64.056 63.154 0.902 1
1 460 . 10 1 1 A 37 37 SER N N 37 110.941 115.568 -4.627 1
1 461 . 10 1 1 A 38 38 ARG H H 38 7.242 8.024 -0.782 1
1 462 . 10 1 1 A 38 38 ARG HA H 38 4.919 4.434 0.485 1
1 469 . 10 1 1 A 38 38 ARG C C 38 176.514 178.286 -1.772 1
1 470 . 10 1 1 A 38 38 ARG CA C 38 56.687 58.053 -1.366 1
1 471 . 10 1 1 A 38 38 ARG CB C 38 32.434 31.344 1.090 1
1 474 . 10 1 1 A 38 38 ARG N N 38 117.062 120.328 -3.266 1
1 475 . 10 1 1 A 39 39 ILE H H 39 8.462 7.951 0.511 1
1 476 . 10 1 1 A 39 39 ILE HA H 39 3.618 3.991 -0.373 1
1 486 . 10 1 1 A 39 39 ILE C C 39 176.267 178.391 -2.124 1
1 487 . 10 1 1 A 39 39 ILE CA C 39 66.134 64.823 1.311 1
1 488 . 10 1 1 A 39 39 ILE CB C 39 39.787 37.561 2.226 1
1 492 . 10 1 1 A 39 39 ILE N N 39 121.214 120.513 0.701 1
1 493 . 10 1 1 A 40 40 ILE H H 40 9.339 8.167 1.172 1
1 494 . 10 1 1 A 40 40 ILE HA H 40 3.401 3.777 -0.376 1
1 504 . 10 1 1 A 40 40 ILE CA C 40 67.844 66.311 1.533 1
1 505 . 10 1 1 A 40 40 ILE CB C 40 34.406 35.203 -0.797 1
1 509 . 10 1 1 A 40 40 ILE N N 40 119.695 121.670 -1.975 1
1 510 . 10 1 1 A 41 41 PRO HA H 41 4.314 4.424 -0.110 1
1 517 . 10 1 1 A 41 41 PRO C C 41 177.418 178.731 -1.313 1
1 518 . 10 1 1 A 41 41 PRO CA C 41 65.912 65.310 0.602 1
1 519 . 10 1 1 A 41 41 PRO CB C 41 30.686 31.392 -0.706 1
1 522 . 10 1 1 A 42 42 SER H H 42 6.857 8.001 -1.144 1
1 523 . 10 1 1 A 42 42 SER HA H 42 4.558 4.487 0.071 1
1 526 . 10 1 1 A 42 42 SER C C 42 174.813 176.262 -1.449 1
1 527 . 10 1 1 A 42 42 SER CA C 42 61.279 60.518 0.761 1
1 528 . 10 1 1 A 42 42 SER CB C 42 64.285 64.328 -0.043 1
1 529 . 10 1 1 A 42 42 SER N N 42 108.994 112.939 -3.945 1
1 530 . 10 1 1 A 43 43 LEU H H 43 8.230 8.202 0.028 1
1 531 . 10 1 1 A 43 43 LEU HA H 43 4.572 4.436 0.136 1
1 541 . 10 1 1 A 43 43 LEU C C 43 177.301 178.332 -1.031 1
1 542 . 10 1 1 A 43 43 LEU CA C 43 54.113 54.937 -0.824 1
1 543 . 10 1 1 A 43 43 LEU CB C 43 44.800 42.310 2.490 1
1 547 . 10 1 1 A 43 43 LEU N N 43 118.715 120.050 -1.335 1
1 548 . 10 1 1 A 44 44 GLY H H 44 8.498 7.899 0.599 1
1 549 . 10 1 1 A 44 44 GLY HA2 H 44 4.010 3.853 0.157 1
1 550 . 10 1 1 A 44 44 GLY HA3 H 44 3.613 3.873 -0.260 1
1 551 . 10 1 1 A 44 44 GLY C C 44 174.178 175.815 -1.637 1
1 552 . 10 1 1 A 44 44 GLY CA C 44 46.271 47.366 -1.095 1
1 553 . 10 1 1 A 44 44 GLY N N 44 105.371 107.957 -2.586 1
1 554 . 10 1 1 A 45 45 ASN H H 45 8.385 7.986 0.399 1
1 555 . 10 1 1 A 45 45 ASN HA H 45 4.789 4.815 -0.026 1
1 560 . 10 1 1 A 45 45 ASN C C 45 175.386 176.140 -0.754 1
1 561 . 10 1 1 A 45 45 ASN CA C 45 53.144 53.758 -0.614 1
1 562 . 10 1 1 A 45 45 ASN CB C 45 37.928 39.085 -1.157 1
1 563 . 10 1 1 A 45 45 ASN N N 45 114.387 117.627 -3.240 1
1 565 . 10 1 1 A 46 46 ILE H H 46 7.465 7.419 0.046 1
1 566 . 10 1 1 A 46 46 ILE HA H 46 3.856 4.055 -0.199 1
1 576 . 10 1 1 A 46 46 ILE C C 46 175.997 176.135 -0.138 1
1 577 . 10 1 1 A 46 46 ILE CA C 46 60.853 61.911 -1.058 1
1 578 . 10 1 1 A 46 46 ILE CB C 46 38.042 38.291 -0.249 1
1 582 . 10 1 1 A 46 46 ILE N N 46 123.998 121.577 2.421 1
1 583 . 10 1 1 A 47 47 LYS H H 47 8.717 8.684 0.033 1
1 584 . 10 1 1 A 47 47 LYS HA H 47 4.249 4.318 -0.069 1
1 591 . 10 1 1 A 47 47 LYS C C 47 177.583 177.661 -0.078 1
1 592 . 10 1 1 A 47 47 LYS CA C 47 56.320 56.922 -0.602 1
1 593 . 10 1 1 A 47 47 LYS CB C 47 30.393 32.729 -2.336 1
1 596 . 10 1 1 A 47 47 LYS N N 47 126.114 124.956 1.158 1
1 597 . 10 1 1 A 48 48 LEU H H 48 8.323 8.772 -0.449 1
1 598 . 10 1 1 A 48 48 LEU HA H 48 3.691 3.967 -0.276 1
1 608 . 10 1 1 A 48 48 LEU C C 48 177.274 178.290 -1.016 1
1 609 . 10 1 1 A 48 48 LEU CA C 48 58.443 58.433 0.010 1
1 610 . 10 1 1 A 48 48 LEU CB C 48 42.282 41.219 1.063 1
1 614 . 10 1 1 A 48 48 LEU N N 48 125.857 125.951 -0.094 1
1 615 . 10 1 1 A 49 49 ALA H H 49 8.929 8.083 0.846 1
1 616 . 10 1 1 A 49 49 ALA HA H 49 4.067 4.016 0.051 1
1 620 . 10 1 1 A 49 49 ALA C C 49 177.468 178.399 -0.931 1
1 621 . 10 1 1 A 49 49 ALA CA C 49 53.092 54.639 -1.547 1
1 622 . 10 1 1 A 49 49 ALA CB C 49 18.562 18.086 0.476 1
1 623 . 10 1 1 A 49 49 ALA N N 49 115.543 120.022 -4.479 1
1 624 . 10 1 1 A 50 50 LYS H H 50 7.684 7.407 0.277 1
1 625 . 10 1 1 A 50 50 LYS HA H 50 4.395 4.272 0.123 1
1 634 . 10 1 1 A 50 50 LYS C C 50 174.958 176.798 -1.840 1
1 635 . 10 1 1 A 50 50 LYS CA C 50 53.977 56.889 -2.912 1
1 636 . 10 1 1 A 50 50 LYS CB C 50 32.645 32.911 -0.266 1
1 640 . 10 1 1 A 50 50 LYS N N 50 114.788 114.744 0.044 1
1 641 . 10 1 1 A 51 51 LEU H H 51 6.776 7.231 -0.455 1
1 642 . 10 1 1 A 51 51 LEU HA H 51 4.569 4.285 0.284 1
1 652 . 10 1 1 A 51 51 LEU C C 51 177.953 175.591 2.362 1
1 653 . 10 1 1 A 51 51 LEU CA C 51 55.318 55.488 -0.170 1
1 654 . 10 1 1 A 51 51 LEU CB C 51 43.182 41.288 1.894 1
1 658 . 10 1 1 A 51 51 LEU N N 51 121.408 122.462 -1.054 1
1 659 . 10 1 1 A 52 52 THR H H 52 10.680 7.932 2.748 1
1 660 . 10 1 1 A 52 52 THR HA H 52 4.938 4.686 0.252 1
1 665 . 10 1 1 A 52 52 THR C C 52 175.553 174.206 1.347 1
1 666 . 10 1 1 A 52 52 THR CA C 52 59.740 59.306 0.434 1
1 667 . 10 1 1 A 52 52 THR CB C 52 73.557 71.025 2.532 1
1 669 . 10 1 1 A 52 52 THR N N 52 119.481 119.037 0.444 1
1 670 . 10 1 1 A 53 53 SER H H 53 9.278 8.999 0.279 1
1 671 . 10 1 1 A 53 53 SER HA H 53 4.261 4.178 0.083 1
1 674 . 10 1 1 A 53 53 SER C C 53 176.990 176.231 0.759 1
1 675 . 10 1 1 A 53 53 SER CA C 53 61.025 61.157 -0.132 1
1 676 . 10 1 1 A 53 53 SER CB C 53 62.312 62.920 -0.608 1
1 677 . 10 1 1 A 53 53 SER N N 53 116.343 121.736 -5.393 1
1 678 . 10 1 1 A 54 54 LEU H H 54 7.808 8.065 -0.257 1
1 679 . 10 1 1 A 54 54 LEU HA H 54 4.229 4.107 0.122 1
1 688 . 10 1 1 A 54 54 LEU C C 54 178.505 178.647 -0.142 1
1 689 . 10 1 1 A 54 54 LEU CA C 54 57.719 58.118 -0.399 1
1 690 . 10 1 1 A 54 54 LEU CB C 54 40.997 41.782 -0.785 1
1 694 . 10 1 1 A 54 54 LEU N N 54 126.055 123.329 2.726 1
1 695 . 10 1 1 A 55 55 HIS H H 55 7.798 8.268 -0.470 1
1 696 . 10 1 1 A 55 55 HIS HA H 55 4.311 4.274 0.037 1
1 701 . 10 1 1 A 55 55 HIS C C 55 180.044 177.593 2.451 1
1 702 . 10 1 1 A 55 55 HIS CA C 55 60.583 60.091 0.492 1
1 703 . 10 1 1 A 55 55 HIS CB C 55 31.445 29.830 1.615 1
1 706 . 10 1 1 A 55 55 HIS N N 55 118.683 117.811 0.872 1
1 707 . 10 1 1 A 56 56 MET H H 56 7.375 8.137 -0.762 1
1 708 . 10 1 1 A 56 56 MET HA H 56 4.513 4.015 0.498 1
1 716 . 10 1 1 A 56 56 MET C C 56 177.169 178.584 -1.415 1
1 717 . 10 1 1 A 56 56 MET CA C 56 55.823 59.218 -3.395 1
1 718 . 10 1 1 A 56 56 MET CB C 56 31.303 33.176 -1.873 1
1 721 . 10 1 1 A 56 56 MET N N 56 114.530 117.738 -3.208 1
1 722 . 10 1 1 A 57 57 GLN H H 57 8.387 8.277 0.110 1
1 723 . 10 1 1 A 57 57 GLN HA H 57 3.981 4.014 -0.033 1
1 730 . 10 1 1 A 57 57 GLN C C 57 178.033 178.416 -0.383 1
1 731 . 10 1 1 A 57 57 GLN CA C 57 57.922 59.260 -1.338 1
1 732 . 10 1 1 A 57 57 GLN CB C 57 29.012 28.449 0.563 1
1 734 . 10 1 1 A 57 57 GLN N N 57 120.713 119.698 1.015 1
1 736 . 10 1 1 A 58 58 ASN H H 58 8.765 8.540 0.225 1
1 737 . 10 1 1 A 58 58 ASN HA H 58 4.539 4.416 0.123 1
1 742 . 10 1 1 A 58 58 ASN C C 58 178.084 177.788 0.296 1
1 743 . 10 1 1 A 58 58 ASN CA C 58 55.345 56.422 -1.077 1
1 744 . 10 1 1 A 58 58 ASN CB C 58 36.924 37.781 -0.857 1
1 745 . 10 1 1 A 58 58 ASN N N 58 117.390 118.063 -0.673 1
1 747 . 10 1 1 A 59 59 TYR H H 59 8.239 7.913 0.326 1
1 748 . 10 1 1 A 59 59 TYR HA H 59 4.586 4.165 0.421 1
1 755 . 10 1 1 A 59 59 TYR C C 59 178.015 177.039 0.976 1
1 756 . 10 1 1 A 59 59 TYR CA C 59 60.779 61.580 -0.801 1
1 757 . 10 1 1 A 59 59 TYR CB C 59 38.047 38.757 -0.710 1
1 762 . 10 1 1 A 59 59 TYR N N 59 122.335 122.544 -0.209 1
1 763 . 10 1 1 A 60 60 VAL H H 60 8.416 8.389 0.027 1
1 764 . 10 1 1 A 60 60 VAL HA H 60 3.244 3.500 -0.256 1
1 772 . 10 1 1 A 60 60 VAL C C 60 177.309 178.192 -0.883 1
1 773 . 10 1 1 A 60 60 VAL CA C 60 67.022 66.388 0.634 1
1 774 . 10 1 1 A 60 60 VAL CB C 60 30.929 31.370 -0.441 1
1 777 . 10 1 1 A 60 60 VAL N N 60 119.842 119.441 0.401 1
1 778 . 10 1 1 A 61 61 ASN H H 61 8.264 8.137 0.127 1
1 779 . 10 1 1 A 61 61 ASN HA H 61 4.305 4.446 -0.141 1
1 784 . 10 1 1 A 61 61 ASN C C 61 177.263 177.928 -0.665 1
1 785 . 10 1 1 A 61 61 ASN CA C 61 55.548 56.311 -0.763 1
1 786 . 10 1 1 A 61 61 ASN CB C 61 36.645 37.612 -0.967 1
1 787 . 10 1 1 A 61 61 ASN N N 61 119.103 120.212 -1.109 1
1 789 . 10 1 1 A 62 62 SER H H 62 8.143 7.616 0.527 1
1 790 . 10 1 1 A 62 62 SER HA H 62 4.343 4.165 0.178 1
1 793 . 10 1 1 A 62 62 SER C C 62 176.409 176.487 -0.078 1
1 794 . 10 1 1 A 62 62 SER CA C 62 61.612 62.055 -0.443 1
1 795 . 10 1 1 A 62 62 SER CB C 62 62.219 62.759 -0.540 1
1 796 . 10 1 1 A 62 62 SER N N 62 118.254 116.361 1.893 1
1 797 . 10 1 1 A 63 63 LEU H H 63 7.664 7.944 -0.280 1
1 798 . 10 1 1 A 63 63 LEU HA H 63 4.003 3.896 0.107 1
1 808 . 10 1 1 A 63 63 LEU C C 63 178.748 178.949 -0.201 1
1 809 . 10 1 1 A 63 63 LEU CA C 63 57.171 58.052 -0.881 1
1 810 . 10 1 1 A 63 63 LEU CB C 63 41.134 41.281 -0.147 1
1 814 . 10 1 1 A 63 63 LEU N N 63 123.812 121.260 2.552 1
1 815 . 10 1 1 A 64 64 ARG H H 64 7.969 7.823 0.146 1
1 816 . 10 1 1 A 64 64 ARG HA H 64 4.038 3.950 0.088 1
1 824 . 10 1 1 A 64 64 ARG C C 64 180.797 177.988 2.809 1
1 825 . 10 1 1 A 64 64 ARG CA C 64 58.598 59.391 -0.793 1
1 826 . 10 1 1 A 64 64 ARG CB C 64 28.849 29.835 -0.986 1
1 829 . 10 1 1 A 64 64 ARG N N 64 120.376 119.837 0.539 1
1 831 . 10 1 1 A 65 65 ASP H H 65 8.465 8.072 0.393 1
1 832 . 10 1 1 A 65 65 ASP HA H 65 4.408 4.366 0.042 1
1 835 . 10 1 1 A 65 65 ASP C C 65 177.336 178.484 -1.148 1
1 836 . 10 1 1 A 65 65 ASP CA C 65 56.957 57.516 -0.559 1
1 837 . 10 1 1 A 65 65 ASP CB C 65 39.602 41.053 -1.451 1
1 838 . 10 1 1 A 65 65 ASP N N 65 122.402 119.952 2.450 1
1 839 . 10 1 1 A 66 66 GLU H H 66 7.703 7.829 -0.126 1
1 840 . 10 1 1 A 66 66 GLU HA H 66 4.213 4.253 -0.040 1
1 845 . 10 1 1 A 66 66 GLU C C 66 176.586 177.408 -0.822 1
1 846 . 10 1 1 A 66 66 GLU CA C 66 56.974 56.442 0.532 1
1 847 . 10 1 1 A 66 66 GLU CB C 66 29.821 29.928 -0.107 1
1 849 . 10 1 1 A 66 66 GLU N N 66 119.076 115.899 3.177 1
1 850 . 10 1 1 A 67 67 GLY H H 67 7.861 7.552 0.309 1
1 851 . 10 1 1 A 67 67 GLY HA2 H 67 4.269 3.943 0.326 1
1 852 . 10 1 1 A 67 67 GLY HA3 H 67 3.731 3.947 -0.216 1
1 853 . 10 1 1 A 67 67 GLY C C 67 174.614 175.022 -0.408 1
1 854 . 10 1 1 A 67 67 GLY CA C 67 44.608 46.456 -1.848 1
1 855 . 10 1 1 A 67 67 GLY N N 67 105.730 109.354 -3.624 1
1 856 . 10 1 1 A 68 68 LEU H H 68 7.324 7.934 -0.610 1
1 857 . 10 1 1 A 68 68 LEU HA H 68 4.257 4.189 0.068 1
1 867 . 10 1 1 A 68 68 LEU C C 68 176.136 177.280 -1.144 1
1 868 . 10 1 1 A 68 68 LEU CA C 68 55.659 54.859 0.800 1
1 869 . 10 1 1 A 68 68 LEU CB C 68 41.874 42.120 -0.246 1
1 873 . 10 1 1 A 68 68 LEU N N 68 121.062 120.881 0.181 1
1 874 . 10 1 1 A 69 69 LYS H H 69 8.368 8.503 -0.135 1
1 875 . 10 1 1 A 69 69 LYS HA H 69 4.281 4.583 -0.302 1
1 884 . 10 1 1 A 69 69 LYS C C 69 177.940 177.894 0.046 1
1 885 . 10 1 1 A 69 69 LYS CA C 69 55.412 55.151 0.261 1
1 886 . 10 1 1 A 69 69 LYS CB C 69 32.761 33.415 -0.654 1
1 890 . 10 1 1 A 69 69 LYS N N 69 120.120 122.286 -2.166 1
1 891 . 10 1 1 A 70 70 ARG H H 70 9.095 8.871 0.224 1
1 892 . 10 1 1 A 70 70 ARG HA H 70 3.684 4.113 -0.429 1
1 900 . 10 1 1 A 70 70 ARG C C 70 177.712 178.666 -0.954 1
1 901 . 10 1 1 A 70 70 ARG CA C 70 60.216 58.582 1.634 1
1 902 . 10 1 1 A 70 70 ARG CB C 70 29.539 30.040 -0.501 1
1 905 . 10 1 1 A 70 70 ARG N N 70 123.339 118.939 4.400 1
1 907 . 10 1 1 A 71 71 GLY H H 71 8.985 8.344 0.641 1
1 908 . 10 1 1 A 71 71 GLY HA2 H 71 3.932 3.701 0.231 1
1 909 . 10 1 1 A 71 71 GLY HA3 H 71 3.905 3.704 0.201 1
1 910 . 10 1 1 A 71 71 GLY C C 71 176.324 175.845 0.479 1
1 911 . 10 1 1 A 71 71 GLY CA C 71 46.752 47.438 -0.686 1
1 912 . 10 1 1 A 71 71 GLY N N 71 104.509 109.345 -4.836 1
1 913 . 10 1 1 A 72 72 THR H H 72 7.295 8.043 -0.748 1
1 914 . 10 1 1 A 72 72 THR HA H 72 4.014 3.943 0.071 1
1 919 . 10 1 1 A 72 72 THR C C 72 175.135 176.079 -0.944 1
1 920 . 10 1 1 A 72 72 THR CA C 72 65.848 66.527 -0.679 1
1 921 . 10 1 1 A 72 72 THR CB C 72 68.160 68.331 -0.171 1
1 923 . 10 1 1 A 72 72 THR N N 72 118.617 117.508 1.109 1
1 924 . 10 1 1 A 73 73 ILE H H 73 7.883 7.879 0.004 1
1 925 . 10 1 1 A 73 73 ILE HA H 73 3.258 3.536 -0.278 1
1 935 . 10 1 1 A 73 73 ILE C C 73 177.060 178.200 -1.140 1
1 936 . 10 1 1 A 73 73 ILE CA C 73 66.561 65.686 0.875 1
1 937 . 10 1 1 A 73 73 ILE CB C 73 37.339 37.772 -0.433 1
1 941 . 10 1 1 A 73 73 ILE N N 73 121.692 121.371 0.321 1
1 942 . 10 1 1 A 74 74 GLU H H 74 8.723 8.125 0.598 1
1 943 . 10 1 1 A 74 74 GLU HA H 74 3.807 3.867 -0.060 1
1 948 . 10 1 1 A 74 74 GLU C C 74 178.319 179.090 -0.771 1
1 949 . 10 1 1 A 74 74 GLU CA C 74 59.637 60.208 -0.571 1
1 950 . 10 1 1 A 74 74 GLU CB C 74 29.257 29.511 -0.254 1
1 952 . 10 1 1 A 74 74 GLU N N 74 117.701 120.807 -3.106 1
1 953 . 10 1 1 A 75 75 LYS H H 75 7.361 7.522 -0.161 1
1 954 . 10 1 1 A 75 75 LYS HA H 75 3.958 4.051 -0.093 1
1 963 . 10 1 1 A 75 75 LYS C C 75 178.554 179.305 -0.751 1
1 964 . 10 1 1 A 75 75 LYS CA C 75 59.764 59.351 0.413 1
1 965 . 10 1 1 A 75 75 LYS CB C 75 32.314 32.163 0.151 1
1 969 . 10 1 1 A 75 75 LYS N N 75 118.734 118.678 0.056 1
1 970 . 10 1 1 A 76 76 ILE H H 76 7.713 7.379 0.334 1
1 971 . 10 1 1 A 76 76 ILE HA H 76 3.221 3.768 -0.547 1
1 981 . 10 1 1 A 76 76 ILE C C 76 177.504 178.279 -0.775 1
1 982 . 10 1 1 A 76 76 ILE CA C 76 65.796 64.461 1.335 1
1 983 . 10 1 1 A 76 76 ILE CB C 76 37.732 36.961 0.771 1
1 987 . 10 1 1 A 76 76 ILE N N 76 120.312 116.653 3.659 1
1 988 . 10 1 1 A 77 77 ILE H H 77 8.587 8.208 0.379 1
1 989 . 10 1 1 A 77 77 ILE HA H 77 3.778 3.688 0.090 1
1 999 . 10 1 1 A 77 77 ILE C C 77 177.074 178.369 -1.295 1
1 1000 . 10 1 1 A 77 77 ILE CA C 77 63.168 64.852 -1.684 1
1 1001 . 10 1 1 A 77 77 ILE CB C 77 36.617 37.101 -0.484 1
1 1005 . 10 1 1 A 77 77 ILE N N 77 118.978 121.129 -2.151 1
1 1006 . 10 1 1 A 78 78 LYS H H 78 8.050 7.726 0.324 1
1 1007 . 10 1 1 A 78 78 LYS HA H 78 3.925 4.065 -0.140 1
1 1016 . 10 1 1 A 78 78 LYS C C 78 178.291 178.945 -0.654 1
1 1017 . 10 1 1 A 78 78 LYS CA C 78 60.192 59.113 1.079 1
1 1018 . 10 1 1 A 78 78 LYS CB C 78 31.886 31.918 -0.032 1
1 1022 . 10 1 1 A 78 78 LYS N N 78 121.618 119.528 2.090 1
1 1023 . 10 1 1 A 79 79 VAL H H 79 7.619 7.845 -0.226 1
1 1024 . 10 1 1 A 79 79 VAL HA H 79 3.846 3.732 0.114 1
1 1032 . 10 1 1 A 79 79 VAL C C 79 177.712 178.389 -0.677 1
1 1033 . 10 1 1 A 79 79 VAL CA C 79 66.494 66.429 0.065 1
1 1034 . 10 1 1 A 79 79 VAL CB C 79 31.298 31.676 -0.378 1
1 1037 . 10 1 1 A 79 79 VAL N N 79 120.254 119.689 0.565 1
1 1038 . 10 1 1 A 80 80 ILE H H 80 7.885 8.097 -0.212 1
1 1039 . 10 1 1 A 80 80 ILE HA H 80 3.367 3.716 -0.349 1
1 1049 . 10 1 1 A 80 80 ILE C C 80 179.892 178.075 1.817 1
1 1050 . 10 1 1 A 80 80 ILE CA C 80 65.343 65.234 0.109 1
1 1051 . 10 1 1 A 80 80 ILE CB C 80 38.129 37.758 0.371 1
1 1055 . 10 1 1 A 80 80 ILE N N 80 119.666 120.470 -0.804 1
1 1056 . 10 1 1 A 81 81 ARG H H 81 9.384 7.988 1.396 1
1 1057 . 10 1 1 A 81 81 ARG HA H 81 3.834 3.961 -0.127 1
1 1065 . 10 1 1 A 81 81 ARG C C 81 178.204 178.176 0.028 1
1 1066 . 10 1 1 A 81 81 ARG CA C 81 60.560 59.100 1.460 1
1 1067 . 10 1 1 A 81 81 ARG CB C 81 30.196 29.758 0.438 1
1 1070 . 10 1 1 A 81 81 ARG N N 81 121.030 121.352 -0.322 1
1 1072 . 10 1 1 A 82 82 ASN H H 82 8.773 7.925 0.848 1
1 1073 . 10 1 1 A 82 82 ASN HA H 82 4.587 4.545 0.042 1
1 1078 . 10 1 1 A 82 82 ASN C C 82 178.300 177.485 0.815 1
1 1079 . 10 1 1 A 82 82 ASN CA C 82 56.160 55.847 0.313 1
1 1080 . 10 1 1 A 82 82 ASN CB C 82 38.464 38.571 -0.107 1
1 1081 . 10 1 1 A 82 82 ASN N N 82 118.483 118.663 -0.180 1
1 1083 . 10 1 1 A 83 83 SER H H 83 8.526 7.962 0.564 1
1 1084 . 10 1 1 A 83 83 SER HA H 83 2.765 3.236 -0.471 1
1 1087 . 10 1 1 A 83 83 SER C C 83 176.386 177.750 -1.364 1
1 1088 . 10 1 1 A 83 83 SER CA C 83 61.245 60.817 0.428 1
1 1089 . 10 1 1 A 83 83 SER CB C 83 61.287 61.491 -0.204 1
1 1090 . 10 1 1 A 83 83 SER N N 83 118.286 115.340 2.946 1
1 1091 . 10 1 1 A 84 84 LEU H H 84 7.782 8.394 -0.612 1
1 1092 . 10 1 1 A 84 84 LEU HA H 84 4.221 4.017 0.204 1
1 1102 . 10 1 1 A 84 84 LEU C C 84 177.846 179.569 -1.723 1
1 1103 . 10 1 1 A 84 84 LEU CA C 84 57.166 58.004 -0.838 1
1 1104 . 10 1 1 A 84 84 LEU CB C 84 40.520 40.657 -0.137 1
1 1108 . 10 1 1 A 84 84 LEU N N 84 127.445 122.491 4.954 1
1 1109 . 10 1 1 A 85 85 GLU H H 85 8.264 8.423 -0.159 1
1 1110 . 10 1 1 A 85 85 GLU HA H 85 3.981 3.975 0.006 1
1 1115 . 10 1 1 A 85 85 GLU C C 85 179.288 179.209 0.079 1
1 1116 . 10 1 1 A 85 85 GLU CA C 85 59.025 60.112 -1.087 1
1 1117 . 10 1 1 A 85 85 GLU CB C 85 29.182 29.309 -0.127 1
1 1119 . 10 1 1 A 85 85 GLU N N 85 121.538 120.418 1.120 1
1 1120 . 10 1 1 A 86 86 HIS H H 86 7.683 8.042 -0.359 1
1 1121 . 10 1 1 A 86 86 HIS HA H 86 4.573 4.349 0.224 1
1 1125 . 10 1 1 A 86 86 HIS C C 86 175.484 177.750 -2.266 1
1 1126 . 10 1 1 A 86 86 HIS CA C 86 58.940 59.574 -0.634 1
1 1127 . 10 1 1 A 86 86 HIS CB C 86 29.267 29.980 -0.713 1
1 1129 . 10 1 1 A 86 86 HIS N N 86 117.087 120.340 -3.253 1
1 1130 . 10 1 1 A 87 87 ALA H H 87 7.197 8.017 -0.820 1
1 1131 . 10 1 1 A 87 87 ALA HA H 87 3.925 3.970 -0.045 1
1 1135 . 10 1 1 A 87 87 ALA C C 87 179.038 180.316 -1.278 1
1 1136 . 10 1 1 A 87 87 ALA CA C 87 54.863 55.000 -0.137 1
1 1137 . 10 1 1 A 87 87 ALA CB C 87 17.034 18.404 -1.370 1
1 1138 . 10 1 1 A 87 87 ALA N N 87 121.510 120.862 0.648 1
1 1139 . 10 1 1 A 88 88 ILE H H 88 7.819 7.622 0.197 1
1 1140 . 10 1 1 A 88 88 ILE HA H 88 4.067 3.977 0.090 1
1 1150 . 10 1 1 A 88 88 ILE C C 88 180.846 177.636 3.210 1
1 1151 . 10 1 1 A 88 88 ILE CA C 88 64.021 65.208 -1.187 1
1 1152 . 10 1 1 A 88 88 ILE CB C 88 37.557 37.701 -0.144 1
1 1156 . 10 1 1 A 88 88 ILE N N 88 120.898 119.416 1.482 1
1 1157 . 10 1 1 A 89 89 ASP H H 89 7.808 8.262 -0.454 1
1 1158 . 10 1 1 A 89 89 ASP HA H 89 4.437 4.373 0.064 1
1 1161 . 10 1 1 A 89 89 ASP C C 89 178.033 177.975 0.058 1
1 1162 . 10 1 1 A 89 89 ASP CA C 89 57.343 57.309 0.034 1
1 1163 . 10 1 1 A 89 89 ASP CB C 89 39.689 41.153 -1.464 1
1 1164 . 10 1 1 A 89 89 ASP N N 89 125.174 121.775 3.399 1
1 1165 . 10 1 1 A 90 90 LEU H H 90 7.607 7.689 -0.082 1
1 1166 . 10 1 1 A 90 90 LEU HA H 90 4.198 4.193 0.005 1
1 1176 . 10 1 1 A 90 90 LEU C C 90 175.416 175.952 -0.536 1
1 1177 . 10 1 1 A 90 90 LEU CA C 90 54.755 54.975 -0.220 1
1 1178 . 10 1 1 A 90 90 LEU CB C 90 42.960 42.203 0.757 1
1 1182 . 10 1 1 A 90 90 LEU N N 90 117.576 117.237 0.339 1
1 1183 . 10 1 1 A 91 91 GLU H H 91 8.143 7.990 0.153 1
1 1184 . 10 1 1 A 91 91 GLU HA H 91 4.005 4.094 -0.089 1
1 1189 . 10 1 1 A 91 91 GLU C C 91 175.792 176.123 -0.331 1
1 1190 . 10 1 1 A 91 91 GLU CA C 91 57.202 57.545 -0.343 1
1 1191 . 10 1 1 A 91 91 GLU CB C 91 26.125 26.724 -0.599 1
1 1193 . 10 1 1 A 91 91 GLU N N 91 113.620 114.966 -1.346 1
1 1194 . 10 1 1 A 92 92 LEU H H 92 8.290 7.961 0.329 1
1 1195 . 10 1 1 A 92 92 LEU HA H 92 4.216 4.077 0.139 1
1 1205 . 10 1 1 A 92 92 LEU C C 92 176.622 176.954 -0.332 1
1 1206 . 10 1 1 A 92 92 LEU CA C 92 56.410 56.963 -0.553 1
1 1207 . 10 1 1 A 92 92 LEU CB C 92 43.378 42.576 0.802 1
1 1211 . 10 1 1 A 92 92 LEU N N 92 116.868 119.233 -2.365 1
1 1212 . 10 1 1 A 93 93 ILE H H 93 6.988 7.068 -0.080 1
1 1213 . 10 1 1 A 93 93 ILE HA H 93 4.580 4.598 -0.018 1
1 1223 . 10 1 1 A 93 93 ILE C C 93 175.145 175.828 -0.683 1
1 1224 . 10 1 1 A 93 93 ILE CA C 93 58.707 58.537 0.170 1
1 1225 . 10 1 1 A 93 93 ILE CB C 93 42.864 41.340 1.524 1
1 1229 . 10 1 1 A 93 93 ILE N N 93 107.565 114.248 -6.683 1
1 1230 . 10 1 1 A 94 94 THR H H 94 8.742 8.711 0.031 1
1 1231 . 10 1 1 A 94 94 THR HA H 94 4.489 4.513 -0.024 1
1 1236 . 10 1 1 A 94 94 THR C C 94 173.875 173.777 0.098 1
1 1237 . 10 1 1 A 94 94 THR CA C 94 61.842 62.295 -0.453 1
1 1238 . 10 1 1 A 94 94 THR CB C 94 69.972 71.213 -1.241 1
1 1240 . 10 1 1 A 94 94 THR N N 94 107.904 116.396 -8.492 1
1 1241 . 10 1 1 A 95 95 LYS H H 95 7.294 7.424 -0.130 1
1 1242 . 10 1 1 A 95 95 LYS HA H 95 4.566 4.772 -0.206 1
1 1251 . 10 1 1 A 95 95 LYS C C 95 173.791 173.875 -0.084 1
1 1252 . 10 1 1 A 95 95 LYS CA C 95 54.533 56.009 -1.476 1
1 1253 . 10 1 1 A 95 95 LYS CB C 95 35.123 35.703 -0.580 1
1 1257 . 10 1 1 A 95 95 LYS N N 95 119.458 120.333 -0.875 1
1 1258 . 10 1 1 A 96 96 ASN H H 96 9.157 8.580 0.577 1
1 1259 . 10 1 1 A 96 96 ASN HA H 96 4.408 5.052 -0.644 1
1 1264 . 10 1 1 A 96 96 ASN C C 96 176.653 176.392 0.261 1
1 1265 . 10 1 1 A 96 96 ASN CA C 96 51.088 52.543 -1.455 1
1 1266 . 10 1 1 A 96 96 ASN CB C 96 37.292 39.556 -2.264 1
1 1267 . 10 1 1 A 96 96 ASN N N 96 121.031 124.020 -2.989 1
1 1269 . 10 1 1 A 97 97 VAL H H 97 8.193 8.484 -0.291 1
1 1270 . 10 1 1 A 97 97 VAL HA H 97 4.019 4.053 -0.034 1
1 1278 . 10 1 1 A 97 97 VAL C C 97 175.089 176.200 -1.111 1
1 1279 . 10 1 1 A 97 97 VAL CA C 97 63.437 63.038 0.399 1
1 1280 . 10 1 1 A 97 97 VAL CB C 97 29.934 31.891 -1.957 1
1 1283 . 10 1 1 A 97 97 VAL N N 97 118.839 119.988 -1.149 1
1 1284 . 10 1 1 A 98 98 ALA H H 98 7.994 7.787 0.207 1
1 1285 . 10 1 1 A 98 98 ALA HA H 98 5.108 4.179 0.929 1
1 1289 . 10 1 1 A 98 98 ALA C C 98 178.033 178.414 -0.381 1
1 1290 . 10 1 1 A 98 98 ALA CA C 98 50.342 53.190 -2.848 1
1 1291 . 10 1 1 A 98 98 ALA CB C 98 19.659 18.553 1.106 1
1 1292 . 10 1 1 A 98 98 ALA N N 98 121.031 125.110 -4.079 1
1 1293 . 10 1 1 A 99 99 ALA H H 99 7.347 7.557 -0.210 1
1 1294 . 10 1 1 A 99 99 ALA HA H 99 3.818 4.009 -0.191 1
1 1298 . 10 1 1 A 99 99 ALA C C 99 177.712 178.614 -0.902 1
1 1299 . 10 1 1 A 99 99 ALA CA C 99 55.117 54.692 0.425 1
1 1300 . 10 1 1 A 99 99 ALA CB C 99 18.879 18.473 0.406 1
1 1301 . 10 1 1 A 99 99 ALA N N 99 122.816 119.987 2.829 1
1 1302 . 10 1 1 A 100 100 LYS H H 100 8.190 7.519 0.671 1
1 1303 . 10 1 1 A 100 100 LYS HA H 100 4.483 4.331 0.152 1
1 1312 . 10 1 1 A 100 100 LYS C C 100 175.899 176.863 -0.964 1
1 1313 . 10 1 1 A 100 100 LYS CA C 100 54.231 57.346 -3.115 1
1 1314 . 10 1 1 A 100 100 LYS CB C 100 32.066 32.942 -0.876 1
1 1318 . 10 1 1 A 100 100 LYS N N 100 113.197 115.203 -2.006 1
1 1319 . 10 1 1 A 101 101 THR H H 101 7.128 7.739 -0.611 1
1 1320 . 10 1 1 A 101 101 THR HA H 101 3.834 4.373 -0.539 1
1 1325 . 10 1 1 A 101 101 THR C C 101 173.255 173.720 -0.465 1
1 1326 . 10 1 1 A 101 101 THR CA C 101 64.392 62.139 2.253 1
1 1327 . 10 1 1 A 101 101 THR CB C 101 69.160 67.821 1.339 1
1 1329 . 10 1 1 A 101 101 THR N N 101 118.368 116.266 2.102 1
1 1330 . 10 1 1 A 102 102 LYS H H 102 8.753 8.347 0.406 1
1 1331 . 10 1 1 A 102 102 LYS HA H 102 4.438 4.730 -0.292 1
1 1340 . 10 1 1 A 102 102 LYS C C 102 175.627 176.112 -0.485 1
1 1341 . 10 1 1 A 102 102 LYS CA C 102 55.117 55.406 -0.289 1
1 1342 . 10 1 1 A 102 102 LYS CB C 102 33.901 33.913 -0.012 1
1 1346 . 10 1 1 A 102 102 LYS N N 102 126.513 124.664 1.849 1
1 1347 . 10 1 1 A 103 103 LEU H H 103 8.602 8.264 0.338 1
1 1348 . 10 1 1 A 103 103 LEU HA H 103 4.486 4.413 0.073 1
1 1358 . 10 1 1 A 103 103 LEU CA C 103 52.233 53.195 -0.962 1
1 1359 . 10 1 1 A 103 103 LEU CB C 103 41.028 42.767 -1.739 1
1 1363 . 10 1 1 A 103 103 LEU N N 103 124.466 123.720 0.746 1
1 1364 . 10 1 1 A 104 104 PRO HA H 104 4.437 4.571 -0.134 1
1 1371 . 10 1 1 A 104 104 PRO C C 104 175.779 176.282 -0.503 1
1 1372 . 10 1 1 A 104 104 PRO CA C 104 62.322 62.543 -0.221 1
1 1373 . 10 1 1 A 104 104 PRO CB C 104 31.899 32.827 -0.928 1
1 1376 . 10 1 1 A 105 105 LYS H H 105 8.460 8.454 0.006 1
1 1377 . 10 1 1 A 105 105 LYS HA H 105 4.154 4.234 -0.080 1
1 1386 . 10 1 1 A 105 105 LYS C C 105 175.998 176.615 -0.617 1
1 1387 . 10 1 1 A 105 105 LYS CA C 105 56.480 56.481 -0.001 1
1 1388 . 10 1 1 A 105 105 LYS CB C 105 32.909 31.411 1.498 1
1 1392 . 10 1 1 A 105 105 LYS N N 105 122.139 120.147 1.992 1
1 1393 . 10 1 1 A 106 106 ALA H H 106 8.448 8.218 0.230 1
1 1394 . 10 1 1 A 106 106 ALA HA H 106 4.309 4.665 -0.356 1
1 1398 . 10 1 1 A 106 106 ALA C C 106 176.828 177.458 -0.630 1
1 1399 . 10 1 1 A 106 106 ALA CA C 106 51.862 51.724 0.138 1
1 1400 . 10 1 1 A 106 106 ALA CB C 106 19.323 21.015 -1.692 1
1 1401 . 10 1 1 A 106 106 ALA N N 106 125.278 122.311 2.967 1
1 1402 . 10 1 1 A 107 107 ASP H H 107 8.428 8.247 0.181 1
1 1403 . 10 1 1 A 107 107 ASP HA H 107 4.574 4.559 0.015 1
1 1406 . 10 1 1 A 107 107 ASP C C 107 175.951 174.998 0.953 1
1 1407 . 10 1 1 A 107 107 ASP CA C 107 54.214 56.299 -2.085 1
1 1408 . 10 1 1 A 107 107 ASP CB C 107 41.141 41.178 -0.037 1
1 1409 . 10 1 1 A 107 107 ASP N N 107 120.771 118.204 2.567 1
1 1410 . 10 1 1 A 108 108 LYS H H 108 8.329 7.994 0.335 1
1 1411 . 10 1 1 A 108 108 LYS HA H 108 4.203 4.762 -0.559 1
1 1420 . 10 1 1 A 108 108 LYS C C 108 176.483 176.376 0.107 1
1 1421 . 10 1 1 A 108 108 LYS CA C 108 56.831 54.553 2.278 1
1 1422 . 10 1 1 A 108 108 LYS CB C 108 32.648 36.073 -3.425 1
1 1426 . 10 1 1 A 108 108 LYS N N 108 120.727 116.610 4.117 1
1 1427 . 10 1 1 A 109 109 GLU H H 109 8.447 8.555 -0.108 1
1 1428 . 10 1 1 A 109 109 GLU HA H 109 4.215 4.436 -0.221 1
1 1433 . 10 1 1 A 109 109 GLU C C 109 176.513 176.285 0.228 1
1 1434 . 10 1 1 A 109 109 GLU CA C 109 56.936 55.880 1.056 1
1 1435 . 10 1 1 A 109 109 GLU CB C 109 29.833 28.013 1.820 1
1 1437 . 10 1 1 A 109 109 GLU N N 109 121.471 122.062 -0.591 1
1 1438 . 10 1 1 A 110 110 GLU H H 110 8.352 8.171 0.181 1
1 1439 . 10 1 1 A 110 110 GLU HA H 110 4.233 4.435 -0.202 1
1 1444 . 10 1 1 A 110 110 GLU C C 110 176.439 175.134 1.305 1
1 1445 . 10 1 1 A 110 110 GLU CA C 110 56.681 56.221 0.460 1
1 1446 . 10 1 1 A 110 110 GLU CB C 110 29.860 29.387 0.473 1
1 1448 . 10 1 1 A 110 110 GLU N N 110 121.559 124.135 -2.576 1
1 1449 . 10 1 1 A 111 111 LEU H H 111 8.145 7.908 0.237 1
1 1450 . 10 1 1 A 111 111 LEU HA H 111 4.251 3.870 0.381 1
1 1460 . 10 1 1 A 111 111 LEU C C 111 177.306 175.837 1.469 1
1 1461 . 10 1 1 A 111 111 LEU CA C 111 55.277 56.127 -0.850 1
1 1462 . 10 1 1 A 111 111 LEU CB C 111 42.054 40.107 1.947 1
1 1466 . 10 1 1 A 111 111 LEU N N 111 122.181 117.036 5.145 1
1 1467 . 10 1 1 A 112 112 GLU H H 112 8.212 8.207 0.005 1
1 1468 . 10 1 1 A 112 112 GLU N N 112 120.291 118.483 1.808 1
1 1469 . 10 1 1 A 114 114 HIS C C 114 176.070 175.660 0.410 1
1 1470 . 10 1 1 A 116 116 HIS H H 116 8.227 7.791 0.436 1
1 1471 . 10 1 1 A 116 116 HIS C C 116 173.580 175.024 -1.444 1
1 1472 . 10 1 1 A 116 116 HIS N N 116 119.156 114.934 4.222 1
1 5 . 11 1 1 A 3 3 PRO HA H 3 4.390 4.525 -0.135 1
1 12 . 11 1 1 A 3 3 PRO C C 3 176.847 176.174 0.673 1
1 13 . 11 1 1 A 3 3 PRO CA C 3 63.449 62.595 0.854 1
1 14 . 11 1 1 A 3 3 PRO CB C 3 31.938 32.927 -0.989 1
1 17 . 11 1 1 A 4 4 SER H H 4 8.531 8.527 0.004 1
1 18 . 11 1 1 A 4 4 SER HA H 4 4.262 4.405 -0.143 1
1 21 . 11 1 1 A 4 4 SER C C 4 175.414 174.099 1.315 1
1 22 . 11 1 1 A 4 4 SER CA C 4 59.163 57.812 1.351 1
1 23 . 11 1 1 A 4 4 SER CB C 4 63.242 60.862 2.380 1
1 24 . 11 1 1 A 4 4 SER N N 4 114.246 118.768 -4.522 1
1 25 . 11 1 1 A 5 5 LYS H H 5 8.468 8.212 0.256 1
1 26 . 11 1 1 A 5 5 LYS HA H 5 4.433 4.393 0.040 1
1 35 . 11 1 1 A 5 5 LYS C C 5 175.984 176.735 -0.751 1
1 36 . 11 1 1 A 5 5 LYS CA C 5 55.724 57.158 -1.434 1
1 37 . 11 1 1 A 5 5 LYS CB C 5 32.881 33.372 -0.491 1
1 41 . 11 1 1 A 5 5 LYS N N 5 123.488 125.615 -2.127 1
1 42 . 11 1 1 A 6 6 LEU H H 6 7.707 7.408 0.299 1
1 43 . 11 1 1 A 6 6 LEU HA H 6 4.381 4.452 -0.071 1
1 53 . 11 1 1 A 6 6 LEU C C 6 177.820 176.719 1.101 1
1 54 . 11 1 1 A 6 6 LEU CA C 6 55.507 54.618 0.889 1
1 55 . 11 1 1 A 6 6 LEU CB C 6 43.374 43.037 0.337 1
1 59 . 11 1 1 A 6 6 LEU N N 6 121.233 122.548 -1.315 1
1 60 . 11 1 1 A 7 7 SER H H 7 9.433 8.763 0.670 1
1 61 . 11 1 1 A 7 7 SER HA H 7 4.638 4.527 0.111 1
1 64 . 11 1 1 A 7 7 SER C C 7 174.120 174.786 -0.666 1
1 65 . 11 1 1 A 7 7 SER CA C 7 57.962 59.129 -1.167 1
1 66 . 11 1 1 A 7 7 SER CB C 7 64.197 63.876 0.321 1
1 67 . 11 1 1 A 7 7 SER N N 7 122.977 122.093 0.884 1
1 68 . 11 1 1 A 8 8 TYR H H 8 9.764 9.073 0.691 1
1 69 . 11 1 1 A 8 8 TYR HA H 8 4.732 4.259 0.473 1
1 76 . 11 1 1 A 8 8 TYR C C 8 177.206 177.717 -0.511 1
1 77 . 11 1 1 A 8 8 TYR CA C 8 58.762 61.856 -3.094 1
1 78 . 11 1 1 A 8 8 TYR CB C 8 36.605 38.881 -2.276 1
1 83 . 11 1 1 A 8 8 TYR N N 8 123.312 124.881 -1.569 1
1 84 . 11 1 1 A 9 9 GLY H H 9 10.131 8.344 1.787 1
1 85 . 11 1 1 A 9 9 GLY HA2 H 9 3.983 3.567 0.416 1
1 86 . 11 1 1 A 9 9 GLY HA3 H 9 3.423 3.668 -0.245 1
1 87 . 11 1 1 A 9 9 GLY C C 9 175.163 176.161 -0.998 1
1 88 . 11 1 1 A 9 9 GLY CA C 9 47.153 47.220 -0.067 1
1 89 . 11 1 1 A 9 9 GLY N N 9 107.177 105.200 1.977 1
1 90 . 11 1 1 A 10 10 GLU H H 10 7.876 8.048 -0.172 1
1 91 . 11 1 1 A 10 10 GLU HA H 10 4.107 4.094 0.013 1
1 96 . 11 1 1 A 10 10 GLU C C 10 179.924 178.885 1.039 1
1 97 . 11 1 1 A 10 10 GLU CA C 10 58.890 59.318 -0.428 1
1 98 . 11 1 1 A 10 10 GLU CB C 10 29.750 29.353 0.397 1
1 100 . 11 1 1 A 10 10 GLU N N 10 122.219 121.699 0.520 1
1 101 . 11 1 1 A 11 11 TYR H H 11 8.384 8.286 0.098 1
1 102 . 11 1 1 A 11 11 TYR HA H 11 4.305 4.399 -0.094 1
1 107 . 11 1 1 A 11 11 TYR C C 11 176.854 177.333 -0.479 1
1 108 . 11 1 1 A 11 11 TYR CA C 11 61.040 60.996 0.044 1
1 109 . 11 1 1 A 11 11 TYR CB C 11 37.593 38.785 -1.192 1
1 112 . 11 1 1 A 11 11 TYR N N 11 120.809 122.987 -2.178 1
1 113 . 11 1 1 A 12 12 LEU H H 12 9.027 7.972 1.055 1
1 114 . 11 1 1 A 12 12 LEU HA H 12 3.778 3.873 -0.095 1
1 124 . 11 1 1 A 12 12 LEU C C 12 178.621 179.286 -0.665 1
1 125 . 11 1 1 A 12 12 LEU CA C 12 57.534 57.416 0.118 1
1 126 . 11 1 1 A 12 12 LEU CB C 12 41.957 41.204 0.753 1
1 130 . 11 1 1 A 12 12 LEU N N 12 121.080 119.387 1.693 1
1 131 . 11 1 1 A 13 13 GLU H H 13 7.614 8.318 -0.704 1
1 132 . 11 1 1 A 13 13 GLU HA H 13 4.102 4.039 0.063 1
1 137 . 11 1 1 A 13 13 GLU C C 13 178.449 179.119 -0.670 1
1 138 . 11 1 1 A 13 13 GLU CA C 13 59.609 59.587 0.022 1
1 139 . 11 1 1 A 13 13 GLU CB C 13 29.124 29.798 -0.674 1
1 141 . 11 1 1 A 13 13 GLU N N 13 118.475 120.716 -2.241 1
1 142 . 11 1 1 A 14 14 SER H H 14 7.329 8.115 -0.786 1
1 143 . 11 1 1 A 14 14 SER HA H 14 4.358 4.255 0.103 1
1 146 . 11 1 1 A 14 14 SER C C 14 176.794 176.484 0.310 1
1 147 . 11 1 1 A 14 14 SER CA C 14 61.064 61.264 -0.200 1
1 148 . 11 1 1 A 14 14 SER CB C 14 62.513 62.369 0.144 1
1 149 . 11 1 1 A 14 14 SER N N 14 115.209 114.203 1.006 1
1 150 . 11 1 1 A 15 15 TRP H H 15 8.870 7.947 0.923 1
1 151 . 11 1 1 A 15 15 TRP HA H 15 4.005 4.301 -0.296 1
1 160 . 11 1 1 A 15 15 TRP C C 15 177.547 178.097 -0.550 1
1 161 . 11 1 1 A 15 15 TRP CA C 15 61.210 61.204 0.006 1
1 162 . 11 1 1 A 15 15 TRP CB C 15 27.341 29.456 -2.115 1
1 168 . 11 1 1 A 15 15 TRP N N 15 124.998 124.047 0.951 1
1 170 . 11 1 1 A 16 16 PHE H H 16 9.087 8.182 0.905 1
1 171 . 11 1 1 A 16 16 PHE HA H 16 3.210 3.757 -0.547 1
1 179 . 11 1 1 A 16 16 PHE C C 16 175.909 176.767 -0.858 1
1 180 . 11 1 1 A 16 16 PHE CA C 16 61.473 61.459 0.014 1
1 181 . 11 1 1 A 16 16 PHE CB C 16 38.506 39.049 -0.543 1
1 187 . 11 1 1 A 16 16 PHE N N 16 119.825 121.166 -1.341 1
1 188 . 11 1 1 A 17 17 ASN H H 17 7.768 8.016 -0.248 1
1 189 . 11 1 1 A 17 17 ASN HA H 17 4.078 4.244 -0.166 1
1 194 . 11 1 1 A 17 17 ASN C C 17 176.604 177.406 -0.802 1
1 195 . 11 1 1 A 17 17 ASN CA C 17 55.621 56.329 -0.708 1
1 196 . 11 1 1 A 17 17 ASN CB C 17 37.830 39.065 -1.235 1
1 197 . 11 1 1 A 17 17 ASN N N 17 115.600 116.899 -1.299 1
1 199 . 11 1 1 A 18 18 THR H H 18 7.454 7.271 0.183 1
1 200 . 11 1 1 A 18 18 THR HA H 18 4.147 3.993 0.154 1
1 205 . 11 1 1 A 18 18 THR C C 18 175.692 176.024 -0.332 1
1 206 . 11 1 1 A 18 18 THR CA C 18 64.679 64.645 0.034 1
1 207 . 11 1 1 A 18 18 THR CB C 18 68.940 68.785 0.155 1
1 209 . 11 1 1 A 18 18 THR N N 18 113.049 113.372 -0.323 1
1 210 . 11 1 1 A 19 19 LYS H H 19 7.918 7.571 0.347 1
1 211 . 11 1 1 A 19 19 LYS HA H 19 3.791 3.617 0.174 1
1 220 . 11 1 1 A 19 19 LYS C C 19 178.120 178.883 -0.763 1
1 221 . 11 1 1 A 19 19 LYS CA C 19 55.985 58.682 -2.697 1
1 222 . 11 1 1 A 19 19 LYS CB C 19 31.130 30.961 0.169 1
1 226 . 11 1 1 A 19 19 LYS N N 19 122.614 120.504 2.110 1
1 227 . 11 1 1 A 20 20 ARG H H 20 7.845 7.503 0.342 1
1 228 . 11 1 1 A 20 20 ARG HA H 20 3.396 3.802 -0.406 1
1 236 . 11 1 1 A 20 20 ARG C C 20 175.601 177.240 -1.639 1
1 237 . 11 1 1 A 20 20 ARG CA C 20 58.182 58.322 -0.140 1
1 238 . 11 1 1 A 20 20 ARG CB C 20 28.045 30.042 -1.997 1
1 241 . 11 1 1 A 20 20 ARG N N 20 116.282 117.985 -1.703 1
1 243 . 11 1 1 A 21 21 HIS H H 21 7.163 7.262 -0.099 1
1 244 . 11 1 1 A 21 21 HIS HA H 21 4.500 4.339 0.161 1
1 249 . 11 1 1 A 21 21 HIS C C 21 175.618 177.021 -1.403 1
1 250 . 11 1 1 A 21 21 HIS CA C 21 56.912 58.619 -1.707 1
1 251 . 11 1 1 A 21 21 HIS CB C 21 29.400 29.808 -0.408 1
1 254 . 11 1 1 A 21 21 HIS N N 21 115.452 117.456 -2.004 1
1 255 . 11 1 1 A 22 22 SER H H 22 7.951 7.501 0.450 1
1 256 . 11 1 1 A 22 22 SER HA H 22 4.573 4.259 0.314 1
1 259 . 11 1 1 A 22 22 SER C C 22 173.948 174.095 -0.147 1
1 260 . 11 1 1 A 22 22 SER CA C 22 58.589 60.863 -2.274 1
1 261 . 11 1 1 A 22 22 SER CB C 22 64.228 63.906 0.322 1
1 262 . 11 1 1 A 22 22 SER N N 22 113.209 113.556 -0.347 1
1 263 . 11 1 1 A 23 23 VAL H H 23 7.179 7.370 -0.191 1
1 264 . 11 1 1 A 23 23 VAL HA H 23 4.626 4.621 0.005 1
1 272 . 11 1 1 A 23 23 VAL C C 23 175.397 175.611 -0.214 1
1 273 . 11 1 1 A 23 23 VAL CA C 23 59.556 59.807 -0.251 1
1 274 . 11 1 1 A 23 23 VAL CB C 23 33.810 34.615 -0.805 1
1 277 . 11 1 1 A 23 23 VAL N N 23 113.108 115.851 -2.743 1
1 278 . 11 1 1 A 24 24 GLY H H 24 8.189 8.378 -0.189 1
1 279 . 11 1 1 A 24 24 GLY HA2 H 24 4.074 4.025 0.049 1
1 280 . 11 1 1 A 24 24 GLY HA3 H 24 4.195 4.051 0.144 1
1 281 . 11 1 1 A 24 24 GLY C C 24 174.037 174.708 -0.671 1
1 282 . 11 1 1 A 24 24 GLY CA C 24 44.452 45.402 -0.950 1
1 283 . 11 1 1 A 24 24 GLY N N 24 108.374 108.745 -0.371 1
1 284 . 11 1 1 A 25 25 ILE H H 25 8.331 8.579 -0.248 1
1 285 . 11 1 1 A 25 25 ILE HA H 25 3.839 3.581 0.258 1
1 295 . 11 1 1 A 25 25 ILE C C 25 178.042 177.628 0.414 1
1 296 . 11 1 1 A 25 25 ILE CA C 25 64.238 64.409 -0.171 1
1 297 . 11 1 1 A 25 25 ILE CB C 25 37.931 37.438 0.493 1
1 301 . 11 1 1 A 25 25 ILE N N 25 119.895 120.701 -0.806 1
1 302 . 11 1 1 A 26 26 GLN H H 26 8.545 8.627 -0.082 1
1 303 . 11 1 1 A 26 26 GLN HA H 26 4.129 4.053 0.076 1
1 310 . 11 1 1 A 26 26 GLN C C 26 178.454 177.565 0.889 1
1 311 . 11 1 1 A 26 26 GLN CA C 26 58.772 58.163 0.609 1
1 312 . 11 1 1 A 26 26 GLN CB C 26 27.346 27.614 -0.268 1
1 314 . 11 1 1 A 26 26 GLN N N 26 120.013 120.107 -0.094 1
1 316 . 11 1 1 A 27 27 THR H H 27 7.944 7.881 0.063 1
1 317 . 11 1 1 A 27 27 THR HA H 27 3.953 3.902 0.051 1
1 322 . 11 1 1 A 27 27 THR C C 27 175.818 175.574 0.244 1
1 323 . 11 1 1 A 27 27 THR CA C 27 65.855 66.543 -0.688 1
1 324 . 11 1 1 A 27 27 THR CB C 27 68.127 68.685 -0.558 1
1 326 . 11 1 1 A 27 27 THR N N 27 117.645 116.917 0.728 1
1 327 . 11 1 1 A 28 28 ALA H H 28 8.593 8.193 0.400 1
1 328 . 11 1 1 A 28 28 ALA HA H 28 3.899 4.028 -0.129 1
1 332 . 11 1 1 A 28 28 ALA C C 28 178.515 179.897 -1.382 1
1 333 . 11 1 1 A 28 28 ALA CA C 28 55.742 55.411 0.331 1
1 334 . 11 1 1 A 28 28 ALA CB C 28 17.513 18.062 -0.549 1
1 335 . 11 1 1 A 28 28 ALA N N 28 123.917 123.519 0.398 1
1 336 . 11 1 1 A 29 29 LYS H H 29 7.800 8.109 -0.309 1
1 337 . 11 1 1 A 29 29 LYS HA H 29 3.982 3.980 0.002 1
1 346 . 11 1 1 A 29 29 LYS C C 29 179.527 178.968 0.559 1
1 347 . 11 1 1 A 29 29 LYS CA C 29 59.761 59.642 0.119 1
1 348 . 11 1 1 A 29 29 LYS CB C 29 32.223 32.350 -0.127 1
1 352 . 11 1 1 A 29 29 LYS N N 29 117.474 118.931 -1.457 1
1 353 . 11 1 1 A 30 30 VAL H H 30 7.591 7.582 0.009 1
1 354 . 11 1 1 A 30 30 VAL HA H 30 3.503 3.266 0.237 1
1 362 . 11 1 1 A 30 30 VAL C C 30 178.389 177.133 1.256 1
1 363 . 11 1 1 A 30 30 VAL CA C 30 65.640 65.709 -0.069 1
1 364 . 11 1 1 A 30 30 VAL CB C 30 31.644 31.484 0.160 1
1 367 . 11 1 1 A 30 30 VAL N N 30 121.749 120.209 1.540 1
1 368 . 11 1 1 A 31 31 LEU H H 31 8.333 7.996 0.337 1
1 369 . 11 1 1 A 31 31 LEU HA H 31 4.074 4.086 -0.012 1
1 379 . 11 1 1 A 31 31 LEU C C 31 177.780 178.970 -1.190 1
1 380 . 11 1 1 A 31 31 LEU CA C 31 58.157 58.365 -0.208 1
1 381 . 11 1 1 A 31 31 LEU CB C 31 42.230 41.451 0.779 1
1 385 . 11 1 1 A 31 31 LEU N N 31 120.901 120.320 0.581 1
1 386 . 11 1 1 A 32 32 LYS H H 32 8.562 7.988 0.574 1
1 387 . 11 1 1 A 32 32 LYS HA H 32 3.290 4.007 -0.717 1
1 395 . 11 1 1 A 32 32 LYS C C 32 178.037 178.797 -0.760 1
1 396 . 11 1 1 A 32 32 LYS CA C 32 58.911 59.477 -0.566 1
1 397 . 11 1 1 A 32 32 LYS CB C 32 31.605 31.297 0.308 1
1 401 . 11 1 1 A 32 32 LYS N N 32 119.075 119.437 -0.362 1
1 402 . 11 1 1 A 33 33 GLY H H 33 7.694 7.858 -0.164 1
1 403 . 11 1 1 A 33 33 GLY HA2 H 33 3.949 3.537 0.412 1
1 404 . 11 1 1 A 33 33 GLY HA3 H 33 3.826 3.627 0.199 1
1 405 . 11 1 1 A 33 33 GLY C C 33 177.101 176.366 0.735 1
1 406 . 11 1 1 A 33 33 GLY CA C 33 46.928 46.914 0.014 1
1 407 . 11 1 1 A 33 33 GLY N N 33 105.282 106.938 -1.656 1
1 408 . 11 1 1 A 34 34 TYR H H 34 8.015 7.580 0.435 1
1 409 . 11 1 1 A 34 34 TYR HA H 34 4.558 4.734 -0.176 1
1 416 . 11 1 1 A 34 34 TYR C C 34 179.611 178.097 1.514 1
1 417 . 11 1 1 A 34 34 TYR CA C 34 59.349 60.359 -1.010 1
1 418 . 11 1 1 A 34 34 TYR CB C 34 37.344 38.736 -1.392 1
1 423 . 11 1 1 A 34 34 TYR N N 34 121.781 121.753 0.028 1
1 424 . 11 1 1 A 35 35 LEU H H 35 8.689 8.069 0.620 1
1 425 . 11 1 1 A 35 35 LEU HA H 35 3.977 3.872 0.105 1
1 435 . 11 1 1 A 35 35 LEU C C 35 177.081 178.883 -1.802 1
1 436 . 11 1 1 A 35 35 LEU CA C 35 59.155 58.516 0.639 1
1 437 . 11 1 1 A 35 35 LEU CB C 35 41.103 41.652 -0.549 1
1 441 . 11 1 1 A 35 35 LEU N N 35 120.392 120.567 -0.175 1
1 442 . 11 1 1 A 36 36 ASN H H 36 8.721 8.399 0.322 1
1 443 . 11 1 1 A 36 36 ASN HA H 36 4.435 4.435 0.000 1
1 448 . 11 1 1 A 36 36 ASN C C 36 176.792 178.033 -1.241 1
1 449 . 11 1 1 A 36 36 ASN CA C 36 55.642 56.253 -0.611 1
1 450 . 11 1 1 A 36 36 ASN CB C 36 38.319 37.694 0.625 1
1 451 . 11 1 1 A 36 36 ASN N N 36 114.623 117.325 -2.702 1
1 453 . 11 1 1 A 37 37 SER H H 37 8.511 7.948 0.563 1
1 454 . 11 1 1 A 37 37 SER HA H 37 4.642 4.251 0.391 1
1 457 . 11 1 1 A 37 37 SER C C 37 175.039 176.550 -1.511 1
1 458 . 11 1 1 A 37 37 SER CA C 37 59.825 61.383 -1.558 1
1 459 . 11 1 1 A 37 37 SER CB C 37 64.056 62.956 1.100 1
1 460 . 11 1 1 A 37 37 SER N N 37 110.941 115.392 -4.451 1
1 461 . 11 1 1 A 38 38 ARG H H 38 7.242 8.067 -0.825 1
1 462 . 11 1 1 A 38 38 ARG HA H 38 4.919 4.458 0.461 1
1 469 . 11 1 1 A 38 38 ARG C C 38 176.514 178.254 -1.740 1
1 470 . 11 1 1 A 38 38 ARG CA C 38 56.687 57.995 -1.308 1
1 471 . 11 1 1 A 38 38 ARG CB C 38 32.434 31.395 1.039 1
1 474 . 11 1 1 A 38 38 ARG N N 38 117.062 120.608 -3.546 1
1 475 . 11 1 1 A 39 39 ILE H H 39 8.462 7.978 0.484 1
1 476 . 11 1 1 A 39 39 ILE HA H 39 3.618 3.941 -0.323 1
1 486 . 11 1 1 A 39 39 ILE C C 39 176.267 178.385 -2.118 1
1 487 . 11 1 1 A 39 39 ILE CA C 39 66.134 64.804 1.330 1
1 488 . 11 1 1 A 39 39 ILE CB C 39 39.787 37.378 2.409 1
1 492 . 11 1 1 A 39 39 ILE N N 39 121.214 120.305 0.909 1
1 493 . 11 1 1 A 40 40 ILE H H 40 9.339 8.153 1.186 1
1 494 . 11 1 1 A 40 40 ILE HA H 40 3.401 3.792 -0.391 1
1 504 . 11 1 1 A 40 40 ILE CA C 40 67.844 66.370 1.474 1
1 505 . 11 1 1 A 40 40 ILE CB C 40 34.406 35.444 -1.038 1
1 509 . 11 1 1 A 40 40 ILE N N 40 119.695 121.946 -2.251 1
1 510 . 11 1 1 A 41 41 PRO HA H 41 4.314 4.431 -0.117 1
1 517 . 11 1 1 A 41 41 PRO C C 41 177.418 178.280 -0.862 1
1 518 . 11 1 1 A 41 41 PRO CA C 41 65.912 65.309 0.603 1
1 519 . 11 1 1 A 41 41 PRO CB C 41 30.686 31.292 -0.606 1
1 522 . 11 1 1 A 42 42 SER H H 42 6.857 8.219 -1.362 1
1 523 . 11 1 1 A 42 42 SER HA H 42 4.558 4.500 0.058 1
1 526 . 11 1 1 A 42 42 SER C C 42 174.813 175.804 -0.991 1
1 527 . 11 1 1 A 42 42 SER CA C 42 61.279 61.263 0.016 1
1 528 . 11 1 1 A 42 42 SER CB C 42 64.285 63.862 0.423 1
1 529 . 11 1 1 A 42 42 SER N N 42 108.994 113.495 -4.501 1
1 530 . 11 1 1 A 43 43 LEU H H 43 8.230 8.058 0.172 1
1 531 . 11 1 1 A 43 43 LEU HA H 43 4.572 4.461 0.111 1
1 541 . 11 1 1 A 43 43 LEU C C 43 177.301 178.671 -1.370 1
1 542 . 11 1 1 A 43 43 LEU CA C 43 54.113 55.198 -1.085 1
1 543 . 11 1 1 A 43 43 LEU CB C 43 44.800 42.437 2.363 1
1 547 . 11 1 1 A 43 43 LEU N N 43 118.715 120.398 -1.683 1
1 548 . 11 1 1 A 44 44 GLY H H 44 8.498 8.483 0.015 1
1 549 . 11 1 1 A 44 44 GLY HA2 H 44 4.010 3.781 0.229 1
1 550 . 11 1 1 A 44 44 GLY HA3 H 44 3.613 3.815 -0.202 1
1 551 . 11 1 1 A 44 44 GLY C C 44 174.178 176.159 -1.981 1
1 552 . 11 1 1 A 44 44 GLY CA C 44 46.271 47.335 -1.064 1
1 553 . 11 1 1 A 44 44 GLY N N 44 105.371 107.546 -2.175 1
1 554 . 11 1 1 A 45 45 ASN H H 45 8.385 7.467 0.918 1
1 555 . 11 1 1 A 45 45 ASN HA H 45 4.789 4.524 0.265 1
1 560 . 11 1 1 A 45 45 ASN C C 45 175.386 176.690 -1.304 1
1 561 . 11 1 1 A 45 45 ASN CA C 45 53.144 55.616 -2.472 1
1 562 . 11 1 1 A 45 45 ASN CB C 45 37.928 38.298 -0.370 1
1 563 . 11 1 1 A 45 45 ASN N N 45 114.387 118.828 -4.441 1
1 565 . 11 1 1 A 46 46 ILE H H 46 7.465 7.593 -0.128 1
1 566 . 11 1 1 A 46 46 ILE HA H 46 3.856 4.112 -0.256 1
1 576 . 11 1 1 A 46 46 ILE C C 46 175.997 176.342 -0.345 1
1 577 . 11 1 1 A 46 46 ILE CA C 46 60.853 61.815 -0.962 1
1 578 . 11 1 1 A 46 46 ILE CB C 46 38.042 38.330 -0.288 1
1 582 . 11 1 1 A 46 46 ILE N N 46 123.998 119.587 4.411 1
1 583 . 11 1 1 A 47 47 LYS H H 47 8.717 8.703 0.014 1
1 584 . 11 1 1 A 47 47 LYS HA H 47 4.249 4.314 -0.065 1
1 591 . 11 1 1 A 47 47 LYS C C 47 177.583 177.671 -0.088 1
1 592 . 11 1 1 A 47 47 LYS CA C 47 56.320 56.945 -0.625 1
1 593 . 11 1 1 A 47 47 LYS CB C 47 30.393 32.683 -2.290 1
1 596 . 11 1 1 A 47 47 LYS N N 47 126.114 124.470 1.644 1
1 597 . 11 1 1 A 48 48 LEU H H 48 8.323 8.188 0.135 1
1 598 . 11 1 1 A 48 48 LEU HA H 48 3.691 3.989 -0.298 1
1 608 . 11 1 1 A 48 48 LEU C C 48 177.274 178.252 -0.978 1
1 609 . 11 1 1 A 48 48 LEU CA C 48 58.443 58.575 -0.132 1
1 610 . 11 1 1 A 48 48 LEU CB C 48 42.282 41.480 0.802 1
1 614 . 11 1 1 A 48 48 LEU N N 48 125.857 126.111 -0.254 1
1 615 . 11 1 1 A 49 49 ALA H H 49 8.929 7.877 1.052 1
1 616 . 11 1 1 A 49 49 ALA HA H 49 4.067 4.009 0.058 1
1 620 . 11 1 1 A 49 49 ALA C C 49 177.468 178.686 -1.218 1
1 621 . 11 1 1 A 49 49 ALA CA C 49 53.092 54.556 -1.464 1
1 622 . 11 1 1 A 49 49 ALA CB C 49 18.562 18.266 0.296 1
1 623 . 11 1 1 A 49 49 ALA N N 49 115.543 120.115 -4.572 1
1 624 . 11 1 1 A 50 50 LYS H H 50 7.684 7.477 0.207 1
1 625 . 11 1 1 A 50 50 LYS HA H 50 4.395 4.236 0.159 1
1 634 . 11 1 1 A 50 50 LYS C C 50 174.958 176.542 -1.584 1
1 635 . 11 1 1 A 50 50 LYS CA C 50 53.977 56.548 -2.571 1
1 636 . 11 1 1 A 50 50 LYS CB C 50 32.645 32.592 0.053 1
1 640 . 11 1 1 A 50 50 LYS N N 50 114.788 114.930 -0.142 1
1 641 . 11 1 1 A 51 51 LEU H H 51 6.776 7.271 -0.495 1
1 642 . 11 1 1 A 51 51 LEU HA H 51 4.569 4.253 0.316 1
1 652 . 11 1 1 A 51 51 LEU C C 51 177.953 175.627 2.326 1
1 653 . 11 1 1 A 51 51 LEU CA C 51 55.318 54.727 0.591 1
1 654 . 11 1 1 A 51 51 LEU CB C 51 43.182 40.437 2.745 1
1 658 . 11 1 1 A 51 51 LEU N N 51 121.408 121.817 -0.409 1
1 659 . 11 1 1 A 52 52 THR H H 52 10.680 7.592 3.088 1
1 660 . 11 1 1 A 52 52 THR HA H 52 4.938 4.530 0.408 1
1 665 . 11 1 1 A 52 52 THR C C 52 175.553 174.499 1.054 1
1 666 . 11 1 1 A 52 52 THR CA C 52 59.740 60.038 -0.298 1
1 667 . 11 1 1 A 52 52 THR CB C 52 73.557 70.967 2.590 1
1 669 . 11 1 1 A 52 52 THR N N 52 119.481 119.264 0.217 1
1 670 . 11 1 1 A 53 53 SER H H 53 9.278 9.000 0.278 1
1 671 . 11 1 1 A 53 53 SER HA H 53 4.261 4.147 0.114 1
1 674 . 11 1 1 A 53 53 SER C C 53 176.990 176.326 0.664 1
1 675 . 11 1 1 A 53 53 SER CA C 53 61.025 61.096 -0.071 1
1 676 . 11 1 1 A 53 53 SER CB C 53 62.312 62.948 -0.636 1
1 677 . 11 1 1 A 53 53 SER N N 53 116.343 121.787 -5.444 1
1 678 . 11 1 1 A 54 54 LEU H H 54 7.808 8.031 -0.223 1
1 679 . 11 1 1 A 54 54 LEU HA H 54 4.229 4.045 0.184 1
1 688 . 11 1 1 A 54 54 LEU C C 54 178.505 178.521 -0.016 1
1 689 . 11 1 1 A 54 54 LEU CA C 54 57.719 58.013 -0.294 1
1 690 . 11 1 1 A 54 54 LEU CB C 54 40.997 41.770 -0.773 1
1 694 . 11 1 1 A 54 54 LEU N N 54 126.055 122.950 3.105 1
1 695 . 11 1 1 A 55 55 HIS H H 55 7.798 7.876 -0.078 1
1 696 . 11 1 1 A 55 55 HIS HA H 55 4.311 4.265 0.046 1
1 701 . 11 1 1 A 55 55 HIS C C 55 180.044 177.728 2.316 1
1 702 . 11 1 1 A 55 55 HIS CA C 55 60.583 60.235 0.348 1
1 703 . 11 1 1 A 55 55 HIS CB C 55 31.445 29.808 1.637 1
1 706 . 11 1 1 A 55 55 HIS N N 55 118.683 117.174 1.509 1
1 707 . 11 1 1 A 56 56 MET H H 56 7.375 7.808 -0.433 1
1 708 . 11 1 1 A 56 56 MET HA H 56 4.513 4.074 0.439 1
1 716 . 11 1 1 A 56 56 MET C C 56 177.169 178.409 -1.240 1
1 717 . 11 1 1 A 56 56 MET CA C 56 55.823 59.070 -3.247 1
1 718 . 11 1 1 A 56 56 MET CB C 56 31.303 33.414 -2.111 1
1 721 . 11 1 1 A 56 56 MET N N 56 114.530 118.054 -3.524 1
1 722 . 11 1 1 A 57 57 GLN H H 57 8.387 8.279 0.108 1
1 723 . 11 1 1 A 57 57 GLN HA H 57 3.981 4.005 -0.024 1
1 730 . 11 1 1 A 57 57 GLN C C 57 178.033 178.464 -0.431 1
1 731 . 11 1 1 A 57 57 GLN CA C 57 57.922 59.152 -1.230 1
1 732 . 11 1 1 A 57 57 GLN CB C 57 29.012 28.506 0.506 1
1 734 . 11 1 1 A 57 57 GLN N N 57 120.713 119.715 0.998 1
1 736 . 11 1 1 A 58 58 ASN H H 58 8.765 8.391 0.374 1
1 737 . 11 1 1 A 58 58 ASN HA H 58 4.539 4.481 0.058 1
1 742 . 11 1 1 A 58 58 ASN C C 58 178.084 177.583 0.501 1
1 743 . 11 1 1 A 58 58 ASN CA C 58 55.345 56.215 -0.870 1
1 744 . 11 1 1 A 58 58 ASN CB C 58 36.924 38.122 -1.198 1
1 745 . 11 1 1 A 58 58 ASN N N 58 117.390 117.755 -0.365 1
1 747 . 11 1 1 A 59 59 TYR H H 59 8.239 7.872 0.367 1
1 748 . 11 1 1 A 59 59 TYR HA H 59 4.586 4.184 0.402 1
1 755 . 11 1 1 A 59 59 TYR C C 59 178.015 176.901 1.114 1
1 756 . 11 1 1 A 59 59 TYR CA C 59 60.779 61.543 -0.764 1
1 757 . 11 1 1 A 59 59 TYR CB C 59 38.047 38.653 -0.606 1
1 762 . 11 1 1 A 59 59 TYR N N 59 122.335 122.991 -0.656 1
1 763 . 11 1 1 A 60 60 VAL H H 60 8.416 8.549 -0.133 1
1 764 . 11 1 1 A 60 60 VAL HA H 60 3.244 3.532 -0.288 1
1 772 . 11 1 1 A 60 60 VAL C C 60 177.309 178.374 -1.065 1
1 773 . 11 1 1 A 60 60 VAL CA C 60 67.022 66.458 0.564 1
1 774 . 11 1 1 A 60 60 VAL CB C 60 30.929 31.388 -0.459 1
1 777 . 11 1 1 A 60 60 VAL N N 60 119.842 119.571 0.271 1
1 778 . 11 1 1 A 61 61 ASN H H 61 8.264 8.219 0.045 1
1 779 . 11 1 1 A 61 61 ASN HA H 61 4.305 4.443 -0.138 1
1 784 . 11 1 1 A 61 61 ASN C C 61 177.263 177.581 -0.318 1
1 785 . 11 1 1 A 61 61 ASN CA C 61 55.548 56.485 -0.937 1
1 786 . 11 1 1 A 61 61 ASN CB C 61 36.645 37.987 -1.342 1
1 787 . 11 1 1 A 61 61 ASN N N 61 119.103 119.844 -0.741 1
1 789 . 11 1 1 A 62 62 SER H H 62 8.143 7.742 0.401 1
1 790 . 11 1 1 A 62 62 SER HA H 62 4.343 4.148 0.195 1
1 793 . 11 1 1 A 62 62 SER C C 62 176.409 177.174 -0.765 1
1 794 . 11 1 1 A 62 62 SER CA C 62 61.612 61.078 0.534 1
1 795 . 11 1 1 A 62 62 SER CB C 62 62.219 62.909 -0.690 1
1 796 . 11 1 1 A 62 62 SER N N 62 118.254 114.215 4.039 1
1 797 . 11 1 1 A 63 63 LEU H H 63 7.664 7.817 -0.153 1
1 798 . 11 1 1 A 63 63 LEU HA H 63 4.003 3.878 0.125 1
1 808 . 11 1 1 A 63 63 LEU C C 63 178.748 178.944 -0.196 1
1 809 . 11 1 1 A 63 63 LEU CA C 63 57.171 57.704 -0.533 1
1 810 . 11 1 1 A 63 63 LEU CB C 63 41.134 40.810 0.324 1
1 814 . 11 1 1 A 63 63 LEU N N 63 123.812 122.232 1.580 1
1 815 . 11 1 1 A 64 64 ARG H H 64 7.969 7.665 0.304 1
1 816 . 11 1 1 A 64 64 ARG HA H 64 4.038 3.940 0.098 1
1 824 . 11 1 1 A 64 64 ARG C C 64 180.797 178.665 2.132 1
1 825 . 11 1 1 A 64 64 ARG CA C 64 58.598 59.166 -0.568 1
1 826 . 11 1 1 A 64 64 ARG CB C 64 28.849 29.893 -1.044 1
1 829 . 11 1 1 A 64 64 ARG N N 64 120.376 121.073 -0.697 1
1 831 . 11 1 1 A 65 65 ASP H H 65 8.465 7.992 0.473 1
1 832 . 11 1 1 A 65 65 ASP HA H 65 4.408 4.407 0.001 1
1 835 . 11 1 1 A 65 65 ASP C C 65 177.336 178.746 -1.410 1
1 836 . 11 1 1 A 65 65 ASP CA C 65 56.957 56.797 0.160 1
1 837 . 11 1 1 A 65 65 ASP CB C 65 39.602 40.057 -0.455 1
1 838 . 11 1 1 A 65 65 ASP N N 65 122.402 119.780 2.622 1
1 839 . 11 1 1 A 66 66 GLU H H 66 7.703 7.933 -0.230 1
1 840 . 11 1 1 A 66 66 GLU HA H 66 4.213 4.310 -0.097 1
1 845 . 11 1 1 A 66 66 GLU C C 66 176.586 177.088 -0.502 1
1 846 . 11 1 1 A 66 66 GLU CA C 66 56.974 56.291 0.683 1
1 847 . 11 1 1 A 66 66 GLU CB C 66 29.821 30.146 -0.325 1
1 849 . 11 1 1 A 66 66 GLU N N 66 119.076 116.470 2.606 1
1 850 . 11 1 1 A 67 67 GLY H H 67 7.861 7.617 0.244 1
1 851 . 11 1 1 A 67 67 GLY HA2 H 67 4.269 3.889 0.380 1
1 852 . 11 1 1 A 67 67 GLY HA3 H 67 3.731 3.894 -0.163 1
1 853 . 11 1 1 A 67 67 GLY C C 67 174.614 175.002 -0.388 1
1 854 . 11 1 1 A 67 67 GLY CA C 67 44.608 46.140 -1.532 1
1 855 . 11 1 1 A 67 67 GLY N N 67 105.730 109.861 -4.131 1
1 856 . 11 1 1 A 68 68 LEU H H 68 7.324 7.757 -0.433 1
1 857 . 11 1 1 A 68 68 LEU HA H 68 4.257 4.195 0.062 1
1 867 . 11 1 1 A 68 68 LEU C C 68 176.136 176.946 -0.810 1
1 868 . 11 1 1 A 68 68 LEU CA C 68 55.659 54.951 0.708 1
1 869 . 11 1 1 A 68 68 LEU CB C 68 41.874 41.751 0.123 1
1 873 . 11 1 1 A 68 68 LEU N N 68 121.062 121.496 -0.434 1
1 874 . 11 1 1 A 69 69 LYS H H 69 8.368 8.475 -0.107 1
1 875 . 11 1 1 A 69 69 LYS HA H 69 4.281 4.454 -0.173 1
1 884 . 11 1 1 A 69 69 LYS C C 69 177.940 177.912 0.028 1
1 885 . 11 1 1 A 69 69 LYS CA C 69 55.412 55.911 -0.499 1
1 886 . 11 1 1 A 69 69 LYS CB C 69 32.761 33.473 -0.712 1
1 890 . 11 1 1 A 69 69 LYS N N 69 120.120 122.595 -2.475 1
1 891 . 11 1 1 A 70 70 ARG H H 70 9.095 8.817 0.278 1
1 892 . 11 1 1 A 70 70 ARG HA H 70 3.684 4.107 -0.423 1
1 900 . 11 1 1 A 70 70 ARG C C 70 177.712 178.537 -0.825 1
1 901 . 11 1 1 A 70 70 ARG CA C 70 60.216 58.320 1.896 1
1 902 . 11 1 1 A 70 70 ARG CB C 70 29.539 29.706 -0.167 1
1 905 . 11 1 1 A 70 70 ARG N N 70 123.339 119.906 3.433 1
1 907 . 11 1 1 A 71 71 GLY H H 71 8.985 8.235 0.750 1
1 908 . 11 1 1 A 71 71 GLY HA2 H 71 3.932 3.583 0.349 1
1 909 . 11 1 1 A 71 71 GLY HA3 H 71 3.905 3.585 0.320 1
1 910 . 11 1 1 A 71 71 GLY C C 71 176.324 175.671 0.653 1
1 911 . 11 1 1 A 71 71 GLY CA C 71 46.752 47.419 -0.667 1
1 912 . 11 1 1 A 71 71 GLY N N 71 104.509 108.970 -4.461 1
1 913 . 11 1 1 A 72 72 THR H H 72 7.295 7.730 -0.435 1
1 914 . 11 1 1 A 72 72 THR HA H 72 4.014 3.938 0.076 1
1 919 . 11 1 1 A 72 72 THR C C 72 175.135 175.948 -0.813 1
1 920 . 11 1 1 A 72 72 THR CA C 72 65.848 66.480 -0.632 1
1 921 . 11 1 1 A 72 72 THR CB C 72 68.160 68.231 -0.071 1
1 923 . 11 1 1 A 72 72 THR N N 72 118.617 117.545 1.072 1
1 924 . 11 1 1 A 73 73 ILE H H 73 7.883 7.989 -0.106 1
1 925 . 11 1 1 A 73 73 ILE HA H 73 3.258 3.514 -0.256 1
1 935 . 11 1 1 A 73 73 ILE C C 73 177.060 178.069 -1.009 1
1 936 . 11 1 1 A 73 73 ILE CA C 73 66.561 65.736 0.825 1
1 937 . 11 1 1 A 73 73 ILE CB C 73 37.339 37.747 -0.408 1
1 941 . 11 1 1 A 73 73 ILE N N 73 121.692 121.451 0.241 1
1 942 . 11 1 1 A 74 74 GLU H H 74 8.723 8.055 0.668 1
1 943 . 11 1 1 A 74 74 GLU HA H 74 3.807 3.913 -0.106 1
1 948 . 11 1 1 A 74 74 GLU C C 74 178.319 179.253 -0.934 1
1 949 . 11 1 1 A 74 74 GLU CA C 74 59.637 60.107 -0.470 1
1 950 . 11 1 1 A 74 74 GLU CB C 74 29.257 29.242 0.015 1
1 952 . 11 1 1 A 74 74 GLU N N 74 117.701 120.612 -2.911 1
1 953 . 11 1 1 A 75 75 LYS H H 75 7.361 7.286 0.075 1
1 954 . 11 1 1 A 75 75 LYS HA H 75 3.958 4.083 -0.125 1
1 963 . 11 1 1 A 75 75 LYS C C 75 178.554 179.519 -0.965 1
1 964 . 11 1 1 A 75 75 LYS CA C 75 59.764 59.250 0.514 1
1 965 . 11 1 1 A 75 75 LYS CB C 75 32.314 32.222 0.092 1
1 969 . 11 1 1 A 75 75 LYS N N 75 118.734 118.880 -0.146 1
1 970 . 11 1 1 A 76 76 ILE H H 76 7.713 7.385 0.328 1
1 971 . 11 1 1 A 76 76 ILE HA H 76 3.221 3.862 -0.641 1
1 981 . 11 1 1 A 76 76 ILE C C 76 177.504 178.188 -0.684 1
1 982 . 11 1 1 A 76 76 ILE CA C 76 65.796 64.463 1.333 1
1 983 . 11 1 1 A 76 76 ILE CB C 76 37.732 37.069 0.663 1
1 987 . 11 1 1 A 76 76 ILE N N 76 120.312 116.859 3.453 1
1 988 . 11 1 1 A 77 77 ILE H H 77 8.587 8.214 0.373 1
1 989 . 11 1 1 A 77 77 ILE HA H 77 3.778 3.525 0.253 1
1 999 . 11 1 1 A 77 77 ILE C C 77 177.074 177.813 -0.739 1
1 1000 . 11 1 1 A 77 77 ILE CA C 77 63.168 65.778 -2.610 1
1 1001 . 11 1 1 A 77 77 ILE CB C 77 36.617 37.868 -1.251 1
1 1005 . 11 1 1 A 77 77 ILE N N 77 118.978 121.734 -2.756 1
1 1006 . 11 1 1 A 78 78 LYS H H 78 8.050 7.767 0.283 1
1 1007 . 11 1 1 A 78 78 LYS HA H 78 3.925 3.990 -0.065 1
1 1016 . 11 1 1 A 78 78 LYS C C 78 178.291 179.325 -1.034 1
1 1017 . 11 1 1 A 78 78 LYS CA C 78 60.192 59.389 0.803 1
1 1018 . 11 1 1 A 78 78 LYS CB C 78 31.886 32.369 -0.483 1
1 1022 . 11 1 1 A 78 78 LYS N N 78 121.618 119.287 2.331 1
1 1023 . 11 1 1 A 79 79 VAL H H 79 7.619 7.814 -0.195 1
1 1024 . 11 1 1 A 79 79 VAL HA H 79 3.846 3.664 0.182 1
1 1032 . 11 1 1 A 79 79 VAL C C 79 177.712 178.318 -0.606 1
1 1033 . 11 1 1 A 79 79 VAL CA C 79 66.494 66.336 0.158 1
1 1034 . 11 1 1 A 79 79 VAL CB C 79 31.298 31.728 -0.430 1
1 1037 . 11 1 1 A 79 79 VAL N N 79 120.254 119.671 0.583 1
1 1038 . 11 1 1 A 80 80 ILE H H 80 7.885 8.071 -0.186 1
1 1039 . 11 1 1 A 80 80 ILE HA H 80 3.367 3.791 -0.424 1
1 1049 . 11 1 1 A 80 80 ILE C C 80 179.892 177.738 2.154 1
1 1050 . 11 1 1 A 80 80 ILE CA C 80 65.343 65.218 0.125 1
1 1051 . 11 1 1 A 80 80 ILE CB C 80 38.129 37.617 0.512 1
1 1055 . 11 1 1 A 80 80 ILE N N 80 119.666 120.747 -1.081 1
1 1056 . 11 1 1 A 81 81 ARG H H 81 9.384 8.165 1.219 1
1 1057 . 11 1 1 A 81 81 ARG HA H 81 3.834 3.971 -0.137 1
1 1065 . 11 1 1 A 81 81 ARG C C 81 178.204 179.493 -1.289 1
1 1066 . 11 1 1 A 81 81 ARG CA C 81 60.560 59.629 0.931 1
1 1067 . 11 1 1 A 81 81 ARG CB C 81 30.196 30.016 0.180 1
1 1070 . 11 1 1 A 81 81 ARG N N 81 121.030 120.477 0.553 1
1 1072 . 11 1 1 A 82 82 ASN H H 82 8.773 8.440 0.333 1
1 1073 . 11 1 1 A 82 82 ASN HA H 82 4.587 4.561 0.026 1
1 1078 . 11 1 1 A 82 82 ASN C C 82 178.300 177.824 0.476 1
1 1079 . 11 1 1 A 82 82 ASN CA C 82 56.160 56.000 0.160 1
1 1080 . 11 1 1 A 82 82 ASN CB C 82 38.464 38.042 0.422 1
1 1081 . 11 1 1 A 82 82 ASN N N 82 118.483 118.432 0.051 1
1 1083 . 11 1 1 A 83 83 SER H H 83 8.526 7.602 0.924 1
1 1084 . 11 1 1 A 83 83 SER HA H 83 2.765 3.575 -0.810 1
1 1087 . 11 1 1 A 83 83 SER C C 83 176.386 177.734 -1.348 1
1 1088 . 11 1 1 A 83 83 SER CA C 83 61.245 60.986 0.259 1
1 1089 . 11 1 1 A 83 83 SER CB C 83 61.287 62.003 -0.716 1
1 1090 . 11 1 1 A 83 83 SER N N 83 118.286 114.640 3.646 1
1 1091 . 11 1 1 A 84 84 LEU H H 84 7.782 8.128 -0.346 1
1 1092 . 11 1 1 A 84 84 LEU HA H 84 4.221 4.020 0.201 1
1 1102 . 11 1 1 A 84 84 LEU C C 84 177.846 179.320 -1.474 1
1 1103 . 11 1 1 A 84 84 LEU CA C 84 57.166 57.649 -0.483 1
1 1104 . 11 1 1 A 84 84 LEU CB C 84 40.520 41.154 -0.634 1
1 1108 . 11 1 1 A 84 84 LEU N N 84 127.445 122.301 5.144 1
1 1109 . 11 1 1 A 85 85 GLU H H 85 8.264 8.574 -0.310 1
1 1110 . 11 1 1 A 85 85 GLU HA H 85 3.981 3.985 -0.004 1
1 1115 . 11 1 1 A 85 85 GLU C C 85 179.288 179.174 0.114 1
1 1116 . 11 1 1 A 85 85 GLU CA C 85 59.025 59.795 -0.770 1
1 1117 . 11 1 1 A 85 85 GLU CB C 85 29.182 29.233 -0.051 1
1 1119 . 11 1 1 A 85 85 GLU N N 85 121.538 120.348 1.190 1
1 1120 . 11 1 1 A 86 86 HIS H H 86 7.683 7.988 -0.305 1
1 1121 . 11 1 1 A 86 86 HIS HA H 86 4.573 4.346 0.227 1
1 1125 . 11 1 1 A 86 86 HIS C C 86 175.484 177.650 -2.166 1
1 1126 . 11 1 1 A 86 86 HIS CA C 86 58.940 59.489 -0.549 1
1 1127 . 11 1 1 A 86 86 HIS CB C 86 29.267 29.905 -0.638 1
1 1129 . 11 1 1 A 86 86 HIS N N 86 117.087 120.614 -3.527 1
1 1130 . 11 1 1 A 87 87 ALA H H 87 7.197 8.138 -0.941 1
1 1131 . 11 1 1 A 87 87 ALA HA H 87 3.925 3.864 0.061 1
1 1135 . 11 1 1 A 87 87 ALA C C 87 179.038 180.140 -1.102 1
1 1136 . 11 1 1 A 87 87 ALA CA C 87 54.863 54.910 -0.047 1
1 1137 . 11 1 1 A 87 87 ALA CB C 87 17.034 18.354 -1.320 1
1 1138 . 11 1 1 A 87 87 ALA N N 87 121.510 120.833 0.677 1
1 1139 . 11 1 1 A 88 88 ILE H H 88 7.819 7.559 0.260 1
1 1140 . 11 1 1 A 88 88 ILE HA H 88 4.067 3.899 0.168 1
1 1150 . 11 1 1 A 88 88 ILE C C 88 180.846 177.458 3.388 1
1 1151 . 11 1 1 A 88 88 ILE CA C 88 64.021 65.273 -1.252 1
1 1152 . 11 1 1 A 88 88 ILE CB C 88 37.557 37.635 -0.078 1
1 1156 . 11 1 1 A 88 88 ILE N N 88 120.898 119.346 1.552 1
1 1157 . 11 1 1 A 89 89 ASP H H 89 7.808 7.963 -0.155 1
1 1158 . 11 1 1 A 89 89 ASP HA H 89 4.437 4.372 0.065 1
1 1161 . 11 1 1 A 89 89 ASP C C 89 178.033 177.580 0.453 1
1 1162 . 11 1 1 A 89 89 ASP CA C 89 57.343 57.181 0.162 1
1 1163 . 11 1 1 A 89 89 ASP CB C 89 39.689 41.817 -2.128 1
1 1164 . 11 1 1 A 89 89 ASP N N 89 125.174 121.302 3.872 1
1 1165 . 11 1 1 A 90 90 LEU H H 90 7.607 7.526 0.081 1
1 1166 . 11 1 1 A 90 90 LEU HA H 90 4.198 4.222 -0.024 1
1 1176 . 11 1 1 A 90 90 LEU C C 90 175.416 176.024 -0.608 1
1 1177 . 11 1 1 A 90 90 LEU CA C 90 54.755 55.111 -0.356 1
1 1178 . 11 1 1 A 90 90 LEU CB C 90 42.960 41.754 1.206 1
1 1182 . 11 1 1 A 90 90 LEU N N 90 117.576 117.311 0.265 1
1 1183 . 11 1 1 A 91 91 GLU H H 91 8.143 7.894 0.249 1
1 1184 . 11 1 1 A 91 91 GLU HA H 91 4.005 4.054 -0.049 1
1 1189 . 11 1 1 A 91 91 GLU C C 91 175.792 176.162 -0.370 1
1 1190 . 11 1 1 A 91 91 GLU CA C 91 57.202 57.569 -0.367 1
1 1191 . 11 1 1 A 91 91 GLU CB C 91 26.125 27.176 -1.051 1
1 1193 . 11 1 1 A 91 91 GLU N N 91 113.620 115.308 -1.688 1
1 1194 . 11 1 1 A 92 92 LEU H H 92 8.290 7.878 0.412 1
1 1195 . 11 1 1 A 92 92 LEU HA H 92 4.216 4.226 -0.010 1
1 1205 . 11 1 1 A 92 92 LEU C C 92 176.622 176.914 -0.292 1
1 1206 . 11 1 1 A 92 92 LEU CA C 92 56.410 56.356 0.054 1
1 1207 . 11 1 1 A 92 92 LEU CB C 92 43.378 42.366 1.012 1
1 1211 . 11 1 1 A 92 92 LEU N N 92 116.868 119.626 -2.758 1
1 1212 . 11 1 1 A 93 93 ILE H H 93 6.988 6.861 0.127 1
1 1213 . 11 1 1 A 93 93 ILE HA H 93 4.580 4.618 -0.038 1
1 1223 . 11 1 1 A 93 93 ILE C C 93 175.145 175.340 -0.195 1
1 1224 . 11 1 1 A 93 93 ILE CA C 93 58.707 58.431 0.276 1
1 1225 . 11 1 1 A 93 93 ILE CB C 93 42.864 41.133 1.731 1
1 1229 . 11 1 1 A 93 93 ILE N N 93 107.565 113.936 -6.371 1
1 1230 . 11 1 1 A 94 94 THR H H 94 8.742 8.669 0.073 1
1 1231 . 11 1 1 A 94 94 THR HA H 94 4.489 4.344 0.145 1
1 1236 . 11 1 1 A 94 94 THR C C 94 173.875 174.523 -0.648 1
1 1237 . 11 1 1 A 94 94 THR CA C 94 61.842 62.736 -0.894 1
1 1238 . 11 1 1 A 94 94 THR CB C 94 69.972 69.010 0.962 1
1 1240 . 11 1 1 A 94 94 THR N N 94 107.904 114.562 -6.658 1
1 1241 . 11 1 1 A 95 95 LYS H H 95 7.294 7.430 -0.136 1
1 1242 . 11 1 1 A 95 95 LYS HA H 95 4.566 4.725 -0.159 1
1 1251 . 11 1 1 A 95 95 LYS C C 95 173.791 174.030 -0.239 1
1 1252 . 11 1 1 A 95 95 LYS CA C 95 54.533 55.822 -1.289 1
1 1253 . 11 1 1 A 95 95 LYS CB C 95 35.123 36.133 -1.010 1
1 1257 . 11 1 1 A 95 95 LYS N N 95 119.458 120.638 -1.180 1
1 1258 . 11 1 1 A 96 96 ASN H H 96 9.157 8.550 0.607 1
1 1259 . 11 1 1 A 96 96 ASN HA H 96 4.408 5.136 -0.728 1
1 1264 . 11 1 1 A 96 96 ASN C C 96 176.653 175.617 1.036 1
1 1265 . 11 1 1 A 96 96 ASN CA C 96 51.088 51.388 -0.300 1
1 1266 . 11 1 1 A 96 96 ASN CB C 96 37.292 41.152 -3.860 1
1 1267 . 11 1 1 A 96 96 ASN N N 96 121.031 123.755 -2.724 1
1 1269 . 11 1 1 A 97 97 VAL H H 97 8.193 8.356 -0.163 1
1 1270 . 11 1 1 A 97 97 VAL HA H 97 4.019 4.348 -0.329 1
1 1278 . 11 1 1 A 97 97 VAL C C 97 175.089 176.506 -1.417 1
1 1279 . 11 1 1 A 97 97 VAL CA C 97 63.437 61.739 1.698 1
1 1280 . 11 1 1 A 97 97 VAL CB C 97 29.934 31.996 -2.062 1
1 1283 . 11 1 1 A 97 97 VAL N N 97 118.839 116.631 2.208 1
1 1284 . 11 1 1 A 98 98 ALA H H 98 7.994 7.764 0.230 1
1 1285 . 11 1 1 A 98 98 ALA HA H 98 5.108 4.361 0.747 1
1 1289 . 11 1 1 A 98 98 ALA C C 98 178.033 179.815 -1.782 1
1 1290 . 11 1 1 A 98 98 ALA CA C 98 50.342 54.582 -4.240 1
1 1291 . 11 1 1 A 98 98 ALA CB C 98 19.659 18.435 1.224 1
1 1292 . 11 1 1 A 98 98 ALA N N 98 121.031 125.589 -4.558 1
1 1293 . 11 1 1 A 99 99 ALA H H 99 7.347 7.866 -0.519 1
1 1294 . 11 1 1 A 99 99 ALA HA H 99 3.818 3.994 -0.176 1
1 1298 . 11 1 1 A 99 99 ALA C C 99 177.712 178.893 -1.181 1
1 1299 . 11 1 1 A 99 99 ALA CA C 99 55.117 55.173 -0.056 1
1 1300 . 11 1 1 A 99 99 ALA CB C 99 18.879 18.437 0.442 1
1 1301 . 11 1 1 A 99 99 ALA N N 99 122.816 120.532 2.284 1
1 1302 . 11 1 1 A 100 100 LYS H H 100 8.190 7.846 0.344 1
1 1303 . 11 1 1 A 100 100 LYS HA H 100 4.483 4.335 0.148 1
1 1312 . 11 1 1 A 100 100 LYS C C 100 175.899 177.244 -1.345 1
1 1313 . 11 1 1 A 100 100 LYS CA C 100 54.231 57.559 -3.328 1
1 1314 . 11 1 1 A 100 100 LYS CB C 100 32.066 32.711 -0.645 1
1 1318 . 11 1 1 A 100 100 LYS N N 100 113.197 115.627 -2.430 1
1 1319 . 11 1 1 A 101 101 THR H H 101 7.128 7.334 -0.206 1
1 1320 . 11 1 1 A 101 101 THR HA H 101 3.834 4.262 -0.428 1
1 1325 . 11 1 1 A 101 101 THR C C 101 173.255 173.411 -0.156 1
1 1326 . 11 1 1 A 101 101 THR CA C 101 64.392 62.721 1.671 1
1 1327 . 11 1 1 A 101 101 THR CB C 101 69.160 68.028 1.132 1
1 1329 . 11 1 1 A 101 101 THR N N 101 118.368 116.166 2.202 1
1 1330 . 11 1 1 A 102 102 LYS H H 102 8.753 8.607 0.146 1
1 1331 . 11 1 1 A 102 102 LYS HA H 102 4.438 5.124 -0.686 1
1 1340 . 11 1 1 A 102 102 LYS C C 102 175.627 175.367 0.260 1
1 1341 . 11 1 1 A 102 102 LYS CA C 102 55.117 54.715 0.402 1
1 1342 . 11 1 1 A 102 102 LYS CB C 102 33.901 35.280 -1.379 1
1 1346 . 11 1 1 A 102 102 LYS N N 102 126.513 124.403 2.110 1
1 1347 . 11 1 1 A 103 103 LEU H H 103 8.602 8.367 0.235 1
1 1348 . 11 1 1 A 103 103 LEU HA H 103 4.486 4.680 -0.194 1
1 1358 . 11 1 1 A 103 103 LEU CA C 103 52.233 52.550 -0.317 1
1 1359 . 11 1 1 A 103 103 LEU CB C 103 41.028 43.210 -2.182 1
1 1363 . 11 1 1 A 103 103 LEU N N 103 124.466 122.812 1.654 1
1 1364 . 11 1 1 A 104 104 PRO HA H 104 4.437 4.690 -0.253 1
1 1371 . 11 1 1 A 104 104 PRO C C 104 175.779 176.148 -0.369 1
1 1372 . 11 1 1 A 104 104 PRO CA C 104 62.322 62.167 0.155 1
1 1373 . 11 1 1 A 104 104 PRO CB C 104 31.899 32.812 -0.913 1
1 1376 . 11 1 1 A 105 105 LYS H H 105 8.460 8.443 0.017 1
1 1377 . 11 1 1 A 105 105 LYS HA H 105 4.154 4.368 -0.214 1
1 1386 . 11 1 1 A 105 105 LYS C C 105 175.998 175.544 0.454 1
1 1387 . 11 1 1 A 105 105 LYS CA C 105 56.480 55.800 0.680 1
1 1388 . 11 1 1 A 105 105 LYS CB C 105 32.909 31.321 1.588 1
1 1392 . 11 1 1 A 105 105 LYS N N 105 122.139 120.765 1.374 1
1 1393 . 11 1 1 A 106 106 ALA H H 106 8.448 8.090 0.358 1
1 1394 . 11 1 1 A 106 106 ALA HA H 106 4.309 4.272 0.037 1
1 1398 . 11 1 1 A 106 106 ALA C C 106 176.828 176.667 0.161 1
1 1399 . 11 1 1 A 106 106 ALA CA C 106 51.862 51.857 0.005 1
1 1400 . 11 1 1 A 106 106 ALA CB C 106 19.323 19.410 -0.087 1
1 1401 . 11 1 1 A 106 106 ALA N N 106 125.278 126.708 -1.430 1
1 1402 . 11 1 1 A 107 107 ASP H H 107 8.428 8.531 -0.103 1
1 1403 . 11 1 1 A 107 107 ASP HA H 107 4.574 4.563 0.011 1
1 1406 . 11 1 1 A 107 107 ASP C C 107 175.951 175.197 0.754 1
1 1407 . 11 1 1 A 107 107 ASP CA C 107 54.214 54.956 -0.742 1
1 1408 . 11 1 1 A 107 107 ASP CB C 107 41.141 40.990 0.151 1
1 1409 . 11 1 1 A 107 107 ASP N N 107 120.771 121.257 -0.486 1
1 1410 . 11 1 1 A 108 108 LYS H H 108 8.329 8.269 0.060 1
1 1411 . 11 1 1 A 108 108 LYS HA H 108 4.203 4.578 -0.375 1
1 1420 . 11 1 1 A 108 108 LYS C C 108 176.483 174.377 2.106 1
1 1421 . 11 1 1 A 108 108 LYS CA C 108 56.831 55.711 1.120 1
1 1422 . 11 1 1 A 108 108 LYS CB C 108 32.648 36.029 -3.381 1
1 1426 . 11 1 1 A 108 108 LYS N N 108 120.727 125.732 -5.005 1
1 1427 . 11 1 1 A 109 109 GLU H H 109 8.447 8.560 -0.113 1
1 1428 . 11 1 1 A 109 109 GLU HA H 109 4.215 4.256 -0.041 1
1 1433 . 11 1 1 A 109 109 GLU C C 109 176.513 177.740 -1.227 1
1 1434 . 11 1 1 A 109 109 GLU CA C 109 56.936 56.145 0.791 1
1 1435 . 11 1 1 A 109 109 GLU CB C 109 29.833 30.014 -0.181 1
1 1437 . 11 1 1 A 109 109 GLU N N 109 121.471 123.575 -2.104 1
1 1438 . 11 1 1 A 110 110 GLU H H 110 8.352 8.393 -0.041 1
1 1439 . 11 1 1 A 110 110 GLU HA H 110 4.233 4.286 -0.053 1
1 1444 . 11 1 1 A 110 110 GLU C C 110 176.439 177.142 -0.703 1
1 1445 . 11 1 1 A 110 110 GLU CA C 110 56.681 55.383 1.298 1
1 1446 . 11 1 1 A 110 110 GLU CB C 110 29.860 28.932 0.928 1
1 1448 . 11 1 1 A 110 110 GLU N N 110 121.559 118.569 2.990 1
1 1449 . 11 1 1 A 111 111 LEU H H 111 8.145 7.707 0.438 1
1 1450 . 11 1 1 A 111 111 LEU HA H 111 4.251 3.897 0.354 1
1 1460 . 11 1 1 A 111 111 LEU C C 111 177.306 179.173 -1.867 1
1 1461 . 11 1 1 A 111 111 LEU CA C 111 55.277 57.852 -2.575 1
1 1462 . 11 1 1 A 111 111 LEU CB C 111 42.054 41.260 0.794 1
1 1466 . 11 1 1 A 111 111 LEU N N 111 122.181 122.182 -0.001 1
1 1467 . 11 1 1 A 112 112 GLU H H 112 8.212 8.335 -0.123 1
1 1468 . 11 1 1 A 112 112 GLU N N 112 120.291 119.494 0.797 1
1 1469 . 11 1 1 A 114 114 HIS C C 114 176.070 174.984 1.086 1
1 1470 . 11 1 1 A 116 116 HIS H H 116 8.227 8.728 -0.501 1
1 1471 . 11 1 1 A 116 116 HIS C C 116 173.580 177.096 -3.516 1
1 1472 . 11 1 1 A 116 116 HIS N N 116 119.156 122.951 -3.795 1
1 5 . 12 1 1 A 3 3 PRO HA H 3 4.390 4.712 -0.322 1
1 12 . 12 1 1 A 3 3 PRO C C 3 176.847 176.893 -0.046 1
1 13 . 12 1 1 A 3 3 PRO CA C 3 63.449 62.655 0.794 1
1 14 . 12 1 1 A 3 3 PRO CB C 3 31.938 33.466 -1.528 1
1 17 . 12 1 1 A 4 4 SER H H 4 8.531 8.695 -0.164 1
1 18 . 12 1 1 A 4 4 SER HA H 4 4.262 4.635 -0.373 1
1 21 . 12 1 1 A 4 4 SER C C 4 175.414 174.285 1.129 1
1 22 . 12 1 1 A 4 4 SER CA C 4 59.163 57.941 1.222 1
1 23 . 12 1 1 A 4 4 SER CB C 4 63.242 62.640 0.602 1
1 24 . 12 1 1 A 4 4 SER N N 4 114.246 118.154 -3.908 1
1 25 . 12 1 1 A 5 5 LYS H H 5 8.468 7.723 0.745 1
1 26 . 12 1 1 A 5 5 LYS HA H 5 4.433 4.277 0.156 1
1 35 . 12 1 1 A 5 5 LYS C C 5 175.984 176.822 -0.838 1
1 36 . 12 1 1 A 5 5 LYS CA C 5 55.724 57.470 -1.746 1
1 37 . 12 1 1 A 5 5 LYS CB C 5 32.881 32.529 0.352 1
1 41 . 12 1 1 A 5 5 LYS N N 5 123.488 121.811 1.677 1
1 42 . 12 1 1 A 6 6 LEU H H 6 7.707 7.355 0.352 1
1 43 . 12 1 1 A 6 6 LEU HA H 6 4.381 4.365 0.016 1
1 53 . 12 1 1 A 6 6 LEU C C 6 177.820 176.359 1.461 1
1 54 . 12 1 1 A 6 6 LEU CA C 6 55.507 54.802 0.705 1
1 55 . 12 1 1 A 6 6 LEU CB C 6 43.374 42.825 0.549 1
1 59 . 12 1 1 A 6 6 LEU N N 6 121.233 123.494 -2.261 1
1 60 . 12 1 1 A 7 7 SER H H 7 9.433 8.865 0.568 1
1 61 . 12 1 1 A 7 7 SER HA H 7 4.638 4.566 0.072 1
1 64 . 12 1 1 A 7 7 SER C C 7 174.120 175.129 -1.009 1
1 65 . 12 1 1 A 7 7 SER CA C 7 57.962 58.752 -0.790 1
1 66 . 12 1 1 A 7 7 SER CB C 7 64.197 64.230 -0.033 1
1 67 . 12 1 1 A 7 7 SER N N 7 122.977 122.965 0.012 1
1 68 . 12 1 1 A 8 8 TYR H H 8 9.764 9.172 0.592 1
1 69 . 12 1 1 A 8 8 TYR HA H 8 4.732 4.237 0.495 1
1 76 . 12 1 1 A 8 8 TYR C C 8 177.206 177.764 -0.558 1
1 77 . 12 1 1 A 8 8 TYR CA C 8 58.762 61.819 -3.057 1
1 78 . 12 1 1 A 8 8 TYR CB C 8 36.605 38.754 -2.149 1
1 83 . 12 1 1 A 8 8 TYR N N 8 123.312 124.431 -1.119 1
1 84 . 12 1 1 A 9 9 GLY H H 9 10.131 8.240 1.891 1
1 85 . 12 1 1 A 9 9 GLY HA2 H 9 3.983 3.558 0.425 1
1 86 . 12 1 1 A 9 9 GLY HA3 H 9 3.423 3.668 -0.245 1
1 87 . 12 1 1 A 9 9 GLY C C 9 175.163 176.291 -1.128 1
1 88 . 12 1 1 A 9 9 GLY CA C 9 47.153 47.198 -0.045 1
1 89 . 12 1 1 A 9 9 GLY N N 9 107.177 105.249 1.928 1
1 90 . 12 1 1 A 10 10 GLU H H 10 7.876 7.982 -0.106 1
1 91 . 12 1 1 A 10 10 GLU HA H 10 4.107 4.094 0.013 1
1 96 . 12 1 1 A 10 10 GLU C C 10 179.924 178.960 0.964 1
1 97 . 12 1 1 A 10 10 GLU CA C 10 58.890 59.452 -0.562 1
1 98 . 12 1 1 A 10 10 GLU CB C 10 29.750 29.480 0.270 1
1 100 . 12 1 1 A 10 10 GLU N N 10 122.219 121.854 0.365 1
1 101 . 12 1 1 A 11 11 TYR H H 11 8.384 8.301 0.083 1
1 102 . 12 1 1 A 11 11 TYR HA H 11 4.305 4.213 0.092 1
1 107 . 12 1 1 A 11 11 TYR C C 11 176.854 177.156 -0.302 1
1 108 . 12 1 1 A 11 11 TYR CA C 11 61.040 61.535 -0.495 1
1 109 . 12 1 1 A 11 11 TYR CB C 11 37.593 39.123 -1.530 1
1 112 . 12 1 1 A 11 11 TYR N N 11 120.809 122.641 -1.832 1
1 113 . 12 1 1 A 12 12 LEU H H 12 9.027 8.339 0.688 1
1 114 . 12 1 1 A 12 12 LEU HA H 12 3.778 3.820 -0.042 1
1 124 . 12 1 1 A 12 12 LEU C C 12 178.621 179.384 -0.763 1
1 125 . 12 1 1 A 12 12 LEU CA C 12 57.534 57.426 0.108 1
1 126 . 12 1 1 A 12 12 LEU CB C 12 41.957 40.774 1.183 1
1 130 . 12 1 1 A 12 12 LEU N N 12 121.080 119.042 2.038 1
1 131 . 12 1 1 A 13 13 GLU H H 13 7.614 7.869 -0.255 1
1 132 . 12 1 1 A 13 13 GLU HA H 13 4.102 4.089 0.013 1
1 137 . 12 1 1 A 13 13 GLU C C 13 178.449 178.870 -0.421 1
1 138 . 12 1 1 A 13 13 GLU CA C 13 59.609 59.350 0.259 1
1 139 . 12 1 1 A 13 13 GLU CB C 13 29.124 29.451 -0.327 1
1 141 . 12 1 1 A 13 13 GLU N N 13 118.475 120.880 -2.405 1
1 142 . 12 1 1 A 14 14 SER H H 14 7.329 7.386 -0.057 1
1 143 . 12 1 1 A 14 14 SER HA H 14 4.358 4.238 0.120 1
1 146 . 12 1 1 A 14 14 SER C C 14 176.794 176.737 0.057 1
1 147 . 12 1 1 A 14 14 SER CA C 14 61.064 61.371 -0.307 1
1 148 . 12 1 1 A 14 14 SER CB C 14 62.513 62.660 -0.147 1
1 149 . 12 1 1 A 14 14 SER N N 14 115.209 114.629 0.580 1
1 150 . 12 1 1 A 15 15 TRP H H 15 8.870 8.189 0.681 1
1 151 . 12 1 1 A 15 15 TRP HA H 15 4.005 4.331 -0.326 1
1 160 . 12 1 1 A 15 15 TRP C C 15 177.547 177.889 -0.342 1
1 161 . 12 1 1 A 15 15 TRP CA C 15 61.210 61.211 -0.001 1
1 162 . 12 1 1 A 15 15 TRP CB C 15 27.341 29.411 -2.070 1
1 168 . 12 1 1 A 15 15 TRP N N 15 124.998 123.785 1.213 1
1 170 . 12 1 1 A 16 16 PHE H H 16 9.087 8.256 0.831 1
1 171 . 12 1 1 A 16 16 PHE HA H 16 3.210 3.673 -0.463 1
1 179 . 12 1 1 A 16 16 PHE C C 16 175.909 177.677 -1.768 1
1 180 . 12 1 1 A 16 16 PHE CA C 16 61.473 61.333 0.140 1
1 181 . 12 1 1 A 16 16 PHE CB C 16 38.506 38.900 -0.394 1
1 187 . 12 1 1 A 16 16 PHE N N 16 119.825 120.946 -1.121 1
1 188 . 12 1 1 A 17 17 ASN H H 17 7.768 7.906 -0.138 1
1 189 . 12 1 1 A 17 17 ASN HA H 17 4.078 4.187 -0.109 1
1 194 . 12 1 1 A 17 17 ASN C C 17 176.604 177.834 -1.230 1
1 195 . 12 1 1 A 17 17 ASN CA C 17 55.621 56.203 -0.582 1
1 196 . 12 1 1 A 17 17 ASN CB C 17 37.830 37.526 0.304 1
1 197 . 12 1 1 A 17 17 ASN N N 17 115.600 117.608 -2.008 1
1 199 . 12 1 1 A 18 18 THR H H 18 7.454 7.729 -0.275 1
1 200 . 12 1 1 A 18 18 THR HA H 18 4.147 4.045 0.102 1
1 205 . 12 1 1 A 18 18 THR C C 18 175.692 175.865 -0.173 1
1 206 . 12 1 1 A 18 18 THR CA C 18 64.679 66.921 -2.242 1
1 207 . 12 1 1 A 18 18 THR CB C 18 68.940 67.939 1.001 1
1 209 . 12 1 1 A 18 18 THR N N 18 113.049 116.785 -3.736 1
1 210 . 12 1 1 A 19 19 LYS H H 19 7.918 7.406 0.512 1
1 211 . 12 1 1 A 19 19 LYS HA H 19 3.791 3.771 0.020 1
1 220 . 12 1 1 A 19 19 LYS C C 19 178.120 178.567 -0.447 1
1 221 . 12 1 1 A 19 19 LYS CA C 19 55.985 58.708 -2.723 1
1 222 . 12 1 1 A 19 19 LYS CB C 19 31.130 31.121 0.009 1
1 226 . 12 1 1 A 19 19 LYS N N 19 122.614 119.900 2.714 1
1 227 . 12 1 1 A 20 20 ARG H H 20 7.845 7.607 0.238 1
1 228 . 12 1 1 A 20 20 ARG HA H 20 3.396 3.813 -0.417 1
1 236 . 12 1 1 A 20 20 ARG C C 20 175.601 177.589 -1.988 1
1 237 . 12 1 1 A 20 20 ARG CA C 20 58.182 57.758 0.424 1
1 238 . 12 1 1 A 20 20 ARG CB C 20 28.045 29.787 -1.742 1
1 241 . 12 1 1 A 20 20 ARG N N 20 116.282 117.693 -1.411 1
1 243 . 12 1 1 A 21 21 HIS H H 21 7.163 7.587 -0.424 1
1 244 . 12 1 1 A 21 21 HIS HA H 21 4.500 4.356 0.144 1
1 249 . 12 1 1 A 21 21 HIS C C 21 175.618 175.799 -0.181 1
1 250 . 12 1 1 A 21 21 HIS CA C 21 56.912 58.812 -1.900 1
1 251 . 12 1 1 A 21 21 HIS CB C 21 29.400 29.353 0.047 1
1 254 . 12 1 1 A 21 21 HIS N N 21 115.452 118.242 -2.790 1
1 255 . 12 1 1 A 22 22 SER H H 22 7.951 7.604 0.347 1
1 256 . 12 1 1 A 22 22 SER HA H 22 4.573 4.438 0.135 1
1 259 . 12 1 1 A 22 22 SER C C 22 173.948 173.834 0.114 1
1 260 . 12 1 1 A 22 22 SER CA C 22 58.589 58.441 0.148 1
1 261 . 12 1 1 A 22 22 SER CB C 22 64.228 64.473 -0.245 1
1 262 . 12 1 1 A 22 22 SER N N 22 113.209 112.636 0.573 1
1 263 . 12 1 1 A 23 23 VAL H H 23 7.179 6.888 0.291 1
1 264 . 12 1 1 A 23 23 VAL HA H 23 4.626 4.655 -0.029 1
1 272 . 12 1 1 A 23 23 VAL C C 23 175.397 175.806 -0.409 1
1 273 . 12 1 1 A 23 23 VAL CA C 23 59.556 59.634 -0.078 1
1 274 . 12 1 1 A 23 23 VAL CB C 23 33.810 34.987 -1.177 1
1 277 . 12 1 1 A 23 23 VAL N N 23 113.108 117.060 -3.952 1
1 278 . 12 1 1 A 24 24 GLY H H 24 8.189 8.597 -0.408 1
1 279 . 12 1 1 A 24 24 GLY HA2 H 24 4.074 3.988 0.086 1
1 280 . 12 1 1 A 24 24 GLY HA3 H 24 4.195 4.013 0.182 1
1 281 . 12 1 1 A 24 24 GLY C C 24 174.037 174.201 -0.164 1
1 282 . 12 1 1 A 24 24 GLY CA C 24 44.452 44.720 -0.268 1
1 283 . 12 1 1 A 24 24 GLY N N 24 108.374 109.172 -0.798 1
1 284 . 12 1 1 A 25 25 ILE H H 25 8.331 8.646 -0.315 1
1 285 . 12 1 1 A 25 25 ILE HA H 25 3.839 3.645 0.194 1
1 295 . 12 1 1 A 25 25 ILE C C 25 178.042 177.784 0.258 1
1 296 . 12 1 1 A 25 25 ILE CA C 25 64.238 64.438 -0.200 1
1 297 . 12 1 1 A 25 25 ILE CB C 25 37.931 37.398 0.533 1
1 301 . 12 1 1 A 25 25 ILE N N 25 119.895 119.100 0.795 1
1 302 . 12 1 1 A 26 26 GLN H H 26 8.545 8.618 -0.073 1
1 303 . 12 1 1 A 26 26 GLN HA H 26 4.129 4.042 0.087 1
1 310 . 12 1 1 A 26 26 GLN C C 26 178.454 177.719 0.735 1
1 311 . 12 1 1 A 26 26 GLN CA C 26 58.772 58.046 0.726 1
1 312 . 12 1 1 A 26 26 GLN CB C 26 27.346 27.881 -0.535 1
1 314 . 12 1 1 A 26 26 GLN N N 26 120.013 119.856 0.157 1
1 316 . 12 1 1 A 27 27 THR H H 27 7.944 7.741 0.203 1
1 317 . 12 1 1 A 27 27 THR HA H 27 3.953 3.926 0.027 1
1 322 . 12 1 1 A 27 27 THR C C 27 175.818 175.904 -0.086 1
1 323 . 12 1 1 A 27 27 THR CA C 27 65.855 66.570 -0.715 1
1 324 . 12 1 1 A 27 27 THR CB C 27 68.127 68.664 -0.537 1
1 326 . 12 1 1 A 27 27 THR N N 27 117.645 116.812 0.833 1
1 327 . 12 1 1 A 28 28 ALA H H 28 8.593 8.321 0.272 1
1 328 . 12 1 1 A 28 28 ALA HA H 28 3.899 4.110 -0.211 1
1 332 . 12 1 1 A 28 28 ALA C C 28 178.515 179.705 -1.190 1
1 333 . 12 1 1 A 28 28 ALA CA C 28 55.742 55.521 0.221 1
1 334 . 12 1 1 A 28 28 ALA CB C 28 17.513 18.145 -0.632 1
1 335 . 12 1 1 A 28 28 ALA N N 28 123.917 123.739 0.178 1
1 336 . 12 1 1 A 29 29 LYS H H 29 7.800 7.968 -0.168 1
1 337 . 12 1 1 A 29 29 LYS HA H 29 3.982 3.978 0.004 1
1 346 . 12 1 1 A 29 29 LYS C C 29 179.527 178.855 0.672 1
1 347 . 12 1 1 A 29 29 LYS CA C 29 59.761 59.581 0.180 1
1 348 . 12 1 1 A 29 29 LYS CB C 29 32.223 32.471 -0.248 1
1 352 . 12 1 1 A 29 29 LYS N N 29 117.474 118.853 -1.379 1
1 353 . 12 1 1 A 30 30 VAL H H 30 7.591 7.630 -0.039 1
1 354 . 12 1 1 A 30 30 VAL HA H 30 3.503 3.339 0.164 1
1 362 . 12 1 1 A 30 30 VAL C C 30 178.389 177.982 0.407 1
1 363 . 12 1 1 A 30 30 VAL CA C 30 65.640 65.911 -0.271 1
1 364 . 12 1 1 A 30 30 VAL CB C 30 31.644 31.532 0.112 1
1 367 . 12 1 1 A 30 30 VAL N N 30 121.749 120.336 1.413 1
1 368 . 12 1 1 A 31 31 LEU H H 31 8.333 8.052 0.281 1
1 369 . 12 1 1 A 31 31 LEU HA H 31 4.074 4.008 0.066 1
1 379 . 12 1 1 A 31 31 LEU C C 31 177.780 179.265 -1.485 1
1 380 . 12 1 1 A 31 31 LEU CA C 31 58.157 57.988 0.169 1
1 381 . 12 1 1 A 31 31 LEU CB C 31 42.230 41.098 1.132 1
1 385 . 12 1 1 A 31 31 LEU N N 31 120.901 119.163 1.738 1
1 386 . 12 1 1 A 32 32 LYS H H 32 8.562 8.160 0.402 1
1 387 . 12 1 1 A 32 32 LYS HA H 32 3.290 3.739 -0.449 1
1 395 . 12 1 1 A 32 32 LYS C C 32 178.037 178.692 -0.655 1
1 396 . 12 1 1 A 32 32 LYS CA C 32 58.911 59.663 -0.752 1
1 397 . 12 1 1 A 32 32 LYS CB C 32 31.605 31.735 -0.130 1
1 401 . 12 1 1 A 32 32 LYS N N 32 119.075 119.450 -0.375 1
1 402 . 12 1 1 A 33 33 GLY H H 33 7.694 7.998 -0.304 1
1 403 . 12 1 1 A 33 33 GLY HA2 H 33 3.949 3.623 0.326 1
1 404 . 12 1 1 A 33 33 GLY HA3 H 33 3.826 3.699 0.127 1
1 405 . 12 1 1 A 33 33 GLY C C 33 177.101 176.560 0.541 1
1 406 . 12 1 1 A 33 33 GLY CA C 33 46.928 46.984 -0.056 1
1 407 . 12 1 1 A 33 33 GLY N N 33 105.282 106.587 -1.305 1
1 408 . 12 1 1 A 34 34 TYR H H 34 8.015 7.458 0.557 1
1 409 . 12 1 1 A 34 34 TYR HA H 34 4.558 4.696 -0.138 1
1 416 . 12 1 1 A 34 34 TYR C C 34 179.611 178.059 1.552 1
1 417 . 12 1 1 A 34 34 TYR CA C 34 59.349 60.274 -0.925 1
1 418 . 12 1 1 A 34 34 TYR CB C 34 37.344 38.369 -1.025 1
1 423 . 12 1 1 A 34 34 TYR N N 34 121.781 121.764 0.017 1
1 424 . 12 1 1 A 35 35 LEU H H 35 8.689 8.151 0.538 1
1 425 . 12 1 1 A 35 35 LEU HA H 35 3.977 3.832 0.145 1
1 435 . 12 1 1 A 35 35 LEU C C 35 177.081 178.763 -1.682 1
1 436 . 12 1 1 A 35 35 LEU CA C 35 59.155 58.432 0.723 1
1 437 . 12 1 1 A 35 35 LEU CB C 35 41.103 41.701 -0.598 1
1 441 . 12 1 1 A 35 35 LEU N N 35 120.392 120.554 -0.162 1
1 442 . 12 1 1 A 36 36 ASN H H 36 8.721 8.398 0.323 1
1 443 . 12 1 1 A 36 36 ASN HA H 36 4.435 4.426 0.009 1
1 448 . 12 1 1 A 36 36 ASN C C 36 176.792 177.456 -0.664 1
1 449 . 12 1 1 A 36 36 ASN CA C 36 55.642 55.817 -0.175 1
1 450 . 12 1 1 A 36 36 ASN CB C 36 38.319 37.309 1.010 1
1 451 . 12 1 1 A 36 36 ASN N N 36 114.623 116.101 -1.478 1
1 453 . 12 1 1 A 37 37 SER H H 37 8.511 8.018 0.493 1
1 454 . 12 1 1 A 37 37 SER HA H 37 4.642 4.364 0.278 1
1 457 . 12 1 1 A 37 37 SER C C 37 175.039 176.179 -1.140 1
1 458 . 12 1 1 A 37 37 SER CA C 37 59.825 61.295 -1.470 1
1 459 . 12 1 1 A 37 37 SER CB C 37 64.056 62.963 1.093 1
1 460 . 12 1 1 A 37 37 SER N N 37 110.941 114.912 -3.971 1
1 461 . 12 1 1 A 38 38 ARG H H 38 7.242 8.182 -0.940 1
1 462 . 12 1 1 A 38 38 ARG HA H 38 4.919 4.457 0.462 1
1 469 . 12 1 1 A 38 38 ARG C C 38 176.514 178.317 -1.803 1
1 470 . 12 1 1 A 38 38 ARG CA C 38 56.687 57.954 -1.267 1
1 471 . 12 1 1 A 38 38 ARG CB C 38 32.434 31.210 1.224 1
1 474 . 12 1 1 A 38 38 ARG N N 38 117.062 120.660 -3.598 1
1 475 . 12 1 1 A 39 39 ILE H H 39 8.462 7.885 0.577 1
1 476 . 12 1 1 A 39 39 ILE HA H 39 3.618 3.840 -0.222 1
1 486 . 12 1 1 A 39 39 ILE C C 39 176.267 178.159 -1.892 1
1 487 . 12 1 1 A 39 39 ILE CA C 39 66.134 64.929 1.205 1
1 488 . 12 1 1 A 39 39 ILE CB C 39 39.787 37.980 1.807 1
1 492 . 12 1 1 A 39 39 ILE N N 39 121.214 120.544 0.670 1
1 493 . 12 1 1 A 40 40 ILE H H 40 9.339 8.320 1.019 1
1 494 . 12 1 1 A 40 40 ILE HA H 40 3.401 3.745 -0.344 1
1 504 . 12 1 1 A 40 40 ILE CA C 40 67.844 66.435 1.409 1
1 505 . 12 1 1 A 40 40 ILE CB C 40 34.406 35.566 -1.160 1
1 509 . 12 1 1 A 40 40 ILE N N 40 119.695 120.954 -1.259 1
1 510 . 12 1 1 A 41 41 PRO HA H 41 4.314 4.499 -0.185 1
1 517 . 12 1 1 A 41 41 PRO C C 41 177.418 178.810 -1.392 1
1 518 . 12 1 1 A 41 41 PRO CA C 41 65.912 65.315 0.597 1
1 519 . 12 1 1 A 41 41 PRO CB C 41 30.686 30.940 -0.254 1
1 522 . 12 1 1 A 42 42 SER H H 42 6.857 7.890 -1.033 1
1 523 . 12 1 1 A 42 42 SER HA H 42 4.558 4.439 0.119 1
1 526 . 12 1 1 A 42 42 SER C C 42 174.813 176.611 -1.798 1
1 527 . 12 1 1 A 42 42 SER CA C 42 61.279 60.539 0.740 1
1 528 . 12 1 1 A 42 42 SER CB C 42 64.285 64.200 0.085 1
1 529 . 12 1 1 A 42 42 SER N N 42 108.994 112.851 -3.857 1
1 530 . 12 1 1 A 43 43 LEU H H 43 8.230 8.078 0.152 1
1 531 . 12 1 1 A 43 43 LEU HA H 43 4.572 4.212 0.360 1
1 541 . 12 1 1 A 43 43 LEU C C 43 177.301 179.257 -1.956 1
1 542 . 12 1 1 A 43 43 LEU CA C 43 54.113 55.982 -1.869 1
1 543 . 12 1 1 A 43 43 LEU CB C 43 44.800 42.279 2.521 1
1 547 . 12 1 1 A 43 43 LEU N N 43 118.715 120.448 -1.733 1
1 548 . 12 1 1 A 44 44 GLY H H 44 8.498 8.562 -0.064 1
1 549 . 12 1 1 A 44 44 GLY HA2 H 44 4.010 3.809 0.201 1
1 550 . 12 1 1 A 44 44 GLY HA3 H 44 3.613 3.870 -0.257 1
1 551 . 12 1 1 A 44 44 GLY C C 44 174.178 176.130 -1.952 1
1 552 . 12 1 1 A 44 44 GLY CA C 44 46.271 47.462 -1.191 1
1 553 . 12 1 1 A 44 44 GLY N N 44 105.371 106.940 -1.569 1
1 554 . 12 1 1 A 45 45 ASN H H 45 8.385 7.676 0.709 1
1 555 . 12 1 1 A 45 45 ASN HA H 45 4.789 4.577 0.212 1
1 560 . 12 1 1 A 45 45 ASN C C 45 175.386 176.439 -1.053 1
1 561 . 12 1 1 A 45 45 ASN CA C 45 53.144 55.222 -2.078 1
1 562 . 12 1 1 A 45 45 ASN CB C 45 37.928 38.336 -0.408 1
1 563 . 12 1 1 A 45 45 ASN N N 45 114.387 118.566 -4.179 1
1 565 . 12 1 1 A 46 46 ILE H H 46 7.465 7.550 -0.085 1
1 566 . 12 1 1 A 46 46 ILE HA H 46 3.856 4.078 -0.222 1
1 576 . 12 1 1 A 46 46 ILE C C 46 175.997 176.130 -0.133 1
1 577 . 12 1 1 A 46 46 ILE CA C 46 60.853 61.728 -0.875 1
1 578 . 12 1 1 A 46 46 ILE CB C 46 38.042 38.223 -0.181 1
1 582 . 12 1 1 A 46 46 ILE N N 46 123.998 120.506 3.492 1
1 583 . 12 1 1 A 47 47 LYS H H 47 8.717 8.739 -0.022 1
1 584 . 12 1 1 A 47 47 LYS HA H 47 4.249 4.320 -0.071 1
1 591 . 12 1 1 A 47 47 LYS C C 47 177.583 177.650 -0.067 1
1 592 . 12 1 1 A 47 47 LYS CA C 47 56.320 56.716 -0.396 1
1 593 . 12 1 1 A 47 47 LYS CB C 47 30.393 32.810 -2.417 1
1 596 . 12 1 1 A 47 47 LYS N N 47 126.114 124.574 1.540 1
1 597 . 12 1 1 A 48 48 LEU H H 48 8.323 8.368 -0.045 1
1 598 . 12 1 1 A 48 48 LEU HA H 48 3.691 4.004 -0.313 1
1 608 . 12 1 1 A 48 48 LEU C C 48 177.274 178.191 -0.917 1
1 609 . 12 1 1 A 48 48 LEU CA C 48 58.443 58.573 -0.130 1
1 610 . 12 1 1 A 48 48 LEU CB C 48 42.282 41.588 0.694 1
1 614 . 12 1 1 A 48 48 LEU N N 48 125.857 126.303 -0.446 1
1 615 . 12 1 1 A 49 49 ALA H H 49 8.929 7.932 0.997 1
1 616 . 12 1 1 A 49 49 ALA HA H 49 4.067 4.063 0.004 1
1 620 . 12 1 1 A 49 49 ALA C C 49 177.468 178.204 -0.736 1
1 621 . 12 1 1 A 49 49 ALA CA C 49 53.092 54.380 -1.288 1
1 622 . 12 1 1 A 49 49 ALA CB C 49 18.562 18.321 0.241 1
1 623 . 12 1 1 A 49 49 ALA N N 49 115.543 120.132 -4.589 1
1 624 . 12 1 1 A 50 50 LYS H H 50 7.684 7.447 0.237 1
1 625 . 12 1 1 A 50 50 LYS HA H 50 4.395 4.305 0.090 1
1 634 . 12 1 1 A 50 50 LYS C C 50 174.958 176.767 -1.809 1
1 635 . 12 1 1 A 50 50 LYS CA C 50 53.977 56.396 -2.419 1
1 636 . 12 1 1 A 50 50 LYS CB C 50 32.645 32.716 -0.071 1
1 640 . 12 1 1 A 50 50 LYS N N 50 114.788 115.184 -0.396 1
1 641 . 12 1 1 A 51 51 LEU H H 51 6.776 6.972 -0.196 1
1 642 . 12 1 1 A 51 51 LEU HA H 51 4.569 4.400 0.169 1
1 652 . 12 1 1 A 51 51 LEU C C 51 177.953 175.816 2.137 1
1 653 . 12 1 1 A 51 51 LEU CA C 51 55.318 55.187 0.131 1
1 654 . 12 1 1 A 51 51 LEU CB C 51 43.182 41.646 1.536 1
1 658 . 12 1 1 A 51 51 LEU N N 51 121.408 121.861 -0.453 1
1 659 . 12 1 1 A 52 52 THR H H 52 10.680 8.106 2.574 1
1 660 . 12 1 1 A 52 52 THR HA H 52 4.938 4.632 0.306 1
1 665 . 12 1 1 A 52 52 THR C C 52 175.553 174.339 1.214 1
1 666 . 12 1 1 A 52 52 THR CA C 52 59.740 59.651 0.089 1
1 667 . 12 1 1 A 52 52 THR CB C 52 73.557 71.224 2.333 1
1 669 . 12 1 1 A 52 52 THR N N 52 119.481 119.771 -0.290 1
1 670 . 12 1 1 A 53 53 SER H H 53 9.278 8.956 0.322 1
1 671 . 12 1 1 A 53 53 SER HA H 53 4.261 4.134 0.127 1
1 674 . 12 1 1 A 53 53 SER C C 53 176.990 176.201 0.789 1
1 675 . 12 1 1 A 53 53 SER CA C 53 61.025 61.036 -0.011 1
1 676 . 12 1 1 A 53 53 SER CB C 53 62.312 62.931 -0.619 1
1 677 . 12 1 1 A 53 53 SER N N 53 116.343 121.365 -5.022 1
1 678 . 12 1 1 A 54 54 LEU H H 54 7.808 8.005 -0.197 1
1 679 . 12 1 1 A 54 54 LEU HA H 54 4.229 4.008 0.221 1
1 688 . 12 1 1 A 54 54 LEU C C 54 178.505 178.621 -0.116 1
1 689 . 12 1 1 A 54 54 LEU CA C 54 57.719 58.024 -0.305 1
1 690 . 12 1 1 A 54 54 LEU CB C 54 40.997 41.620 -0.623 1
1 694 . 12 1 1 A 54 54 LEU N N 54 126.055 123.171 2.884 1
1 695 . 12 1 1 A 55 55 HIS H H 55 7.798 7.859 -0.061 1
1 696 . 12 1 1 A 55 55 HIS HA H 55 4.311 4.368 -0.057 1
1 701 . 12 1 1 A 55 55 HIS C C 55 180.044 177.850 2.194 1
1 702 . 12 1 1 A 55 55 HIS CA C 55 60.583 59.556 1.027 1
1 703 . 12 1 1 A 55 55 HIS CB C 55 31.445 29.645 1.800 1
1 706 . 12 1 1 A 55 55 HIS N N 55 118.683 117.828 0.855 1
1 707 . 12 1 1 A 56 56 MET H H 56 7.375 8.312 -0.937 1
1 708 . 12 1 1 A 56 56 MET HA H 56 4.513 4.231 0.282 1
1 716 . 12 1 1 A 56 56 MET C C 56 177.169 178.347 -1.178 1
1 717 . 12 1 1 A 56 56 MET CA C 56 55.823 58.783 -2.960 1
1 718 . 12 1 1 A 56 56 MET CB C 56 31.303 31.803 -0.500 1
1 721 . 12 1 1 A 56 56 MET N N 56 114.530 117.966 -3.436 1
1 722 . 12 1 1 A 57 57 GLN H H 57 8.387 8.255 0.132 1
1 723 . 12 1 1 A 57 57 GLN HA H 57 3.981 4.003 -0.022 1
1 730 . 12 1 1 A 57 57 GLN C C 57 178.033 178.267 -0.234 1
1 731 . 12 1 1 A 57 57 GLN CA C 57 57.922 59.179 -1.257 1
1 732 . 12 1 1 A 57 57 GLN CB C 57 29.012 28.386 0.626 1
1 734 . 12 1 1 A 57 57 GLN N N 57 120.713 120.557 0.156 1
1 736 . 12 1 1 A 58 58 ASN H H 58 8.765 8.393 0.372 1
1 737 . 12 1 1 A 58 58 ASN HA H 58 4.539 4.401 0.138 1
1 742 . 12 1 1 A 58 58 ASN C C 58 178.084 177.868 0.216 1
1 743 . 12 1 1 A 58 58 ASN CA C 58 55.345 56.422 -1.077 1
1 744 . 12 1 1 A 58 58 ASN CB C 58 36.924 38.049 -1.125 1
1 745 . 12 1 1 A 58 58 ASN N N 58 117.390 118.044 -0.654 1
1 747 . 12 1 1 A 59 59 TYR H H 59 8.239 7.897 0.342 1
1 748 . 12 1 1 A 59 59 TYR HA H 59 4.586 4.179 0.407 1
1 755 . 12 1 1 A 59 59 TYR C C 59 178.015 176.933 1.082 1
1 756 . 12 1 1 A 59 59 TYR CA C 59 60.779 61.409 -0.630 1
1 757 . 12 1 1 A 59 59 TYR CB C 59 38.047 38.562 -0.515 1
1 762 . 12 1 1 A 59 59 TYR N N 59 122.335 122.153 0.182 1
1 763 . 12 1 1 A 60 60 VAL H H 60 8.416 8.488 -0.072 1
1 764 . 12 1 1 A 60 60 VAL HA H 60 3.244 3.547 -0.303 1
1 772 . 12 1 1 A 60 60 VAL C C 60 177.309 178.215 -0.906 1
1 773 . 12 1 1 A 60 60 VAL CA C 60 67.022 66.519 0.503 1
1 774 . 12 1 1 A 60 60 VAL CB C 60 30.929 31.474 -0.545 1
1 777 . 12 1 1 A 60 60 VAL N N 60 119.842 119.556 0.286 1
1 778 . 12 1 1 A 61 61 ASN H H 61 8.264 8.113 0.151 1
1 779 . 12 1 1 A 61 61 ASN HA H 61 4.305 4.479 -0.174 1
1 784 . 12 1 1 A 61 61 ASN C C 61 177.263 177.784 -0.521 1
1 785 . 12 1 1 A 61 61 ASN CA C 61 55.548 56.023 -0.475 1
1 786 . 12 1 1 A 61 61 ASN CB C 61 36.645 37.538 -0.893 1
1 787 . 12 1 1 A 61 61 ASN N N 61 119.103 120.027 -0.924 1
1 789 . 12 1 1 A 62 62 SER H H 62 8.143 7.844 0.299 1
1 790 . 12 1 1 A 62 62 SER HA H 62 4.343 4.340 0.003 1
1 793 . 12 1 1 A 62 62 SER C C 62 176.409 176.753 -0.344 1
1 794 . 12 1 1 A 62 62 SER CA C 62 61.612 61.841 -0.229 1
1 795 . 12 1 1 A 62 62 SER CB C 62 62.219 62.809 -0.590 1
1 796 . 12 1 1 A 62 62 SER N N 62 118.254 116.917 1.337 1
1 797 . 12 1 1 A 63 63 LEU H H 63 7.664 7.796 -0.132 1
1 798 . 12 1 1 A 63 63 LEU HA H 63 4.003 3.857 0.146 1
1 808 . 12 1 1 A 63 63 LEU C C 63 178.748 178.779 -0.031 1
1 809 . 12 1 1 A 63 63 LEU CA C 63 57.171 57.595 -0.424 1
1 810 . 12 1 1 A 63 63 LEU CB C 63 41.134 41.301 -0.167 1
1 814 . 12 1 1 A 63 63 LEU N N 63 123.812 122.748 1.064 1
1 815 . 12 1 1 A 64 64 ARG H H 64 7.969 7.634 0.335 1
1 816 . 12 1 1 A 64 64 ARG HA H 64 4.038 3.915 0.123 1
1 824 . 12 1 1 A 64 64 ARG C C 64 180.797 178.789 2.008 1
1 825 . 12 1 1 A 64 64 ARG CA C 64 58.598 59.157 -0.559 1
1 826 . 12 1 1 A 64 64 ARG CB C 64 28.849 29.749 -0.900 1
1 829 . 12 1 1 A 64 64 ARG N N 64 120.376 121.333 -0.957 1
1 831 . 12 1 1 A 65 65 ASP H H 65 8.465 7.917 0.548 1
1 832 . 12 1 1 A 65 65 ASP HA H 65 4.408 4.398 0.010 1
1 835 . 12 1 1 A 65 65 ASP C C 65 177.336 179.069 -1.733 1
1 836 . 12 1 1 A 65 65 ASP CA C 65 56.957 56.794 0.163 1
1 837 . 12 1 1 A 65 65 ASP CB C 65 39.602 40.028 -0.426 1
1 838 . 12 1 1 A 65 65 ASP N N 65 122.402 119.154 3.248 1
1 839 . 12 1 1 A 66 66 GLU H H 66 7.703 7.814 -0.111 1
1 840 . 12 1 1 A 66 66 GLU HA H 66 4.213 4.288 -0.075 1
1 845 . 12 1 1 A 66 66 GLU C C 66 176.586 177.441 -0.855 1
1 846 . 12 1 1 A 66 66 GLU CA C 66 56.974 56.451 0.523 1
1 847 . 12 1 1 A 66 66 GLU CB C 66 29.821 30.149 -0.328 1
1 849 . 12 1 1 A 66 66 GLU N N 66 119.076 116.496 2.580 1
1 850 . 12 1 1 A 67 67 GLY H H 67 7.861 7.701 0.160 1
1 851 . 12 1 1 A 67 67 GLY HA2 H 67 4.269 3.925 0.344 1
1 852 . 12 1 1 A 67 67 GLY HA3 H 67 3.731 3.930 -0.199 1
1 853 . 12 1 1 A 67 67 GLY C C 67 174.614 174.945 -0.331 1
1 854 . 12 1 1 A 67 67 GLY CA C 67 44.608 46.538 -1.930 1
1 855 . 12 1 1 A 67 67 GLY N N 67 105.730 109.365 -3.635 1
1 856 . 12 1 1 A 68 68 LEU H H 68 7.324 7.936 -0.612 1
1 857 . 12 1 1 A 68 68 LEU HA H 68 4.257 4.316 -0.059 1
1 867 . 12 1 1 A 68 68 LEU C C 68 176.136 177.617 -1.481 1
1 868 . 12 1 1 A 68 68 LEU CA C 68 55.659 54.950 0.709 1
1 869 . 12 1 1 A 68 68 LEU CB C 68 41.874 42.369 -0.495 1
1 873 . 12 1 1 A 68 68 LEU N N 68 121.062 120.615 0.447 1
1 874 . 12 1 1 A 69 69 LYS H H 69 8.368 8.388 -0.020 1
1 875 . 12 1 1 A 69 69 LYS HA H 69 4.281 4.541 -0.260 1
1 884 . 12 1 1 A 69 69 LYS C C 69 177.940 178.170 -0.230 1
1 885 . 12 1 1 A 69 69 LYS CA C 69 55.412 55.200 0.212 1
1 886 . 12 1 1 A 69 69 LYS CB C 69 32.761 33.428 -0.667 1
1 890 . 12 1 1 A 69 69 LYS N N 69 120.120 120.955 -0.835 1
1 891 . 12 1 1 A 70 70 ARG H H 70 9.095 8.867 0.228 1
1 892 . 12 1 1 A 70 70 ARG HA H 70 3.684 4.079 -0.395 1
1 900 . 12 1 1 A 70 70 ARG C C 70 177.712 178.409 -0.697 1
1 901 . 12 1 1 A 70 70 ARG CA C 70 60.216 58.526 1.690 1
1 902 . 12 1 1 A 70 70 ARG CB C 70 29.539 30.050 -0.511 1
1 905 . 12 1 1 A 70 70 ARG N N 70 123.339 118.703 4.636 1
1 907 . 12 1 1 A 71 71 GLY H H 71 8.985 8.384 0.601 1
1 908 . 12 1 1 A 71 71 GLY HA2 H 71 3.932 3.691 0.241 1
1 909 . 12 1 1 A 71 71 GLY HA3 H 71 3.905 3.693 0.212 1
1 910 . 12 1 1 A 71 71 GLY C C 71 176.324 175.596 0.728 1
1 911 . 12 1 1 A 71 71 GLY CA C 71 46.752 47.408 -0.656 1
1 912 . 12 1 1 A 71 71 GLY N N 71 104.509 109.033 -4.524 1
1 913 . 12 1 1 A 72 72 THR H H 72 7.295 8.227 -0.932 1
1 914 . 12 1 1 A 72 72 THR HA H 72 4.014 3.870 0.144 1
1 919 . 12 1 1 A 72 72 THR C C 72 175.135 176.047 -0.912 1
1 920 . 12 1 1 A 72 72 THR CA C 72 65.848 66.487 -0.639 1
1 921 . 12 1 1 A 72 72 THR CB C 72 68.160 68.317 -0.157 1
1 923 . 12 1 1 A 72 72 THR N N 72 118.617 117.264 1.353 1
1 924 . 12 1 1 A 73 73 ILE H H 73 7.883 7.897 -0.014 1
1 925 . 12 1 1 A 73 73 ILE HA H 73 3.258 3.576 -0.318 1
1 935 . 12 1 1 A 73 73 ILE C C 73 177.060 178.147 -1.087 1
1 936 . 12 1 1 A 73 73 ILE CA C 73 66.561 65.581 0.980 1
1 937 . 12 1 1 A 73 73 ILE CB C 73 37.339 37.698 -0.359 1
1 941 . 12 1 1 A 73 73 ILE N N 73 121.692 121.467 0.225 1
1 942 . 12 1 1 A 74 74 GLU H H 74 8.723 7.946 0.777 1
1 943 . 12 1 1 A 74 74 GLU HA H 74 3.807 3.913 -0.106 1
1 948 . 12 1 1 A 74 74 GLU C C 74 178.319 178.795 -0.476 1
1 949 . 12 1 1 A 74 74 GLU CA C 74 59.637 60.026 -0.389 1
1 950 . 12 1 1 A 74 74 GLU CB C 74 29.257 29.212 0.045 1
1 952 . 12 1 1 A 74 74 GLU N N 74 117.701 120.912 -3.211 1
1 953 . 12 1 1 A 75 75 LYS H H 75 7.361 7.746 -0.385 1
1 954 . 12 1 1 A 75 75 LYS HA H 75 3.958 4.107 -0.149 1
1 963 . 12 1 1 A 75 75 LYS C C 75 178.554 179.411 -0.857 1
1 964 . 12 1 1 A 75 75 LYS CA C 75 59.764 59.417 0.347 1
1 965 . 12 1 1 A 75 75 LYS CB C 75 32.314 32.435 -0.121 1
1 969 . 12 1 1 A 75 75 LYS N N 75 118.734 118.515 0.219 1
1 970 . 12 1 1 A 76 76 ILE H H 76 7.713 7.503 0.210 1
1 971 . 12 1 1 A 76 76 ILE HA H 76 3.221 3.896 -0.675 1
1 981 . 12 1 1 A 76 76 ILE C C 76 177.504 178.323 -0.819 1
1 982 . 12 1 1 A 76 76 ILE CA C 76 65.796 64.477 1.319 1
1 983 . 12 1 1 A 76 76 ILE CB C 76 37.732 37.296 0.436 1
1 987 . 12 1 1 A 76 76 ILE N N 76 120.312 116.818 3.494 1
1 988 . 12 1 1 A 77 77 ILE H H 77 8.587 8.186 0.401 1
1 989 . 12 1 1 A 77 77 ILE HA H 77 3.778 3.606 0.172 1
1 999 . 12 1 1 A 77 77 ILE C C 77 177.074 177.955 -0.881 1
1 1000 . 12 1 1 A 77 77 ILE CA C 77 63.168 65.269 -2.101 1
1 1001 . 12 1 1 A 77 77 ILE CB C 77 36.617 37.442 -0.825 1
1 1005 . 12 1 1 A 77 77 ILE N N 77 118.978 121.644 -2.666 1
1 1006 . 12 1 1 A 78 78 LYS H H 78 8.050 7.930 0.120 1
1 1007 . 12 1 1 A 78 78 LYS HA H 78 3.925 4.048 -0.123 1
1 1016 . 12 1 1 A 78 78 LYS C C 78 178.291 179.159 -0.868 1
1 1017 . 12 1 1 A 78 78 LYS CA C 78 60.192 59.359 0.833 1
1 1018 . 12 1 1 A 78 78 LYS CB C 78 31.886 32.392 -0.506 1
1 1022 . 12 1 1 A 78 78 LYS N N 78 121.618 119.544 2.074 1
1 1023 . 12 1 1 A 79 79 VAL H H 79 7.619 7.816 -0.197 1
1 1024 . 12 1 1 A 79 79 VAL HA H 79 3.846 3.730 0.116 1
1 1032 . 12 1 1 A 79 79 VAL C C 79 177.712 178.288 -0.576 1
1 1033 . 12 1 1 A 79 79 VAL CA C 79 66.494 66.211 0.283 1
1 1034 . 12 1 1 A 79 79 VAL CB C 79 31.298 31.715 -0.417 1
1 1037 . 12 1 1 A 79 79 VAL N N 79 120.254 119.519 0.735 1
1 1038 . 12 1 1 A 80 80 ILE H H 80 7.885 8.250 -0.365 1
1 1039 . 12 1 1 A 80 80 ILE HA H 80 3.367 3.945 -0.578 1
1 1049 . 12 1 1 A 80 80 ILE C C 80 179.892 177.788 2.104 1
1 1050 . 12 1 1 A 80 80 ILE CA C 80 65.343 65.232 0.111 1
1 1051 . 12 1 1 A 80 80 ILE CB C 80 38.129 37.652 0.477 1
1 1055 . 12 1 1 A 80 80 ILE N N 80 119.666 120.504 -0.838 1
1 1056 . 12 1 1 A 81 81 ARG H H 81 9.384 8.423 0.961 1
1 1057 . 12 1 1 A 81 81 ARG HA H 81 3.834 3.958 -0.124 1
1 1065 . 12 1 1 A 81 81 ARG C C 81 178.204 179.185 -0.981 1
1 1066 . 12 1 1 A 81 81 ARG CA C 81 60.560 59.750 0.810 1
1 1067 . 12 1 1 A 81 81 ARG CB C 81 30.196 30.179 0.017 1
1 1070 . 12 1 1 A 81 81 ARG N N 81 121.030 120.411 0.619 1
1 1072 . 12 1 1 A 82 82 ASN H H 82 8.773 8.479 0.294 1
1 1073 . 12 1 1 A 82 82 ASN HA H 82 4.587 4.609 -0.022 1
1 1078 . 12 1 1 A 82 82 ASN C C 82 178.300 177.654 0.646 1
1 1079 . 12 1 1 A 82 82 ASN CA C 82 56.160 56.698 -0.538 1
1 1080 . 12 1 1 A 82 82 ASN CB C 82 38.464 39.468 -1.004 1
1 1081 . 12 1 1 A 82 82 ASN N N 82 118.483 118.758 -0.275 1
1 1083 . 12 1 1 A 83 83 SER H H 83 8.526 7.568 0.958 1
1 1084 . 12 1 1 A 83 83 SER HA H 83 2.765 3.509 -0.744 1
1 1087 . 12 1 1 A 83 83 SER C C 83 176.386 177.569 -1.183 1
1 1088 . 12 1 1 A 83 83 SER CA C 83 61.245 60.975 0.270 1
1 1089 . 12 1 1 A 83 83 SER CB C 83 61.287 62.405 -1.118 1
1 1090 . 12 1 1 A 83 83 SER N N 83 118.286 114.310 3.976 1
1 1091 . 12 1 1 A 84 84 LEU H H 84 7.782 8.383 -0.601 1
1 1092 . 12 1 1 A 84 84 LEU HA H 84 4.221 4.017 0.204 1
1 1102 . 12 1 1 A 84 84 LEU C C 84 177.846 179.363 -1.517 1
1 1103 . 12 1 1 A 84 84 LEU CA C 84 57.166 57.893 -0.727 1
1 1104 . 12 1 1 A 84 84 LEU CB C 84 40.520 41.192 -0.672 1
1 1108 . 12 1 1 A 84 84 LEU N N 84 127.445 121.772 5.673 1
1 1109 . 12 1 1 A 85 85 GLU H H 85 8.264 8.609 -0.345 1
1 1110 . 12 1 1 A 85 85 GLU HA H 85 3.981 3.979 0.002 1
1 1115 . 12 1 1 A 85 85 GLU C C 85 179.288 179.453 -0.165 1
1 1116 . 12 1 1 A 85 85 GLU CA C 85 59.025 60.183 -1.158 1
1 1117 . 12 1 1 A 85 85 GLU CB C 85 29.182 29.539 -0.357 1
1 1119 . 12 1 1 A 85 85 GLU N N 85 121.538 120.303 1.235 1
1 1120 . 12 1 1 A 86 86 HIS H H 86 7.683 8.181 -0.498 1
1 1121 . 12 1 1 A 86 86 HIS HA H 86 4.573 4.401 0.172 1
1 1125 . 12 1 1 A 86 86 HIS C C 86 175.484 177.573 -2.089 1
1 1126 . 12 1 1 A 86 86 HIS CA C 86 58.940 59.389 -0.449 1
1 1127 . 12 1 1 A 86 86 HIS CB C 86 29.267 30.133 -0.866 1
1 1129 . 12 1 1 A 86 86 HIS N N 86 117.087 120.516 -3.429 1
1 1130 . 12 1 1 A 87 87 ALA H H 87 7.197 8.135 -0.938 1
1 1131 . 12 1 1 A 87 87 ALA HA H 87 3.925 3.904 0.021 1
1 1135 . 12 1 1 A 87 87 ALA C C 87 179.038 180.302 -1.264 1
1 1136 . 12 1 1 A 87 87 ALA CA C 87 54.863 54.984 -0.121 1
1 1137 . 12 1 1 A 87 87 ALA CB C 87 17.034 18.434 -1.400 1
1 1138 . 12 1 1 A 87 87 ALA N N 87 121.510 120.891 0.619 1
1 1139 . 12 1 1 A 88 88 ILE H H 88 7.819 7.786 0.033 1
1 1140 . 12 1 1 A 88 88 ILE HA H 88 4.067 3.884 0.183 1
1 1150 . 12 1 1 A 88 88 ILE C C 88 180.846 177.410 3.436 1
1 1151 . 12 1 1 A 88 88 ILE CA C 88 64.021 65.211 -1.190 1
1 1152 . 12 1 1 A 88 88 ILE CB C 88 37.557 37.451 0.106 1
1 1156 . 12 1 1 A 88 88 ILE N N 88 120.898 119.312 1.586 1
1 1157 . 12 1 1 A 89 89 ASP H H 89 7.808 8.093 -0.285 1
1 1158 . 12 1 1 A 89 89 ASP HA H 89 4.437 4.332 0.105 1
1 1161 . 12 1 1 A 89 89 ASP C C 89 178.033 177.999 0.034 1
1 1162 . 12 1 1 A 89 89 ASP CA C 89 57.343 57.807 -0.464 1
1 1163 . 12 1 1 A 89 89 ASP CB C 89 39.689 41.505 -1.816 1
1 1164 . 12 1 1 A 89 89 ASP N N 89 125.174 121.773 3.401 1
1 1165 . 12 1 1 A 90 90 LEU H H 90 7.607 7.657 -0.050 1
1 1166 . 12 1 1 A 90 90 LEU HA H 90 4.198 4.217 -0.019 1
1 1176 . 12 1 1 A 90 90 LEU C C 90 175.416 175.910 -0.494 1
1 1177 . 12 1 1 A 90 90 LEU CA C 90 54.755 55.075 -0.320 1
1 1178 . 12 1 1 A 90 90 LEU CB C 90 42.960 41.679 1.281 1
1 1182 . 12 1 1 A 90 90 LEU N N 90 117.576 117.262 0.314 1
1 1183 . 12 1 1 A 91 91 GLU H H 91 8.143 7.793 0.350 1
1 1184 . 12 1 1 A 91 91 GLU HA H 91 4.005 4.041 -0.036 1
1 1189 . 12 1 1 A 91 91 GLU C C 91 175.792 176.148 -0.356 1
1 1190 . 12 1 1 A 91 91 GLU CA C 91 57.202 57.575 -0.373 1
1 1191 . 12 1 1 A 91 91 GLU CB C 91 26.125 27.145 -1.020 1
1 1193 . 12 1 1 A 91 91 GLU N N 91 113.620 115.129 -1.509 1
1 1194 . 12 1 1 A 92 92 LEU H H 92 8.290 8.071 0.219 1
1 1195 . 12 1 1 A 92 92 LEU HA H 92 4.216 4.168 0.048 1
1 1205 . 12 1 1 A 92 92 LEU C C 92 176.622 177.021 -0.399 1
1 1206 . 12 1 1 A 92 92 LEU CA C 92 56.410 56.396 0.014 1
1 1207 . 12 1 1 A 92 92 LEU CB C 92 43.378 42.419 0.959 1
1 1211 . 12 1 1 A 92 92 LEU N N 92 116.868 119.472 -2.604 1
1 1212 . 12 1 1 A 93 93 ILE H H 93 6.988 6.887 0.101 1
1 1213 . 12 1 1 A 93 93 ILE HA H 93 4.580 4.599 -0.019 1
1 1223 . 12 1 1 A 93 93 ILE C C 93 175.145 175.541 -0.396 1
1 1224 . 12 1 1 A 93 93 ILE CA C 93 58.707 58.617 0.090 1
1 1225 . 12 1 1 A 93 93 ILE CB C 93 42.864 41.467 1.397 1
1 1229 . 12 1 1 A 93 93 ILE N N 93 107.565 113.899 -6.334 1
1 1230 . 12 1 1 A 94 94 THR H H 94 8.742 8.615 0.127 1
1 1231 . 12 1 1 A 94 94 THR HA H 94 4.489 4.458 0.031 1
1 1236 . 12 1 1 A 94 94 THR C C 94 173.875 174.555 -0.680 1
1 1237 . 12 1 1 A 94 94 THR CA C 94 61.842 62.247 -0.405 1
1 1238 . 12 1 1 A 94 94 THR CB C 94 69.972 69.479 0.493 1
1 1240 . 12 1 1 A 94 94 THR N N 94 107.904 112.951 -5.047 1
1 1241 . 12 1 1 A 95 95 LYS H H 95 7.294 7.717 -0.423 1
1 1242 . 12 1 1 A 95 95 LYS HA H 95 4.566 4.798 -0.232 1
1 1251 . 12 1 1 A 95 95 LYS C C 95 173.791 174.228 -0.437 1
1 1252 . 12 1 1 A 95 95 LYS CA C 95 54.533 55.685 -1.152 1
1 1253 . 12 1 1 A 95 95 LYS CB C 95 35.123 35.807 -0.684 1
1 1257 . 12 1 1 A 95 95 LYS N N 95 119.458 120.893 -1.435 1
1 1258 . 12 1 1 A 96 96 ASN H H 96 9.157 8.765 0.392 1
1 1259 . 12 1 1 A 96 96 ASN HA H 96 4.408 4.834 -0.426 1
1 1264 . 12 1 1 A 96 96 ASN C C 96 176.653 176.065 0.588 1
1 1265 . 12 1 1 A 96 96 ASN CA C 96 51.088 52.417 -1.329 1
1 1266 . 12 1 1 A 96 96 ASN CB C 96 37.292 38.412 -1.120 1
1 1267 . 12 1 1 A 96 96 ASN N N 96 121.031 124.338 -3.307 1
1 1269 . 12 1 1 A 97 97 VAL H H 97 8.193 8.404 -0.211 1
1 1270 . 12 1 1 A 97 97 VAL HA H 97 4.019 3.974 0.045 1
1 1278 . 12 1 1 A 97 97 VAL C C 97 175.089 176.190 -1.101 1
1 1279 . 12 1 1 A 97 97 VAL CA C 97 63.437 63.839 -0.402 1
1 1280 . 12 1 1 A 97 97 VAL CB C 97 29.934 31.657 -1.723 1
1 1283 . 12 1 1 A 97 97 VAL N N 97 118.839 121.570 -2.731 1
1 1284 . 12 1 1 A 98 98 ALA H H 98 7.994 7.650 0.344 1
1 1285 . 12 1 1 A 98 98 ALA HA H 98 5.108 4.092 1.016 1
1 1289 . 12 1 1 A 98 98 ALA C C 98 178.033 178.807 -0.774 1
1 1290 . 12 1 1 A 98 98 ALA CA C 98 50.342 52.596 -2.254 1
1 1291 . 12 1 1 A 98 98 ALA CB C 98 19.659 19.161 0.498 1
1 1292 . 12 1 1 A 98 98 ALA N N 98 121.031 124.526 -3.495 1
1 1293 . 12 1 1 A 99 99 ALA H H 99 7.347 7.531 -0.184 1
1 1294 . 12 1 1 A 99 99 ALA HA H 99 3.818 4.014 -0.196 1
1 1298 . 12 1 1 A 99 99 ALA C C 99 177.712 178.967 -1.255 1
1 1299 . 12 1 1 A 99 99 ALA CA C 99 55.117 54.750 0.367 1
1 1300 . 12 1 1 A 99 99 ALA CB C 99 18.879 18.465 0.414 1
1 1301 . 12 1 1 A 99 99 ALA N N 99 122.816 120.139 2.677 1
1 1302 . 12 1 1 A 100 100 LYS H H 100 8.190 7.850 0.340 1
1 1303 . 12 1 1 A 100 100 LYS HA H 100 4.483 4.368 0.115 1
1 1312 . 12 1 1 A 100 100 LYS C C 100 175.899 176.187 -0.288 1
1 1313 . 12 1 1 A 100 100 LYS CA C 100 54.231 57.529 -3.298 1
1 1314 . 12 1 1 A 100 100 LYS CB C 100 32.066 32.651 -0.585 1
1 1318 . 12 1 1 A 100 100 LYS N N 100 113.197 114.968 -1.771 1
1 1319 . 12 1 1 A 101 101 THR H H 101 7.128 7.824 -0.696 1
1 1320 . 12 1 1 A 101 101 THR HA H 101 3.834 4.697 -0.863 1
1 1325 . 12 1 1 A 101 101 THR C C 101 173.255 173.790 -0.535 1
1 1326 . 12 1 1 A 101 101 THR CA C 101 64.392 62.285 2.107 1
1 1327 . 12 1 1 A 101 101 THR CB C 101 69.160 69.584 -0.424 1
1 1329 . 12 1 1 A 101 101 THR N N 101 118.368 115.092 3.276 1
1 1330 . 12 1 1 A 102 102 LYS H H 102 8.753 8.674 0.079 1
1 1331 . 12 1 1 A 102 102 LYS HA H 102 4.438 4.762 -0.324 1
1 1340 . 12 1 1 A 102 102 LYS C C 102 175.627 175.724 -0.097 1
1 1341 . 12 1 1 A 102 102 LYS CA C 102 55.117 54.095 1.022 1
1 1342 . 12 1 1 A 102 102 LYS CB C 102 33.901 35.072 -1.171 1
1 1346 . 12 1 1 A 102 102 LYS N N 102 126.513 126.519 -0.006 1
1 1347 . 12 1 1 A 103 103 LEU H H 103 8.602 8.389 0.213 1
1 1348 . 12 1 1 A 103 103 LEU HA H 103 4.486 4.426 0.060 1
1 1358 . 12 1 1 A 103 103 LEU CA C 103 52.233 53.098 -0.865 1
1 1359 . 12 1 1 A 103 103 LEU CB C 103 41.028 42.798 -1.770 1
1 1363 . 12 1 1 A 103 103 LEU N N 103 124.466 123.242 1.224 1
1 1364 . 12 1 1 A 104 104 PRO HA H 104 4.437 4.405 0.032 1
1 1371 . 12 1 1 A 104 104 PRO C C 104 175.779 176.944 -1.165 1
1 1372 . 12 1 1 A 104 104 PRO CA C 104 62.322 63.146 -0.824 1
1 1373 . 12 1 1 A 104 104 PRO CB C 104 31.899 31.661 0.238 1
1 1376 . 12 1 1 A 105 105 LYS H H 105 8.460 8.364 0.096 1
1 1377 . 12 1 1 A 105 105 LYS HA H 105 4.154 4.306 -0.152 1
1 1386 . 12 1 1 A 105 105 LYS C C 105 175.998 177.366 -1.368 1
1 1387 . 12 1 1 A 105 105 LYS CA C 105 56.480 56.543 -0.063 1
1 1388 . 12 1 1 A 105 105 LYS CB C 105 32.909 32.400 0.509 1
1 1392 . 12 1 1 A 105 105 LYS N N 105 122.139 122.542 -0.403 1
1 1393 . 12 1 1 A 106 106 ALA H H 106 8.448 8.651 -0.203 1
1 1394 . 12 1 1 A 106 106 ALA HA H 106 4.309 4.654 -0.345 1
1 1398 . 12 1 1 A 106 106 ALA C C 106 176.828 176.728 0.100 1
1 1399 . 12 1 1 A 106 106 ALA CA C 106 51.862 51.143 0.719 1
1 1400 . 12 1 1 A 106 106 ALA CB C 106 19.323 20.081 -0.758 1
1 1401 . 12 1 1 A 106 106 ALA N N 106 125.278 126.365 -1.087 1
1 1402 . 12 1 1 A 107 107 ASP H H 107 8.428 7.603 0.825 1
1 1403 . 12 1 1 A 107 107 ASP HA H 107 4.574 4.818 -0.244 1
1 1406 . 12 1 1 A 107 107 ASP C C 107 175.951 176.236 -0.285 1
1 1407 . 12 1 1 A 107 107 ASP CA C 107 54.214 53.463 0.751 1
1 1408 . 12 1 1 A 107 107 ASP CB C 107 41.141 41.843 -0.702 1
1 1409 . 12 1 1 A 107 107 ASP N N 107 120.771 118.505 2.266 1
1 1410 . 12 1 1 A 108 108 LYS H H 108 8.329 8.574 -0.245 1
1 1411 . 12 1 1 A 108 108 LYS HA H 108 4.203 4.401 -0.198 1
1 1420 . 12 1 1 A 108 108 LYS C C 108 176.483 175.202 1.281 1
1 1421 . 12 1 1 A 108 108 LYS CA C 108 56.831 55.366 1.465 1
1 1422 . 12 1 1 A 108 108 LYS CB C 108 32.648 31.116 1.532 1
1 1426 . 12 1 1 A 108 108 LYS N N 108 120.727 121.603 -0.876 1
1 1427 . 12 1 1 A 109 109 GLU H H 109 8.447 8.197 0.250 1
1 1428 . 12 1 1 A 109 109 GLU HA H 109 4.215 4.422 -0.207 1
1 1433 . 12 1 1 A 109 109 GLU C C 109 176.513 177.057 -0.544 1
1 1434 . 12 1 1 A 109 109 GLU CA C 109 56.936 56.218 0.718 1
1 1435 . 12 1 1 A 109 109 GLU CB C 109 29.833 30.737 -0.904 1
1 1437 . 12 1 1 A 109 109 GLU N N 109 121.471 123.435 -1.964 1
1 1438 . 12 1 1 A 110 110 GLU H H 110 8.352 8.785 -0.433 1
1 1439 . 12 1 1 A 110 110 GLU HA H 110 4.233 4.324 -0.091 1
1 1444 . 12 1 1 A 110 110 GLU C C 110 176.439 176.542 -0.103 1
1 1445 . 12 1 1 A 110 110 GLU CA C 110 56.681 56.266 0.415 1
1 1446 . 12 1 1 A 110 110 GLU CB C 110 29.860 28.936 0.924 1
1 1448 . 12 1 1 A 110 110 GLU N N 110 121.559 120.679 0.880 1
1 1449 . 12 1 1 A 111 111 LEU H H 111 8.145 7.775 0.370 1
1 1450 . 12 1 1 A 111 111 LEU HA H 111 4.251 4.109 0.142 1
1 1460 . 12 1 1 A 111 111 LEU C C 111 177.306 176.713 0.593 1
1 1461 . 12 1 1 A 111 111 LEU CA C 111 55.277 55.267 0.010 1
1 1462 . 12 1 1 A 111 111 LEU CB C 111 42.054 41.418 0.636 1
1 1466 . 12 1 1 A 111 111 LEU N N 111 122.181 123.510 -1.329 1
1 1467 . 12 1 1 A 112 112 GLU H H 112 8.212 7.388 0.824 1
1 1468 . 12 1 1 A 112 112 GLU N N 112 120.291 118.915 1.376 1
1 1469 . 12 1 1 A 114 114 HIS C C 114 176.070 174.712 1.358 1
1 1470 . 12 1 1 A 116 116 HIS H H 116 8.227 8.440 -0.213 1
1 1471 . 12 1 1 A 116 116 HIS C C 116 173.580 174.853 -1.273 1
1 1472 . 12 1 1 A 116 116 HIS N N 116 119.156 125.219 -6.063 1
1 5 . 13 1 1 A 3 3 PRO HA H 3 4.390 4.549 -0.159 1
1 12 . 13 1 1 A 3 3 PRO C C 3 176.847 176.458 0.389 1
1 13 . 13 1 1 A 3 3 PRO CA C 3 63.449 62.499 0.950 1
1 14 . 13 1 1 A 3 3 PRO CB C 3 31.938 31.950 -0.012 1
1 17 . 13 1 1 A 4 4 SER H H 4 8.531 8.369 0.162 1
1 18 . 13 1 1 A 4 4 SER HA H 4 4.262 4.591 -0.329 1
1 21 . 13 1 1 A 4 4 SER C C 4 175.414 173.926 1.488 1
1 22 . 13 1 1 A 4 4 SER CA C 4 59.163 57.701 1.462 1
1 23 . 13 1 1 A 4 4 SER CB C 4 63.242 62.290 0.952 1
1 24 . 13 1 1 A 4 4 SER N N 4 114.246 116.314 -2.068 1
1 25 . 13 1 1 A 5 5 LYS H H 5 8.468 7.999 0.469 1
1 26 . 13 1 1 A 5 5 LYS HA H 5 4.433 4.395 0.038 1
1 35 . 13 1 1 A 5 5 LYS C C 5 175.984 177.178 -1.194 1
1 36 . 13 1 1 A 5 5 LYS CA C 5 55.724 58.022 -2.298 1
1 37 . 13 1 1 A 5 5 LYS CB C 5 32.881 33.092 -0.211 1
1 41 . 13 1 1 A 5 5 LYS N N 5 123.488 124.536 -1.048 1
1 42 . 13 1 1 A 6 6 LEU H H 6 7.707 7.514 0.193 1
1 43 . 13 1 1 A 6 6 LEU HA H 6 4.381 4.325 0.056 1
1 53 . 13 1 1 A 6 6 LEU C C 6 177.820 176.235 1.585 1
1 54 . 13 1 1 A 6 6 LEU CA C 6 55.507 54.844 0.663 1
1 55 . 13 1 1 A 6 6 LEU CB C 6 43.374 42.616 0.758 1
1 59 . 13 1 1 A 6 6 LEU N N 6 121.233 120.540 0.693 1
1 60 . 13 1 1 A 7 7 SER H H 7 9.433 8.850 0.583 1
1 61 . 13 1 1 A 7 7 SER HA H 7 4.638 4.504 0.134 1
1 64 . 13 1 1 A 7 7 SER C C 7 174.120 175.273 -1.153 1
1 65 . 13 1 1 A 7 7 SER CA C 7 57.962 58.464 -0.502 1
1 66 . 13 1 1 A 7 7 SER CB C 7 64.197 63.611 0.586 1
1 67 . 13 1 1 A 7 7 SER N N 7 122.977 121.562 1.415 1
1 68 . 13 1 1 A 8 8 TYR H H 8 9.764 9.072 0.692 1
1 69 . 13 1 1 A 8 8 TYR HA H 8 4.732 4.252 0.480 1
1 76 . 13 1 1 A 8 8 TYR C C 8 177.206 177.724 -0.518 1
1 77 . 13 1 1 A 8 8 TYR CA C 8 58.762 61.849 -3.087 1
1 78 . 13 1 1 A 8 8 TYR CB C 8 36.605 38.885 -2.280 1
1 83 . 13 1 1 A 8 8 TYR N N 8 123.312 129.000 -5.688 1
1 84 . 13 1 1 A 9 9 GLY H H 9 10.131 8.358 1.773 1
1 85 . 13 1 1 A 9 9 GLY HA2 H 9 3.983 3.561 0.422 1
1 86 . 13 1 1 A 9 9 GLY HA3 H 9 3.423 3.657 -0.234 1
1 87 . 13 1 1 A 9 9 GLY C C 9 175.163 176.159 -0.996 1
1 88 . 13 1 1 A 9 9 GLY CA C 9 47.153 47.212 -0.059 1
1 89 . 13 1 1 A 9 9 GLY N N 9 107.177 105.430 1.747 1
1 90 . 13 1 1 A 10 10 GLU H H 10 7.876 8.013 -0.137 1
1 91 . 13 1 1 A 10 10 GLU HA H 10 4.107 4.093 0.014 1
1 96 . 13 1 1 A 10 10 GLU C C 10 179.924 179.035 0.889 1
1 97 . 13 1 1 A 10 10 GLU CA C 10 58.890 59.425 -0.535 1
1 98 . 13 1 1 A 10 10 GLU CB C 10 29.750 29.481 0.269 1
1 100 . 13 1 1 A 10 10 GLU N N 10 122.219 121.777 0.442 1
1 101 . 13 1 1 A 11 11 TYR H H 11 8.384 8.102 0.282 1
1 102 . 13 1 1 A 11 11 TYR HA H 11 4.305 4.183 0.122 1
1 107 . 13 1 1 A 11 11 TYR C C 11 176.854 177.011 -0.157 1
1 108 . 13 1 1 A 11 11 TYR CA C 11 61.040 61.444 -0.404 1
1 109 . 13 1 1 A 11 11 TYR CB C 11 37.593 38.990 -1.397 1
1 112 . 13 1 1 A 11 11 TYR N N 11 120.809 122.507 -1.698 1
1 113 . 13 1 1 A 12 12 LEU H H 12 9.027 8.158 0.869 1
1 114 . 13 1 1 A 12 12 LEU HA H 12 3.778 3.761 0.017 1
1 124 . 13 1 1 A 12 12 LEU C C 12 178.621 179.630 -1.009 1
1 125 . 13 1 1 A 12 12 LEU CA C 12 57.534 57.465 0.069 1
1 126 . 13 1 1 A 12 12 LEU CB C 12 41.957 40.901 1.056 1
1 130 . 13 1 1 A 12 12 LEU N N 12 121.080 119.043 2.037 1
1 131 . 13 1 1 A 13 13 GLU H H 13 7.614 8.285 -0.671 1
1 132 . 13 1 1 A 13 13 GLU HA H 13 4.102 4.119 -0.017 1
1 137 . 13 1 1 A 13 13 GLU C C 13 178.449 179.560 -1.111 1
1 138 . 13 1 1 A 13 13 GLU CA C 13 59.609 59.750 -0.141 1
1 139 . 13 1 1 A 13 13 GLU CB C 13 29.124 29.325 -0.201 1
1 141 . 13 1 1 A 13 13 GLU N N 13 118.475 120.488 -2.013 1
1 142 . 13 1 1 A 14 14 SER H H 14 7.329 7.899 -0.570 1
1 143 . 13 1 1 A 14 14 SER HA H 14 4.358 4.214 0.144 1
1 146 . 13 1 1 A 14 14 SER C C 14 176.794 175.894 0.900 1
1 147 . 13 1 1 A 14 14 SER CA C 14 61.064 62.415 -1.351 1
1 148 . 13 1 1 A 14 14 SER CB C 14 62.513 63.285 -0.772 1
1 149 . 13 1 1 A 14 14 SER N N 14 115.209 116.437 -1.228 1
1 150 . 13 1 1 A 15 15 TRP H H 15 8.870 8.205 0.665 1
1 151 . 13 1 1 A 15 15 TRP HA H 15 4.005 4.281 -0.276 1
1 160 . 13 1 1 A 15 15 TRP C C 15 177.547 177.973 -0.426 1
1 161 . 13 1 1 A 15 15 TRP CA C 15 61.210 61.204 0.006 1
1 162 . 13 1 1 A 15 15 TRP CB C 15 27.341 29.290 -1.949 1
1 168 . 13 1 1 A 15 15 TRP N N 15 124.998 123.928 1.070 1
1 170 . 13 1 1 A 16 16 PHE H H 16 9.087 8.266 0.821 1
1 171 . 13 1 1 A 16 16 PHE HA H 16 3.210 3.737 -0.527 1
1 179 . 13 1 1 A 16 16 PHE C C 16 175.909 177.085 -1.176 1
1 180 . 13 1 1 A 16 16 PHE CA C 16 61.473 61.475 -0.002 1
1 181 . 13 1 1 A 16 16 PHE CB C 16 38.506 39.105 -0.599 1
1 187 . 13 1 1 A 16 16 PHE N N 16 119.825 121.190 -1.365 1
1 188 . 13 1 1 A 17 17 ASN H H 17 7.768 8.097 -0.329 1
1 189 . 13 1 1 A 17 17 ASN HA H 17 4.078 3.990 0.088 1
1 194 . 13 1 1 A 17 17 ASN C C 17 176.604 177.828 -1.224 1
1 195 . 13 1 1 A 17 17 ASN CA C 17 55.621 56.112 -0.491 1
1 196 . 13 1 1 A 17 17 ASN CB C 17 37.830 37.459 0.371 1
1 197 . 13 1 1 A 17 17 ASN N N 17 115.600 117.047 -1.447 1
1 199 . 13 1 1 A 18 18 THR H H 18 7.454 7.632 -0.178 1
1 200 . 13 1 1 A 18 18 THR HA H 18 4.147 4.020 0.127 1
1 205 . 13 1 1 A 18 18 THR C C 18 175.692 175.924 -0.232 1
1 206 . 13 1 1 A 18 18 THR CA C 18 64.679 66.548 -1.869 1
1 207 . 13 1 1 A 18 18 THR CB C 18 68.940 68.124 0.816 1
1 209 . 13 1 1 A 18 18 THR N N 18 113.049 116.640 -3.591 1
1 210 . 13 1 1 A 19 19 LYS H H 19 7.918 7.569 0.349 1
1 211 . 13 1 1 A 19 19 LYS HA H 19 3.791 3.731 0.060 1
1 220 . 13 1 1 A 19 19 LYS C C 19 178.120 178.812 -0.692 1
1 221 . 13 1 1 A 19 19 LYS CA C 19 55.985 58.695 -2.710 1
1 222 . 13 1 1 A 19 19 LYS CB C 19 31.130 31.009 0.121 1
1 226 . 13 1 1 A 19 19 LYS N N 19 122.614 120.046 2.568 1
1 227 . 13 1 1 A 20 20 ARG H H 20 7.845 7.726 0.119 1
1 228 . 13 1 1 A 20 20 ARG HA H 20 3.396 3.835 -0.439 1
1 236 . 13 1 1 A 20 20 ARG C C 20 175.601 178.520 -2.919 1
1 237 . 13 1 1 A 20 20 ARG CA C 20 58.182 58.447 -0.265 1
1 238 . 13 1 1 A 20 20 ARG CB C 20 28.045 29.715 -1.670 1
1 241 . 13 1 1 A 20 20 ARG N N 20 116.282 117.829 -1.547 1
1 243 . 13 1 1 A 21 21 HIS H H 21 7.163 7.282 -0.119 1
1 244 . 13 1 1 A 21 21 HIS HA H 21 4.500 4.243 0.257 1
1 249 . 13 1 1 A 21 21 HIS C C 21 175.618 176.995 -1.377 1
1 250 . 13 1 1 A 21 21 HIS CA C 21 56.912 59.201 -2.289 1
1 251 . 13 1 1 A 21 21 HIS CB C 21 29.400 29.893 -0.493 1
1 254 . 13 1 1 A 21 21 HIS N N 21 115.452 118.305 -2.853 1
1 255 . 13 1 1 A 22 22 SER H H 22 7.951 7.463 0.488 1
1 256 . 13 1 1 A 22 22 SER HA H 22 4.573 4.265 0.308 1
1 259 . 13 1 1 A 22 22 SER C C 22 173.948 174.075 -0.127 1
1 260 . 13 1 1 A 22 22 SER CA C 22 58.589 60.954 -2.365 1
1 261 . 13 1 1 A 22 22 SER CB C 22 64.228 63.815 0.413 1
1 262 . 13 1 1 A 22 22 SER N N 22 113.209 113.278 -0.069 1
1 263 . 13 1 1 A 23 23 VAL H H 23 7.179 7.354 -0.175 1
1 264 . 13 1 1 A 23 23 VAL HA H 23 4.626 4.625 0.001 1
1 272 . 13 1 1 A 23 23 VAL C C 23 175.397 175.760 -0.363 1
1 273 . 13 1 1 A 23 23 VAL CA C 23 59.556 59.884 -0.328 1
1 274 . 13 1 1 A 23 23 VAL CB C 23 33.810 34.657 -0.847 1
1 277 . 13 1 1 A 23 23 VAL N N 23 113.108 115.898 -2.790 1
1 278 . 13 1 1 A 24 24 GLY H H 24 8.189 8.383 -0.194 1
1 279 . 13 1 1 A 24 24 GLY HA2 H 24 4.074 4.032 0.042 1
1 280 . 13 1 1 A 24 24 GLY HA3 H 24 4.195 4.052 0.143 1
1 281 . 13 1 1 A 24 24 GLY C C 24 174.037 174.698 -0.661 1
1 282 . 13 1 1 A 24 24 GLY CA C 24 44.452 45.298 -0.846 1
1 283 . 13 1 1 A 24 24 GLY N N 24 108.374 108.750 -0.376 1
1 284 . 13 1 1 A 25 25 ILE H H 25 8.331 8.633 -0.302 1
1 285 . 13 1 1 A 25 25 ILE HA H 25 3.839 3.619 0.220 1
1 295 . 13 1 1 A 25 25 ILE C C 25 178.042 177.735 0.307 1
1 296 . 13 1 1 A 25 25 ILE CA C 25 64.238 64.401 -0.163 1
1 297 . 13 1 1 A 25 25 ILE CB C 25 37.931 37.292 0.639 1
1 301 . 13 1 1 A 25 25 ILE N N 25 119.895 120.679 -0.784 1
1 302 . 13 1 1 A 26 26 GLN H H 26 8.545 8.601 -0.056 1
1 303 . 13 1 1 A 26 26 GLN HA H 26 4.129 4.055 0.074 1
1 310 . 13 1 1 A 26 26 GLN C C 26 178.454 177.608 0.846 1
1 311 . 13 1 1 A 26 26 GLN CA C 26 58.772 58.045 0.727 1
1 312 . 13 1 1 A 26 26 GLN CB C 26 27.346 27.329 0.017 1
1 314 . 13 1 1 A 26 26 GLN N N 26 120.013 119.895 0.118 1
1 316 . 13 1 1 A 27 27 THR H H 27 7.944 7.354 0.590 1
1 317 . 13 1 1 A 27 27 THR HA H 27 3.953 4.084 -0.131 1
1 322 . 13 1 1 A 27 27 THR C C 27 175.818 176.307 -0.489 1
1 323 . 13 1 1 A 27 27 THR CA C 27 65.855 65.948 -0.093 1
1 324 . 13 1 1 A 27 27 THR CB C 27 68.127 68.927 -0.800 1
1 326 . 13 1 1 A 27 27 THR N N 27 117.645 116.440 1.205 1
1 327 . 13 1 1 A 28 28 ALA H H 28 8.593 8.186 0.407 1
1 328 . 13 1 1 A 28 28 ALA HA H 28 3.899 4.001 -0.102 1
1 332 . 13 1 1 A 28 28 ALA C C 28 178.515 179.725 -1.210 1
1 333 . 13 1 1 A 28 28 ALA CA C 28 55.742 55.545 0.197 1
1 334 . 13 1 1 A 28 28 ALA CB C 28 17.513 18.088 -0.575 1
1 335 . 13 1 1 A 28 28 ALA N N 28 123.917 123.602 0.315 1
1 336 . 13 1 1 A 29 29 LYS H H 29 7.800 7.886 -0.086 1
1 337 . 13 1 1 A 29 29 LYS HA H 29 3.982 3.923 0.059 1
1 346 . 13 1 1 A 29 29 LYS C C 29 179.527 178.994 0.533 1
1 347 . 13 1 1 A 29 29 LYS CA C 29 59.761 59.595 0.166 1
1 348 . 13 1 1 A 29 29 LYS CB C 29 32.223 32.337 -0.114 1
1 352 . 13 1 1 A 29 29 LYS N N 29 117.474 118.861 -1.387 1
1 353 . 13 1 1 A 30 30 VAL H H 30 7.591 7.571 0.020 1
1 354 . 13 1 1 A 30 30 VAL HA H 30 3.503 3.220 0.283 1
1 362 . 13 1 1 A 30 30 VAL C C 30 178.389 177.814 0.575 1
1 363 . 13 1 1 A 30 30 VAL CA C 30 65.640 65.681 -0.041 1
1 364 . 13 1 1 A 30 30 VAL CB C 30 31.644 31.422 0.222 1
1 367 . 13 1 1 A 30 30 VAL N N 30 121.749 120.398 1.351 1
1 368 . 13 1 1 A 31 31 LEU H H 31 8.333 7.972 0.361 1
1 369 . 13 1 1 A 31 31 LEU HA H 31 4.074 3.970 0.104 1
1 379 . 13 1 1 A 31 31 LEU C C 31 177.780 179.300 -1.520 1
1 380 . 13 1 1 A 31 31 LEU CA C 31 58.157 58.447 -0.290 1
1 381 . 13 1 1 A 31 31 LEU CB C 31 42.230 41.740 0.490 1
1 385 . 13 1 1 A 31 31 LEU N N 31 120.901 120.348 0.553 1
1 386 . 13 1 1 A 32 32 LYS H H 32 8.562 8.001 0.561 1
1 387 . 13 1 1 A 32 32 LYS HA H 32 3.290 3.903 -0.613 1
1 395 . 13 1 1 A 32 32 LYS C C 32 178.037 178.805 -0.768 1
1 396 . 13 1 1 A 32 32 LYS CA C 32 58.911 59.508 -0.597 1
1 397 . 13 1 1 A 32 32 LYS CB C 32 31.605 31.161 0.444 1
1 401 . 13 1 1 A 32 32 LYS N N 32 119.075 118.759 0.316 1
1 402 . 13 1 1 A 33 33 GLY H H 33 7.694 7.963 -0.269 1
1 403 . 13 1 1 A 33 33 GLY HA2 H 33 3.949 3.571 0.378 1
1 404 . 13 1 1 A 33 33 GLY HA3 H 33 3.826 3.643 0.183 1
1 405 . 13 1 1 A 33 33 GLY C C 33 177.101 176.634 0.467 1
1 406 . 13 1 1 A 33 33 GLY CA C 33 46.928 47.120 -0.192 1
1 407 . 13 1 1 A 33 33 GLY N N 33 105.282 106.932 -1.650 1
1 408 . 13 1 1 A 34 34 TYR H H 34 8.015 7.624 0.391 1
1 409 . 13 1 1 A 34 34 TYR HA H 34 4.558 4.701 -0.143 1
1 416 . 13 1 1 A 34 34 TYR C C 34 179.611 178.207 1.404 1
1 417 . 13 1 1 A 34 34 TYR CA C 34 59.349 59.900 -0.551 1
1 418 . 13 1 1 A 34 34 TYR CB C 34 37.344 38.159 -0.815 1
1 423 . 13 1 1 A 34 34 TYR N N 34 121.781 121.857 -0.076 1
1 424 . 13 1 1 A 35 35 LEU H H 35 8.689 8.159 0.530 1
1 425 . 13 1 1 A 35 35 LEU HA H 35 3.977 3.846 0.131 1
1 435 . 13 1 1 A 35 35 LEU C C 35 177.081 178.730 -1.649 1
1 436 . 13 1 1 A 35 35 LEU CA C 35 59.155 58.419 0.736 1
1 437 . 13 1 1 A 35 35 LEU CB C 35 41.103 41.588 -0.485 1
1 441 . 13 1 1 A 35 35 LEU N N 35 120.392 120.592 -0.200 1
1 442 . 13 1 1 A 36 36 ASN H H 36 8.721 8.376 0.345 1
1 443 . 13 1 1 A 36 36 ASN HA H 36 4.435 4.438 -0.003 1
1 448 . 13 1 1 A 36 36 ASN C C 36 176.792 177.562 -0.770 1
1 449 . 13 1 1 A 36 36 ASN CA C 36 55.642 55.773 -0.131 1
1 450 . 13 1 1 A 36 36 ASN CB C 36 38.319 38.295 0.024 1
1 451 . 13 1 1 A 36 36 ASN N N 36 114.623 116.504 -1.881 1
1 453 . 13 1 1 A 37 37 SER H H 37 8.511 7.985 0.526 1
1 454 . 13 1 1 A 37 37 SER HA H 37 4.642 4.331 0.311 1
1 457 . 13 1 1 A 37 37 SER C C 37 175.039 176.146 -1.107 1
1 458 . 13 1 1 A 37 37 SER CA C 37 59.825 61.331 -1.506 1
1 459 . 13 1 1 A 37 37 SER CB C 37 64.056 63.036 1.020 1
1 460 . 13 1 1 A 37 37 SER N N 37 110.941 115.637 -4.696 1
1 461 . 13 1 1 A 38 38 ARG H H 38 7.242 7.854 -0.612 1
1 462 . 13 1 1 A 38 38 ARG HA H 38 4.919 4.465 0.454 1
1 469 . 13 1 1 A 38 38 ARG C C 38 176.514 178.439 -1.925 1
1 470 . 13 1 1 A 38 38 ARG CA C 38 56.687 57.956 -1.269 1
1 471 . 13 1 1 A 38 38 ARG CB C 38 32.434 31.198 1.236 1
1 474 . 13 1 1 A 38 38 ARG N N 38 117.062 120.429 -3.367 1
1 475 . 13 1 1 A 39 39 ILE H H 39 8.462 8.035 0.427 1
1 476 . 13 1 1 A 39 39 ILE HA H 39 3.618 3.742 -0.124 1
1 486 . 13 1 1 A 39 39 ILE C C 39 176.267 178.433 -2.166 1
1 487 . 13 1 1 A 39 39 ILE CA C 39 66.134 65.181 0.953 1
1 488 . 13 1 1 A 39 39 ILE CB C 39 39.787 37.876 1.911 1
1 492 . 13 1 1 A 39 39 ILE N N 39 121.214 120.342 0.872 1
1 493 . 13 1 1 A 40 40 ILE H H 40 9.339 8.202 1.137 1
1 494 . 13 1 1 A 40 40 ILE HA H 40 3.401 3.740 -0.339 1
1 504 . 13 1 1 A 40 40 ILE CA C 40 67.844 66.307 1.537 1
1 505 . 13 1 1 A 40 40 ILE CB C 40 34.406 35.236 -0.830 1
1 509 . 13 1 1 A 40 40 ILE N N 40 119.695 121.523 -1.828 1
1 510 . 13 1 1 A 41 41 PRO HA H 41 4.314 4.362 -0.048 1
1 517 . 13 1 1 A 41 41 PRO C C 41 177.418 178.721 -1.303 1
1 518 . 13 1 1 A 41 41 PRO CA C 41 65.912 65.911 0.001 1
1 519 . 13 1 1 A 41 41 PRO CB C 41 30.686 30.980 -0.294 1
1 522 . 13 1 1 A 42 42 SER H H 42 6.857 8.025 -1.168 1
1 523 . 13 1 1 A 42 42 SER HA H 42 4.558 4.594 -0.036 1
1 526 . 13 1 1 A 42 42 SER C C 42 174.813 176.179 -1.366 1
1 527 . 13 1 1 A 42 42 SER CA C 42 61.279 60.304 0.975 1
1 528 . 13 1 1 A 42 42 SER CB C 42 64.285 64.469 -0.184 1
1 529 . 13 1 1 A 42 42 SER N N 42 108.994 112.787 -3.793 1
1 530 . 13 1 1 A 43 43 LEU H H 43 8.230 8.224 0.006 1
1 531 . 13 1 1 A 43 43 LEU HA H 43 4.572 4.301 0.271 1
1 541 . 13 1 1 A 43 43 LEU C C 43 177.301 178.321 -1.020 1
1 542 . 13 1 1 A 43 43 LEU CA C 43 54.113 55.172 -1.059 1
1 543 . 13 1 1 A 43 43 LEU CB C 43 44.800 42.279 2.521 1
1 547 . 13 1 1 A 43 43 LEU N N 43 118.715 120.332 -1.617 1
1 548 . 13 1 1 A 44 44 GLY H H 44 8.498 7.921 0.577 1
1 549 . 13 1 1 A 44 44 GLY HA2 H 44 4.010 3.832 0.178 1
1 550 . 13 1 1 A 44 44 GLY HA3 H 44 3.613 3.836 -0.223 1
1 551 . 13 1 1 A 44 44 GLY C C 44 174.178 175.752 -1.574 1
1 552 . 13 1 1 A 44 44 GLY CA C 44 46.271 47.369 -1.098 1
1 553 . 13 1 1 A 44 44 GLY N N 44 105.371 107.794 -2.423 1
1 554 . 13 1 1 A 45 45 ASN H H 45 8.385 8.004 0.381 1
1 555 . 13 1 1 A 45 45 ASN HA H 45 4.789 4.781 0.008 1
1 560 . 13 1 1 A 45 45 ASN C C 45 175.386 175.556 -0.170 1
1 561 . 13 1 1 A 45 45 ASN CA C 45 53.144 53.697 -0.553 1
1 562 . 13 1 1 A 45 45 ASN CB C 45 37.928 38.841 -0.913 1
1 563 . 13 1 1 A 45 45 ASN N N 45 114.387 119.786 -5.399 1
1 565 . 13 1 1 A 46 46 ILE H H 46 7.465 7.326 0.139 1
1 566 . 13 1 1 A 46 46 ILE HA H 46 3.856 4.064 -0.208 1
1 576 . 13 1 1 A 46 46 ILE C C 46 175.997 176.069 -0.072 1
1 577 . 13 1 1 A 46 46 ILE CA C 46 60.853 61.540 -0.687 1
1 578 . 13 1 1 A 46 46 ILE CB C 46 38.042 38.393 -0.351 1
1 582 . 13 1 1 A 46 46 ILE N N 46 123.998 122.107 1.891 1
1 583 . 13 1 1 A 47 47 LYS H H 47 8.717 8.794 -0.077 1
1 584 . 13 1 1 A 47 47 LYS HA H 47 4.249 4.346 -0.097 1
1 591 . 13 1 1 A 47 47 LYS C C 47 177.583 177.651 -0.068 1
1 592 . 13 1 1 A 47 47 LYS CA C 47 56.320 56.074 0.246 1
1 593 . 13 1 1 A 47 47 LYS CB C 47 30.393 33.013 -2.620 1
1 596 . 13 1 1 A 47 47 LYS N N 47 126.114 125.009 1.105 1
1 597 . 13 1 1 A 48 48 LEU H H 48 8.323 8.661 -0.338 1
1 598 . 13 1 1 A 48 48 LEU HA H 48 3.691 3.976 -0.285 1
1 608 . 13 1 1 A 48 48 LEU C C 48 177.274 178.251 -0.977 1
1 609 . 13 1 1 A 48 48 LEU CA C 48 58.443 58.500 -0.057 1
1 610 . 13 1 1 A 48 48 LEU CB C 48 42.282 41.197 1.085 1
1 614 . 13 1 1 A 48 48 LEU N N 48 125.857 126.168 -0.311 1
1 615 . 13 1 1 A 49 49 ALA H H 49 8.929 7.977 0.952 1
1 616 . 13 1 1 A 49 49 ALA HA H 49 4.067 4.037 0.030 1
1 620 . 13 1 1 A 49 49 ALA C C 49 177.468 178.414 -0.946 1
1 621 . 13 1 1 A 49 49 ALA CA C 49 53.092 54.563 -1.471 1
1 622 . 13 1 1 A 49 49 ALA CB C 49 18.562 18.197 0.365 1
1 623 . 13 1 1 A 49 49 ALA N N 49 115.543 120.087 -4.544 1
1 624 . 13 1 1 A 50 50 LYS H H 50 7.684 7.313 0.371 1
1 625 . 13 1 1 A 50 50 LYS HA H 50 4.395 4.333 0.062 1
1 634 . 13 1 1 A 50 50 LYS C C 50 174.958 176.698 -1.740 1
1 635 . 13 1 1 A 50 50 LYS CA C 50 53.977 56.713 -2.736 1
1 636 . 13 1 1 A 50 50 LYS CB C 50 32.645 32.649 -0.004 1
1 640 . 13 1 1 A 50 50 LYS N N 50 114.788 114.927 -0.139 1
1 641 . 13 1 1 A 51 51 LEU H H 51 6.776 6.953 -0.177 1
1 642 . 13 1 1 A 51 51 LEU HA H 51 4.569 4.335 0.234 1
1 652 . 13 1 1 A 51 51 LEU C C 51 177.953 175.805 2.148 1
1 653 . 13 1 1 A 51 51 LEU CA C 51 55.318 54.609 0.709 1
1 654 . 13 1 1 A 51 51 LEU CB C 51 43.182 40.337 2.845 1
1 658 . 13 1 1 A 51 51 LEU N N 51 121.408 122.258 -0.850 1
1 659 . 13 1 1 A 52 52 THR H H 52 10.680 8.755 1.925 1
1 660 . 13 1 1 A 52 52 THR HA H 52 4.938 4.647 0.291 1
1 665 . 13 1 1 A 52 52 THR C C 52 175.553 174.705 0.848 1
1 666 . 13 1 1 A 52 52 THR CA C 52 59.740 60.554 -0.814 1
1 667 . 13 1 1 A 52 52 THR CB C 52 73.557 70.638 2.919 1
1 669 . 13 1 1 A 52 52 THR N N 52 119.481 119.804 -0.323 1
1 670 . 13 1 1 A 53 53 SER H H 53 9.278 9.010 0.268 1
1 671 . 13 1 1 A 53 53 SER HA H 53 4.261 4.141 0.120 1
1 674 . 13 1 1 A 53 53 SER C C 53 176.990 176.430 0.560 1
1 675 . 13 1 1 A 53 53 SER CA C 53 61.025 61.188 -0.163 1
1 676 . 13 1 1 A 53 53 SER CB C 53 62.312 62.899 -0.587 1
1 677 . 13 1 1 A 53 53 SER N N 53 116.343 121.842 -5.499 1
1 678 . 13 1 1 A 54 54 LEU H H 54 7.808 8.046 -0.238 1
1 679 . 13 1 1 A 54 54 LEU HA H 54 4.229 3.963 0.266 1
1 688 . 13 1 1 A 54 54 LEU C C 54 178.505 178.760 -0.255 1
1 689 . 13 1 1 A 54 54 LEU CA C 54 57.719 57.743 -0.024 1
1 690 . 13 1 1 A 54 54 LEU CB C 54 40.997 41.512 -0.515 1
1 694 . 13 1 1 A 54 54 LEU N N 54 126.055 122.772 3.283 1
1 695 . 13 1 1 A 55 55 HIS H H 55 7.798 7.747 0.051 1
1 696 . 13 1 1 A 55 55 HIS HA H 55 4.311 4.308 0.003 1
1 701 . 13 1 1 A 55 55 HIS C C 55 180.044 178.017 2.027 1
1 702 . 13 1 1 A 55 55 HIS CA C 55 60.583 59.135 1.448 1
1 703 . 13 1 1 A 55 55 HIS CB C 55 31.445 29.866 1.579 1
1 706 . 13 1 1 A 55 55 HIS N N 55 118.683 118.279 0.404 1
1 707 . 13 1 1 A 56 56 MET H H 56 7.375 8.334 -0.959 1
1 708 . 13 1 1 A 56 56 MET HA H 56 4.513 4.045 0.468 1
1 716 . 13 1 1 A 56 56 MET C C 56 177.169 178.404 -1.235 1
1 717 . 13 1 1 A 56 56 MET CA C 56 55.823 59.159 -3.336 1
1 718 . 13 1 1 A 56 56 MET CB C 56 31.303 32.688 -1.385 1
1 721 . 13 1 1 A 56 56 MET N N 56 114.530 117.387 -2.857 1
1 722 . 13 1 1 A 57 57 GLN H H 57 8.387 8.091 0.296 1
1 723 . 13 1 1 A 57 57 GLN HA H 57 3.981 4.024 -0.043 1
1 730 . 13 1 1 A 57 57 GLN C C 57 178.033 178.500 -0.467 1
1 731 . 13 1 1 A 57 57 GLN CA C 57 57.922 59.053 -1.131 1
1 732 . 13 1 1 A 57 57 GLN CB C 57 29.012 28.578 0.434 1
1 734 . 13 1 1 A 57 57 GLN N N 57 120.713 120.288 0.425 1
1 736 . 13 1 1 A 58 58 ASN H H 58 8.765 8.259 0.506 1
1 737 . 13 1 1 A 58 58 ASN HA H 58 4.539 4.486 0.053 1
1 742 . 13 1 1 A 58 58 ASN C C 58 178.084 177.611 0.473 1
1 743 . 13 1 1 A 58 58 ASN CA C 58 55.345 56.230 -0.885 1
1 744 . 13 1 1 A 58 58 ASN CB C 58 36.924 38.083 -1.159 1
1 745 . 13 1 1 A 58 58 ASN N N 58 117.390 117.553 -0.163 1
1 747 . 13 1 1 A 59 59 TYR H H 59 8.239 8.133 0.106 1
1 748 . 13 1 1 A 59 59 TYR HA H 59 4.586 4.194 0.392 1
1 755 . 13 1 1 A 59 59 TYR C C 59 178.015 176.964 1.051 1
1 756 . 13 1 1 A 59 59 TYR CA C 59 60.779 61.541 -0.762 1
1 757 . 13 1 1 A 59 59 TYR CB C 59 38.047 38.675 -0.628 1
1 762 . 13 1 1 A 59 59 TYR N N 59 122.335 123.025 -0.690 1
1 763 . 13 1 1 A 60 60 VAL H H 60 8.416 8.438 -0.022 1
1 764 . 13 1 1 A 60 60 VAL HA H 60 3.244 3.535 -0.291 1
1 772 . 13 1 1 A 60 60 VAL C C 60 177.309 178.267 -0.958 1
1 773 . 13 1 1 A 60 60 VAL CA C 60 67.022 66.463 0.559 1
1 774 . 13 1 1 A 60 60 VAL CB C 60 30.929 31.345 -0.416 1
1 777 . 13 1 1 A 60 60 VAL N N 60 119.842 119.527 0.315 1
1 778 . 13 1 1 A 61 61 ASN H H 61 8.264 8.090 0.174 1
1 779 . 13 1 1 A 61 61 ASN HA H 61 4.305 4.459 -0.154 1
1 784 . 13 1 1 A 61 61 ASN C C 61 177.263 178.070 -0.807 1
1 785 . 13 1 1 A 61 61 ASN CA C 61 55.548 56.446 -0.898 1
1 786 . 13 1 1 A 61 61 ASN CB C 61 36.645 37.882 -1.237 1
1 787 . 13 1 1 A 61 61 ASN N N 61 119.103 119.961 -0.858 1
1 789 . 13 1 1 A 62 62 SER H H 62 8.143 7.819 0.324 1
1 790 . 13 1 1 A 62 62 SER HA H 62 4.343 4.057 0.286 1
1 793 . 13 1 1 A 62 62 SER C C 62 176.409 175.856 0.553 1
1 794 . 13 1 1 A 62 62 SER CA C 62 61.612 62.347 -0.735 1
1 795 . 13 1 1 A 62 62 SER CB C 62 62.219 62.992 -0.773 1
1 796 . 13 1 1 A 62 62 SER N N 62 118.254 116.105 2.149 1
1 797 . 13 1 1 A 63 63 LEU H H 63 7.664 8.148 -0.484 1
1 798 . 13 1 1 A 63 63 LEU HA H 63 4.003 3.822 0.181 1
1 808 . 13 1 1 A 63 63 LEU C C 63 178.748 179.131 -0.383 1
1 809 . 13 1 1 A 63 63 LEU CA C 63 57.171 57.923 -0.752 1
1 810 . 13 1 1 A 63 63 LEU CB C 63 41.134 41.479 -0.345 1
1 814 . 13 1 1 A 63 63 LEU N N 63 123.812 120.717 3.095 1
1 815 . 13 1 1 A 64 64 ARG H H 64 7.969 7.522 0.447 1
1 816 . 13 1 1 A 64 64 ARG HA H 64 4.038 3.966 0.072 1
1 824 . 13 1 1 A 64 64 ARG C C 64 180.797 178.623 2.174 1
1 825 . 13 1 1 A 64 64 ARG CA C 64 58.598 59.218 -0.620 1
1 826 . 13 1 1 A 64 64 ARG CB C 64 28.849 29.984 -1.135 1
1 829 . 13 1 1 A 64 64 ARG N N 64 120.376 120.912 -0.536 1
1 831 . 13 1 1 A 65 65 ASP H H 65 8.465 7.833 0.632 1
1 832 . 13 1 1 A 65 65 ASP HA H 65 4.408 4.474 -0.066 1
1 835 . 13 1 1 A 65 65 ASP C C 65 177.336 177.701 -0.365 1
1 836 . 13 1 1 A 65 65 ASP CA C 65 56.957 56.647 0.310 1
1 837 . 13 1 1 A 65 65 ASP CB C 65 39.602 40.615 -1.013 1
1 838 . 13 1 1 A 65 65 ASP N N 65 122.402 119.625 2.777 1
1 839 . 13 1 1 A 66 66 GLU H H 66 7.703 7.823 -0.120 1
1 840 . 13 1 1 A 66 66 GLU HA H 66 4.213 4.327 -0.114 1
1 845 . 13 1 1 A 66 66 GLU C C 66 176.586 177.073 -0.487 1
1 846 . 13 1 1 A 66 66 GLU CA C 66 56.974 56.338 0.636 1
1 847 . 13 1 1 A 66 66 GLU CB C 66 29.821 29.993 -0.172 1
1 849 . 13 1 1 A 66 66 GLU N N 66 119.076 117.192 1.884 1
1 850 . 13 1 1 A 67 67 GLY H H 67 7.861 7.757 0.104 1
1 851 . 13 1 1 A 67 67 GLY HA2 H 67 4.269 3.901 0.368 1
1 852 . 13 1 1 A 67 67 GLY HA3 H 67 3.731 3.904 -0.173 1
1 853 . 13 1 1 A 67 67 GLY C C 67 174.614 174.705 -0.091 1
1 854 . 13 1 1 A 67 67 GLY CA C 67 44.608 45.848 -1.240 1
1 855 . 13 1 1 A 67 67 GLY N N 67 105.730 109.743 -4.013 1
1 856 . 13 1 1 A 68 68 LEU H H 68 7.324 7.551 -0.227 1
1 857 . 13 1 1 A 68 68 LEU HA H 68 4.257 4.196 0.061 1
1 867 . 13 1 1 A 68 68 LEU C C 68 176.136 176.812 -0.676 1
1 868 . 13 1 1 A 68 68 LEU CA C 68 55.659 54.833 0.826 1
1 869 . 13 1 1 A 68 68 LEU CB C 68 41.874 42.000 -0.126 1
1 873 . 13 1 1 A 68 68 LEU N N 68 121.062 121.947 -0.885 1
1 874 . 13 1 1 A 69 69 LYS H H 69 8.368 8.480 -0.112 1
1 875 . 13 1 1 A 69 69 LYS HA H 69 4.281 4.449 -0.168 1
1 884 . 13 1 1 A 69 69 LYS C C 69 177.940 178.101 -0.161 1
1 885 . 13 1 1 A 69 69 LYS CA C 69 55.412 55.872 -0.460 1
1 886 . 13 1 1 A 69 69 LYS CB C 69 32.761 33.357 -0.596 1
1 890 . 13 1 1 A 69 69 LYS N N 69 120.120 122.622 -2.502 1
1 891 . 13 1 1 A 70 70 ARG H H 70 9.095 8.876 0.219 1
1 892 . 13 1 1 A 70 70 ARG HA H 70 3.684 4.090 -0.406 1
1 900 . 13 1 1 A 70 70 ARG C C 70 177.712 178.633 -0.921 1
1 901 . 13 1 1 A 70 70 ARG CA C 70 60.216 58.457 1.759 1
1 902 . 13 1 1 A 70 70 ARG CB C 70 29.539 29.859 -0.320 1
1 905 . 13 1 1 A 70 70 ARG N N 70 123.339 118.972 4.367 1
1 907 . 13 1 1 A 71 71 GLY H H 71 8.985 8.369 0.616 1
1 908 . 13 1 1 A 71 71 GLY HA2 H 71 3.932 3.675 0.257 1
1 909 . 13 1 1 A 71 71 GLY HA3 H 71 3.905 3.678 0.227 1
1 910 . 13 1 1 A 71 71 GLY C C 71 176.324 175.917 0.407 1
1 911 . 13 1 1 A 71 71 GLY CA C 71 46.752 47.410 -0.658 1
1 912 . 13 1 1 A 71 71 GLY N N 71 104.509 108.911 -4.402 1
1 913 . 13 1 1 A 72 72 THR H H 72 7.295 8.015 -0.720 1
1 914 . 13 1 1 A 72 72 THR HA H 72 4.014 3.885 0.129 1
1 919 . 13 1 1 A 72 72 THR C C 72 175.135 176.135 -1.000 1
1 920 . 13 1 1 A 72 72 THR CA C 72 65.848 66.495 -0.647 1
1 921 . 13 1 1 A 72 72 THR CB C 72 68.160 68.512 -0.352 1
1 923 . 13 1 1 A 72 72 THR N N 72 118.617 117.441 1.176 1
1 924 . 13 1 1 A 73 73 ILE H H 73 7.883 7.906 -0.023 1
1 925 . 13 1 1 A 73 73 ILE HA H 73 3.258 3.556 -0.298 1
1 935 . 13 1 1 A 73 73 ILE C C 73 177.060 178.201 -1.141 1
1 936 . 13 1 1 A 73 73 ILE CA C 73 66.561 65.513 1.048 1
1 937 . 13 1 1 A 73 73 ILE CB C 73 37.339 37.608 -0.269 1
1 941 . 13 1 1 A 73 73 ILE N N 73 121.692 121.224 0.468 1
1 942 . 13 1 1 A 74 74 GLU H H 74 8.723 7.902 0.821 1
1 943 . 13 1 1 A 74 74 GLU HA H 74 3.807 3.934 -0.127 1
1 948 . 13 1 1 A 74 74 GLU C C 74 178.319 179.277 -0.958 1
1 949 . 13 1 1 A 74 74 GLU CA C 74 59.637 59.772 -0.135 1
1 950 . 13 1 1 A 74 74 GLU CB C 74 29.257 28.909 0.348 1
1 952 . 13 1 1 A 74 74 GLU N N 74 117.701 120.823 -3.122 1
1 953 . 13 1 1 A 75 75 LYS H H 75 7.361 7.718 -0.357 1
1 954 . 13 1 1 A 75 75 LYS HA H 75 3.958 4.044 -0.086 1
1 963 . 13 1 1 A 75 75 LYS C C 75 178.554 179.536 -0.982 1
1 964 . 13 1 1 A 75 75 LYS CA C 75 59.764 59.275 0.489 1
1 965 . 13 1 1 A 75 75 LYS CB C 75 32.314 32.534 -0.220 1
1 969 . 13 1 1 A 75 75 LYS N N 75 118.734 118.978 -0.244 1
1 970 . 13 1 1 A 76 76 ILE H H 76 7.713 7.492 0.221 1
1 971 . 13 1 1 A 76 76 ILE HA H 76 3.221 3.823 -0.602 1
1 981 . 13 1 1 A 76 76 ILE C C 76 177.504 178.188 -0.684 1
1 982 . 13 1 1 A 76 76 ILE CA C 76 65.796 64.523 1.273 1
1 983 . 13 1 1 A 76 76 ILE CB C 76 37.732 37.083 0.649 1
1 987 . 13 1 1 A 76 76 ILE N N 76 120.312 116.319 3.993 1
1 988 . 13 1 1 A 77 77 ILE H H 77 8.587 8.041 0.546 1
1 989 . 13 1 1 A 77 77 ILE HA H 77 3.778 3.555 0.223 1
1 999 . 13 1 1 A 77 77 ILE C C 77 177.074 177.868 -0.794 1
1 1000 . 13 1 1 A 77 77 ILE CA C 77 63.168 65.402 -2.234 1
1 1001 . 13 1 1 A 77 77 ILE CB C 77 36.617 37.426 -0.809 1
1 1005 . 13 1 1 A 77 77 ILE N N 77 118.978 121.755 -2.777 1
1 1006 . 13 1 1 A 78 78 LYS H H 78 8.050 7.935 0.115 1
1 1007 . 13 1 1 A 78 78 LYS HA H 78 3.925 4.055 -0.130 1
1 1016 . 13 1 1 A 78 78 LYS C C 78 178.291 179.355 -1.064 1
1 1017 . 13 1 1 A 78 78 LYS CA C 78 60.192 59.654 0.538 1
1 1018 . 13 1 1 A 78 78 LYS CB C 78 31.886 32.603 -0.717 1
1 1022 . 13 1 1 A 78 78 LYS N N 78 121.618 119.464 2.154 1
1 1023 . 13 1 1 A 79 79 VAL H H 79 7.619 7.340 0.279 1
1 1024 . 13 1 1 A 79 79 VAL HA H 79 3.846 3.715 0.131 1
1 1032 . 13 1 1 A 79 79 VAL C C 79 177.712 178.100 -0.388 1
1 1033 . 13 1 1 A 79 79 VAL CA C 79 66.494 66.193 0.301 1
1 1034 . 13 1 1 A 79 79 VAL CB C 79 31.298 31.833 -0.535 1
1 1037 . 13 1 1 A 79 79 VAL N N 79 120.254 119.559 0.695 1
1 1038 . 13 1 1 A 80 80 ILE H H 80 7.885 8.388 -0.503 1
1 1039 . 13 1 1 A 80 80 ILE HA H 80 3.367 3.455 -0.088 1
1 1049 . 13 1 1 A 80 80 ILE C C 80 179.892 177.872 2.020 1
1 1050 . 13 1 1 A 80 80 ILE CA C 80 65.343 65.317 0.026 1
1 1051 . 13 1 1 A 80 80 ILE CB C 80 38.129 37.401 0.728 1
1 1055 . 13 1 1 A 80 80 ILE N N 80 119.666 120.379 -0.713 1
1 1056 . 13 1 1 A 81 81 ARG H H 81 9.384 8.608 0.776 1
1 1057 . 13 1 1 A 81 81 ARG HA H 81 3.834 3.938 -0.104 1
1 1065 . 13 1 1 A 81 81 ARG C C 81 178.204 178.972 -0.768 1
1 1066 . 13 1 1 A 81 81 ARG CA C 81 60.560 59.939 0.621 1
1 1067 . 13 1 1 A 81 81 ARG CB C 81 30.196 30.341 -0.145 1
1 1070 . 13 1 1 A 81 81 ARG N N 81 121.030 119.719 1.311 1
1 1072 . 13 1 1 A 82 82 ASN H H 82 8.773 8.228 0.545 1
1 1073 . 13 1 1 A 82 82 ASN HA H 82 4.587 4.629 -0.042 1
1 1078 . 13 1 1 A 82 82 ASN C C 82 178.300 177.722 0.578 1
1 1079 . 13 1 1 A 82 82 ASN CA C 82 56.160 56.291 -0.131 1
1 1080 . 13 1 1 A 82 82 ASN CB C 82 38.464 39.603 -1.139 1
1 1081 . 13 1 1 A 82 82 ASN N N 82 118.483 118.852 -0.369 1
1 1083 . 13 1 1 A 83 83 SER H H 83 8.526 7.562 0.964 1
1 1084 . 13 1 1 A 83 83 SER HA H 83 2.765 2.736 0.029 1
1 1087 . 13 1 1 A 83 83 SER C C 83 176.386 175.914 0.472 1
1 1088 . 13 1 1 A 83 83 SER CA C 83 61.245 61.715 -0.470 1
1 1089 . 13 1 1 A 83 83 SER CB C 83 61.287 62.504 -1.217 1
1 1090 . 13 1 1 A 83 83 SER N N 83 118.286 115.930 2.356 1
1 1091 . 13 1 1 A 84 84 LEU H H 84 7.782 7.533 0.249 1
1 1092 . 13 1 1 A 84 84 LEU HA H 84 4.221 4.191 0.030 1
1 1102 . 13 1 1 A 84 84 LEU C C 84 177.846 178.981 -1.135 1
1 1103 . 13 1 1 A 84 84 LEU CA C 84 57.166 56.490 0.676 1
1 1104 . 13 1 1 A 84 84 LEU CB C 84 40.520 41.871 -1.351 1
1 1108 . 13 1 1 A 84 84 LEU N N 84 127.445 120.626 6.819 1
1 1109 . 13 1 1 A 85 85 GLU H H 85 8.264 8.447 -0.183 1
1 1110 . 13 1 1 A 85 85 GLU HA H 85 3.981 3.991 -0.010 1
1 1115 . 13 1 1 A 85 85 GLU C C 85 179.288 179.119 0.169 1
1 1116 . 13 1 1 A 85 85 GLU CA C 85 59.025 59.694 -0.669 1
1 1117 . 13 1 1 A 85 85 GLU CB C 85 29.182 29.284 -0.102 1
1 1119 . 13 1 1 A 85 85 GLU N N 85 121.538 120.412 1.126 1
1 1120 . 13 1 1 A 86 86 HIS H H 86 7.683 8.267 -0.584 1
1 1121 . 13 1 1 A 86 86 HIS HA H 86 4.573 4.425 0.148 1
1 1125 . 13 1 1 A 86 86 HIS C C 86 175.484 177.926 -2.442 1
1 1126 . 13 1 1 A 86 86 HIS CA C 86 58.940 59.895 -0.955 1
1 1127 . 13 1 1 A 86 86 HIS CB C 86 29.267 29.640 -0.373 1
1 1129 . 13 1 1 A 86 86 HIS N N 86 117.087 120.317 -3.230 1
1 1130 . 13 1 1 A 87 87 ALA H H 87 7.197 7.951 -0.754 1
1 1131 . 13 1 1 A 87 87 ALA HA H 87 3.925 3.959 -0.034 1
1 1135 . 13 1 1 A 87 87 ALA C C 87 179.038 180.096 -1.058 1
1 1136 . 13 1 1 A 87 87 ALA CA C 87 54.863 54.938 -0.075 1
1 1137 . 13 1 1 A 87 87 ALA CB C 87 17.034 18.422 -1.388 1
1 1138 . 13 1 1 A 87 87 ALA N N 87 121.510 120.910 0.600 1
1 1139 . 13 1 1 A 88 88 ILE H H 88 7.819 7.663 0.156 1
1 1140 . 13 1 1 A 88 88 ILE HA H 88 4.067 3.544 0.523 1
1 1150 . 13 1 1 A 88 88 ILE C C 88 180.846 177.474 3.372 1
1 1151 . 13 1 1 A 88 88 ILE CA C 88 64.021 65.420 -1.399 1
1 1152 . 13 1 1 A 88 88 ILE CB C 88 37.557 37.641 -0.084 1
1 1156 . 13 1 1 A 88 88 ILE N N 88 120.898 119.422 1.476 1
1 1157 . 13 1 1 A 89 89 ASP H H 89 7.808 7.969 -0.161 1
1 1158 . 13 1 1 A 89 89 ASP HA H 89 4.437 4.336 0.101 1
1 1161 . 13 1 1 A 89 89 ASP C C 89 178.033 178.055 -0.022 1
1 1162 . 13 1 1 A 89 89 ASP CA C 89 57.343 57.945 -0.602 1
1 1163 . 13 1 1 A 89 89 ASP CB C 89 39.689 41.742 -2.053 1
1 1164 . 13 1 1 A 89 89 ASP N N 89 125.174 120.780 4.394 1
1 1165 . 13 1 1 A 90 90 LEU H H 90 7.607 7.546 0.061 1
1 1166 . 13 1 1 A 90 90 LEU HA H 90 4.198 4.227 -0.029 1
1 1176 . 13 1 1 A 90 90 LEU C C 90 175.416 175.985 -0.569 1
1 1177 . 13 1 1 A 90 90 LEU CA C 90 54.755 55.213 -0.458 1
1 1178 . 13 1 1 A 90 90 LEU CB C 90 42.960 41.702 1.258 1
1 1182 . 13 1 1 A 90 90 LEU N N 90 117.576 117.384 0.192 1
1 1183 . 13 1 1 A 91 91 GLU H H 91 8.143 7.825 0.318 1
1 1184 . 13 1 1 A 91 91 GLU HA H 91 4.005 4.057 -0.052 1
1 1189 . 13 1 1 A 91 91 GLU C C 91 175.792 176.165 -0.373 1
1 1190 . 13 1 1 A 91 91 GLU CA C 91 57.202 57.620 -0.418 1
1 1191 . 13 1 1 A 91 91 GLU CB C 91 26.125 26.693 -0.568 1
1 1193 . 13 1 1 A 91 91 GLU N N 91 113.620 115.201 -1.581 1
1 1194 . 13 1 1 A 92 92 LEU H H 92 8.290 8.075 0.215 1
1 1195 . 13 1 1 A 92 92 LEU HA H 92 4.216 4.134 0.082 1
1 1205 . 13 1 1 A 92 92 LEU C C 92 176.622 176.984 -0.362 1
1 1206 . 13 1 1 A 92 92 LEU CA C 92 56.410 56.536 -0.126 1
1 1207 . 13 1 1 A 92 92 LEU CB C 92 43.378 42.399 0.979 1
1 1211 . 13 1 1 A 92 92 LEU N N 92 116.868 119.463 -2.595 1
1 1212 . 13 1 1 A 93 93 ILE H H 93 6.988 6.863 0.125 1
1 1213 . 13 1 1 A 93 93 ILE HA H 93 4.580 4.575 0.005 1
1 1223 . 13 1 1 A 93 93 ILE C C 93 175.145 175.491 -0.346 1
1 1224 . 13 1 1 A 93 93 ILE CA C 93 58.707 58.587 0.120 1
1 1225 . 13 1 1 A 93 93 ILE CB C 93 42.864 41.498 1.366 1
1 1229 . 13 1 1 A 93 93 ILE N N 93 107.565 113.950 -6.385 1
1 1230 . 13 1 1 A 94 94 THR H H 94 8.742 8.590 0.152 1
1 1231 . 13 1 1 A 94 94 THR HA H 94 4.489 4.347 0.142 1
1 1236 . 13 1 1 A 94 94 THR C C 94 173.875 174.431 -0.556 1
1 1237 . 13 1 1 A 94 94 THR CA C 94 61.842 62.768 -0.926 1
1 1238 . 13 1 1 A 94 94 THR CB C 94 69.972 69.188 0.784 1
1 1240 . 13 1 1 A 94 94 THR N N 94 107.904 113.554 -5.650 1
1 1241 . 13 1 1 A 95 95 LYS H H 95 7.294 7.684 -0.390 1
1 1242 . 13 1 1 A 95 95 LYS HA H 95 4.566 4.773 -0.207 1
1 1251 . 13 1 1 A 95 95 LYS C C 95 173.791 174.588 -0.797 1
1 1252 . 13 1 1 A 95 95 LYS CA C 95 54.533 55.488 -0.955 1
1 1253 . 13 1 1 A 95 95 LYS CB C 95 35.123 35.675 -0.552 1
1 1257 . 13 1 1 A 95 95 LYS N N 95 119.458 120.623 -1.165 1
1 1258 . 13 1 1 A 96 96 ASN H H 96 9.157 8.761 0.396 1
1 1259 . 13 1 1 A 96 96 ASN HA H 96 4.408 4.891 -0.483 1
1 1264 . 13 1 1 A 96 96 ASN C C 96 176.653 176.171 0.482 1
1 1265 . 13 1 1 A 96 96 ASN CA C 96 51.088 52.551 -1.463 1
1 1266 . 13 1 1 A 96 96 ASN CB C 96 37.292 38.633 -1.341 1
1 1267 . 13 1 1 A 96 96 ASN N N 96 121.031 124.825 -3.794 1
1 1269 . 13 1 1 A 97 97 VAL H H 97 8.193 8.472 -0.279 1
1 1270 . 13 1 1 A 97 97 VAL HA H 97 4.019 3.869 0.150 1
1 1278 . 13 1 1 A 97 97 VAL C C 97 175.089 176.269 -1.180 1
1 1279 . 13 1 1 A 97 97 VAL CA C 97 63.437 64.028 -0.591 1
1 1280 . 13 1 1 A 97 97 VAL CB C 97 29.934 31.401 -1.467 1
1 1283 . 13 1 1 A 97 97 VAL N N 97 118.839 122.966 -4.127 1
1 1284 . 13 1 1 A 98 98 ALA H H 98 7.994 7.856 0.138 1
1 1285 . 13 1 1 A 98 98 ALA HA H 98 5.108 4.376 0.732 1
1 1289 . 13 1 1 A 98 98 ALA C C 98 178.033 179.579 -1.546 1
1 1290 . 13 1 1 A 98 98 ALA CA C 98 50.342 52.823 -2.481 1
1 1291 . 13 1 1 A 98 98 ALA CB C 98 19.659 19.281 0.378 1
1 1292 . 13 1 1 A 98 98 ALA N N 98 121.031 124.146 -3.115 1
1 1293 . 13 1 1 A 99 99 ALA H H 99 7.347 7.897 -0.550 1
1 1294 . 13 1 1 A 99 99 ALA HA H 99 3.818 4.020 -0.202 1
1 1298 . 13 1 1 A 99 99 ALA C C 99 177.712 179.325 -1.613 1
1 1299 . 13 1 1 A 99 99 ALA CA C 99 55.117 55.152 -0.035 1
1 1300 . 13 1 1 A 99 99 ALA CB C 99 18.879 18.533 0.346 1
1 1301 . 13 1 1 A 99 99 ALA N N 99 122.816 120.979 1.837 1
1 1302 . 13 1 1 A 100 100 LYS H H 100 8.190 7.773 0.417 1
1 1303 . 13 1 1 A 100 100 LYS HA H 100 4.483 4.338 0.145 1
1 1312 . 13 1 1 A 100 100 LYS C C 100 175.899 176.962 -1.063 1
1 1313 . 13 1 1 A 100 100 LYS CA C 100 54.231 57.281 -3.050 1
1 1314 . 13 1 1 A 100 100 LYS CB C 100 32.066 32.687 -0.621 1
1 1318 . 13 1 1 A 100 100 LYS N N 100 113.197 115.675 -2.478 1
1 1319 . 13 1 1 A 101 101 THR H H 101 7.128 7.568 -0.440 1
1 1320 . 13 1 1 A 101 101 THR HA H 101 3.834 4.246 -0.412 1
1 1325 . 13 1 1 A 101 101 THR C C 101 173.255 173.493 -0.238 1
1 1326 . 13 1 1 A 101 101 THR CA C 101 64.392 62.905 1.487 1
1 1327 . 13 1 1 A 101 101 THR CB C 101 69.160 68.448 0.712 1
1 1329 . 13 1 1 A 101 101 THR N N 101 118.368 115.595 2.773 1
1 1330 . 13 1 1 A 102 102 LYS H H 102 8.753 8.567 0.186 1
1 1331 . 13 1 1 A 102 102 LYS HA H 102 4.438 4.736 -0.298 1
1 1340 . 13 1 1 A 102 102 LYS C C 102 175.627 175.761 -0.134 1
1 1341 . 13 1 1 A 102 102 LYS CA C 102 55.117 54.035 1.082 1
1 1342 . 13 1 1 A 102 102 LYS CB C 102 33.901 34.930 -1.029 1
1 1346 . 13 1 1 A 102 102 LYS N N 102 126.513 126.776 -0.263 1
1 1347 . 13 1 1 A 103 103 LEU H H 103 8.602 8.217 0.385 1
1 1348 . 13 1 1 A 103 103 LEU HA H 103 4.486 4.376 0.110 1
1 1358 . 13 1 1 A 103 103 LEU CA C 103 52.233 53.187 -0.954 1
1 1359 . 13 1 1 A 103 103 LEU CB C 103 41.028 42.819 -1.791 1
1 1363 . 13 1 1 A 103 103 LEU N N 103 124.466 123.275 1.191 1
1 1364 . 13 1 1 A 104 104 PRO HA H 104 4.437 4.487 -0.050 1
1 1371 . 13 1 1 A 104 104 PRO C C 104 175.779 176.670 -0.891 1
1 1372 . 13 1 1 A 104 104 PRO CA C 104 62.322 63.123 -0.801 1
1 1373 . 13 1 1 A 104 104 PRO CB C 104 31.899 31.805 0.094 1
1 1376 . 13 1 1 A 105 105 LYS H H 105 8.460 8.265 0.195 1
1 1377 . 13 1 1 A 105 105 LYS HA H 105 4.154 4.290 -0.136 1
1 1386 . 13 1 1 A 105 105 LYS C C 105 175.998 176.505 -0.507 1
1 1387 . 13 1 1 A 105 105 LYS CA C 105 56.480 56.296 0.184 1
1 1388 . 13 1 1 A 105 105 LYS CB C 105 32.909 31.886 1.023 1
1 1392 . 13 1 1 A 105 105 LYS N N 105 122.139 122.518 -0.379 1
1 1393 . 13 1 1 A 106 106 ALA H H 106 8.448 8.397 0.051 1
1 1394 . 13 1 1 A 106 106 ALA HA H 106 4.309 4.435 -0.126 1
1 1398 . 13 1 1 A 106 106 ALA C C 106 176.828 176.668 0.160 1
1 1399 . 13 1 1 A 106 106 ALA CA C 106 51.862 51.293 0.569 1
1 1400 . 13 1 1 A 106 106 ALA CB C 106 19.323 20.015 -0.692 1
1 1401 . 13 1 1 A 106 106 ALA N N 106 125.278 128.328 -3.050 1
1 1402 . 13 1 1 A 107 107 ASP H H 107 8.428 8.678 -0.250 1
1 1403 . 13 1 1 A 107 107 ASP HA H 107 4.574 4.708 -0.134 1
1 1406 . 13 1 1 A 107 107 ASP C C 107 175.951 175.320 0.631 1
1 1407 . 13 1 1 A 107 107 ASP CA C 107 54.214 53.552 0.662 1
1 1408 . 13 1 1 A 107 107 ASP CB C 107 41.141 39.182 1.959 1
1 1409 . 13 1 1 A 107 107 ASP N N 107 120.771 117.873 2.898 1
1 1410 . 13 1 1 A 108 108 LYS H H 108 8.329 8.264 0.065 1
1 1411 . 13 1 1 A 108 108 LYS HA H 108 4.203 4.437 -0.234 1
1 1420 . 13 1 1 A 108 108 LYS C C 108 176.483 175.298 1.185 1
1 1421 . 13 1 1 A 108 108 LYS CA C 108 56.831 55.423 1.408 1
1 1422 . 13 1 1 A 108 108 LYS CB C 108 32.648 30.841 1.807 1
1 1426 . 13 1 1 A 108 108 LYS N N 108 120.727 123.822 -3.095 1
1 1427 . 13 1 1 A 109 109 GLU H H 109 8.447 7.960 0.487 1
1 1428 . 13 1 1 A 109 109 GLU HA H 109 4.215 4.622 -0.407 1
1 1433 . 13 1 1 A 109 109 GLU C C 109 176.513 176.912 -0.399 1
1 1434 . 13 1 1 A 109 109 GLU CA C 109 56.936 55.874 1.062 1
1 1435 . 13 1 1 A 109 109 GLU CB C 109 29.833 28.963 0.870 1
1 1437 . 13 1 1 A 109 109 GLU N N 109 121.471 119.891 1.580 1
1 1438 . 13 1 1 A 110 110 GLU H H 110 8.352 8.565 -0.213 1
1 1439 . 13 1 1 A 110 110 GLU HA H 110 4.233 4.414 -0.181 1
1 1444 . 13 1 1 A 110 110 GLU C C 110 176.439 176.845 -0.406 1
1 1445 . 13 1 1 A 110 110 GLU CA C 110 56.681 56.112 0.569 1
1 1446 . 13 1 1 A 110 110 GLU CB C 110 29.860 29.225 0.635 1
1 1448 . 13 1 1 A 110 110 GLU N N 110 121.559 121.019 0.540 1
1 1449 . 13 1 1 A 111 111 LEU H H 111 8.145 7.862 0.283 1
1 1450 . 13 1 1 A 111 111 LEU HA H 111 4.251 4.478 -0.227 1
1 1460 . 13 1 1 A 111 111 LEU C C 111 177.306 176.288 1.018 1
1 1461 . 13 1 1 A 111 111 LEU CA C 111 55.277 55.080 0.197 1
1 1462 . 13 1 1 A 111 111 LEU CB C 111 42.054 41.349 0.705 1
1 1466 . 13 1 1 A 111 111 LEU N N 111 122.181 121.832 0.349 1
1 1467 . 13 1 1 A 112 112 GLU H H 112 8.212 7.746 0.466 1
1 1468 . 13 1 1 A 112 112 GLU N N 112 120.291 121.710 -1.419 1
1 1469 . 13 1 1 A 114 114 HIS C C 114 176.070 173.450 2.620 1
1 1470 . 13 1 1 A 116 116 HIS H H 116 8.227 8.645 -0.418 1
1 1471 . 13 1 1 A 116 116 HIS C C 116 173.580 175.528 -1.948 1
1 1472 . 13 1 1 A 116 116 HIS N N 116 119.156 122.798 -3.642 1
1 5 . 14 1 1 A 3 3 PRO HA H 3 4.390 4.587 -0.197 1
1 12 . 14 1 1 A 3 3 PRO C C 3 176.847 176.383 0.464 1
1 13 . 14 1 1 A 3 3 PRO CA C 3 63.449 62.786 0.663 1
1 14 . 14 1 1 A 3 3 PRO CB C 3 31.938 32.782 -0.844 1
1 17 . 14 1 1 A 4 4 SER H H 4 8.531 8.403 0.128 1
1 18 . 14 1 1 A 4 4 SER HA H 4 4.262 4.533 -0.271 1
1 21 . 14 1 1 A 4 4 SER C C 4 175.414 174.415 0.999 1
1 22 . 14 1 1 A 4 4 SER CA C 4 59.163 57.655 1.508 1
1 23 . 14 1 1 A 4 4 SER CB C 4 63.242 62.335 0.907 1
1 24 . 14 1 1 A 4 4 SER N N 4 114.246 115.832 -1.586 1
1 25 . 14 1 1 A 5 5 LYS H H 5 8.468 8.140 0.328 1
1 26 . 14 1 1 A 5 5 LYS HA H 5 4.433 4.190 0.243 1
1 35 . 14 1 1 A 5 5 LYS C C 5 175.984 177.086 -1.102 1
1 36 . 14 1 1 A 5 5 LYS CA C 5 55.724 57.625 -1.901 1
1 37 . 14 1 1 A 5 5 LYS CB C 5 32.881 32.985 -0.104 1
1 41 . 14 1 1 A 5 5 LYS N N 5 123.488 124.128 -0.640 1
1 42 . 14 1 1 A 6 6 LEU H H 6 7.707 7.343 0.364 1
1 43 . 14 1 1 A 6 6 LEU HA H 6 4.381 4.338 0.043 1
1 53 . 14 1 1 A 6 6 LEU C C 6 177.820 176.185 1.635 1
1 54 . 14 1 1 A 6 6 LEU CA C 6 55.507 54.946 0.561 1
1 55 . 14 1 1 A 6 6 LEU CB C 6 43.374 42.509 0.865 1
1 59 . 14 1 1 A 6 6 LEU N N 6 121.233 123.271 -2.038 1
1 60 . 14 1 1 A 7 7 SER H H 7 9.433 8.639 0.794 1
1 61 . 14 1 1 A 7 7 SER HA H 7 4.638 4.717 -0.079 1
1 64 . 14 1 1 A 7 7 SER C C 7 174.120 175.114 -0.994 1
1 65 . 14 1 1 A 7 7 SER CA C 7 57.962 57.619 0.343 1
1 66 . 14 1 1 A 7 7 SER CB C 7 64.197 64.668 -0.471 1
1 67 . 14 1 1 A 7 7 SER N N 7 122.977 118.373 4.604 1
1 68 . 14 1 1 A 8 8 TYR H H 8 9.764 8.902 0.862 1
1 69 . 14 1 1 A 8 8 TYR HA H 8 4.732 4.257 0.475 1
1 76 . 14 1 1 A 8 8 TYR C C 8 177.206 177.735 -0.529 1
1 77 . 14 1 1 A 8 8 TYR CA C 8 58.762 61.801 -3.039 1
1 78 . 14 1 1 A 8 8 TYR CB C 8 36.605 38.846 -2.241 1
1 83 . 14 1 1 A 8 8 TYR N N 8 123.312 122.638 0.674 1
1 84 . 14 1 1 A 9 9 GLY H H 9 10.131 8.319 1.812 1
1 85 . 14 1 1 A 9 9 GLY HA2 H 9 3.983 3.622 0.361 1
1 86 . 14 1 1 A 9 9 GLY HA3 H 9 3.423 3.705 -0.282 1
1 87 . 14 1 1 A 9 9 GLY C C 9 175.163 176.013 -0.850 1
1 88 . 14 1 1 A 9 9 GLY CA C 9 47.153 47.313 -0.160 1
1 89 . 14 1 1 A 9 9 GLY N N 9 107.177 106.010 1.167 1
1 90 . 14 1 1 A 10 10 GLU H H 10 7.876 8.032 -0.156 1
1 91 . 14 1 1 A 10 10 GLU HA H 10 4.107 4.112 -0.005 1
1 96 . 14 1 1 A 10 10 GLU C C 10 179.924 178.829 1.095 1
1 97 . 14 1 1 A 10 10 GLU CA C 10 58.890 59.332 -0.442 1
1 98 . 14 1 1 A 10 10 GLU CB C 10 29.750 29.318 0.432 1
1 100 . 14 1 1 A 10 10 GLU N N 10 122.219 121.869 0.350 1
1 101 . 14 1 1 A 11 11 TYR H H 11 8.384 8.240 0.144 1
1 102 . 14 1 1 A 11 11 TYR HA H 11 4.305 4.236 0.069 1
1 107 . 14 1 1 A 11 11 TYR C C 11 176.854 177.045 -0.191 1
1 108 . 14 1 1 A 11 11 TYR CA C 11 61.040 61.489 -0.449 1
1 109 . 14 1 1 A 11 11 TYR CB C 11 37.593 39.095 -1.502 1
1 112 . 14 1 1 A 11 11 TYR N N 11 120.809 123.149 -2.340 1
1 113 . 14 1 1 A 12 12 LEU H H 12 9.027 8.175 0.852 1
1 114 . 14 1 1 A 12 12 LEU HA H 12 3.778 3.926 -0.148 1
1 124 . 14 1 1 A 12 12 LEU C C 12 178.621 179.494 -0.873 1
1 125 . 14 1 1 A 12 12 LEU CA C 12 57.534 57.420 0.114 1
1 126 . 14 1 1 A 12 12 LEU CB C 12 41.957 41.107 0.850 1
1 130 . 14 1 1 A 12 12 LEU N N 12 121.080 118.916 2.164 1
1 131 . 14 1 1 A 13 13 GLU H H 13 7.614 7.897 -0.283 1
1 132 . 14 1 1 A 13 13 GLU HA H 13 4.102 4.017 0.085 1
1 137 . 14 1 1 A 13 13 GLU C C 13 178.449 179.130 -0.681 1
1 138 . 14 1 1 A 13 13 GLU CA C 13 59.609 59.886 -0.277 1
1 139 . 14 1 1 A 13 13 GLU CB C 13 29.124 29.434 -0.310 1
1 141 . 14 1 1 A 13 13 GLU N N 13 118.475 120.545 -2.070 1
1 142 . 14 1 1 A 14 14 SER H H 14 7.329 7.784 -0.455 1
1 143 . 14 1 1 A 14 14 SER HA H 14 4.358 4.165 0.193 1
1 146 . 14 1 1 A 14 14 SER C C 14 176.794 175.942 0.852 1
1 147 . 14 1 1 A 14 14 SER CA C 14 61.064 62.462 -1.398 1
1 148 . 14 1 1 A 14 14 SER CB C 14 62.513 63.181 -0.668 1
1 149 . 14 1 1 A 14 14 SER N N 14 115.209 116.334 -1.125 1
1 150 . 14 1 1 A 15 15 TRP H H 15 8.870 8.056 0.814 1
1 151 . 14 1 1 A 15 15 TRP HA H 15 4.005 4.088 -0.083 1
1 160 . 14 1 1 A 15 15 TRP C C 15 177.547 177.908 -0.361 1
1 161 . 14 1 1 A 15 15 TRP CA C 15 61.210 61.087 0.123 1
1 162 . 14 1 1 A 15 15 TRP CB C 15 27.341 29.085 -1.744 1
1 168 . 14 1 1 A 15 15 TRP N N 15 124.998 124.011 0.987 1
1 170 . 14 1 1 A 16 16 PHE H H 16 9.087 8.104 0.983 1
1 171 . 14 1 1 A 16 16 PHE HA H 16 3.210 3.698 -0.488 1
1 179 . 14 1 1 A 16 16 PHE C C 16 175.909 177.529 -1.620 1
1 180 . 14 1 1 A 16 16 PHE CA C 16 61.473 61.278 0.195 1
1 181 . 14 1 1 A 16 16 PHE CB C 16 38.506 39.044 -0.538 1
1 187 . 14 1 1 A 16 16 PHE N N 16 119.825 120.984 -1.159 1
1 188 . 14 1 1 A 17 17 ASN H H 17 7.768 7.656 0.112 1
1 189 . 14 1 1 A 17 17 ASN HA H 17 4.078 4.087 -0.009 1
1 194 . 14 1 1 A 17 17 ASN C C 17 176.604 177.857 -1.253 1
1 195 . 14 1 1 A 17 17 ASN CA C 17 55.621 56.263 -0.642 1
1 196 . 14 1 1 A 17 17 ASN CB C 17 37.830 37.905 -0.075 1
1 197 . 14 1 1 A 17 17 ASN N N 17 115.600 117.229 -1.629 1
1 199 . 14 1 1 A 18 18 THR H H 18 7.454 7.399 0.055 1
1 200 . 14 1 1 A 18 18 THR HA H 18 4.147 4.091 0.056 1
1 205 . 14 1 1 A 18 18 THR C C 18 175.692 175.921 -0.229 1
1 206 . 14 1 1 A 18 18 THR CA C 18 64.679 66.548 -1.869 1
1 207 . 14 1 1 A 18 18 THR CB C 18 68.940 68.128 0.812 1
1 209 . 14 1 1 A 18 18 THR N N 18 113.049 116.705 -3.656 1
1 210 . 14 1 1 A 19 19 LYS H H 19 7.918 7.679 0.239 1
1 211 . 14 1 1 A 19 19 LYS HA H 19 3.791 3.608 0.183 1
1 220 . 14 1 1 A 19 19 LYS C C 19 178.120 178.967 -0.847 1
1 221 . 14 1 1 A 19 19 LYS CA C 19 55.985 58.708 -2.723 1
1 222 . 14 1 1 A 19 19 LYS CB C 19 31.130 31.034 0.096 1
1 226 . 14 1 1 A 19 19 LYS N N 19 122.614 120.157 2.457 1
1 227 . 14 1 1 A 20 20 ARG H H 20 7.845 7.389 0.456 1
1 228 . 14 1 1 A 20 20 ARG HA H 20 3.396 3.923 -0.527 1
1 236 . 14 1 1 A 20 20 ARG C C 20 175.601 177.865 -2.264 1
1 237 . 14 1 1 A 20 20 ARG CA C 20 58.182 58.055 0.127 1
1 238 . 14 1 1 A 20 20 ARG CB C 20 28.045 29.823 -1.778 1
1 241 . 14 1 1 A 20 20 ARG N N 20 116.282 117.993 -1.711 1
1 243 . 14 1 1 A 21 21 HIS H H 21 7.163 7.415 -0.252 1
1 244 . 14 1 1 A 21 21 HIS HA H 21 4.500 4.231 0.269 1
1 249 . 14 1 1 A 21 21 HIS C C 21 175.618 176.959 -1.341 1
1 250 . 14 1 1 A 21 21 HIS CA C 21 56.912 59.408 -2.496 1
1 251 . 14 1 1 A 21 21 HIS CB C 21 29.400 30.396 -0.996 1
1 254 . 14 1 1 A 21 21 HIS N N 21 115.452 118.350 -2.898 1
1 255 . 14 1 1 A 22 22 SER H H 22 7.951 7.634 0.317 1
1 256 . 14 1 1 A 22 22 SER HA H 22 4.573 4.357 0.216 1
1 259 . 14 1 1 A 22 22 SER C C 22 173.948 173.934 0.014 1
1 260 . 14 1 1 A 22 22 SER CA C 22 58.589 60.980 -2.391 1
1 261 . 14 1 1 A 22 22 SER CB C 22 64.228 63.968 0.260 1
1 262 . 14 1 1 A 22 22 SER N N 22 113.209 112.966 0.243 1
1 263 . 14 1 1 A 23 23 VAL H H 23 7.179 7.386 -0.207 1
1 264 . 14 1 1 A 23 23 VAL HA H 23 4.626 4.400 0.226 1
1 272 . 14 1 1 A 23 23 VAL C C 23 175.397 176.037 -0.640 1
1 273 . 14 1 1 A 23 23 VAL CA C 23 59.556 60.217 -0.661 1
1 274 . 14 1 1 A 23 23 VAL CB C 23 33.810 34.237 -0.427 1
1 277 . 14 1 1 A 23 23 VAL N N 23 113.108 116.209 -3.101 1
1 278 . 14 1 1 A 24 24 GLY H H 24 8.189 8.457 -0.268 1
1 279 . 14 1 1 A 24 24 GLY HA2 H 24 4.074 4.020 0.054 1
1 280 . 14 1 1 A 24 24 GLY HA3 H 24 4.195 4.047 0.148 1
1 281 . 14 1 1 A 24 24 GLY C C 24 174.037 174.602 -0.565 1
1 282 . 14 1 1 A 24 24 GLY CA C 24 44.452 45.217 -0.765 1
1 283 . 14 1 1 A 24 24 GLY N N 24 108.374 109.674 -1.300 1
1 284 . 14 1 1 A 25 25 ILE H H 25 8.331 8.628 -0.297 1
1 285 . 14 1 1 A 25 25 ILE HA H 25 3.839 3.656 0.183 1
1 295 . 14 1 1 A 25 25 ILE C C 25 178.042 177.688 0.354 1
1 296 . 14 1 1 A 25 25 ILE CA C 25 64.238 64.414 -0.176 1
1 297 . 14 1 1 A 25 25 ILE CB C 25 37.931 37.349 0.582 1
1 301 . 14 1 1 A 25 25 ILE N N 25 119.895 119.976 -0.081 1
1 302 . 14 1 1 A 26 26 GLN H H 26 8.545 8.719 -0.174 1
1 303 . 14 1 1 A 26 26 GLN HA H 26 4.129 4.056 0.073 1
1 310 . 14 1 1 A 26 26 GLN C C 26 178.454 177.661 0.793 1
1 311 . 14 1 1 A 26 26 GLN CA C 26 58.772 58.137 0.635 1
1 312 . 14 1 1 A 26 26 GLN CB C 26 27.346 27.460 -0.114 1
1 314 . 14 1 1 A 26 26 GLN N N 26 120.013 119.960 0.053 1
1 316 . 14 1 1 A 27 27 THR H H 27 7.944 7.300 0.644 1
1 317 . 14 1 1 A 27 27 THR HA H 27 3.953 4.145 -0.192 1
1 322 . 14 1 1 A 27 27 THR C C 27 175.818 176.193 -0.375 1
1 323 . 14 1 1 A 27 27 THR CA C 27 65.855 65.375 0.480 1
1 324 . 14 1 1 A 27 27 THR CB C 27 68.127 69.126 -0.999 1
1 326 . 14 1 1 A 27 27 THR N N 27 117.645 116.436 1.209 1
1 327 . 14 1 1 A 28 28 ALA H H 28 8.593 8.173 0.420 1
1 328 . 14 1 1 A 28 28 ALA HA H 28 3.899 4.047 -0.148 1
1 332 . 14 1 1 A 28 28 ALA C C 28 178.515 179.856 -1.341 1
1 333 . 14 1 1 A 28 28 ALA CA C 28 55.742 55.538 0.204 1
1 334 . 14 1 1 A 28 28 ALA CB C 28 17.513 18.065 -0.552 1
1 335 . 14 1 1 A 28 28 ALA N N 28 123.917 123.882 0.035 1
1 336 . 14 1 1 A 29 29 LYS H H 29 7.800 8.059 -0.259 1
1 337 . 14 1 1 A 29 29 LYS HA H 29 3.982 3.943 0.039 1
1 346 . 14 1 1 A 29 29 LYS C C 29 179.527 179.068 0.459 1
1 347 . 14 1 1 A 29 29 LYS CA C 29 59.761 59.611 0.150 1
1 348 . 14 1 1 A 29 29 LYS CB C 29 32.223 32.305 -0.082 1
1 352 . 14 1 1 A 29 29 LYS N N 29 117.474 118.802 -1.328 1
1 353 . 14 1 1 A 30 30 VAL H H 30 7.591 7.573 0.018 1
1 354 . 14 1 1 A 30 30 VAL HA H 30 3.503 3.214 0.289 1
1 362 . 14 1 1 A 30 30 VAL C C 30 178.389 177.316 1.073 1
1 363 . 14 1 1 A 30 30 VAL CA C 30 65.640 65.506 0.134 1
1 364 . 14 1 1 A 30 30 VAL CB C 30 31.644 31.472 0.172 1
1 367 . 14 1 1 A 30 30 VAL N N 30 121.749 120.397 1.352 1
1 368 . 14 1 1 A 31 31 LEU H H 31 8.333 8.106 0.227 1
1 369 . 14 1 1 A 31 31 LEU HA H 31 4.074 4.104 -0.030 1
1 379 . 14 1 1 A 31 31 LEU C C 31 177.780 179.338 -1.558 1
1 380 . 14 1 1 A 31 31 LEU CA C 31 58.157 58.215 -0.058 1
1 381 . 14 1 1 A 31 31 LEU CB C 31 42.230 41.181 1.049 1
1 385 . 14 1 1 A 31 31 LEU N N 31 120.901 120.120 0.781 1
1 386 . 14 1 1 A 32 32 LYS H H 32 8.562 8.153 0.409 1
1 387 . 14 1 1 A 32 32 LYS HA H 32 3.290 3.887 -0.597 1
1 395 . 14 1 1 A 32 32 LYS C C 32 178.037 178.614 -0.577 1
1 396 . 14 1 1 A 32 32 LYS CA C 32 58.911 59.654 -0.743 1
1 397 . 14 1 1 A 32 32 LYS CB C 32 31.605 31.418 0.187 1
1 401 . 14 1 1 A 32 32 LYS N N 32 119.075 119.308 -0.233 1
1 402 . 14 1 1 A 33 33 GLY H H 33 7.694 7.802 -0.108 1
1 403 . 14 1 1 A 33 33 GLY HA2 H 33 3.949 3.544 0.405 1
1 404 . 14 1 1 A 33 33 GLY HA3 H 33 3.826 3.610 0.216 1
1 405 . 14 1 1 A 33 33 GLY C C 33 177.101 176.535 0.566 1
1 406 . 14 1 1 A 33 33 GLY CA C 33 46.928 46.952 -0.024 1
1 407 . 14 1 1 A 33 33 GLY N N 33 105.282 106.574 -1.292 1
1 408 . 14 1 1 A 34 34 TYR H H 34 8.015 7.708 0.307 1
1 409 . 14 1 1 A 34 34 TYR HA H 34 4.558 4.692 -0.134 1
1 416 . 14 1 1 A 34 34 TYR C C 34 179.611 178.094 1.517 1
1 417 . 14 1 1 A 34 34 TYR CA C 34 59.349 60.253 -0.904 1
1 418 . 14 1 1 A 34 34 TYR CB C 34 37.344 38.294 -0.950 1
1 423 . 14 1 1 A 34 34 TYR N N 34 121.781 121.802 -0.021 1
1 424 . 14 1 1 A 35 35 LEU H H 35 8.689 8.309 0.380 1
1 425 . 14 1 1 A 35 35 LEU HA H 35 3.977 3.930 0.047 1
1 435 . 14 1 1 A 35 35 LEU C C 35 177.081 179.111 -2.030 1
1 436 . 14 1 1 A 35 35 LEU CA C 35 59.155 58.480 0.675 1
1 437 . 14 1 1 A 35 35 LEU CB C 35 41.103 41.859 -0.756 1
1 441 . 14 1 1 A 35 35 LEU N N 35 120.392 120.583 -0.191 1
1 442 . 14 1 1 A 36 36 ASN H H 36 8.721 8.226 0.495 1
1 443 . 14 1 1 A 36 36 ASN HA H 36 4.435 4.488 -0.053 1
1 448 . 14 1 1 A 36 36 ASN C C 36 176.792 177.957 -1.165 1
1 449 . 14 1 1 A 36 36 ASN CA C 36 55.642 55.808 -0.166 1
1 450 . 14 1 1 A 36 36 ASN CB C 36 38.319 38.209 0.110 1
1 451 . 14 1 1 A 36 36 ASN N N 36 114.623 117.072 -2.449 1
1 453 . 14 1 1 A 37 37 SER H H 37 8.511 7.938 0.573 1
1 454 . 14 1 1 A 37 37 SER HA H 37 4.642 4.275 0.367 1
1 457 . 14 1 1 A 37 37 SER C C 37 175.039 176.325 -1.286 1
1 458 . 14 1 1 A 37 37 SER CA C 37 59.825 61.356 -1.531 1
1 459 . 14 1 1 A 37 37 SER CB C 37 64.056 62.987 1.069 1
1 460 . 14 1 1 A 37 37 SER N N 37 110.941 115.588 -4.647 1
1 461 . 14 1 1 A 38 38 ARG H H 38 7.242 8.002 -0.760 1
1 462 . 14 1 1 A 38 38 ARG HA H 38 4.919 4.431 0.488 1
1 469 . 14 1 1 A 38 38 ARG C C 38 176.514 178.578 -2.064 1
1 470 . 14 1 1 A 38 38 ARG CA C 38 56.687 57.949 -1.262 1
1 471 . 14 1 1 A 38 38 ARG CB C 38 32.434 31.162 1.272 1
1 474 . 14 1 1 A 38 38 ARG N N 38 117.062 120.411 -3.349 1
1 475 . 14 1 1 A 39 39 ILE H H 39 8.462 7.977 0.485 1
1 476 . 14 1 1 A 39 39 ILE HA H 39 3.618 3.827 -0.209 1
1 486 . 14 1 1 A 39 39 ILE C C 39 176.267 178.222 -1.955 1
1 487 . 14 1 1 A 39 39 ILE CA C 39 66.134 65.282 0.852 1
1 488 . 14 1 1 A 39 39 ILE CB C 39 39.787 38.005 1.782 1
1 492 . 14 1 1 A 39 39 ILE N N 39 121.214 120.526 0.688 1
1 493 . 14 1 1 A 40 40 ILE H H 40 9.339 8.432 0.907 1
1 494 . 14 1 1 A 40 40 ILE HA H 40 3.401 3.757 -0.356 1
1 504 . 14 1 1 A 40 40 ILE CA C 40 67.844 66.393 1.451 1
1 505 . 14 1 1 A 40 40 ILE CB C 40 34.406 35.383 -0.977 1
1 509 . 14 1 1 A 40 40 ILE N N 40 119.695 121.365 -1.670 1
1 510 . 14 1 1 A 41 41 PRO HA H 41 4.314 4.402 -0.088 1
1 517 . 14 1 1 A 41 41 PRO C C 41 177.418 178.572 -1.154 1
1 518 . 14 1 1 A 41 41 PRO CA C 41 65.912 65.759 0.153 1
1 519 . 14 1 1 A 41 41 PRO CB C 41 30.686 30.943 -0.257 1
1 522 . 14 1 1 A 42 42 SER H H 42 6.857 8.143 -1.286 1
1 523 . 14 1 1 A 42 42 SER HA H 42 4.558 4.438 0.120 1
1 526 . 14 1 1 A 42 42 SER C C 42 174.813 175.754 -0.941 1
1 527 . 14 1 1 A 42 42 SER CA C 42 61.279 61.412 -0.133 1
1 528 . 14 1 1 A 42 42 SER CB C 42 64.285 63.925 0.360 1
1 529 . 14 1 1 A 42 42 SER N N 42 108.994 113.986 -4.992 1
1 530 . 14 1 1 A 43 43 LEU H H 43 8.230 8.131 0.099 1
1 531 . 14 1 1 A 43 43 LEU HA H 43 4.572 4.401 0.171 1
1 541 . 14 1 1 A 43 43 LEU C C 43 177.301 178.977 -1.676 1
1 542 . 14 1 1 A 43 43 LEU CA C 43 54.113 55.508 -1.395 1
1 543 . 14 1 1 A 43 43 LEU CB C 43 44.800 42.452 2.348 1
1 547 . 14 1 1 A 43 43 LEU N N 43 118.715 120.425 -1.710 1
1 548 . 14 1 1 A 44 44 GLY H H 44 8.498 8.636 -0.138 1
1 549 . 14 1 1 A 44 44 GLY HA2 H 44 4.010 3.768 0.242 1
1 550 . 14 1 1 A 44 44 GLY HA3 H 44 3.613 3.835 -0.222 1
1 551 . 14 1 1 A 44 44 GLY C C 44 174.178 176.006 -1.828 1
1 552 . 14 1 1 A 44 44 GLY CA C 44 46.271 47.423 -1.152 1
1 553 . 14 1 1 A 44 44 GLY N N 44 105.371 106.823 -1.452 1
1 554 . 14 1 1 A 45 45 ASN H H 45 8.385 8.279 0.106 1
1 555 . 14 1 1 A 45 45 ASN HA H 45 4.789 4.594 0.195 1
1 560 . 14 1 1 A 45 45 ASN C C 45 175.386 175.626 -0.240 1
1 561 . 14 1 1 A 45 45 ASN CA C 45 53.144 55.584 -2.440 1
1 562 . 14 1 1 A 45 45 ASN CB C 45 37.928 39.080 -1.152 1
1 563 . 14 1 1 A 45 45 ASN N N 45 114.387 119.477 -5.090 1
1 565 . 14 1 1 A 46 46 ILE H H 46 7.465 7.549 -0.084 1
1 566 . 14 1 1 A 46 46 ILE HA H 46 3.856 4.120 -0.264 1
1 576 . 14 1 1 A 46 46 ILE C C 46 175.997 176.310 -0.313 1
1 577 . 14 1 1 A 46 46 ILE CA C 46 60.853 61.854 -1.001 1
1 578 . 14 1 1 A 46 46 ILE CB C 46 38.042 38.314 -0.272 1
1 582 . 14 1 1 A 46 46 ILE N N 46 123.998 121.337 2.661 1
1 583 . 14 1 1 A 47 47 LYS H H 47 8.717 8.695 0.022 1
1 584 . 14 1 1 A 47 47 LYS HA H 47 4.249 4.321 -0.072 1
1 591 . 14 1 1 A 47 47 LYS C C 47 177.583 177.613 -0.030 1
1 592 . 14 1 1 A 47 47 LYS CA C 47 56.320 56.912 -0.592 1
1 593 . 14 1 1 A 47 47 LYS CB C 47 30.393 32.718 -2.325 1
1 596 . 14 1 1 A 47 47 LYS N N 47 126.114 124.643 1.471 1
1 597 . 14 1 1 A 48 48 LEU H H 48 8.323 8.706 -0.383 1
1 598 . 14 1 1 A 48 48 LEU HA H 48 3.691 3.992 -0.301 1
1 608 . 14 1 1 A 48 48 LEU C C 48 177.274 178.455 -1.181 1
1 609 . 14 1 1 A 48 48 LEU CA C 48 58.443 58.117 0.326 1
1 610 . 14 1 1 A 48 48 LEU CB C 48 42.282 41.179 1.103 1
1 614 . 14 1 1 A 48 48 LEU N N 48 125.857 126.003 -0.146 1
1 615 . 14 1 1 A 49 49 ALA H H 49 8.929 8.112 0.817 1
1 616 . 14 1 1 A 49 49 ALA HA H 49 4.067 3.898 0.169 1
1 620 . 14 1 1 A 49 49 ALA C C 49 177.468 178.967 -1.499 1
1 621 . 14 1 1 A 49 49 ALA CA C 49 53.092 54.972 -1.880 1
1 622 . 14 1 1 A 49 49 ALA CB C 49 18.562 18.322 0.240 1
1 623 . 14 1 1 A 49 49 ALA N N 49 115.543 120.549 -5.006 1
1 624 . 14 1 1 A 50 50 LYS H H 50 7.684 7.518 0.166 1
1 625 . 14 1 1 A 50 50 LYS HA H 50 4.395 4.258 0.137 1
1 634 . 14 1 1 A 50 50 LYS C C 50 174.958 176.865 -1.907 1
1 635 . 14 1 1 A 50 50 LYS CA C 50 53.977 57.284 -3.307 1
1 636 . 14 1 1 A 50 50 LYS CB C 50 32.645 32.649 -0.004 1
1 640 . 14 1 1 A 50 50 LYS N N 50 114.788 115.391 -0.603 1
1 641 . 14 1 1 A 51 51 LEU H H 51 6.776 7.312 -0.536 1
1 642 . 14 1 1 A 51 51 LEU HA H 51 4.569 4.074 0.495 1
1 652 . 14 1 1 A 51 51 LEU C C 51 177.953 175.523 2.430 1
1 653 . 14 1 1 A 51 51 LEU CA C 51 55.318 54.922 0.396 1
1 654 . 14 1 1 A 51 51 LEU CB C 51 43.182 41.086 2.096 1
1 658 . 14 1 1 A 51 51 LEU N N 51 121.408 122.054 -0.646 1
1 659 . 14 1 1 A 52 52 THR H H 52 10.680 7.531 3.149 1
1 660 . 14 1 1 A 52 52 THR HA H 52 4.938 4.581 0.357 1
1 665 . 14 1 1 A 52 52 THR C C 52 175.553 175.897 -0.344 1
1 666 . 14 1 1 A 52 52 THR CA C 52 59.740 59.508 0.232 1
1 667 . 14 1 1 A 52 52 THR CB C 52 73.557 71.191 2.366 1
1 669 . 14 1 1 A 52 52 THR N N 52 119.481 119.113 0.368 1
1 670 . 14 1 1 A 53 53 SER H H 53 9.278 9.028 0.250 1
1 671 . 14 1 1 A 53 53 SER HA H 53 4.261 4.146 0.115 1
1 674 . 14 1 1 A 53 53 SER C C 53 176.990 176.788 0.202 1
1 675 . 14 1 1 A 53 53 SER CA C 53 61.025 61.337 -0.312 1
1 676 . 14 1 1 A 53 53 SER CB C 53 62.312 63.063 -0.751 1
1 677 . 14 1 1 A 53 53 SER N N 53 116.343 118.444 -2.101 1
1 678 . 14 1 1 A 54 54 LEU H H 54 7.808 8.037 -0.229 1
1 679 . 14 1 1 A 54 54 LEU HA H 54 4.229 4.136 0.093 1
1 688 . 14 1 1 A 54 54 LEU C C 54 178.505 178.994 -0.489 1
1 689 . 14 1 1 A 54 54 LEU CA C 54 57.719 57.900 -0.181 1
1 690 . 14 1 1 A 54 54 LEU CB C 54 40.997 41.771 -0.774 1
1 694 . 14 1 1 A 54 54 LEU N N 54 126.055 124.896 1.159 1
1 695 . 14 1 1 A 55 55 HIS H H 55 7.798 8.301 -0.503 1
1 696 . 14 1 1 A 55 55 HIS HA H 55 4.311 4.276 0.035 1
1 701 . 14 1 1 A 55 55 HIS C C 55 180.044 177.718 2.326 1
1 702 . 14 1 1 A 55 55 HIS CA C 55 60.583 60.137 0.446 1
1 703 . 14 1 1 A 55 55 HIS CB C 55 31.445 29.747 1.698 1
1 706 . 14 1 1 A 55 55 HIS N N 55 118.683 118.338 0.345 1
1 707 . 14 1 1 A 56 56 MET H H 56 7.375 7.920 -0.545 1
1 708 . 14 1 1 A 56 56 MET HA H 56 4.513 4.029 0.484 1
1 716 . 14 1 1 A 56 56 MET C C 56 177.169 178.380 -1.211 1
1 717 . 14 1 1 A 56 56 MET CA C 56 55.823 59.059 -3.236 1
1 718 . 14 1 1 A 56 56 MET CB C 56 31.303 33.382 -2.079 1
1 721 . 14 1 1 A 56 56 MET N N 56 114.530 118.020 -3.490 1
1 722 . 14 1 1 A 57 57 GLN H H 57 8.387 8.212 0.175 1
1 723 . 14 1 1 A 57 57 GLN HA H 57 3.981 3.993 -0.012 1
1 730 . 14 1 1 A 57 57 GLN C C 57 178.033 178.446 -0.413 1
1 731 . 14 1 1 A 57 57 GLN CA C 57 57.922 59.129 -1.207 1
1 732 . 14 1 1 A 57 57 GLN CB C 57 29.012 28.479 0.533 1
1 734 . 14 1 1 A 57 57 GLN N N 57 120.713 119.922 0.791 1
1 736 . 14 1 1 A 58 58 ASN H H 58 8.765 8.480 0.285 1
1 737 . 14 1 1 A 58 58 ASN HA H 58 4.539 4.425 0.114 1
1 742 . 14 1 1 A 58 58 ASN C C 58 178.084 177.773 0.311 1
1 743 . 14 1 1 A 58 58 ASN CA C 58 55.345 56.386 -1.041 1
1 744 . 14 1 1 A 58 58 ASN CB C 58 36.924 37.779 -0.855 1
1 745 . 14 1 1 A 58 58 ASN N N 58 117.390 117.648 -0.258 1
1 747 . 14 1 1 A 59 59 TYR H H 59 8.239 7.810 0.429 1
1 748 . 14 1 1 A 59 59 TYR HA H 59 4.586 4.152 0.434 1
1 755 . 14 1 1 A 59 59 TYR C C 59 178.015 176.878 1.137 1
1 756 . 14 1 1 A 59 59 TYR CA C 59 60.779 61.570 -0.791 1
1 757 . 14 1 1 A 59 59 TYR CB C 59 38.047 38.739 -0.692 1
1 762 . 14 1 1 A 59 59 TYR N N 59 122.335 122.449 -0.114 1
1 763 . 14 1 1 A 60 60 VAL H H 60 8.416 8.532 -0.116 1
1 764 . 14 1 1 A 60 60 VAL HA H 60 3.244 3.522 -0.278 1
1 772 . 14 1 1 A 60 60 VAL C C 60 177.309 178.245 -0.936 1
1 773 . 14 1 1 A 60 60 VAL CA C 60 67.022 66.481 0.541 1
1 774 . 14 1 1 A 60 60 VAL CB C 60 30.929 31.520 -0.591 1
1 777 . 14 1 1 A 60 60 VAL N N 60 119.842 119.522 0.320 1
1 778 . 14 1 1 A 61 61 ASN H H 61 8.264 8.109 0.155 1
1 779 . 14 1 1 A 61 61 ASN HA H 61 4.305 4.478 -0.173 1
1 784 . 14 1 1 A 61 61 ASN C C 61 177.263 177.768 -0.505 1
1 785 . 14 1 1 A 61 61 ASN CA C 61 55.548 56.431 -0.883 1
1 786 . 14 1 1 A 61 61 ASN CB C 61 36.645 37.868 -1.223 1
1 787 . 14 1 1 A 61 61 ASN N N 61 119.103 119.636 -0.533 1
1 789 . 14 1 1 A 62 62 SER H H 62 8.143 7.978 0.165 1
1 790 . 14 1 1 A 62 62 SER HA H 62 4.343 4.163 0.180 1
1 793 . 14 1 1 A 62 62 SER C C 62 176.409 177.558 -1.149 1
1 794 . 14 1 1 A 62 62 SER CA C 62 61.612 61.310 0.302 1
1 795 . 14 1 1 A 62 62 SER CB C 62 62.219 62.648 -0.429 1
1 796 . 14 1 1 A 62 62 SER N N 62 118.254 114.782 3.472 1
1 797 . 14 1 1 A 63 63 LEU H H 63 7.664 8.004 -0.340 1
1 798 . 14 1 1 A 63 63 LEU HA H 63 4.003 3.848 0.155 1
1 808 . 14 1 1 A 63 63 LEU C C 63 178.748 179.010 -0.262 1
1 809 . 14 1 1 A 63 63 LEU CA C 63 57.171 58.020 -0.849 1
1 810 . 14 1 1 A 63 63 LEU CB C 63 41.134 41.358 -0.224 1
1 814 . 14 1 1 A 63 63 LEU N N 63 123.812 122.547 1.265 1
1 815 . 14 1 1 A 64 64 ARG H H 64 7.969 7.583 0.386 1
1 816 . 14 1 1 A 64 64 ARG HA H 64 4.038 3.885 0.153 1
1 824 . 14 1 1 A 64 64 ARG C C 64 180.797 177.676 3.121 1
1 825 . 14 1 1 A 64 64 ARG CA C 64 58.598 59.598 -1.000 1
1 826 . 14 1 1 A 64 64 ARG CB C 64 28.849 29.774 -0.925 1
1 829 . 14 1 1 A 64 64 ARG N N 64 120.376 120.204 0.172 1
1 831 . 14 1 1 A 65 65 ASP H H 65 8.465 7.714 0.751 1
1 832 . 14 1 1 A 65 65 ASP HA H 65 4.408 4.348 0.060 1
1 835 . 14 1 1 A 65 65 ASP C C 65 177.336 178.592 -1.256 1
1 836 . 14 1 1 A 65 65 ASP CA C 65 56.957 56.658 0.299 1
1 837 . 14 1 1 A 65 65 ASP CB C 65 39.602 40.689 -1.087 1
1 838 . 14 1 1 A 65 65 ASP N N 65 122.402 119.732 2.670 1
1 839 . 14 1 1 A 66 66 GLU H H 66 7.703 7.856 -0.153 1
1 840 . 14 1 1 A 66 66 GLU HA H 66 4.213 4.282 -0.069 1
1 845 . 14 1 1 A 66 66 GLU C C 66 176.586 177.338 -0.752 1
1 846 . 14 1 1 A 66 66 GLU CA C 66 56.974 56.377 0.597 1
1 847 . 14 1 1 A 66 66 GLU CB C 66 29.821 30.006 -0.185 1
1 849 . 14 1 1 A 66 66 GLU N N 66 119.076 115.976 3.100 1
1 850 . 14 1 1 A 67 67 GLY H H 67 7.861 7.543 0.318 1
1 851 . 14 1 1 A 67 67 GLY HA2 H 67 4.269 3.936 0.333 1
1 852 . 14 1 1 A 67 67 GLY HA3 H 67 3.731 3.940 -0.209 1
1 853 . 14 1 1 A 67 67 GLY C C 67 174.614 174.974 -0.360 1
1 854 . 14 1 1 A 67 67 GLY CA C 67 44.608 46.493 -1.885 1
1 855 . 14 1 1 A 67 67 GLY N N 67 105.730 109.457 -3.727 1
1 856 . 14 1 1 A 68 68 LEU H H 68 7.324 7.728 -0.404 1
1 857 . 14 1 1 A 68 68 LEU HA H 68 4.257 4.218 0.039 1
1 867 . 14 1 1 A 68 68 LEU C C 68 176.136 177.127 -0.991 1
1 868 . 14 1 1 A 68 68 LEU CA C 68 55.659 54.687 0.972 1
1 869 . 14 1 1 A 68 68 LEU CB C 68 41.874 42.283 -0.409 1
1 873 . 14 1 1 A 68 68 LEU N N 68 121.062 121.093 -0.031 1
1 874 . 14 1 1 A 69 69 LYS H H 69 8.368 8.526 -0.158 1
1 875 . 14 1 1 A 69 69 LYS HA H 69 4.281 4.399 -0.118 1
1 884 . 14 1 1 A 69 69 LYS C C 69 177.940 177.775 0.165 1
1 885 . 14 1 1 A 69 69 LYS CA C 69 55.412 56.113 -0.701 1
1 886 . 14 1 1 A 69 69 LYS CB C 69 32.761 33.273 -0.512 1
1 890 . 14 1 1 A 69 69 LYS N N 69 120.120 122.292 -2.172 1
1 891 . 14 1 1 A 70 70 ARG H H 70 9.095 8.869 0.226 1
1 892 . 14 1 1 A 70 70 ARG HA H 70 3.684 4.097 -0.413 1
1 900 . 14 1 1 A 70 70 ARG C C 70 177.712 178.481 -0.769 1
1 901 . 14 1 1 A 70 70 ARG CA C 70 60.216 58.446 1.770 1
1 902 . 14 1 1 A 70 70 ARG CB C 70 29.539 29.938 -0.399 1
1 905 . 14 1 1 A 70 70 ARG N N 70 123.339 119.164 4.175 1
1 907 . 14 1 1 A 71 71 GLY H H 71 8.985 8.373 0.612 1
1 908 . 14 1 1 A 71 71 GLY HA2 H 71 3.932 3.691 0.241 1
1 909 . 14 1 1 A 71 71 GLY HA3 H 71 3.905 3.696 0.209 1
1 910 . 14 1 1 A 71 71 GLY C C 71 176.324 175.697 0.627 1
1 911 . 14 1 1 A 71 71 GLY CA C 71 46.752 47.446 -0.694 1
1 912 . 14 1 1 A 71 71 GLY N N 71 104.509 108.966 -4.457 1
1 913 . 14 1 1 A 72 72 THR H H 72 7.295 8.080 -0.785 1
1 914 . 14 1 1 A 72 72 THR HA H 72 4.014 3.851 0.163 1
1 919 . 14 1 1 A 72 72 THR C C 72 175.135 175.875 -0.740 1
1 920 . 14 1 1 A 72 72 THR CA C 72 65.848 66.490 -0.642 1
1 921 . 14 1 1 A 72 72 THR CB C 72 68.160 68.351 -0.191 1
1 923 . 14 1 1 A 72 72 THR N N 72 118.617 117.485 1.132 1
1 924 . 14 1 1 A 73 73 ILE H H 73 7.883 8.002 -0.119 1
1 925 . 14 1 1 A 73 73 ILE HA H 73 3.258 3.552 -0.294 1
1 935 . 14 1 1 A 73 73 ILE C C 73 177.060 178.525 -1.465 1
1 936 . 14 1 1 A 73 73 ILE CA C 73 66.561 65.662 0.899 1
1 937 . 14 1 1 A 73 73 ILE CB C 73 37.339 37.789 -0.450 1
1 941 . 14 1 1 A 73 73 ILE N N 73 121.692 121.291 0.401 1
1 942 . 14 1 1 A 74 74 GLU H H 74 8.723 7.839 0.884 1
1 943 . 14 1 1 A 74 74 GLU HA H 74 3.807 3.953 -0.146 1
1 948 . 14 1 1 A 74 74 GLU C C 74 178.319 179.098 -0.779 1
1 949 . 14 1 1 A 74 74 GLU CA C 74 59.637 59.757 -0.120 1
1 950 . 14 1 1 A 74 74 GLU CB C 74 29.257 28.929 0.328 1
1 952 . 14 1 1 A 74 74 GLU N N 74 117.701 120.653 -2.952 1
1 953 . 14 1 1 A 75 75 LYS H H 75 7.361 7.724 -0.363 1
1 954 . 14 1 1 A 75 75 LYS HA H 75 3.958 4.058 -0.100 1
1 963 . 14 1 1 A 75 75 LYS C C 75 178.554 179.746 -1.192 1
1 964 . 14 1 1 A 75 75 LYS CA C 75 59.764 59.094 0.670 1
1 965 . 14 1 1 A 75 75 LYS CB C 75 32.314 32.134 0.180 1
1 969 . 14 1 1 A 75 75 LYS N N 75 118.734 118.902 -0.168 1
1 970 . 14 1 1 A 76 76 ILE H H 76 7.713 7.583 0.130 1
1 971 . 14 1 1 A 76 76 ILE HA H 76 3.221 3.877 -0.656 1
1 981 . 14 1 1 A 76 76 ILE C C 76 177.504 178.185 -0.681 1
1 982 . 14 1 1 A 76 76 ILE CA C 76 65.796 64.475 1.321 1
1 983 . 14 1 1 A 76 76 ILE CB C 76 37.732 37.063 0.669 1
1 987 . 14 1 1 A 76 76 ILE N N 76 120.312 117.119 3.193 1
1 988 . 14 1 1 A 77 77 ILE H H 77 8.587 7.887 0.700 1
1 989 . 14 1 1 A 77 77 ILE HA H 77 3.778 3.574 0.204 1
1 999 . 14 1 1 A 77 77 ILE C C 77 177.074 177.650 -0.576 1
1 1000 . 14 1 1 A 77 77 ILE CA C 77 63.168 65.547 -2.379 1
1 1001 . 14 1 1 A 77 77 ILE CB C 77 36.617 37.842 -1.225 1
1 1005 . 14 1 1 A 77 77 ILE N N 77 118.978 121.555 -2.577 1
1 1006 . 14 1 1 A 78 78 LYS H H 78 8.050 7.875 0.175 1
1 1007 . 14 1 1 A 78 78 LYS HA H 78 3.925 4.028 -0.103 1
1 1016 . 14 1 1 A 78 78 LYS C C 78 178.291 179.310 -1.019 1
1 1017 . 14 1 1 A 78 78 LYS CA C 78 60.192 59.602 0.590 1
1 1018 . 14 1 1 A 78 78 LYS CB C 78 31.886 32.536 -0.650 1
1 1022 . 14 1 1 A 78 78 LYS N N 78 121.618 119.270 2.348 1
1 1023 . 14 1 1 A 79 79 VAL H H 79 7.619 7.718 -0.099 1
1 1024 . 14 1 1 A 79 79 VAL HA H 79 3.846 3.783 0.063 1
1 1032 . 14 1 1 A 79 79 VAL C C 79 177.712 178.446 -0.734 1
1 1033 . 14 1 1 A 79 79 VAL CA C 79 66.494 66.399 0.095 1
1 1034 . 14 1 1 A 79 79 VAL CB C 79 31.298 31.767 -0.469 1
1 1037 . 14 1 1 A 79 79 VAL N N 79 120.254 119.433 0.821 1
1 1038 . 14 1 1 A 80 80 ILE H H 80 7.885 8.091 -0.206 1
1 1039 . 14 1 1 A 80 80 ILE HA H 80 3.367 3.860 -0.493 1
1 1049 . 14 1 1 A 80 80 ILE C C 80 179.892 177.780 2.112 1
1 1050 . 14 1 1 A 80 80 ILE CA C 80 65.343 65.188 0.155 1
1 1051 . 14 1 1 A 80 80 ILE CB C 80 38.129 37.398 0.731 1
1 1055 . 14 1 1 A 80 80 ILE N N 80 119.666 120.819 -1.153 1
1 1056 . 14 1 1 A 81 81 ARG H H 81 9.384 8.434 0.950 1
1 1057 . 14 1 1 A 81 81 ARG HA H 81 3.834 3.951 -0.117 1
1 1065 . 14 1 1 A 81 81 ARG C C 81 178.204 179.152 -0.948 1
1 1066 . 14 1 1 A 81 81 ARG CA C 81 60.560 59.739 0.821 1
1 1067 . 14 1 1 A 81 81 ARG CB C 81 30.196 30.199 -0.003 1
1 1070 . 14 1 1 A 81 81 ARG N N 81 121.030 120.621 0.409 1
1 1072 . 14 1 1 A 82 82 ASN H H 82 8.773 8.148 0.625 1
1 1073 . 14 1 1 A 82 82 ASN HA H 82 4.587 4.650 -0.063 1
1 1078 . 14 1 1 A 82 82 ASN C C 82 178.300 177.674 0.626 1
1 1079 . 14 1 1 A 82 82 ASN CA C 82 56.160 56.255 -0.095 1
1 1080 . 14 1 1 A 82 82 ASN CB C 82 38.464 38.812 -0.348 1
1 1081 . 14 1 1 A 82 82 ASN N N 82 118.483 118.681 -0.198 1
1 1083 . 14 1 1 A 83 83 SER H H 83 8.526 7.504 1.022 1
1 1084 . 14 1 1 A 83 83 SER HA H 83 2.765 3.078 -0.313 1
1 1087 . 14 1 1 A 83 83 SER C C 83 176.386 177.432 -1.046 1
1 1088 . 14 1 1 A 83 83 SER CA C 83 61.245 60.796 0.449 1
1 1089 . 14 1 1 A 83 83 SER CB C 83 61.287 62.333 -1.046 1
1 1090 . 14 1 1 A 83 83 SER N N 83 118.286 114.234 4.052 1
1 1091 . 14 1 1 A 84 84 LEU H H 84 7.782 8.414 -0.632 1
1 1092 . 14 1 1 A 84 84 LEU HA H 84 4.221 3.998 0.223 1
1 1102 . 14 1 1 A 84 84 LEU C C 84 177.846 179.450 -1.604 1
1 1103 . 14 1 1 A 84 84 LEU CA C 84 57.166 57.830 -0.664 1
1 1104 . 14 1 1 A 84 84 LEU CB C 84 40.520 40.972 -0.452 1
1 1108 . 14 1 1 A 84 84 LEU N N 84 127.445 121.549 5.896 1
1 1109 . 14 1 1 A 85 85 GLU H H 85 8.264 8.325 -0.061 1
1 1110 . 14 1 1 A 85 85 GLU HA H 85 3.981 3.954 0.027 1
1 1115 . 14 1 1 A 85 85 GLU C C 85 179.288 179.219 0.069 1
1 1116 . 14 1 1 A 85 85 GLU CA C 85 59.025 59.912 -0.887 1
1 1117 . 14 1 1 A 85 85 GLU CB C 85 29.182 29.474 -0.292 1
1 1119 . 14 1 1 A 85 85 GLU N N 85 121.538 120.436 1.102 1
1 1120 . 14 1 1 A 86 86 HIS H H 86 7.683 8.050 -0.367 1
1 1121 . 14 1 1 A 86 86 HIS HA H 86 4.573 4.334 0.239 1
1 1125 . 14 1 1 A 86 86 HIS C C 86 175.484 177.731 -2.247 1
1 1126 . 14 1 1 A 86 86 HIS CA C 86 58.940 59.668 -0.728 1
1 1127 . 14 1 1 A 86 86 HIS CB C 86 29.267 29.857 -0.590 1
1 1129 . 14 1 1 A 86 86 HIS N N 86 117.087 120.257 -3.170 1
1 1130 . 14 1 1 A 87 87 ALA H H 87 7.197 8.136 -0.939 1
1 1131 . 14 1 1 A 87 87 ALA HA H 87 3.925 3.913 0.012 1
1 1135 . 14 1 1 A 87 87 ALA C C 87 179.038 180.214 -1.176 1
1 1136 . 14 1 1 A 87 87 ALA CA C 87 54.863 55.038 -0.175 1
1 1137 . 14 1 1 A 87 87 ALA CB C 87 17.034 17.884 -0.850 1
1 1138 . 14 1 1 A 87 87 ALA N N 87 121.510 120.800 0.710 1
1 1139 . 14 1 1 A 88 88 ILE H H 88 7.819 7.731 0.088 1
1 1140 . 14 1 1 A 88 88 ILE HA H 88 4.067 3.841 0.226 1
1 1150 . 14 1 1 A 88 88 ILE C C 88 180.846 177.564 3.282 1
1 1151 . 14 1 1 A 88 88 ILE CA C 88 64.021 65.278 -1.257 1
1 1152 . 14 1 1 A 88 88 ILE CB C 88 37.557 37.535 0.022 1
1 1156 . 14 1 1 A 88 88 ILE N N 88 120.898 119.139 1.759 1
1 1157 . 14 1 1 A 89 89 ASP H H 89 7.808 8.084 -0.276 1
1 1158 . 14 1 1 A 89 89 ASP HA H 89 4.437 4.321 0.116 1
1 1161 . 14 1 1 A 89 89 ASP C C 89 178.033 178.071 -0.038 1
1 1162 . 14 1 1 A 89 89 ASP CA C 89 57.343 57.605 -0.262 1
1 1163 . 14 1 1 A 89 89 ASP CB C 89 39.689 41.506 -1.817 1
1 1164 . 14 1 1 A 89 89 ASP N N 89 125.174 121.521 3.653 1
1 1165 . 14 1 1 A 90 90 LEU H H 90 7.607 7.529 0.078 1
1 1166 . 14 1 1 A 90 90 LEU HA H 90 4.198 4.200 -0.002 1
1 1176 . 14 1 1 A 90 90 LEU C C 90 175.416 175.833 -0.417 1
1 1177 . 14 1 1 A 90 90 LEU CA C 90 54.755 55.020 -0.265 1
1 1178 . 14 1 1 A 90 90 LEU CB C 90 42.960 42.030 0.930 1
1 1182 . 14 1 1 A 90 90 LEU N N 90 117.576 117.414 0.162 1
1 1183 . 14 1 1 A 91 91 GLU H H 91 8.143 7.808 0.335 1
1 1184 . 14 1 1 A 91 91 GLU HA H 91 4.005 4.046 -0.041 1
1 1189 . 14 1 1 A 91 91 GLU C C 91 175.792 176.078 -0.286 1
1 1190 . 14 1 1 A 91 91 GLU CA C 91 57.202 57.530 -0.328 1
1 1191 . 14 1 1 A 91 91 GLU CB C 91 26.125 26.590 -0.465 1
1 1193 . 14 1 1 A 91 91 GLU N N 91 113.620 114.888 -1.268 1
1 1194 . 14 1 1 A 92 92 LEU H H 92 8.290 7.930 0.360 1
1 1195 . 14 1 1 A 92 92 LEU HA H 92 4.216 4.041 0.175 1
1 1205 . 14 1 1 A 92 92 LEU C C 92 176.622 177.028 -0.406 1
1 1206 . 14 1 1 A 92 92 LEU CA C 92 56.410 57.199 -0.789 1
1 1207 . 14 1 1 A 92 92 LEU CB C 92 43.378 42.430 0.948 1
1 1211 . 14 1 1 A 92 92 LEU N N 92 116.868 119.402 -2.534 1
1 1212 . 14 1 1 A 93 93 ILE H H 93 6.988 6.975 0.013 1
1 1213 . 14 1 1 A 93 93 ILE HA H 93 4.580 4.649 -0.069 1
1 1223 . 14 1 1 A 93 93 ILE C C 93 175.145 175.822 -0.677 1
1 1224 . 14 1 1 A 93 93 ILE CA C 93 58.707 58.386 0.321 1
1 1225 . 14 1 1 A 93 93 ILE CB C 93 42.864 40.968 1.896 1
1 1229 . 14 1 1 A 93 93 ILE N N 93 107.565 114.392 -6.827 1
1 1230 . 14 1 1 A 94 94 THR H H 94 8.742 8.540 0.202 1
1 1231 . 14 1 1 A 94 94 THR HA H 94 4.489 4.360 0.129 1
1 1236 . 14 1 1 A 94 94 THR C C 94 173.875 173.703 0.172 1
1 1237 . 14 1 1 A 94 94 THR CA C 94 61.842 63.389 -1.547 1
1 1238 . 14 1 1 A 94 94 THR CB C 94 69.972 70.116 -0.144 1
1 1240 . 14 1 1 A 94 94 THR N N 94 107.904 115.976 -8.072 1
1 1241 . 14 1 1 A 95 95 LYS H H 95 7.294 7.578 -0.284 1
1 1242 . 14 1 1 A 95 95 LYS HA H 95 4.566 4.798 -0.232 1
1 1251 . 14 1 1 A 95 95 LYS C C 95 173.791 174.397 -0.606 1
1 1252 . 14 1 1 A 95 95 LYS CA C 95 54.533 55.748 -1.215 1
1 1253 . 14 1 1 A 95 95 LYS CB C 95 35.123 35.722 -0.599 1
1 1257 . 14 1 1 A 95 95 LYS N N 95 119.458 120.514 -1.056 1
1 1258 . 14 1 1 A 96 96 ASN H H 96 9.157 8.723 0.434 1
1 1259 . 14 1 1 A 96 96 ASN HA H 96 4.408 4.786 -0.378 1
1 1264 . 14 1 1 A 96 96 ASN C C 96 176.653 175.919 0.734 1
1 1265 . 14 1 1 A 96 96 ASN CA C 96 51.088 52.468 -1.380 1
1 1266 . 14 1 1 A 96 96 ASN CB C 96 37.292 38.005 -0.713 1
1 1267 . 14 1 1 A 96 96 ASN N N 96 121.031 124.621 -3.590 1
1 1269 . 14 1 1 A 97 97 VAL H H 97 8.193 8.331 -0.138 1
1 1270 . 14 1 1 A 97 97 VAL HA H 97 4.019 3.811 0.208 1
1 1278 . 14 1 1 A 97 97 VAL C C 97 175.089 176.446 -1.357 1
1 1279 . 14 1 1 A 97 97 VAL CA C 97 63.437 64.072 -0.635 1
1 1280 . 14 1 1 A 97 97 VAL CB C 97 29.934 31.315 -1.381 1
1 1283 . 14 1 1 A 97 97 VAL N N 97 118.839 123.010 -4.171 1
1 1284 . 14 1 1 A 98 98 ALA H H 98 7.994 7.613 0.381 1
1 1285 . 14 1 1 A 98 98 ALA HA H 98 5.108 4.272 0.836 1
1 1289 . 14 1 1 A 98 98 ALA C C 98 178.033 179.548 -1.515 1
1 1290 . 14 1 1 A 98 98 ALA CA C 98 50.342 52.885 -2.543 1
1 1291 . 14 1 1 A 98 98 ALA CB C 98 19.659 19.213 0.446 1
1 1292 . 14 1 1 A 98 98 ALA N N 98 121.031 124.118 -3.087 1
1 1293 . 14 1 1 A 99 99 ALA H H 99 7.347 7.593 -0.246 1
1 1294 . 14 1 1 A 99 99 ALA HA H 99 3.818 4.012 -0.194 1
1 1298 . 14 1 1 A 99 99 ALA C C 99 177.712 179.163 -1.451 1
1 1299 . 14 1 1 A 99 99 ALA CA C 99 55.117 54.943 0.174 1
1 1300 . 14 1 1 A 99 99 ALA CB C 99 18.879 18.424 0.455 1
1 1301 . 14 1 1 A 99 99 ALA N N 99 122.816 120.399 2.417 1
1 1302 . 14 1 1 A 100 100 LYS H H 100 8.190 7.853 0.337 1
1 1303 . 14 1 1 A 100 100 LYS HA H 100 4.483 4.324 0.159 1
1 1312 . 14 1 1 A 100 100 LYS C C 100 175.899 176.266 -0.367 1
1 1313 . 14 1 1 A 100 100 LYS CA C 100 54.231 57.263 -3.032 1
1 1314 . 14 1 1 A 100 100 LYS CB C 100 32.066 32.546 -0.480 1
1 1318 . 14 1 1 A 100 100 LYS N N 100 113.197 114.886 -1.689 1
1 1319 . 14 1 1 A 101 101 THR H H 101 7.128 7.552 -0.424 1
1 1320 . 14 1 1 A 101 101 THR HA H 101 3.834 4.471 -0.637 1
1 1325 . 14 1 1 A 101 101 THR C C 101 173.255 173.773 -0.518 1
1 1326 . 14 1 1 A 101 101 THR CA C 101 64.392 62.015 2.377 1
1 1327 . 14 1 1 A 101 101 THR CB C 101 69.160 68.533 0.627 1
1 1329 . 14 1 1 A 101 101 THR N N 101 118.368 115.458 2.910 1
1 1330 . 14 1 1 A 102 102 LYS H H 102 8.753 8.821 -0.068 1
1 1331 . 14 1 1 A 102 102 LYS HA H 102 4.438 4.987 -0.549 1
1 1340 . 14 1 1 A 102 102 LYS C C 102 175.627 175.967 -0.340 1
1 1341 . 14 1 1 A 102 102 LYS CA C 102 55.117 55.019 0.098 1
1 1342 . 14 1 1 A 102 102 LYS CB C 102 33.901 34.679 -0.778 1
1 1346 . 14 1 1 A 102 102 LYS N N 102 126.513 124.327 2.186 1
1 1347 . 14 1 1 A 103 103 LEU H H 103 8.602 8.299 0.303 1
1 1348 . 14 1 1 A 103 103 LEU HA H 103 4.486 4.421 0.065 1
1 1358 . 14 1 1 A 103 103 LEU CA C 103 52.233 53.227 -0.994 1
1 1359 . 14 1 1 A 103 103 LEU CB C 103 41.028 42.810 -1.782 1
1 1363 . 14 1 1 A 103 103 LEU N N 103 124.466 123.305 1.161 1
1 1364 . 14 1 1 A 104 104 PRO HA H 104 4.437 4.581 -0.144 1
1 1371 . 14 1 1 A 104 104 PRO C C 104 175.779 176.172 -0.393 1
1 1372 . 14 1 1 A 104 104 PRO CA C 104 62.322 62.336 -0.014 1
1 1373 . 14 1 1 A 104 104 PRO CB C 104 31.899 33.013 -1.114 1
1 1376 . 14 1 1 A 105 105 LYS H H 105 8.460 8.498 -0.038 1
1 1377 . 14 1 1 A 105 105 LYS HA H 105 4.154 4.271 -0.117 1
1 1386 . 14 1 1 A 105 105 LYS C C 105 175.998 176.608 -0.610 1
1 1387 . 14 1 1 A 105 105 LYS CA C 105 56.480 56.528 -0.048 1
1 1388 . 14 1 1 A 105 105 LYS CB C 105 32.909 31.501 1.408 1
1 1392 . 14 1 1 A 105 105 LYS N N 105 122.139 119.205 2.934 1
1 1393 . 14 1 1 A 106 106 ALA H H 106 8.448 8.322 0.126 1
1 1394 . 14 1 1 A 106 106 ALA HA H 106 4.309 4.553 -0.244 1
1 1398 . 14 1 1 A 106 106 ALA C C 106 176.828 175.870 0.958 1
1 1399 . 14 1 1 A 106 106 ALA CA C 106 51.862 51.553 0.309 1
1 1400 . 14 1 1 A 106 106 ALA CB C 106 19.323 19.975 -0.652 1
1 1401 . 14 1 1 A 106 106 ALA N N 106 125.278 123.361 1.917 1
1 1402 . 14 1 1 A 107 107 ASP H H 107 8.428 7.615 0.813 1
1 1403 . 14 1 1 A 107 107 ASP HA H 107 4.574 5.151 -0.577 1
1 1406 . 14 1 1 A 107 107 ASP C C 107 175.951 174.276 1.675 1
1 1407 . 14 1 1 A 107 107 ASP CA C 107 54.214 52.674 1.540 1
1 1408 . 14 1 1 A 107 107 ASP CB C 107 41.141 44.507 -3.366 1
1 1409 . 14 1 1 A 107 107 ASP N N 107 120.771 120.346 0.425 1
1 1410 . 14 1 1 A 108 108 LYS H H 108 8.329 8.899 -0.570 1
1 1411 . 14 1 1 A 108 108 LYS HA H 108 4.203 4.862 -0.659 1
1 1420 . 14 1 1 A 108 108 LYS C C 108 176.483 175.116 1.367 1
1 1421 . 14 1 1 A 108 108 LYS CA C 108 56.831 54.805 2.026 1
1 1422 . 14 1 1 A 108 108 LYS CB C 108 32.648 34.652 -2.004 1
1 1426 . 14 1 1 A 108 108 LYS N N 108 120.727 125.049 -4.322 1
1 1427 . 14 1 1 A 109 109 GLU H H 109 8.447 8.975 -0.528 1
1 1428 . 14 1 1 A 109 109 GLU HA H 109 4.215 4.740 -0.525 1
1 1433 . 14 1 1 A 109 109 GLU C C 109 176.513 176.043 0.470 1
1 1434 . 14 1 1 A 109 109 GLU CA C 109 56.936 56.508 0.428 1
1 1435 . 14 1 1 A 109 109 GLU CB C 109 29.833 31.163 -1.330 1
1 1437 . 14 1 1 A 109 109 GLU N N 109 121.471 125.712 -4.241 1
1 1438 . 14 1 1 A 110 110 GLU H H 110 8.352 8.822 -0.470 1
1 1439 . 14 1 1 A 110 110 GLU HA H 110 4.233 4.972 -0.739 1
1 1444 . 14 1 1 A 110 110 GLU C C 110 176.439 176.727 -0.288 1
1 1445 . 14 1 1 A 110 110 GLU CA C 110 56.681 55.679 1.002 1
1 1446 . 14 1 1 A 110 110 GLU CB C 110 29.860 30.352 -0.492 1
1 1448 . 14 1 1 A 110 110 GLU N N 110 121.559 125.828 -4.269 1
1 1449 . 14 1 1 A 111 111 LEU H H 111 8.145 7.853 0.292 1
1 1450 . 14 1 1 A 111 111 LEU HA H 111 4.251 4.359 -0.108 1
1 1460 . 14 1 1 A 111 111 LEU C C 111 177.306 177.174 0.132 1
1 1461 . 14 1 1 A 111 111 LEU CA C 111 55.277 55.230 0.047 1
1 1462 . 14 1 1 A 111 111 LEU CB C 111 42.054 42.325 -0.271 1
1 1466 . 14 1 1 A 111 111 LEU N N 111 122.181 119.787 2.394 1
1 1467 . 14 1 1 A 112 112 GLU H H 112 8.212 8.068 0.144 1
1 1468 . 14 1 1 A 112 112 GLU N N 112 120.291 118.552 1.739 1
1 1469 . 14 1 1 A 114 114 HIS C C 114 176.070 173.886 2.184 1
1 1470 . 14 1 1 A 116 116 HIS H H 116 8.227 8.883 -0.656 1
1 1471 . 14 1 1 A 116 116 HIS C C 116 173.580 173.950 -0.370 1
1 1472 . 14 1 1 A 116 116 HIS N N 116 119.156 117.349 1.807 1
1 5 . 15 1 1 A 3 3 PRO HA H 3 4.390 4.754 -0.364 1
1 12 . 15 1 1 A 3 3 PRO C C 3 176.847 177.222 -0.375 1
1 13 . 15 1 1 A 3 3 PRO CA C 3 63.449 62.550 0.899 1
1 14 . 15 1 1 A 3 3 PRO CB C 3 31.938 32.047 -0.109 1
1 17 . 15 1 1 A 4 4 SER H H 4 8.531 8.999 -0.468 1
1 18 . 15 1 1 A 4 4 SER HA H 4 4.262 4.155 0.107 1
1 21 . 15 1 1 A 4 4 SER C C 4 175.414 174.391 1.023 1
1 22 . 15 1 1 A 4 4 SER CA C 4 59.163 61.699 -2.536 1
1 23 . 15 1 1 A 4 4 SER CB C 4 63.242 63.249 -0.007 1
1 24 . 15 1 1 A 4 4 SER N N 4 114.246 118.555 -4.309 1
1 25 . 15 1 1 A 5 5 LYS H H 5 8.468 7.843 0.625 1
1 26 . 15 1 1 A 5 5 LYS HA H 5 4.433 3.886 0.547 1
1 35 . 15 1 1 A 5 5 LYS C C 5 175.984 175.110 0.874 1
1 36 . 15 1 1 A 5 5 LYS CA C 5 55.724 57.270 -1.546 1
1 37 . 15 1 1 A 5 5 LYS CB C 5 32.881 29.270 3.611 1
1 41 . 15 1 1 A 5 5 LYS N N 5 123.488 119.366 4.122 1
1 42 . 15 1 1 A 6 6 LEU H H 6 7.707 8.092 -0.385 1
1 43 . 15 1 1 A 6 6 LEU HA H 6 4.381 4.358 0.023 1
1 53 . 15 1 1 A 6 6 LEU C C 6 177.820 176.050 1.770 1
1 54 . 15 1 1 A 6 6 LEU CA C 6 55.507 55.428 0.079 1
1 55 . 15 1 1 A 6 6 LEU CB C 6 43.374 42.905 0.469 1
1 59 . 15 1 1 A 6 6 LEU N N 6 121.233 122.306 -1.073 1
1 60 . 15 1 1 A 7 7 SER H H 7 9.433 8.712 0.721 1
1 61 . 15 1 1 A 7 7 SER HA H 7 4.638 4.917 -0.279 1
1 64 . 15 1 1 A 7 7 SER C C 7 174.120 174.990 -0.870 1
1 65 . 15 1 1 A 7 7 SER CA C 7 57.962 57.349 0.613 1
1 66 . 15 1 1 A 7 7 SER CB C 7 64.197 64.512 -0.315 1
1 67 . 15 1 1 A 7 7 SER N N 7 122.977 118.200 4.777 1
1 68 . 15 1 1 A 8 8 TYR H H 8 9.764 9.308 0.456 1
1 69 . 15 1 1 A 8 8 TYR HA H 8 4.732 4.268 0.464 1
1 76 . 15 1 1 A 8 8 TYR C C 8 177.206 177.645 -0.439 1
1 77 . 15 1 1 A 8 8 TYR CA C 8 58.762 61.804 -3.042 1
1 78 . 15 1 1 A 8 8 TYR CB C 8 36.605 38.856 -2.251 1
1 83 . 15 1 1 A 8 8 TYR N N 8 123.312 122.663 0.649 1
1 84 . 15 1 1 A 9 9 GLY H H 9 10.131 8.302 1.829 1
1 85 . 15 1 1 A 9 9 GLY HA2 H 9 3.983 3.595 0.388 1
1 86 . 15 1 1 A 9 9 GLY HA3 H 9 3.423 3.674 -0.251 1
1 87 . 15 1 1 A 9 9 GLY C C 9 175.163 175.762 -0.599 1
1 88 . 15 1 1 A 9 9 GLY CA C 9 47.153 47.324 -0.171 1
1 89 . 15 1 1 A 9 9 GLY N N 9 107.177 106.116 1.061 1
1 90 . 15 1 1 A 10 10 GLU H H 10 7.876 7.573 0.303 1
1 91 . 15 1 1 A 10 10 GLU HA H 10 4.107 4.091 0.016 1
1 96 . 15 1 1 A 10 10 GLU C C 10 179.924 178.721 1.203 1
1 97 . 15 1 1 A 10 10 GLU CA C 10 58.890 59.342 -0.452 1
1 98 . 15 1 1 A 10 10 GLU CB C 10 29.750 29.512 0.238 1
1 100 . 15 1 1 A 10 10 GLU N N 10 122.219 121.486 0.733 1
1 101 . 15 1 1 A 11 11 TYR H H 11 8.384 8.293 0.091 1
1 102 . 15 1 1 A 11 11 TYR HA H 11 4.305 4.263 0.042 1
1 107 . 15 1 1 A 11 11 TYR C C 11 176.854 177.102 -0.248 1
1 108 . 15 1 1 A 11 11 TYR CA C 11 61.040 61.429 -0.389 1
1 109 . 15 1 1 A 11 11 TYR CB C 11 37.593 38.949 -1.356 1
1 112 . 15 1 1 A 11 11 TYR N N 11 120.809 123.142 -2.333 1
1 113 . 15 1 1 A 12 12 LEU H H 12 9.027 8.341 0.686 1
1 114 . 15 1 1 A 12 12 LEU HA H 12 3.778 3.852 -0.074 1
1 124 . 15 1 1 A 12 12 LEU C C 12 178.621 179.452 -0.831 1
1 125 . 15 1 1 A 12 12 LEU CA C 12 57.534 57.459 0.075 1
1 126 . 15 1 1 A 12 12 LEU CB C 12 41.957 40.958 0.999 1
1 130 . 15 1 1 A 12 12 LEU N N 12 121.080 119.114 1.966 1
1 131 . 15 1 1 A 13 13 GLU H H 13 7.614 8.004 -0.390 1
1 132 . 15 1 1 A 13 13 GLU HA H 13 4.102 4.053 0.049 1
1 137 . 15 1 1 A 13 13 GLU C C 13 178.449 179.313 -0.864 1
1 138 . 15 1 1 A 13 13 GLU CA C 13 59.609 59.372 0.237 1
1 139 . 15 1 1 A 13 13 GLU CB C 13 29.124 29.494 -0.370 1
1 141 . 15 1 1 A 13 13 GLU N N 13 118.475 120.840 -2.365 1
1 142 . 15 1 1 A 14 14 SER H H 14 7.329 7.931 -0.602 1
1 143 . 15 1 1 A 14 14 SER HA H 14 4.358 4.218 0.140 1
1 146 . 15 1 1 A 14 14 SER C C 14 176.794 176.084 0.710 1
1 147 . 15 1 1 A 14 14 SER CA C 14 61.064 62.329 -1.265 1
1 148 . 15 1 1 A 14 14 SER CB C 14 62.513 63.351 -0.838 1
1 149 . 15 1 1 A 14 14 SER N N 14 115.209 117.159 -1.950 1
1 150 . 15 1 1 A 15 15 TRP H H 15 8.870 7.920 0.950 1
1 151 . 15 1 1 A 15 15 TRP HA H 15 4.005 4.179 -0.174 1
1 160 . 15 1 1 A 15 15 TRP C C 15 177.547 178.007 -0.460 1
1 161 . 15 1 1 A 15 15 TRP CA C 15 61.210 61.048 0.162 1
1 162 . 15 1 1 A 15 15 TRP CB C 15 27.341 29.266 -1.925 1
1 168 . 15 1 1 A 15 15 TRP N N 15 124.998 123.704 1.294 1
1 170 . 15 1 1 A 16 16 PHE H H 16 9.087 8.187 0.900 1
1 171 . 15 1 1 A 16 16 PHE HA H 16 3.210 3.691 -0.481 1
1 179 . 15 1 1 A 16 16 PHE C C 16 175.909 176.964 -1.055 1
1 180 . 15 1 1 A 16 16 PHE CA C 16 61.473 61.364 0.109 1
1 181 . 15 1 1 A 16 16 PHE CB C 16 38.506 39.115 -0.609 1
1 187 . 15 1 1 A 16 16 PHE N N 16 119.825 121.015 -1.190 1
1 188 . 15 1 1 A 17 17 ASN H H 17 7.768 8.167 -0.399 1
1 189 . 15 1 1 A 17 17 ASN HA H 17 4.078 4.168 -0.090 1
1 194 . 15 1 1 A 17 17 ASN C C 17 176.604 177.497 -0.893 1
1 195 . 15 1 1 A 17 17 ASN CA C 17 55.621 55.990 -0.369 1
1 196 . 15 1 1 A 17 17 ASN CB C 17 37.830 38.441 -0.611 1
1 197 . 15 1 1 A 17 17 ASN N N 17 115.600 116.919 -1.319 1
1 199 . 15 1 1 A 18 18 THR H H 18 7.454 7.127 0.327 1
1 200 . 15 1 1 A 18 18 THR HA H 18 4.147 3.867 0.280 1
1 205 . 15 1 1 A 18 18 THR C C 18 175.692 176.048 -0.356 1
1 206 . 15 1 1 A 18 18 THR CA C 18 64.679 64.385 0.294 1
1 207 . 15 1 1 A 18 18 THR CB C 18 68.940 68.803 0.137 1
1 209 . 15 1 1 A 18 18 THR N N 18 113.049 114.734 -1.685 1
1 210 . 15 1 1 A 19 19 LYS H H 19 7.918 7.575 0.343 1
1 211 . 15 1 1 A 19 19 LYS HA H 19 3.791 3.611 0.180 1
1 220 . 15 1 1 A 19 19 LYS C C 19 178.120 179.289 -1.169 1
1 221 . 15 1 1 A 19 19 LYS CA C 19 55.985 58.790 -2.805 1
1 222 . 15 1 1 A 19 19 LYS CB C 19 31.130 31.019 0.111 1
1 226 . 15 1 1 A 19 19 LYS N N 19 122.614 120.888 1.726 1
1 227 . 15 1 1 A 20 20 ARG H H 20 7.845 7.519 0.326 1
1 228 . 15 1 1 A 20 20 ARG HA H 20 3.396 3.868 -0.472 1
1 236 . 15 1 1 A 20 20 ARG C C 20 175.601 177.429 -1.828 1
1 237 . 15 1 1 A 20 20 ARG CA C 20 58.182 58.363 -0.181 1
1 238 . 15 1 1 A 20 20 ARG CB C 20 28.045 30.002 -1.957 1
1 241 . 15 1 1 A 20 20 ARG N N 20 116.282 118.347 -2.065 1
1 243 . 15 1 1 A 21 21 HIS H H 21 7.163 7.889 -0.726 1
1 244 . 15 1 1 A 21 21 HIS HA H 21 4.500 4.327 0.173 1
1 249 . 15 1 1 A 21 21 HIS C C 21 175.618 175.633 -0.015 1
1 250 . 15 1 1 A 21 21 HIS CA C 21 56.912 58.952 -2.040 1
1 251 . 15 1 1 A 21 21 HIS CB C 21 29.400 30.066 -0.666 1
1 254 . 15 1 1 A 21 21 HIS N N 21 115.452 117.799 -2.347 1
1 255 . 15 1 1 A 22 22 SER H H 22 7.951 7.754 0.197 1
1 256 . 15 1 1 A 22 22 SER HA H 22 4.573 4.423 0.150 1
1 259 . 15 1 1 A 22 22 SER C C 22 173.948 174.042 -0.094 1
1 260 . 15 1 1 A 22 22 SER CA C 22 58.589 58.996 -0.407 1
1 261 . 15 1 1 A 22 22 SER CB C 22 64.228 64.374 -0.146 1
1 262 . 15 1 1 A 22 22 SER N N 22 113.209 111.507 1.702 1
1 263 . 15 1 1 A 23 23 VAL H H 23 7.179 7.191 -0.012 1
1 264 . 15 1 1 A 23 23 VAL HA H 23 4.626 4.669 -0.043 1
1 272 . 15 1 1 A 23 23 VAL C C 23 175.397 175.547 -0.150 1
1 273 . 15 1 1 A 23 23 VAL CA C 23 59.556 59.691 -0.135 1
1 274 . 15 1 1 A 23 23 VAL CB C 23 33.810 34.702 -0.892 1
1 277 . 15 1 1 A 23 23 VAL N N 23 113.108 116.802 -3.694 1
1 278 . 15 1 1 A 24 24 GLY H H 24 8.189 8.403 -0.214 1
1 279 . 15 1 1 A 24 24 GLY HA2 H 24 4.074 4.031 0.043 1
1 280 . 15 1 1 A 24 24 GLY HA3 H 24 4.195 4.053 0.142 1
1 281 . 15 1 1 A 24 24 GLY C C 24 174.037 174.748 -0.711 1
1 282 . 15 1 1 A 24 24 GLY CA C 24 44.452 45.465 -1.013 1
1 283 . 15 1 1 A 24 24 GLY N N 24 108.374 108.758 -0.384 1
1 284 . 15 1 1 A 25 25 ILE H H 25 8.331 8.578 -0.247 1
1 285 . 15 1 1 A 25 25 ILE HA H 25 3.839 3.583 0.256 1
1 295 . 15 1 1 A 25 25 ILE C C 25 178.042 177.674 0.368 1
1 296 . 15 1 1 A 25 25 ILE CA C 25 64.238 64.432 -0.194 1
1 297 . 15 1 1 A 25 25 ILE CB C 25 37.931 37.483 0.448 1
1 301 . 15 1 1 A 25 25 ILE N N 25 119.895 121.511 -1.616 1
1 302 . 15 1 1 A 26 26 GLN H H 26 8.545 8.541 0.004 1
1 303 . 15 1 1 A 26 26 GLN HA H 26 4.129 4.039 0.090 1
1 310 . 15 1 1 A 26 26 GLN C C 26 178.454 178.097 0.357 1
1 311 . 15 1 1 A 26 26 GLN CA C 26 58.772 58.128 0.644 1
1 312 . 15 1 1 A 26 26 GLN CB C 26 27.346 28.311 -0.965 1
1 314 . 15 1 1 A 26 26 GLN N N 26 120.013 119.705 0.308 1
1 316 . 15 1 1 A 27 27 THR H H 27 7.944 8.000 -0.056 1
1 317 . 15 1 1 A 27 27 THR HA H 27 3.953 3.875 0.078 1
1 322 . 15 1 1 A 27 27 THR C C 27 175.818 175.915 -0.097 1
1 323 . 15 1 1 A 27 27 THR CA C 27 65.855 66.471 -0.616 1
1 324 . 15 1 1 A 27 27 THR CB C 27 68.127 68.495 -0.368 1
1 326 . 15 1 1 A 27 27 THR N N 27 117.645 116.755 0.890 1
1 327 . 15 1 1 A 28 28 ALA H H 28 8.593 8.225 0.368 1
1 328 . 15 1 1 A 28 28 ALA HA H 28 3.899 3.992 -0.093 1
1 332 . 15 1 1 A 28 28 ALA C C 28 178.515 179.969 -1.454 1
1 333 . 15 1 1 A 28 28 ALA CA C 28 55.742 55.378 0.364 1
1 334 . 15 1 1 A 28 28 ALA CB C 28 17.513 18.140 -0.627 1
1 335 . 15 1 1 A 28 28 ALA N N 28 123.917 123.504 0.413 1
1 336 . 15 1 1 A 29 29 LYS H H 29 7.800 7.922 -0.122 1
1 337 . 15 1 1 A 29 29 LYS HA H 29 3.982 4.046 -0.064 1
1 346 . 15 1 1 A 29 29 LYS C C 29 179.527 179.253 0.274 1
1 347 . 15 1 1 A 29 29 LYS CA C 29 59.761 59.487 0.274 1
1 348 . 15 1 1 A 29 29 LYS CB C 29 32.223 32.299 -0.076 1
1 352 . 15 1 1 A 29 29 LYS N N 29 117.474 118.817 -1.343 1
1 353 . 15 1 1 A 30 30 VAL H H 30 7.591 7.239 0.352 1
1 354 . 15 1 1 A 30 30 VAL HA H 30 3.503 3.412 0.091 1
1 362 . 15 1 1 A 30 30 VAL C C 30 178.389 178.020 0.369 1
1 363 . 15 1 1 A 30 30 VAL CA C 30 65.640 65.998 -0.358 1
1 364 . 15 1 1 A 30 30 VAL CB C 30 31.644 31.489 0.155 1
1 367 . 15 1 1 A 30 30 VAL N N 30 121.749 120.397 1.352 1
1 368 . 15 1 1 A 31 31 LEU H H 31 8.333 8.115 0.218 1
1 369 . 15 1 1 A 31 31 LEU HA H 31 4.074 4.082 -0.008 1
1 379 . 15 1 1 A 31 31 LEU C C 31 177.780 178.908 -1.128 1
1 380 . 15 1 1 A 31 31 LEU CA C 31 58.157 58.233 -0.076 1
1 381 . 15 1 1 A 31 31 LEU CB C 31 42.230 41.321 0.909 1
1 385 . 15 1 1 A 31 31 LEU N N 31 120.901 120.434 0.467 1
1 386 . 15 1 1 A 32 32 LYS H H 32 8.562 8.008 0.554 1
1 387 . 15 1 1 A 32 32 LYS HA H 32 3.290 3.989 -0.699 1
1 395 . 15 1 1 A 32 32 LYS C C 32 178.037 178.791 -0.754 1
1 396 . 15 1 1 A 32 32 LYS CA C 32 58.911 59.469 -0.558 1
1 397 . 15 1 1 A 32 32 LYS CB C 32 31.605 31.277 0.328 1
1 401 . 15 1 1 A 32 32 LYS N N 32 119.075 119.437 -0.362 1
1 402 . 15 1 1 A 33 33 GLY H H 33 7.694 7.757 -0.063 1
1 403 . 15 1 1 A 33 33 GLY HA2 H 33 3.949 3.509 0.440 1
1 404 . 15 1 1 A 33 33 GLY HA3 H 33 3.826 3.609 0.217 1
1 405 . 15 1 1 A 33 33 GLY C C 33 177.101 176.308 0.793 1
1 406 . 15 1 1 A 33 33 GLY CA C 33 46.928 46.938 -0.010 1
1 407 . 15 1 1 A 33 33 GLY N N 33 105.282 106.938 -1.656 1
1 408 . 15 1 1 A 34 34 TYR H H 34 8.015 7.500 0.515 1
1 409 . 15 1 1 A 34 34 TYR HA H 34 4.558 4.621 -0.063 1
1 416 . 15 1 1 A 34 34 TYR C C 34 179.611 178.083 1.528 1
1 417 . 15 1 1 A 34 34 TYR CA C 34 59.349 60.556 -1.207 1
1 418 . 15 1 1 A 34 34 TYR CB C 34 37.344 38.645 -1.301 1
1 423 . 15 1 1 A 34 34 TYR N N 34 121.781 121.753 0.028 1
1 424 . 15 1 1 A 35 35 LEU H H 35 8.689 8.179 0.510 1
1 425 . 15 1 1 A 35 35 LEU HA H 35 3.977 3.884 0.093 1
1 435 . 15 1 1 A 35 35 LEU C C 35 177.081 178.853 -1.772 1
1 436 . 15 1 1 A 35 35 LEU CA C 35 59.155 58.476 0.679 1
1 437 . 15 1 1 A 35 35 LEU CB C 35 41.103 41.782 -0.679 1
1 441 . 15 1 1 A 35 35 LEU N N 35 120.392 120.626 -0.234 1
1 442 . 15 1 1 A 36 36 ASN H H 36 8.721 8.486 0.235 1
1 443 . 15 1 1 A 36 36 ASN HA H 36 4.435 4.455 -0.020 1
1 448 . 15 1 1 A 36 36 ASN C C 36 176.792 177.672 -0.880 1
1 449 . 15 1 1 A 36 36 ASN CA C 36 55.642 55.989 -0.347 1
1 450 . 15 1 1 A 36 36 ASN CB C 36 38.319 37.878 0.441 1
1 451 . 15 1 1 A 36 36 ASN N N 36 114.623 116.772 -2.149 1
1 453 . 15 1 1 A 37 37 SER H H 37 8.511 8.041 0.470 1
1 454 . 15 1 1 A 37 37 SER HA H 37 4.642 4.361 0.281 1
1 457 . 15 1 1 A 37 37 SER C C 37 175.039 175.499 -0.460 1
1 458 . 15 1 1 A 37 37 SER CA C 37 59.825 61.459 -1.634 1
1 459 . 15 1 1 A 37 37 SER CB C 37 64.056 63.675 0.381 1
1 460 . 15 1 1 A 37 37 SER N N 37 110.941 116.424 -5.483 1
1 461 . 15 1 1 A 38 38 ARG H H 38 7.242 8.003 -0.761 1
1 462 . 15 1 1 A 38 38 ARG HA H 38 4.919 4.436 0.483 1
1 469 . 15 1 1 A 38 38 ARG C C 38 176.514 178.234 -1.720 1
1 470 . 15 1 1 A 38 38 ARG CA C 38 56.687 57.979 -1.292 1
1 471 . 15 1 1 A 38 38 ARG CB C 38 32.434 31.137 1.297 1
1 474 . 15 1 1 A 38 38 ARG N N 38 117.062 119.861 -2.799 1
1 475 . 15 1 1 A 39 39 ILE H H 39 8.462 8.028 0.434 1
1 476 . 15 1 1 A 39 39 ILE HA H 39 3.618 3.925 -0.307 1
1 486 . 15 1 1 A 39 39 ILE C C 39 176.267 178.295 -2.028 1
1 487 . 15 1 1 A 39 39 ILE CA C 39 66.134 64.799 1.335 1
1 488 . 15 1 1 A 39 39 ILE CB C 39 39.787 37.720 2.067 1
1 492 . 15 1 1 A 39 39 ILE N N 39 121.214 120.538 0.676 1
1 493 . 15 1 1 A 40 40 ILE H H 40 9.339 8.168 1.171 1
1 494 . 15 1 1 A 40 40 ILE HA H 40 3.401 3.756 -0.355 1
1 504 . 15 1 1 A 40 40 ILE CA C 40 67.844 66.403 1.441 1
1 505 . 15 1 1 A 40 40 ILE CB C 40 34.406 35.560 -1.154 1
1 509 . 15 1 1 A 40 40 ILE N N 40 119.695 121.495 -1.800 1
1 510 . 15 1 1 A 41 41 PRO HA H 41 4.314 4.399 -0.085 1
1 517 . 15 1 1 A 41 41 PRO C C 41 177.418 178.110 -0.692 1
1 518 . 15 1 1 A 41 41 PRO CA C 41 65.912 64.673 1.239 1
1 519 . 15 1 1 A 41 41 PRO CB C 41 30.686 31.616 -0.930 1
1 522 . 15 1 1 A 42 42 SER H H 42 6.857 8.182 -1.325 1
1 523 . 15 1 1 A 42 42 SER HA H 42 4.558 4.501 0.057 1
1 526 . 15 1 1 A 42 42 SER C C 42 174.813 175.659 -0.846 1
1 527 . 15 1 1 A 42 42 SER CA C 42 61.279 60.980 0.299 1
1 528 . 15 1 1 A 42 42 SER CB C 42 64.285 64.114 0.171 1
1 529 . 15 1 1 A 42 42 SER N N 42 108.994 112.898 -3.904 1
1 530 . 15 1 1 A 43 43 LEU H H 43 8.230 8.058 0.172 1
1 531 . 15 1 1 A 43 43 LEU HA H 43 4.572 4.343 0.229 1
1 541 . 15 1 1 A 43 43 LEU C C 43 177.301 178.534 -1.233 1
1 542 . 15 1 1 A 43 43 LEU CA C 43 54.113 55.268 -1.155 1
1 543 . 15 1 1 A 43 43 LEU CB C 43 44.800 42.438 2.362 1
1 547 . 15 1 1 A 43 43 LEU N N 43 118.715 120.292 -1.577 1
1 548 . 15 1 1 A 44 44 GLY H H 44 8.498 8.176 0.322 1
1 549 . 15 1 1 A 44 44 GLY HA2 H 44 4.010 3.800 0.210 1
1 550 . 15 1 1 A 44 44 GLY HA3 H 44 3.613 3.818 -0.205 1
1 551 . 15 1 1 A 44 44 GLY C C 44 174.178 176.211 -2.033 1
1 552 . 15 1 1 A 44 44 GLY CA C 44 46.271 47.367 -1.096 1
1 553 . 15 1 1 A 44 44 GLY N N 44 105.371 107.529 -2.158 1
1 554 . 15 1 1 A 45 45 ASN H H 45 8.385 7.977 0.408 1
1 555 . 15 1 1 A 45 45 ASN HA H 45 4.789 4.698 0.091 1
1 560 . 15 1 1 A 45 45 ASN C C 45 175.386 176.434 -1.048 1
1 561 . 15 1 1 A 45 45 ASN CA C 45 53.144 54.801 -1.657 1
1 562 . 15 1 1 A 45 45 ASN CB C 45 37.928 38.597 -0.669 1
1 563 . 15 1 1 A 45 45 ASN N N 45 114.387 118.454 -4.067 1
1 565 . 15 1 1 A 46 46 ILE H H 46 7.465 7.452 0.013 1
1 566 . 15 1 1 A 46 46 ILE HA H 46 3.856 4.096 -0.240 1
1 576 . 15 1 1 A 46 46 ILE C C 46 175.997 176.321 -0.324 1
1 577 . 15 1 1 A 46 46 ILE CA C 46 60.853 61.548 -0.695 1
1 578 . 15 1 1 A 46 46 ILE CB C 46 38.042 38.191 -0.149 1
1 582 . 15 1 1 A 46 46 ILE N N 46 123.998 120.735 3.263 1
1 583 . 15 1 1 A 47 47 LYS H H 47 8.717 8.584 0.133 1
1 584 . 15 1 1 A 47 47 LYS HA H 47 4.249 4.311 -0.062 1
1 591 . 15 1 1 A 47 47 LYS C C 47 177.583 177.674 -0.091 1
1 592 . 15 1 1 A 47 47 LYS CA C 47 56.320 56.999 -0.679 1
1 593 . 15 1 1 A 47 47 LYS CB C 47 30.393 32.805 -2.412 1
1 596 . 15 1 1 A 47 47 LYS N N 47 126.114 124.280 1.834 1
1 597 . 15 1 1 A 48 48 LEU H H 48 8.323 8.727 -0.404 1
1 598 . 15 1 1 A 48 48 LEU HA H 48 3.691 3.991 -0.300 1
1 608 . 15 1 1 A 48 48 LEU C C 48 177.274 178.153 -0.879 1
1 609 . 15 1 1 A 48 48 LEU CA C 48 58.443 58.589 -0.146 1
1 610 . 15 1 1 A 48 48 LEU CB C 48 42.282 41.152 1.130 1
1 614 . 15 1 1 A 48 48 LEU N N 48 125.857 126.309 -0.452 1
1 615 . 15 1 1 A 49 49 ALA H H 49 8.929 7.908 1.021 1
1 616 . 15 1 1 A 49 49 ALA HA H 49 4.067 4.028 0.039 1
1 620 . 15 1 1 A 49 49 ALA C C 49 177.468 179.352 -1.884 1
1 621 . 15 1 1 A 49 49 ALA CA C 49 53.092 54.885 -1.793 1
1 622 . 15 1 1 A 49 49 ALA CB C 49 18.562 18.039 0.523 1
1 623 . 15 1 1 A 49 49 ALA N N 49 115.543 120.324 -4.781 1
1 624 . 15 1 1 A 50 50 LYS H H 50 7.684 7.571 0.113 1
1 625 . 15 1 1 A 50 50 LYS HA H 50 4.395 4.265 0.130 1
1 634 . 15 1 1 A 50 50 LYS C C 50 174.958 176.591 -1.633 1
1 635 . 15 1 1 A 50 50 LYS CA C 50 53.977 56.984 -3.007 1
1 636 . 15 1 1 A 50 50 LYS CB C 50 32.645 32.448 0.197 1
1 640 . 15 1 1 A 50 50 LYS N N 50 114.788 115.412 -0.624 1
1 641 . 15 1 1 A 51 51 LEU H H 51 6.776 7.197 -0.421 1
1 642 . 15 1 1 A 51 51 LEU HA H 51 4.569 4.370 0.199 1
1 652 . 15 1 1 A 51 51 LEU C C 51 177.953 175.820 2.133 1
1 653 . 15 1 1 A 51 51 LEU CA C 51 55.318 54.918 0.400 1
1 654 . 15 1 1 A 51 51 LEU CB C 51 43.182 41.103 2.079 1
1 658 . 15 1 1 A 51 51 LEU N N 51 121.408 121.753 -0.345 1
1 659 . 15 1 1 A 52 52 THR H H 52 10.680 7.964 2.716 1
1 660 . 15 1 1 A 52 52 THR HA H 52 4.938 4.539 0.399 1
1 665 . 15 1 1 A 52 52 THR C C 52 175.553 175.801 -0.248 1
1 666 . 15 1 1 A 52 52 THR CA C 52 59.740 60.365 -0.625 1
1 667 . 15 1 1 A 52 52 THR CB C 52 73.557 70.432 3.125 1
1 669 . 15 1 1 A 52 52 THR N N 52 119.481 119.423 0.058 1
1 670 . 15 1 1 A 53 53 SER H H 53 9.278 9.077 0.201 1
1 671 . 15 1 1 A 53 53 SER HA H 53 4.261 4.166 0.095 1
1 674 . 15 1 1 A 53 53 SER C C 53 176.990 176.747 0.243 1
1 675 . 15 1 1 A 53 53 SER CA C 53 61.025 61.265 -0.240 1
1 676 . 15 1 1 A 53 53 SER CB C 53 62.312 63.050 -0.738 1
1 677 . 15 1 1 A 53 53 SER N N 53 116.343 119.049 -2.706 1
1 678 . 15 1 1 A 54 54 LEU H H 54 7.808 7.606 0.202 1
1 679 . 15 1 1 A 54 54 LEU HA H 54 4.229 4.036 0.193 1
1 688 . 15 1 1 A 54 54 LEU C C 54 178.505 178.585 -0.080 1
1 689 . 15 1 1 A 54 54 LEU CA C 54 57.719 58.044 -0.325 1
1 690 . 15 1 1 A 54 54 LEU CB C 54 40.997 41.616 -0.619 1
1 694 . 15 1 1 A 54 54 LEU N N 54 126.055 124.866 1.189 1
1 695 . 15 1 1 A 55 55 HIS H H 55 7.798 8.168 -0.370 1
1 696 . 15 1 1 A 55 55 HIS HA H 55 4.311 4.387 -0.076 1
1 701 . 15 1 1 A 55 55 HIS C C 55 180.044 177.721 2.323 1
1 702 . 15 1 1 A 55 55 HIS CA C 55 60.583 59.568 1.015 1
1 703 . 15 1 1 A 55 55 HIS CB C 55 31.445 29.697 1.748 1
1 706 . 15 1 1 A 55 55 HIS N N 55 118.683 117.832 0.851 1
1 707 . 15 1 1 A 56 56 MET H H 56 7.375 7.834 -0.459 1
1 708 . 15 1 1 A 56 56 MET HA H 56 4.513 4.013 0.500 1
1 716 . 15 1 1 A 56 56 MET C C 56 177.169 178.485 -1.316 1
1 717 . 15 1 1 A 56 56 MET CA C 56 55.823 59.232 -3.409 1
1 718 . 15 1 1 A 56 56 MET CB C 56 31.303 33.357 -2.054 1
1 721 . 15 1 1 A 56 56 MET N N 56 114.530 117.638 -3.108 1
1 722 . 15 1 1 A 57 57 GLN H H 57 8.387 8.234 0.153 1
1 723 . 15 1 1 A 57 57 GLN HA H 57 3.981 3.985 -0.004 1
1 730 . 15 1 1 A 57 57 GLN C C 57 178.033 178.379 -0.346 1
1 731 . 15 1 1 A 57 57 GLN CA C 57 57.922 59.183 -1.261 1
1 732 . 15 1 1 A 57 57 GLN CB C 57 29.012 28.443 0.569 1
1 734 . 15 1 1 A 57 57 GLN N N 57 120.713 119.692 1.021 1
1 736 . 15 1 1 A 58 58 ASN H H 58 8.765 8.422 0.343 1
1 737 . 15 1 1 A 58 58 ASN HA H 58 4.539 4.445 0.094 1
1 742 . 15 1 1 A 58 58 ASN C C 58 178.084 177.759 0.325 1
1 743 . 15 1 1 A 58 58 ASN CA C 58 55.345 56.384 -1.039 1
1 744 . 15 1 1 A 58 58 ASN CB C 58 36.924 37.730 -0.806 1
1 745 . 15 1 1 A 58 58 ASN N N 58 117.390 117.649 -0.259 1
1 747 . 15 1 1 A 59 59 TYR H H 59 8.239 8.010 0.229 1
1 748 . 15 1 1 A 59 59 TYR HA H 59 4.586 4.168 0.418 1
1 755 . 15 1 1 A 59 59 TYR C C 59 178.015 176.701 1.314 1
1 756 . 15 1 1 A 59 59 TYR CA C 59 60.779 61.556 -0.777 1
1 757 . 15 1 1 A 59 59 TYR CB C 59 38.047 38.859 -0.812 1
1 762 . 15 1 1 A 59 59 TYR N N 59 122.335 122.877 -0.542 1
1 763 . 15 1 1 A 60 60 VAL H H 60 8.416 8.083 0.333 1
1 764 . 15 1 1 A 60 60 VAL HA H 60 3.244 3.531 -0.287 1
1 772 . 15 1 1 A 60 60 VAL C C 60 177.309 177.851 -0.542 1
1 773 . 15 1 1 A 60 60 VAL CA C 60 67.022 66.007 1.015 1
1 774 . 15 1 1 A 60 60 VAL CB C 60 30.929 31.088 -0.159 1
1 777 . 15 1 1 A 60 60 VAL N N 60 119.842 119.515 0.327 1
1 778 . 15 1 1 A 61 61 ASN H H 61 8.264 8.176 0.088 1
1 779 . 15 1 1 A 61 61 ASN HA H 61 4.305 4.416 -0.111 1
1 784 . 15 1 1 A 61 61 ASN C C 61 177.263 177.801 -0.538 1
1 785 . 15 1 1 A 61 61 ASN CA C 61 55.548 56.553 -1.005 1
1 786 . 15 1 1 A 61 61 ASN CB C 61 36.645 38.074 -1.429 1
1 787 . 15 1 1 A 61 61 ASN N N 61 119.103 119.482 -0.379 1
1 789 . 15 1 1 A 62 62 SER H H 62 8.143 7.961 0.182 1
1 790 . 15 1 1 A 62 62 SER HA H 62 4.343 4.116 0.227 1
1 793 . 15 1 1 A 62 62 SER C C 62 176.409 177.765 -1.356 1
1 794 . 15 1 1 A 62 62 SER CA C 62 61.612 61.367 0.245 1
1 795 . 15 1 1 A 62 62 SER CB C 62 62.219 62.473 -0.254 1
1 796 . 15 1 1 A 62 62 SER N N 62 118.254 114.717 3.537 1
1 797 . 15 1 1 A 63 63 LEU H H 63 7.664 7.702 -0.038 1
1 798 . 15 1 1 A 63 63 LEU HA H 63 4.003 3.886 0.117 1
1 808 . 15 1 1 A 63 63 LEU C C 63 178.748 178.996 -0.248 1
1 809 . 15 1 1 A 63 63 LEU CA C 63 57.171 57.853 -0.682 1
1 810 . 15 1 1 A 63 63 LEU CB C 63 41.134 41.066 0.068 1
1 814 . 15 1 1 A 63 63 LEU N N 63 123.812 122.118 1.694 1
1 815 . 15 1 1 A 64 64 ARG H H 64 7.969 7.708 0.261 1
1 816 . 15 1 1 A 64 64 ARG HA H 64 4.038 3.879 0.159 1
1 824 . 15 1 1 A 64 64 ARG C C 64 180.797 178.708 2.089 1
1 825 . 15 1 1 A 64 64 ARG CA C 64 58.598 59.416 -0.818 1
1 826 . 15 1 1 A 64 64 ARG CB C 64 28.849 29.779 -0.930 1
1 829 . 15 1 1 A 64 64 ARG N N 64 120.376 121.107 -0.731 1
1 831 . 15 1 1 A 65 65 ASP H H 65 8.465 7.850 0.615 1
1 832 . 15 1 1 A 65 65 ASP HA H 65 4.408 4.463 -0.055 1
1 835 . 15 1 1 A 65 65 ASP C C 65 177.336 178.621 -1.285 1
1 836 . 15 1 1 A 65 65 ASP CA C 65 56.957 56.851 0.106 1
1 837 . 15 1 1 A 65 65 ASP CB C 65 39.602 40.188 -0.586 1
1 838 . 15 1 1 A 65 65 ASP N N 65 122.402 119.591 2.811 1
1 839 . 15 1 1 A 66 66 GLU H H 66 7.703 7.795 -0.092 1
1 840 . 15 1 1 A 66 66 GLU HA H 66 4.213 4.255 -0.042 1
1 845 . 15 1 1 A 66 66 GLU C C 66 176.586 177.441 -0.855 1
1 846 . 15 1 1 A 66 66 GLU CA C 66 56.974 56.319 0.655 1
1 847 . 15 1 1 A 66 66 GLU CB C 66 29.821 29.938 -0.117 1
1 849 . 15 1 1 A 66 66 GLU N N 66 119.076 116.946 2.130 1
1 850 . 15 1 1 A 67 67 GLY H H 67 7.861 7.933 -0.072 1
1 851 . 15 1 1 A 67 67 GLY HA2 H 67 4.269 3.922 0.347 1
1 852 . 15 1 1 A 67 67 GLY HA3 H 67 3.731 3.926 -0.195 1
1 853 . 15 1 1 A 67 67 GLY C C 67 174.614 174.972 -0.358 1
1 854 . 15 1 1 A 67 67 GLY CA C 67 44.608 46.580 -1.972 1
1 855 . 15 1 1 A 67 67 GLY N N 67 105.730 109.394 -3.664 1
1 856 . 15 1 1 A 68 68 LEU H H 68 7.324 7.657 -0.333 1
1 857 . 15 1 1 A 68 68 LEU HA H 68 4.257 4.325 -0.068 1
1 867 . 15 1 1 A 68 68 LEU C C 68 176.136 177.037 -0.901 1
1 868 . 15 1 1 A 68 68 LEU CA C 68 55.659 54.919 0.740 1
1 869 . 15 1 1 A 68 68 LEU CB C 68 41.874 42.538 -0.664 1
1 873 . 15 1 1 A 68 68 LEU N N 68 121.062 120.858 0.204 1
1 874 . 15 1 1 A 69 69 LYS H H 69 8.368 8.496 -0.128 1
1 875 . 15 1 1 A 69 69 LYS HA H 69 4.281 4.305 -0.024 1
1 884 . 15 1 1 A 69 69 LYS C C 69 177.940 177.603 0.337 1
1 885 . 15 1 1 A 69 69 LYS CA C 69 55.412 56.198 -0.786 1
1 886 . 15 1 1 A 69 69 LYS CB C 69 32.761 33.224 -0.463 1
1 890 . 15 1 1 A 69 69 LYS N N 69 120.120 121.137 -1.017 1
1 891 . 15 1 1 A 70 70 ARG H H 70 9.095 8.715 0.380 1
1 892 . 15 1 1 A 70 70 ARG HA H 70 3.684 4.100 -0.416 1
1 900 . 15 1 1 A 70 70 ARG C C 70 177.712 178.507 -0.795 1
1 901 . 15 1 1 A 70 70 ARG CA C 70 60.216 58.264 1.952 1
1 902 . 15 1 1 A 70 70 ARG CB C 70 29.539 29.779 -0.240 1
1 905 . 15 1 1 A 70 70 ARG N N 70 123.339 121.258 2.081 1
1 907 . 15 1 1 A 71 71 GLY H H 71 8.985 8.296 0.689 1
1 908 . 15 1 1 A 71 71 GLY HA2 H 71 3.932 3.663 0.269 1
1 909 . 15 1 1 A 71 71 GLY HA3 H 71 3.905 3.663 0.242 1
1 910 . 15 1 1 A 71 71 GLY C C 71 176.324 175.846 0.478 1
1 911 . 15 1 1 A 71 71 GLY CA C 71 46.752 47.450 -0.698 1
1 912 . 15 1 1 A 71 71 GLY N N 71 104.509 109.386 -4.877 1
1 913 . 15 1 1 A 72 72 THR H H 72 7.295 8.105 -0.810 1
1 914 . 15 1 1 A 72 72 THR HA H 72 4.014 3.922 0.092 1
1 919 . 15 1 1 A 72 72 THR C C 72 175.135 176.054 -0.919 1
1 920 . 15 1 1 A 72 72 THR CA C 72 65.848 66.424 -0.576 1
1 921 . 15 1 1 A 72 72 THR CB C 72 68.160 67.922 0.238 1
1 923 . 15 1 1 A 72 72 THR N N 72 118.617 117.383 1.234 1
1 924 . 15 1 1 A 73 73 ILE H H 73 7.883 7.781 0.102 1
1 925 . 15 1 1 A 73 73 ILE HA H 73 3.258 3.553 -0.295 1
1 935 . 15 1 1 A 73 73 ILE C C 73 177.060 178.384 -1.324 1
1 936 . 15 1 1 A 73 73 ILE CA C 73 66.561 65.668 0.893 1
1 937 . 15 1 1 A 73 73 ILE CB C 73 37.339 37.733 -0.394 1
1 941 . 15 1 1 A 73 73 ILE N N 73 121.692 121.536 0.156 1
1 942 . 15 1 1 A 74 74 GLU H H 74 8.723 8.118 0.605 1
1 943 . 15 1 1 A 74 74 GLU HA H 74 3.807 3.937 -0.130 1
1 948 . 15 1 1 A 74 74 GLU C C 74 178.319 179.359 -1.040 1
1 949 . 15 1 1 A 74 74 GLU CA C 74 59.637 59.939 -0.302 1
1 950 . 15 1 1 A 74 74 GLU CB C 74 29.257 29.160 0.097 1
1 952 . 15 1 1 A 74 74 GLU N N 74 117.701 120.841 -3.140 1
1 953 . 15 1 1 A 75 75 LYS H H 75 7.361 7.433 -0.072 1
1 954 . 15 1 1 A 75 75 LYS HA H 75 3.958 4.048 -0.090 1
1 963 . 15 1 1 A 75 75 LYS C C 75 178.554 179.665 -1.111 1
1 964 . 15 1 1 A 75 75 LYS CA C 75 59.764 59.286 0.478 1
1 965 . 15 1 1 A 75 75 LYS CB C 75 32.314 32.155 0.159 1
1 969 . 15 1 1 A 75 75 LYS N N 75 118.734 118.948 -0.214 1
1 970 . 15 1 1 A 76 76 ILE H H 76 7.713 7.557 0.156 1
1 971 . 15 1 1 A 76 76 ILE HA H 76 3.221 3.858 -0.637 1
1 981 . 15 1 1 A 76 76 ILE C C 76 177.504 178.214 -0.710 1
1 982 . 15 1 1 A 76 76 ILE CA C 76 65.796 64.624 1.172 1
1 983 . 15 1 1 A 76 76 ILE CB C 76 37.732 36.236 1.496 1
1 987 . 15 1 1 A 76 76 ILE N N 76 120.312 116.807 3.505 1
1 988 . 15 1 1 A 77 77 ILE H H 77 8.587 8.227 0.360 1
1 989 . 15 1 1 A 77 77 ILE HA H 77 3.778 3.587 0.191 1
1 999 . 15 1 1 A 77 77 ILE C C 77 177.074 177.777 -0.703 1
1 1000 . 15 1 1 A 77 77 ILE CA C 77 63.168 65.333 -2.165 1
1 1001 . 15 1 1 A 77 77 ILE CB C 77 36.617 37.559 -0.942 1
1 1005 . 15 1 1 A 77 77 ILE N N 77 118.978 120.994 -2.016 1
1 1006 . 15 1 1 A 78 78 LYS H H 78 8.050 7.836 0.214 1
1 1007 . 15 1 1 A 78 78 LYS HA H 78 3.925 4.014 -0.089 1
1 1016 . 15 1 1 A 78 78 LYS C C 78 178.291 179.304 -1.013 1
1 1017 . 15 1 1 A 78 78 LYS CA C 78 60.192 59.267 0.925 1
1 1018 . 15 1 1 A 78 78 LYS CB C 78 31.886 32.185 -0.299 1
1 1022 . 15 1 1 A 78 78 LYS N N 78 121.618 119.408 2.210 1
1 1023 . 15 1 1 A 79 79 VAL H H 79 7.619 7.826 -0.207 1
1 1024 . 15 1 1 A 79 79 VAL HA H 79 3.846 3.714 0.132 1
1 1032 . 15 1 1 A 79 79 VAL C C 79 177.712 178.396 -0.684 1
1 1033 . 15 1 1 A 79 79 VAL CA C 79 66.494 66.308 0.186 1
1 1034 . 15 1 1 A 79 79 VAL CB C 79 31.298 31.738 -0.440 1
1 1037 . 15 1 1 A 79 79 VAL N N 79 120.254 119.518 0.736 1
1 1038 . 15 1 1 A 80 80 ILE H H 80 7.885 8.164 -0.279 1
1 1039 . 15 1 1 A 80 80 ILE HA H 80 3.367 3.804 -0.437 1
1 1049 . 15 1 1 A 80 80 ILE C C 80 179.892 178.075 1.817 1
1 1050 . 15 1 1 A 80 80 ILE CA C 80 65.343 65.156 0.187 1
1 1051 . 15 1 1 A 80 80 ILE CB C 80 38.129 37.352 0.777 1
1 1055 . 15 1 1 A 80 80 ILE N N 80 119.666 120.655 -0.989 1
1 1056 . 15 1 1 A 81 81 ARG H H 81 9.384 8.201 1.183 1
1 1057 . 15 1 1 A 81 81 ARG HA H 81 3.834 4.022 -0.188 1
1 1065 . 15 1 1 A 81 81 ARG C C 81 178.204 179.587 -1.383 1
1 1066 . 15 1 1 A 81 81 ARG CA C 81 60.560 59.665 0.895 1
1 1067 . 15 1 1 A 81 81 ARG CB C 81 30.196 30.088 0.108 1
1 1070 . 15 1 1 A 81 81 ARG N N 81 121.030 120.941 0.089 1
1 1072 . 15 1 1 A 82 82 ASN H H 82 8.773 8.434 0.339 1
1 1073 . 15 1 1 A 82 82 ASN HA H 82 4.587 4.621 -0.034 1
1 1078 . 15 1 1 A 82 82 ASN C C 82 178.300 177.981 0.319 1
1 1079 . 15 1 1 A 82 82 ASN CA C 82 56.160 56.079 0.081 1
1 1080 . 15 1 1 A 82 82 ASN CB C 82 38.464 38.100 0.364 1
1 1081 . 15 1 1 A 82 82 ASN N N 82 118.483 118.906 -0.423 1
1 1083 . 15 1 1 A 83 83 SER H H 83 8.526 7.825 0.701 1
1 1084 . 15 1 1 A 83 83 SER HA H 83 2.765 3.162 -0.397 1
1 1087 . 15 1 1 A 83 83 SER C C 83 176.386 177.740 -1.354 1
1 1088 . 15 1 1 A 83 83 SER CA C 83 61.245 60.983 0.262 1
1 1089 . 15 1 1 A 83 83 SER CB C 83 61.287 61.925 -0.638 1
1 1090 . 15 1 1 A 83 83 SER N N 83 118.286 114.304 3.982 1
1 1091 . 15 1 1 A 84 84 LEU H H 84 7.782 8.214 -0.432 1
1 1092 . 15 1 1 A 84 84 LEU HA H 84 4.221 3.967 0.254 1
1 1102 . 15 1 1 A 84 84 LEU C C 84 177.846 179.706 -1.860 1
1 1103 . 15 1 1 A 84 84 LEU CA C 84 57.166 57.840 -0.674 1
1 1104 . 15 1 1 A 84 84 LEU CB C 84 40.520 40.949 -0.429 1
1 1108 . 15 1 1 A 84 84 LEU N N 84 127.445 121.614 5.831 1
1 1109 . 15 1 1 A 85 85 GLU H H 85 8.264 8.444 -0.180 1
1 1110 . 15 1 1 A 85 85 GLU HA H 85 3.981 3.957 0.024 1
1 1115 . 15 1 1 A 85 85 GLU C C 85 179.288 179.093 0.195 1
1 1116 . 15 1 1 A 85 85 GLU CA C 85 59.025 59.667 -0.642 1
1 1117 . 15 1 1 A 85 85 GLU CB C 85 29.182 29.235 -0.053 1
1 1119 . 15 1 1 A 85 85 GLU N N 85 121.538 120.308 1.230 1
1 1120 . 15 1 1 A 86 86 HIS H H 86 7.683 8.049 -0.366 1
1 1121 . 15 1 1 A 86 86 HIS HA H 86 4.573 4.316 0.257 1
1 1125 . 15 1 1 A 86 86 HIS C C 86 175.484 177.540 -2.056 1
1 1126 . 15 1 1 A 86 86 HIS CA C 86 58.940 59.350 -0.410 1
1 1127 . 15 1 1 A 86 86 HIS CB C 86 29.267 30.170 -0.903 1
1 1129 . 15 1 1 A 86 86 HIS N N 86 117.087 120.453 -3.366 1
1 1130 . 15 1 1 A 87 87 ALA H H 87 7.197 8.169 -0.972 1
1 1131 . 15 1 1 A 87 87 ALA HA H 87 3.925 3.914 0.011 1
1 1135 . 15 1 1 A 87 87 ALA C C 87 179.038 180.392 -1.354 1
1 1136 . 15 1 1 A 87 87 ALA CA C 87 54.863 54.910 -0.047 1
1 1137 . 15 1 1 A 87 87 ALA CB C 87 17.034 18.249 -1.215 1
1 1138 . 15 1 1 A 87 87 ALA N N 87 121.510 120.965 0.545 1
1 1139 . 15 1 1 A 88 88 ILE H H 88 7.819 7.521 0.298 1
1 1140 . 15 1 1 A 88 88 ILE HA H 88 4.067 4.075 -0.008 1
1 1150 . 15 1 1 A 88 88 ILE C C 88 180.846 177.451 3.395 1
1 1151 . 15 1 1 A 88 88 ILE CA C 88 64.021 65.202 -1.181 1
1 1152 . 15 1 1 A 88 88 ILE CB C 88 37.557 37.441 0.116 1
1 1156 . 15 1 1 A 88 88 ILE N N 88 120.898 119.709 1.189 1
1 1157 . 15 1 1 A 89 89 ASP H H 89 7.808 8.162 -0.354 1
1 1158 . 15 1 1 A 89 89 ASP HA H 89 4.437 4.285 0.152 1
1 1161 . 15 1 1 A 89 89 ASP C C 89 178.033 178.369 -0.336 1
1 1162 . 15 1 1 A 89 89 ASP CA C 89 57.343 57.834 -0.491 1
1 1163 . 15 1 1 A 89 89 ASP CB C 89 39.689 41.582 -1.893 1
1 1164 . 15 1 1 A 89 89 ASP N N 89 125.174 121.756 3.418 1
1 1165 . 15 1 1 A 90 90 LEU H H 90 7.607 7.679 -0.072 1
1 1166 . 15 1 1 A 90 90 LEU HA H 90 4.198 4.186 0.012 1
1 1176 . 15 1 1 A 90 90 LEU C C 90 175.416 175.922 -0.506 1
1 1177 . 15 1 1 A 90 90 LEU CA C 90 54.755 54.998 -0.243 1
1 1178 . 15 1 1 A 90 90 LEU CB C 90 42.960 42.140 0.820 1
1 1182 . 15 1 1 A 90 90 LEU N N 90 117.576 117.352 0.224 1
1 1183 . 15 1 1 A 91 91 GLU H H 91 8.143 7.986 0.157 1
1 1184 . 15 1 1 A 91 91 GLU HA H 91 4.005 4.082 -0.077 1
1 1189 . 15 1 1 A 91 91 GLU C C 91 175.792 176.190 -0.398 1
1 1190 . 15 1 1 A 91 91 GLU CA C 91 57.202 57.617 -0.415 1
1 1191 . 15 1 1 A 91 91 GLU CB C 91 26.125 26.704 -0.579 1
1 1193 . 15 1 1 A 91 91 GLU N N 91 113.620 115.024 -1.404 1
1 1194 . 15 1 1 A 92 92 LEU H H 92 8.290 7.897 0.393 1
1 1195 . 15 1 1 A 92 92 LEU HA H 92 4.216 4.171 0.045 1
1 1205 . 15 1 1 A 92 92 LEU C C 92 176.622 176.991 -0.369 1
1 1206 . 15 1 1 A 92 92 LEU CA C 92 56.410 56.511 -0.101 1
1 1207 . 15 1 1 A 92 92 LEU CB C 92 43.378 42.432 0.946 1
1 1211 . 15 1 1 A 92 92 LEU N N 92 116.868 119.351 -2.483 1
1 1212 . 15 1 1 A 93 93 ILE H H 93 6.988 6.920 0.068 1
1 1213 . 15 1 1 A 93 93 ILE HA H 93 4.580 4.604 -0.024 1
1 1223 . 15 1 1 A 93 93 ILE C C 93 175.145 175.678 -0.533 1
1 1224 . 15 1 1 A 93 93 ILE CA C 93 58.707 58.483 0.224 1
1 1225 . 15 1 1 A 93 93 ILE CB C 93 42.864 41.580 1.284 1
1 1229 . 15 1 1 A 93 93 ILE N N 93 107.565 113.805 -6.240 1
1 1230 . 15 1 1 A 94 94 THR H H 94 8.742 8.430 0.312 1
1 1231 . 15 1 1 A 94 94 THR HA H 94 4.489 4.510 -0.021 1
1 1236 . 15 1 1 A 94 94 THR C C 94 173.875 174.515 -0.640 1
1 1237 . 15 1 1 A 94 94 THR CA C 94 61.842 61.727 0.115 1
1 1238 . 15 1 1 A 94 94 THR CB C 94 69.972 69.828 0.144 1
1 1240 . 15 1 1 A 94 94 THR N N 94 107.904 112.745 -4.841 1
1 1241 . 15 1 1 A 95 95 LYS H H 95 7.294 7.494 -0.200 1
1 1242 . 15 1 1 A 95 95 LYS HA H 95 4.566 4.853 -0.287 1
1 1251 . 15 1 1 A 95 95 LYS C C 95 173.791 174.229 -0.438 1
1 1252 . 15 1 1 A 95 95 LYS CA C 95 54.533 55.836 -1.303 1
1 1253 . 15 1 1 A 95 95 LYS CB C 95 35.123 36.041 -0.918 1
1 1257 . 15 1 1 A 95 95 LYS N N 95 119.458 121.529 -2.071 1
1 1258 . 15 1 1 A 96 96 ASN H H 96 9.157 8.787 0.370 1
1 1259 . 15 1 1 A 96 96 ASN HA H 96 4.408 5.361 -0.953 1
1 1264 . 15 1 1 A 96 96 ASN C C 96 176.653 175.621 1.032 1
1 1265 . 15 1 1 A 96 96 ASN CA C 96 51.088 51.284 -0.196 1
1 1266 . 15 1 1 A 96 96 ASN CB C 96 37.292 41.965 -4.673 1
1 1267 . 15 1 1 A 96 96 ASN N N 96 121.031 123.234 -2.203 1
1 1269 . 15 1 1 A 97 97 VAL H H 97 8.193 8.628 -0.435 1
1 1270 . 15 1 1 A 97 97 VAL HA H 97 4.019 4.058 -0.039 1
1 1278 . 15 1 1 A 97 97 VAL C C 97 175.089 176.525 -1.436 1
1 1279 . 15 1 1 A 97 97 VAL CA C 97 63.437 63.185 0.252 1
1 1280 . 15 1 1 A 97 97 VAL CB C 97 29.934 31.794 -1.860 1
1 1283 . 15 1 1 A 97 97 VAL N N 97 118.839 118.425 0.414 1
1 1284 . 15 1 1 A 98 98 ALA H H 98 7.994 7.759 0.235 1
1 1285 . 15 1 1 A 98 98 ALA HA H 98 5.108 4.220 0.888 1
1 1289 . 15 1 1 A 98 98 ALA C C 98 178.033 179.853 -1.820 1
1 1290 . 15 1 1 A 98 98 ALA CA C 98 50.342 53.727 -3.385 1
1 1291 . 15 1 1 A 98 98 ALA CB C 98 19.659 18.747 0.912 1
1 1292 . 15 1 1 A 98 98 ALA N N 98 121.031 125.222 -4.191 1
1 1293 . 15 1 1 A 99 99 ALA H H 99 7.347 7.553 -0.206 1
1 1294 . 15 1 1 A 99 99 ALA HA H 99 3.818 3.993 -0.175 1
1 1298 . 15 1 1 A 99 99 ALA C C 99 177.712 179.074 -1.362 1
1 1299 . 15 1 1 A 99 99 ALA CA C 99 55.117 54.893 0.224 1
1 1300 . 15 1 1 A 99 99 ALA CB C 99 18.879 18.610 0.269 1
1 1301 . 15 1 1 A 99 99 ALA N N 99 122.816 119.613 3.203 1
1 1302 . 15 1 1 A 100 100 LYS H H 100 8.190 7.850 0.340 1
1 1303 . 15 1 1 A 100 100 LYS HA H 100 4.483 4.339 0.144 1
1 1312 . 15 1 1 A 100 100 LYS C C 100 175.899 177.072 -1.173 1
1 1313 . 15 1 1 A 100 100 LYS CA C 100 54.231 57.423 -3.192 1
1 1314 . 15 1 1 A 100 100 LYS CB C 100 32.066 32.986 -0.920 1
1 1318 . 15 1 1 A 100 100 LYS N N 100 113.197 115.786 -2.589 1
1 1319 . 15 1 1 A 101 101 THR H H 101 7.128 7.726 -0.598 1
1 1320 . 15 1 1 A 101 101 THR HA H 101 3.834 4.351 -0.517 1
1 1325 . 15 1 1 A 101 101 THR C C 101 173.255 173.733 -0.478 1
1 1326 . 15 1 1 A 101 101 THR CA C 101 64.392 62.264 2.128 1
1 1327 . 15 1 1 A 101 101 THR CB C 101 69.160 67.861 1.299 1
1 1329 . 15 1 1 A 101 101 THR N N 101 118.368 116.352 2.016 1
1 1330 . 15 1 1 A 102 102 LYS H H 102 8.753 8.610 0.143 1
1 1331 . 15 1 1 A 102 102 LYS HA H 102 4.438 4.721 -0.283 1
1 1340 . 15 1 1 A 102 102 LYS C C 102 175.627 175.841 -0.214 1
1 1341 . 15 1 1 A 102 102 LYS CA C 102 55.117 54.303 0.814 1
1 1342 . 15 1 1 A 102 102 LYS CB C 102 33.901 33.808 0.093 1
1 1346 . 15 1 1 A 102 102 LYS N N 102 126.513 126.057 0.456 1
1 1347 . 15 1 1 A 103 103 LEU H H 103 8.602 8.193 0.409 1
1 1348 . 15 1 1 A 103 103 LEU HA H 103 4.486 4.396 0.090 1
1 1358 . 15 1 1 A 103 103 LEU CA C 103 52.233 53.199 -0.966 1
1 1359 . 15 1 1 A 103 103 LEU CB C 103 41.028 42.833 -1.805 1
1 1363 . 15 1 1 A 103 103 LEU N N 103 124.466 123.171 1.295 1
1 1364 . 15 1 1 A 104 104 PRO HA H 104 4.437 4.549 -0.112 1
1 1371 . 15 1 1 A 104 104 PRO C C 104 175.779 176.221 -0.442 1
1 1372 . 15 1 1 A 104 104 PRO CA C 104 62.322 62.809 -0.487 1
1 1373 . 15 1 1 A 104 104 PRO CB C 104 31.899 32.034 -0.135 1
1 1376 . 15 1 1 A 105 105 LYS H H 105 8.460 8.452 0.008 1
1 1377 . 15 1 1 A 105 105 LYS HA H 105 4.154 4.270 -0.116 1
1 1386 . 15 1 1 A 105 105 LYS C C 105 175.998 176.985 -0.987 1
1 1387 . 15 1 1 A 105 105 LYS CA C 105 56.480 55.589 0.891 1
1 1388 . 15 1 1 A 105 105 LYS CB C 105 32.909 31.348 1.561 1
1 1392 . 15 1 1 A 105 105 LYS N N 105 122.139 121.725 0.414 1
1 1393 . 15 1 1 A 106 106 ALA H H 106 8.448 8.233 0.215 1
1 1394 . 15 1 1 A 106 106 ALA HA H 106 4.309 4.594 -0.285 1
1 1398 . 15 1 1 A 106 106 ALA C C 106 176.828 176.530 0.298 1
1 1399 . 15 1 1 A 106 106 ALA CA C 106 51.862 51.504 0.358 1
1 1400 . 15 1 1 A 106 106 ALA CB C 106 19.323 21.279 -1.956 1
1 1401 . 15 1 1 A 106 106 ALA N N 106 125.278 125.495 -0.217 1
1 1402 . 15 1 1 A 107 107 ASP H H 107 8.428 7.857 0.571 1
1 1403 . 15 1 1 A 107 107 ASP HA H 107 4.574 4.896 -0.322 1
1 1406 . 15 1 1 A 107 107 ASP C C 107 175.951 175.595 0.356 1
1 1407 . 15 1 1 A 107 107 ASP CA C 107 54.214 53.380 0.834 1
1 1408 . 15 1 1 A 107 107 ASP CB C 107 41.141 42.440 -1.299 1
1 1409 . 15 1 1 A 107 107 ASP N N 107 120.771 120.094 0.677 1
1 1410 . 15 1 1 A 108 108 LYS H H 108 8.329 8.401 -0.072 1
1 1411 . 15 1 1 A 108 108 LYS HA H 108 4.203 4.417 -0.214 1
1 1420 . 15 1 1 A 108 108 LYS C C 108 176.483 175.310 1.173 1
1 1421 . 15 1 1 A 108 108 LYS CA C 108 56.831 55.395 1.436 1
1 1422 . 15 1 1 A 108 108 LYS CB C 108 32.648 31.115 1.533 1
1 1426 . 15 1 1 A 108 108 LYS N N 108 120.727 124.855 -4.128 1
1 1427 . 15 1 1 A 109 109 GLU H H 109 8.447 8.366 0.081 1
1 1428 . 15 1 1 A 109 109 GLU HA H 109 4.215 4.299 -0.084 1
1 1433 . 15 1 1 A 109 109 GLU C C 109 176.513 177.798 -1.285 1
1 1434 . 15 1 1 A 109 109 GLU CA C 109 56.936 56.635 0.301 1
1 1435 . 15 1 1 A 109 109 GLU CB C 109 29.833 30.029 -0.196 1
1 1437 . 15 1 1 A 109 109 GLU N N 109 121.471 123.784 -2.313 1
1 1438 . 15 1 1 A 110 110 GLU H H 110 8.352 8.803 -0.451 1
1 1439 . 15 1 1 A 110 110 GLU HA H 110 4.233 4.073 0.160 1
1 1444 . 15 1 1 A 110 110 GLU C C 110 176.439 178.050 -1.611 1
1 1445 . 15 1 1 A 110 110 GLU CA C 110 56.681 58.687 -2.006 1
1 1446 . 15 1 1 A 110 110 GLU CB C 110 29.860 28.892 0.968 1
1 1448 . 15 1 1 A 110 110 GLU N N 110 121.559 124.744 -3.185 1
1 1449 . 15 1 1 A 111 111 LEU H H 111 8.145 7.994 0.151 1
1 1450 . 15 1 1 A 111 111 LEU HA H 111 4.251 4.074 0.177 1
1 1460 . 15 1 1 A 111 111 LEU C C 111 177.306 179.066 -1.760 1
1 1461 . 15 1 1 A 111 111 LEU CA C 111 55.277 57.497 -2.220 1
1 1462 . 15 1 1 A 111 111 LEU CB C 111 42.054 40.983 1.071 1
1 1466 . 15 1 1 A 111 111 LEU N N 111 122.181 121.506 0.675 1
1 1467 . 15 1 1 A 112 112 GLU H H 112 8.212 7.956 0.256 1
1 1468 . 15 1 1 A 112 112 GLU N N 112 120.291 119.120 1.171 1
1 1469 . 15 1 1 A 114 114 HIS C C 114 176.070 174.578 1.492 1
1 1470 . 15 1 1 A 116 116 HIS H H 116 8.227 8.450 -0.223 1
1 1471 . 15 1 1 A 116 116 HIS C C 116 173.580 174.681 -1.101 1
1 1472 . 15 1 1 A 116 116 HIS N N 116 119.156 123.186 -4.030 1
1 5 . 16 1 1 A 3 3 PRO HA H 3 4.390 4.546 -0.156 1
1 12 . 16 1 1 A 3 3 PRO C C 3 176.847 176.339 0.508 1
1 13 . 16 1 1 A 3 3 PRO CA C 3 63.449 62.615 0.834 1
1 14 . 16 1 1 A 3 3 PRO CB C 3 31.938 32.160 -0.222 1
1 17 . 16 1 1 A 4 4 SER H H 4 8.531 8.556 -0.025 1
1 18 . 16 1 1 A 4 4 SER HA H 4 4.262 4.352 -0.090 1
1 21 . 16 1 1 A 4 4 SER C C 4 175.414 174.606 0.808 1
1 22 . 16 1 1 A 4 4 SER CA C 4 59.163 57.741 1.422 1
1 23 . 16 1 1 A 4 4 SER CB C 4 63.242 62.635 0.607 1
1 24 . 16 1 1 A 4 4 SER N N 4 114.246 118.150 -3.904 1
1 25 . 16 1 1 A 5 5 LYS H H 5 8.468 8.036 0.432 1
1 26 . 16 1 1 A 5 5 LYS HA H 5 4.433 4.448 -0.015 1
1 35 . 16 1 1 A 5 5 LYS C C 5 175.984 176.628 -0.644 1
1 36 . 16 1 1 A 5 5 LYS CA C 5 55.724 56.230 -0.506 1
1 37 . 16 1 1 A 5 5 LYS CB C 5 32.881 33.162 -0.281 1
1 41 . 16 1 1 A 5 5 LYS N N 5 123.488 126.854 -3.366 1
1 42 . 16 1 1 A 6 6 LEU H H 6 7.707 7.407 0.300 1
1 43 . 16 1 1 A 6 6 LEU HA H 6 4.381 4.377 0.004 1
1 53 . 16 1 1 A 6 6 LEU C C 6 177.820 175.736 2.084 1
1 54 . 16 1 1 A 6 6 LEU CA C 6 55.507 54.908 0.599 1
1 55 . 16 1 1 A 6 6 LEU CB C 6 43.374 42.749 0.625 1
1 59 . 16 1 1 A 6 6 LEU N N 6 121.233 123.396 -2.163 1
1 60 . 16 1 1 A 7 7 SER H H 7 9.433 8.922 0.511 1
1 61 . 16 1 1 A 7 7 SER HA H 7 4.638 4.657 -0.019 1
1 64 . 16 1 1 A 7 7 SER C C 7 174.120 175.055 -0.935 1
1 65 . 16 1 1 A 7 7 SER CA C 7 57.962 58.230 -0.268 1
1 66 . 16 1 1 A 7 7 SER CB C 7 64.197 64.385 -0.188 1
1 67 . 16 1 1 A 7 7 SER N N 7 122.977 121.971 1.006 1
1 68 . 16 1 1 A 8 8 TYR H H 8 9.764 9.303 0.461 1
1 69 . 16 1 1 A 8 8 TYR HA H 8 4.732 4.274 0.458 1
1 76 . 16 1 1 A 8 8 TYR C C 8 177.206 177.508 -0.302 1
1 77 . 16 1 1 A 8 8 TYR CA C 8 58.762 61.831 -3.069 1
1 78 . 16 1 1 A 8 8 TYR CB C 8 36.605 38.871 -2.266 1
1 83 . 16 1 1 A 8 8 TYR N N 8 123.312 128.859 -5.547 1
1 84 . 16 1 1 A 9 9 GLY H H 9 10.131 8.376 1.755 1
1 85 . 16 1 1 A 9 9 GLY HA2 H 9 3.983 3.651 0.332 1
1 86 . 16 1 1 A 9 9 GLY HA3 H 9 3.423 3.742 -0.319 1
1 87 . 16 1 1 A 9 9 GLY C C 9 175.163 176.159 -0.996 1
1 88 . 16 1 1 A 9 9 GLY CA C 9 47.153 47.471 -0.318 1
1 89 . 16 1 1 A 9 9 GLY N N 9 107.177 106.167 1.010 1
1 90 . 16 1 1 A 10 10 GLU H H 10 7.876 8.022 -0.146 1
1 91 . 16 1 1 A 10 10 GLU HA H 10 4.107 4.102 0.005 1
1 96 . 16 1 1 A 10 10 GLU C C 10 179.924 178.924 1.000 1
1 97 . 16 1 1 A 10 10 GLU CA C 10 58.890 59.447 -0.557 1
1 98 . 16 1 1 A 10 10 GLU CB C 10 29.750 29.458 0.292 1
1 100 . 16 1 1 A 10 10 GLU N N 10 122.219 121.783 0.436 1
1 101 . 16 1 1 A 11 11 TYR H H 11 8.384 8.312 0.072 1
1 102 . 16 1 1 A 11 11 TYR HA H 11 4.305 4.209 0.096 1
1 107 . 16 1 1 A 11 11 TYR C C 11 176.854 177.017 -0.163 1
1 108 . 16 1 1 A 11 11 TYR CA C 11 61.040 61.512 -0.472 1
1 109 . 16 1 1 A 11 11 TYR CB C 11 37.593 39.035 -1.442 1
1 112 . 16 1 1 A 11 11 TYR N N 11 120.809 122.990 -2.181 1
1 113 . 16 1 1 A 12 12 LEU H H 12 9.027 8.187 0.840 1
1 114 . 16 1 1 A 12 12 LEU HA H 12 3.778 3.754 0.024 1
1 124 . 16 1 1 A 12 12 LEU C C 12 178.621 179.566 -0.945 1
1 125 . 16 1 1 A 12 12 LEU CA C 12 57.534 57.440 0.094 1
1 126 . 16 1 1 A 12 12 LEU CB C 12 41.957 41.140 0.817 1
1 130 . 16 1 1 A 12 12 LEU N N 12 121.080 118.771 2.309 1
1 131 . 16 1 1 A 13 13 GLU H H 13 7.614 7.838 -0.224 1
1 132 . 16 1 1 A 13 13 GLU HA H 13 4.102 4.106 -0.004 1
1 137 . 16 1 1 A 13 13 GLU C C 13 178.449 179.180 -0.731 1
1 138 . 16 1 1 A 13 13 GLU CA C 13 59.609 59.691 -0.082 1
1 139 . 16 1 1 A 13 13 GLU CB C 13 29.124 29.441 -0.317 1
1 141 . 16 1 1 A 13 13 GLU N N 13 118.475 120.272 -1.797 1
1 142 . 16 1 1 A 14 14 SER H H 14 7.329 7.655 -0.326 1
1 143 . 16 1 1 A 14 14 SER HA H 14 4.358 4.231 0.127 1
1 146 . 16 1 1 A 14 14 SER C C 14 176.794 176.858 -0.064 1
1 147 . 16 1 1 A 14 14 SER CA C 14 61.064 61.409 -0.345 1
1 148 . 16 1 1 A 14 14 SER CB C 14 62.513 62.784 -0.271 1
1 149 . 16 1 1 A 14 14 SER N N 14 115.209 115.258 -0.049 1
1 150 . 16 1 1 A 15 15 TRP H H 15 8.870 8.016 0.854 1
1 151 . 16 1 1 A 15 15 TRP HA H 15 4.005 4.085 -0.080 1
1 160 . 16 1 1 A 15 15 TRP C C 15 177.547 177.912 -0.365 1
1 161 . 16 1 1 A 15 15 TRP CA C 15 61.210 61.098 0.112 1
1 162 . 16 1 1 A 15 15 TRP CB C 15 27.341 29.006 -1.665 1
1 168 . 16 1 1 A 15 15 TRP N N 15 124.998 123.559 1.439 1
1 170 . 16 1 1 A 16 16 PHE H H 16 9.087 8.247 0.840 1
1 171 . 16 1 1 A 16 16 PHE HA H 16 3.210 3.688 -0.478 1
1 179 . 16 1 1 A 16 16 PHE C C 16 175.909 177.730 -1.821 1
1 180 . 16 1 1 A 16 16 PHE CA C 16 61.473 61.418 0.055 1
1 181 . 16 1 1 A 16 16 PHE CB C 16 38.506 38.937 -0.431 1
1 187 . 16 1 1 A 16 16 PHE N N 16 119.825 120.644 -0.819 1
1 188 . 16 1 1 A 17 17 ASN H H 17 7.768 7.970 -0.202 1
1 189 . 16 1 1 A 17 17 ASN HA H 17 4.078 4.178 -0.100 1
1 194 . 16 1 1 A 17 17 ASN C C 17 176.604 177.345 -0.741 1
1 195 . 16 1 1 A 17 17 ASN CA C 17 55.621 56.313 -0.692 1
1 196 . 16 1 1 A 17 17 ASN CB C 17 37.830 38.029 -0.199 1
1 197 . 16 1 1 A 17 17 ASN N N 17 115.600 117.384 -1.784 1
1 199 . 16 1 1 A 18 18 THR H H 18 7.454 7.278 0.176 1
1 200 . 16 1 1 A 18 18 THR HA H 18 4.147 4.071 0.076 1
1 205 . 16 1 1 A 18 18 THR C C 18 175.692 176.013 -0.321 1
1 206 . 16 1 1 A 18 18 THR CA C 18 64.679 64.472 0.207 1
1 207 . 16 1 1 A 18 18 THR CB C 18 68.940 68.832 0.108 1
1 209 . 16 1 1 A 18 18 THR N N 18 113.049 115.490 -2.441 1
1 210 . 16 1 1 A 19 19 LYS H H 19 7.918 7.597 0.321 1
1 211 . 16 1 1 A 19 19 LYS HA H 19 3.791 3.552 0.239 1
1 220 . 16 1 1 A 19 19 LYS C C 19 178.120 178.719 -0.599 1
1 221 . 16 1 1 A 19 19 LYS CA C 19 55.985 58.721 -2.736 1
1 222 . 16 1 1 A 19 19 LYS CB C 19 31.130 30.997 0.133 1
1 226 . 16 1 1 A 19 19 LYS N N 19 122.614 120.959 1.655 1
1 227 . 16 1 1 A 20 20 ARG H H 20 7.845 7.618 0.227 1
1 228 . 16 1 1 A 20 20 ARG HA H 20 3.396 3.785 -0.389 1
1 236 . 16 1 1 A 20 20 ARG C C 20 175.601 178.848 -3.247 1
1 237 . 16 1 1 A 20 20 ARG CA C 20 58.182 59.024 -0.842 1
1 238 . 16 1 1 A 20 20 ARG CB C 20 28.045 29.686 -1.641 1
1 241 . 16 1 1 A 20 20 ARG N N 20 116.282 118.306 -2.024 1
1 243 . 16 1 1 A 21 21 HIS H H 21 7.163 7.615 -0.452 1
1 244 . 16 1 1 A 21 21 HIS HA H 21 4.500 4.213 0.287 1
1 249 . 16 1 1 A 21 21 HIS C C 21 175.618 176.531 -0.913 1
1 250 . 16 1 1 A 21 21 HIS CA C 21 56.912 59.190 -2.278 1
1 251 . 16 1 1 A 21 21 HIS CB C 21 29.400 29.745 -0.345 1
1 254 . 16 1 1 A 21 21 HIS N N 21 115.452 118.762 -3.310 1
1 255 . 16 1 1 A 22 22 SER H H 22 7.951 7.734 0.217 1
1 256 . 16 1 1 A 22 22 SER HA H 22 4.573 4.439 0.134 1
1 259 . 16 1 1 A 22 22 SER C C 22 173.948 174.235 -0.287 1
1 260 . 16 1 1 A 22 22 SER CA C 22 58.589 60.215 -1.626 1
1 261 . 16 1 1 A 22 22 SER CB C 22 64.228 64.316 -0.088 1
1 262 . 16 1 1 A 22 22 SER N N 22 113.209 112.528 0.681 1
1 263 . 16 1 1 A 23 23 VAL H H 23 7.179 7.217 -0.038 1
1 264 . 16 1 1 A 23 23 VAL HA H 23 4.626 4.498 0.128 1
1 272 . 16 1 1 A 23 23 VAL C C 23 175.397 176.091 -0.694 1
1 273 . 16 1 1 A 23 23 VAL CA C 23 59.556 60.246 -0.690 1
1 274 . 16 1 1 A 23 23 VAL CB C 23 33.810 34.115 -0.305 1
1 277 . 16 1 1 A 23 23 VAL N N 23 113.108 116.187 -3.079 1
1 278 . 16 1 1 A 24 24 GLY H H 24 8.189 8.441 -0.252 1
1 279 . 16 1 1 A 24 24 GLY HA2 H 24 4.074 4.038 0.036 1
1 280 . 16 1 1 A 24 24 GLY HA3 H 24 4.195 4.059 0.136 1
1 281 . 16 1 1 A 24 24 GLY C C 24 174.037 174.442 -0.405 1
1 282 . 16 1 1 A 24 24 GLY CA C 24 44.452 44.762 -0.310 1
1 283 . 16 1 1 A 24 24 GLY N N 24 108.374 109.405 -1.031 1
1 284 . 16 1 1 A 25 25 ILE H H 25 8.331 8.608 -0.277 1
1 285 . 16 1 1 A 25 25 ILE HA H 25 3.839 3.657 0.182 1
1 295 . 16 1 1 A 25 25 ILE C C 25 178.042 177.840 0.202 1
1 296 . 16 1 1 A 25 25 ILE CA C 25 64.238 64.542 -0.304 1
1 297 . 16 1 1 A 25 25 ILE CB C 25 37.931 37.666 0.265 1
1 301 . 16 1 1 A 25 25 ILE N N 25 119.895 119.245 0.650 1
1 302 . 16 1 1 A 26 26 GLN H H 26 8.545 8.583 -0.038 1
1 303 . 16 1 1 A 26 26 GLN HA H 26 4.129 4.048 0.081 1
1 310 . 16 1 1 A 26 26 GLN C C 26 178.454 178.131 0.323 1
1 311 . 16 1 1 A 26 26 GLN CA C 26 58.772 58.127 0.645 1
1 312 . 16 1 1 A 26 26 GLN CB C 26 27.346 28.159 -0.813 1
1 314 . 16 1 1 A 26 26 GLN N N 26 120.013 119.875 0.138 1
1 316 . 16 1 1 A 27 27 THR H H 27 7.944 8.061 -0.117 1
1 317 . 16 1 1 A 27 27 THR HA H 27 3.953 3.877 0.076 1
1 322 . 16 1 1 A 27 27 THR C C 27 175.818 176.119 -0.301 1
1 323 . 16 1 1 A 27 27 THR CA C 27 65.855 66.329 -0.474 1
1 324 . 16 1 1 A 27 27 THR CB C 27 68.127 68.547 -0.420 1
1 326 . 16 1 1 A 27 27 THR N N 27 117.645 116.771 0.874 1
1 327 . 16 1 1 A 28 28 ALA H H 28 8.593 8.242 0.351 1
1 328 . 16 1 1 A 28 28 ALA HA H 28 3.899 4.152 -0.253 1
1 332 . 16 1 1 A 28 28 ALA C C 28 178.515 179.941 -1.426 1
1 333 . 16 1 1 A 28 28 ALA CA C 28 55.742 55.340 0.402 1
1 334 . 16 1 1 A 28 28 ALA CB C 28 17.513 18.376 -0.863 1
1 335 . 16 1 1 A 28 28 ALA N N 28 123.917 123.543 0.374 1
1 336 . 16 1 1 A 29 29 LYS H H 29 7.800 7.862 -0.062 1
1 337 . 16 1 1 A 29 29 LYS HA H 29 3.982 3.915 0.067 1
1 346 . 16 1 1 A 29 29 LYS C C 29 179.527 179.014 0.513 1
1 347 . 16 1 1 A 29 29 LYS CA C 29 59.761 59.632 0.129 1
1 348 . 16 1 1 A 29 29 LYS CB C 29 32.223 32.362 -0.139 1
1 352 . 16 1 1 A 29 29 LYS N N 29 117.474 118.862 -1.388 1
1 353 . 16 1 1 A 30 30 VAL H H 30 7.591 7.085 0.506 1
1 354 . 16 1 1 A 30 30 VAL HA H 30 3.503 3.350 0.153 1
1 362 . 16 1 1 A 30 30 VAL C C 30 178.389 177.533 0.856 1
1 363 . 16 1 1 A 30 30 VAL CA C 30 65.640 65.895 -0.255 1
1 364 . 16 1 1 A 30 30 VAL CB C 30 31.644 31.636 0.008 1
1 367 . 16 1 1 A 30 30 VAL N N 30 121.749 120.225 1.524 1
1 368 . 16 1 1 A 31 31 LEU H H 31 8.333 8.222 0.111 1
1 369 . 16 1 1 A 31 31 LEU HA H 31 4.074 4.104 -0.030 1
1 379 . 16 1 1 A 31 31 LEU C C 31 177.780 179.483 -1.703 1
1 380 . 16 1 1 A 31 31 LEU CA C 31 58.157 58.394 -0.237 1
1 381 . 16 1 1 A 31 31 LEU CB C 31 42.230 41.427 0.803 1
1 385 . 16 1 1 A 31 31 LEU N N 31 120.901 119.416 1.485 1
1 386 . 16 1 1 A 32 32 LYS H H 32 8.562 8.090 0.472 1
1 387 . 16 1 1 A 32 32 LYS HA H 32 3.290 3.686 -0.396 1
1 395 . 16 1 1 A 32 32 LYS C C 32 178.037 178.939 -0.902 1
1 396 . 16 1 1 A 32 32 LYS CA C 32 58.911 59.471 -0.560 1
1 397 . 16 1 1 A 32 32 LYS CB C 32 31.605 31.303 0.302 1
1 401 . 16 1 1 A 32 32 LYS N N 32 119.075 119.342 -0.267 1
1 402 . 16 1 1 A 33 33 GLY H H 33 7.694 8.064 -0.370 1
1 403 . 16 1 1 A 33 33 GLY HA2 H 33 3.949 3.710 0.239 1
1 404 . 16 1 1 A 33 33 GLY HA3 H 33 3.826 3.781 0.045 1
1 405 . 16 1 1 A 33 33 GLY C C 33 177.101 176.389 0.712 1
1 406 . 16 1 1 A 33 33 GLY CA C 33 46.928 46.852 0.076 1
1 407 . 16 1 1 A 33 33 GLY N N 33 105.282 106.783 -1.501 1
1 408 . 16 1 1 A 34 34 TYR H H 34 8.015 7.704 0.311 1
1 409 . 16 1 1 A 34 34 TYR HA H 34 4.558 4.706 -0.148 1
1 416 . 16 1 1 A 34 34 TYR C C 34 179.611 178.096 1.515 1
1 417 . 16 1 1 A 34 34 TYR CA C 34 59.349 60.370 -1.021 1
1 418 . 16 1 1 A 34 34 TYR CB C 34 37.344 38.697 -1.353 1
1 423 . 16 1 1 A 34 34 TYR N N 34 121.781 121.499 0.282 1
1 424 . 16 1 1 A 35 35 LEU H H 35 8.689 8.282 0.407 1
1 425 . 16 1 1 A 35 35 LEU HA H 35 3.977 3.916 0.061 1
1 435 . 16 1 1 A 35 35 LEU C C 35 177.081 179.019 -1.938 1
1 436 . 16 1 1 A 35 35 LEU CA C 35 59.155 58.405 0.750 1
1 437 . 16 1 1 A 35 35 LEU CB C 35 41.103 41.744 -0.641 1
1 441 . 16 1 1 A 35 35 LEU N N 35 120.392 120.582 -0.190 1
1 442 . 16 1 1 A 36 36 ASN H H 36 8.721 8.562 0.159 1
1 443 . 16 1 1 A 36 36 ASN HA H 36 4.435 4.416 0.019 1
1 448 . 16 1 1 A 36 36 ASN C C 36 176.792 177.655 -0.863 1
1 449 . 16 1 1 A 36 36 ASN CA C 36 55.642 55.836 -0.194 1
1 450 . 16 1 1 A 36 36 ASN CB C 36 38.319 37.264 1.055 1
1 451 . 16 1 1 A 36 36 ASN N N 36 114.623 115.913 -1.290 1
1 453 . 16 1 1 A 37 37 SER H H 37 8.511 7.933 0.578 1
1 454 . 16 1 1 A 37 37 SER HA H 37 4.642 4.287 0.355 1
1 457 . 16 1 1 A 37 37 SER C C 37 175.039 176.434 -1.395 1
1 458 . 16 1 1 A 37 37 SER CA C 37 59.825 61.340 -1.515 1
1 459 . 16 1 1 A 37 37 SER CB C 37 64.056 62.995 1.061 1
1 460 . 16 1 1 A 37 37 SER N N 37 110.941 114.936 -3.995 1
1 461 . 16 1 1 A 38 38 ARG H H 38 7.242 8.146 -0.904 1
1 462 . 16 1 1 A 38 38 ARG HA H 38 4.919 4.441 0.478 1
1 469 . 16 1 1 A 38 38 ARG C C 38 176.514 178.256 -1.742 1
1 470 . 16 1 1 A 38 38 ARG CA C 38 56.687 58.020 -1.333 1
1 471 . 16 1 1 A 38 38 ARG CB C 38 32.434 31.376 1.058 1
1 474 . 16 1 1 A 38 38 ARG N N 38 117.062 120.410 -3.348 1
1 475 . 16 1 1 A 39 39 ILE H H 39 8.462 7.888 0.574 1
1 476 . 16 1 1 A 39 39 ILE HA H 39 3.618 4.055 -0.437 1
1 486 . 16 1 1 A 39 39 ILE C C 39 176.267 178.450 -2.183 1
1 487 . 16 1 1 A 39 39 ILE CA C 39 66.134 64.752 1.382 1
1 488 . 16 1 1 A 39 39 ILE CB C 39 39.787 37.439 2.348 1
1 492 . 16 1 1 A 39 39 ILE N N 39 121.214 120.520 0.694 1
1 493 . 16 1 1 A 40 40 ILE H H 40 9.339 8.207 1.132 1
1 494 . 16 1 1 A 40 40 ILE HA H 40 3.401 3.796 -0.395 1
1 504 . 16 1 1 A 40 40 ILE CA C 40 67.844 66.291 1.553 1
1 505 . 16 1 1 A 40 40 ILE CB C 40 34.406 35.271 -0.865 1
1 509 . 16 1 1 A 40 40 ILE N N 40 119.695 121.427 -1.732 1
1 510 . 16 1 1 A 41 41 PRO HA H 41 4.314 4.402 -0.088 1
1 517 . 16 1 1 A 41 41 PRO C C 41 177.418 178.743 -1.325 1
1 518 . 16 1 1 A 41 41 PRO CA C 41 65.912 65.636 0.276 1
1 519 . 16 1 1 A 41 41 PRO CB C 41 30.686 30.947 -0.261 1
1 522 . 16 1 1 A 42 42 SER H H 42 6.857 7.859 -1.002 1
1 523 . 16 1 1 A 42 42 SER HA H 42 4.558 4.452 0.106 1
1 526 . 16 1 1 A 42 42 SER C C 42 174.813 176.478 -1.665 1
1 527 . 16 1 1 A 42 42 SER CA C 42 61.279 60.754 0.525 1
1 528 . 16 1 1 A 42 42 SER CB C 42 64.285 64.135 0.150 1
1 529 . 16 1 1 A 42 42 SER N N 42 108.994 112.855 -3.861 1
1 530 . 16 1 1 A 43 43 LEU H H 43 8.230 8.135 0.095 1
1 531 . 16 1 1 A 43 43 LEU HA H 43 4.572 4.456 0.116 1
1 541 . 16 1 1 A 43 43 LEU C C 43 177.301 178.654 -1.353 1
1 542 . 16 1 1 A 43 43 LEU CA C 43 54.113 55.287 -1.174 1
1 543 . 16 1 1 A 43 43 LEU CB C 43 44.800 42.514 2.286 1
1 547 . 16 1 1 A 43 43 LEU N N 43 118.715 119.945 -1.230 1
1 548 . 16 1 1 A 44 44 GLY H H 44 8.498 8.446 0.052 1
1 549 . 16 1 1 A 44 44 GLY HA2 H 44 4.010 3.697 0.313 1
1 550 . 16 1 1 A 44 44 GLY HA3 H 44 3.613 3.743 -0.130 1
1 551 . 16 1 1 A 44 44 GLY C C 44 174.178 176.035 -1.857 1
1 552 . 16 1 1 A 44 44 GLY CA C 44 46.271 47.287 -1.016 1
1 553 . 16 1 1 A 44 44 GLY N N 44 105.371 107.573 -2.202 1
1 554 . 16 1 1 A 45 45 ASN H H 45 8.385 7.578 0.807 1
1 555 . 16 1 1 A 45 45 ASN HA H 45 4.789 4.551 0.238 1
1 560 . 16 1 1 A 45 45 ASN C C 45 175.386 176.579 -1.193 1
1 561 . 16 1 1 A 45 45 ASN CA C 45 53.144 55.458 -2.314 1
1 562 . 16 1 1 A 45 45 ASN CB C 45 37.928 38.111 -0.183 1
1 563 . 16 1 1 A 45 45 ASN N N 45 114.387 118.774 -4.387 1
1 565 . 16 1 1 A 46 46 ILE H H 46 7.465 7.599 -0.134 1
1 566 . 16 1 1 A 46 46 ILE HA H 46 3.856 4.039 -0.183 1
1 576 . 16 1 1 A 46 46 ILE C C 46 175.997 176.204 -0.207 1
1 577 . 16 1 1 A 46 46 ILE CA C 46 60.853 62.100 -1.247 1
1 578 . 16 1 1 A 46 46 ILE CB C 46 38.042 38.343 -0.301 1
1 582 . 16 1 1 A 46 46 ILE N N 46 123.998 120.746 3.252 1
1 583 . 16 1 1 A 47 47 LYS H H 47 8.717 8.756 -0.039 1
1 584 . 16 1 1 A 47 47 LYS HA H 47 4.249 4.363 -0.114 1
1 591 . 16 1 1 A 47 47 LYS C C 47 177.583 177.716 -0.133 1
1 592 . 16 1 1 A 47 47 LYS CA C 47 56.320 56.384 -0.064 1
1 593 . 16 1 1 A 47 47 LYS CB C 47 30.393 32.964 -2.571 1
1 596 . 16 1 1 A 47 47 LYS N N 47 126.114 124.867 1.247 1
1 597 . 16 1 1 A 48 48 LEU H H 48 8.323 8.708 -0.385 1
1 598 . 16 1 1 A 48 48 LEU HA H 48 3.691 4.004 -0.313 1
1 608 . 16 1 1 A 48 48 LEU C C 48 177.274 178.353 -1.079 1
1 609 . 16 1 1 A 48 48 LEU CA C 48 58.443 58.065 0.378 1
1 610 . 16 1 1 A 48 48 LEU CB C 48 42.282 41.238 1.044 1
1 614 . 16 1 1 A 48 48 LEU N N 48 125.857 126.264 -0.407 1
1 615 . 16 1 1 A 49 49 ALA H H 49 8.929 7.897 1.032 1
1 616 . 16 1 1 A 49 49 ALA HA H 49 4.067 4.028 0.039 1
1 620 . 16 1 1 A 49 49 ALA C C 49 177.468 178.612 -1.144 1
1 621 . 16 1 1 A 49 49 ALA CA C 49 53.092 54.672 -1.580 1
1 622 . 16 1 1 A 49 49 ALA CB C 49 18.562 18.218 0.344 1
1 623 . 16 1 1 A 49 49 ALA N N 49 115.543 120.596 -5.053 1
1 624 . 16 1 1 A 50 50 LYS H H 50 7.684 7.578 0.106 1
1 625 . 16 1 1 A 50 50 LYS HA H 50 4.395 4.311 0.084 1
1 634 . 16 1 1 A 50 50 LYS C C 50 174.958 176.829 -1.871 1
1 635 . 16 1 1 A 50 50 LYS CA C 50 53.977 57.001 -3.024 1
1 636 . 16 1 1 A 50 50 LYS CB C 50 32.645 32.733 -0.088 1
1 640 . 16 1 1 A 50 50 LYS N N 50 114.788 115.045 -0.257 1
1 641 . 16 1 1 A 51 51 LEU H H 51 6.776 6.905 -0.129 1
1 642 . 16 1 1 A 51 51 LEU HA H 51 4.569 3.925 0.644 1
1 652 . 16 1 1 A 51 51 LEU C C 51 177.953 175.575 2.378 1
1 653 . 16 1 1 A 51 51 LEU CA C 51 55.318 54.956 0.362 1
1 654 . 16 1 1 A 51 51 LEU CB C 51 43.182 41.427 1.755 1
1 658 . 16 1 1 A 51 51 LEU N N 51 121.408 121.716 -0.308 1
1 659 . 16 1 1 A 52 52 THR H H 52 10.680 7.417 3.263 1
1 660 . 16 1 1 A 52 52 THR HA H 52 4.938 4.643 0.295 1
1 665 . 16 1 1 A 52 52 THR C C 52 175.553 174.597 0.956 1
1 666 . 16 1 1 A 52 52 THR CA C 52 59.740 59.468 0.272 1
1 667 . 16 1 1 A 52 52 THR CB C 52 73.557 71.527 2.030 1
1 669 . 16 1 1 A 52 52 THR N N 52 119.481 119.541 -0.060 1
1 670 . 16 1 1 A 53 53 SER H H 53 9.278 9.161 0.117 1
1 671 . 16 1 1 A 53 53 SER HA H 53 4.261 4.169 0.092 1
1 674 . 16 1 1 A 53 53 SER C C 53 176.990 176.174 0.816 1
1 675 . 16 1 1 A 53 53 SER CA C 53 61.025 62.141 -1.116 1
1 676 . 16 1 1 A 53 53 SER CB C 53 62.312 63.076 -0.764 1
1 677 . 16 1 1 A 53 53 SER N N 53 116.343 120.475 -4.132 1
1 678 . 16 1 1 A 54 54 LEU H H 54 7.808 8.077 -0.269 1
1 679 . 16 1 1 A 54 54 LEU HA H 54 4.229 4.082 0.147 1
1 688 . 16 1 1 A 54 54 LEU C C 54 178.505 178.902 -0.397 1
1 689 . 16 1 1 A 54 54 LEU CA C 54 57.719 58.062 -0.343 1
1 690 . 16 1 1 A 54 54 LEU CB C 54 40.997 41.675 -0.678 1
1 694 . 16 1 1 A 54 54 LEU N N 54 126.055 122.787 3.268 1
1 695 . 16 1 1 A 55 55 HIS H H 55 7.798 8.369 -0.571 1
1 696 . 16 1 1 A 55 55 HIS HA H 55 4.311 4.378 -0.067 1
1 701 . 16 1 1 A 55 55 HIS C C 55 180.044 177.808 2.236 1
1 702 . 16 1 1 A 55 55 HIS CA C 55 60.583 59.529 1.054 1
1 703 . 16 1 1 A 55 55 HIS CB C 55 31.445 29.699 1.746 1
1 706 . 16 1 1 A 55 55 HIS N N 55 118.683 117.905 0.778 1
1 707 . 16 1 1 A 56 56 MET H H 56 7.375 7.794 -0.419 1
1 708 . 16 1 1 A 56 56 MET HA H 56 4.513 4.161 0.352 1
1 716 . 16 1 1 A 56 56 MET C C 56 177.169 178.361 -1.192 1
1 717 . 16 1 1 A 56 56 MET CA C 56 55.823 58.812 -2.989 1
1 718 . 16 1 1 A 56 56 MET CB C 56 31.303 32.057 -0.754 1
1 721 . 16 1 1 A 56 56 MET N N 56 114.530 117.988 -3.458 1
1 722 . 16 1 1 A 57 57 GLN H H 57 8.387 8.312 0.075 1
1 723 . 16 1 1 A 57 57 GLN HA H 57 3.981 4.003 -0.022 1
1 730 . 16 1 1 A 57 57 GLN C C 57 178.033 178.078 -0.045 1
1 731 . 16 1 1 A 57 57 GLN CA C 57 57.922 59.456 -1.534 1
1 732 . 16 1 1 A 57 57 GLN CB C 57 29.012 28.662 0.350 1
1 734 . 16 1 1 A 57 57 GLN N N 57 120.713 120.499 0.214 1
1 736 . 16 1 1 A 58 58 ASN H H 58 8.765 8.422 0.343 1
1 737 . 16 1 1 A 58 58 ASN HA H 58 4.539 4.462 0.077 1
1 742 . 16 1 1 A 58 58 ASN C C 58 178.084 177.583 0.501 1
1 743 . 16 1 1 A 58 58 ASN CA C 58 55.345 56.275 -0.930 1
1 744 . 16 1 1 A 58 58 ASN CB C 58 36.924 37.930 -1.006 1
1 745 . 16 1 1 A 58 58 ASN N N 58 117.390 117.938 -0.548 1
1 747 . 16 1 1 A 59 59 TYR H H 59 8.239 7.927 0.312 1
1 748 . 16 1 1 A 59 59 TYR HA H 59 4.586 4.113 0.473 1
1 755 . 16 1 1 A 59 59 TYR C C 59 178.015 176.891 1.124 1
1 756 . 16 1 1 A 59 59 TYR CA C 59 60.779 61.487 -0.708 1
1 757 . 16 1 1 A 59 59 TYR CB C 59 38.047 38.626 -0.579 1
1 762 . 16 1 1 A 59 59 TYR N N 59 122.335 123.031 -0.696 1
1 763 . 16 1 1 A 60 60 VAL H H 60 8.416 8.331 0.085 1
1 764 . 16 1 1 A 60 60 VAL HA H 60 3.244 3.562 -0.318 1
1 772 . 16 1 1 A 60 60 VAL C C 60 177.309 178.275 -0.966 1
1 773 . 16 1 1 A 60 60 VAL CA C 60 67.022 66.543 0.479 1
1 774 . 16 1 1 A 60 60 VAL CB C 60 30.929 31.516 -0.587 1
1 777 . 16 1 1 A 60 60 VAL N N 60 119.842 119.671 0.171 1
1 778 . 16 1 1 A 61 61 ASN H H 61 8.264 8.157 0.107 1
1 779 . 16 1 1 A 61 61 ASN HA H 61 4.305 4.487 -0.182 1
1 784 . 16 1 1 A 61 61 ASN C C 61 177.263 178.391 -1.128 1
1 785 . 16 1 1 A 61 61 ASN CA C 61 55.548 55.977 -0.429 1
1 786 . 16 1 1 A 61 61 ASN CB C 61 36.645 37.681 -1.036 1
1 787 . 16 1 1 A 61 61 ASN N N 61 119.103 119.979 -0.876 1
1 789 . 16 1 1 A 62 62 SER H H 62 8.143 7.985 0.158 1
1 790 . 16 1 1 A 62 62 SER HA H 62 4.343 4.306 0.037 1
1 793 . 16 1 1 A 62 62 SER C C 62 176.409 175.997 0.412 1
1 794 . 16 1 1 A 62 62 SER CA C 62 61.612 62.369 -0.757 1
1 795 . 16 1 1 A 62 62 SER CB C 62 62.219 63.120 -0.901 1
1 796 . 16 1 1 A 62 62 SER N N 62 118.254 117.924 0.330 1
1 797 . 16 1 1 A 63 63 LEU H H 63 7.664 8.056 -0.392 1
1 798 . 16 1 1 A 63 63 LEU HA H 63 4.003 3.825 0.178 1
1 808 . 16 1 1 A 63 63 LEU C C 63 178.748 179.084 -0.336 1
1 809 . 16 1 1 A 63 63 LEU CA C 63 57.171 57.865 -0.694 1
1 810 . 16 1 1 A 63 63 LEU CB C 63 41.134 40.608 0.526 1
1 814 . 16 1 1 A 63 63 LEU N N 63 123.812 120.760 3.052 1
1 815 . 16 1 1 A 64 64 ARG H H 64 7.969 7.491 0.478 1
1 816 . 16 1 1 A 64 64 ARG HA H 64 4.038 3.870 0.168 1
1 824 . 16 1 1 A 64 64 ARG C C 64 180.797 178.313 2.484 1
1 825 . 16 1 1 A 64 64 ARG CA C 64 58.598 59.951 -1.353 1
1 826 . 16 1 1 A 64 64 ARG CB C 64 28.849 30.072 -1.223 1
1 829 . 16 1 1 A 64 64 ARG N N 64 120.376 121.354 -0.978 1
1 831 . 16 1 1 A 65 65 ASP H H 65 8.465 8.199 0.266 1
1 832 . 16 1 1 A 65 65 ASP HA H 65 4.408 4.372 0.036 1
1 835 . 16 1 1 A 65 65 ASP C C 65 177.336 177.492 -0.156 1
1 836 . 16 1 1 A 65 65 ASP CA C 65 56.957 55.108 1.849 1
1 837 . 16 1 1 A 65 65 ASP CB C 65 39.602 39.564 0.038 1
1 838 . 16 1 1 A 65 65 ASP N N 65 122.402 115.989 6.413 1
1 839 . 16 1 1 A 66 66 GLU H H 66 7.703 7.767 -0.064 1
1 840 . 16 1 1 A 66 66 GLU HA H 66 4.213 4.280 -0.067 1
1 845 . 16 1 1 A 66 66 GLU C C 66 176.586 177.482 -0.896 1
1 846 . 16 1 1 A 66 66 GLU CA C 66 56.974 56.439 0.535 1
1 847 . 16 1 1 A 66 66 GLU CB C 66 29.821 30.148 -0.327 1
1 849 . 16 1 1 A 66 66 GLU N N 66 119.076 117.783 1.293 1
1 850 . 16 1 1 A 67 67 GLY H H 67 7.861 7.679 0.182 1
1 851 . 16 1 1 A 67 67 GLY HA2 H 67 4.269 3.937 0.332 1
1 852 . 16 1 1 A 67 67 GLY HA3 H 67 3.731 3.942 -0.211 1
1 853 . 16 1 1 A 67 67 GLY C C 67 174.614 174.995 -0.381 1
1 854 . 16 1 1 A 67 67 GLY CA C 67 44.608 46.468 -1.860 1
1 855 . 16 1 1 A 67 67 GLY N N 67 105.730 109.271 -3.541 1
1 856 . 16 1 1 A 68 68 LEU H H 68 7.324 7.825 -0.501 1
1 857 . 16 1 1 A 68 68 LEU HA H 68 4.257 4.203 0.054 1
1 867 . 16 1 1 A 68 68 LEU C C 68 176.136 176.782 -0.646 1
1 868 . 16 1 1 A 68 68 LEU CA C 68 55.659 54.525 1.134 1
1 869 . 16 1 1 A 68 68 LEU CB C 68 41.874 41.937 -0.063 1
1 873 . 16 1 1 A 68 68 LEU N N 68 121.062 121.265 -0.203 1
1 874 . 16 1 1 A 69 69 LYS H H 69 8.368 8.429 -0.061 1
1 875 . 16 1 1 A 69 69 LYS HA H 69 4.281 4.395 -0.114 1
1 884 . 16 1 1 A 69 69 LYS C C 69 177.940 177.673 0.267 1
1 885 . 16 1 1 A 69 69 LYS CA C 69 55.412 56.132 -0.720 1
1 886 . 16 1 1 A 69 69 LYS CB C 69 32.761 33.236 -0.475 1
1 890 . 16 1 1 A 69 69 LYS N N 69 120.120 122.759 -2.639 1
1 891 . 16 1 1 A 70 70 ARG H H 70 9.095 8.857 0.238 1
1 892 . 16 1 1 A 70 70 ARG HA H 70 3.684 4.103 -0.419 1
1 900 . 16 1 1 A 70 70 ARG C C 70 177.712 178.615 -0.903 1
1 901 . 16 1 1 A 70 70 ARG CA C 70 60.216 58.443 1.773 1
1 902 . 16 1 1 A 70 70 ARG CB C 70 29.539 29.864 -0.325 1
1 905 . 16 1 1 A 70 70 ARG N N 70 123.339 119.579 3.760 1
1 907 . 16 1 1 A 71 71 GLY H H 71 8.985 8.363 0.622 1
1 908 . 16 1 1 A 71 71 GLY HA2 H 71 3.932 3.676 0.256 1
1 909 . 16 1 1 A 71 71 GLY HA3 H 71 3.905 3.680 0.225 1
1 910 . 16 1 1 A 71 71 GLY C C 71 176.324 175.837 0.487 1
1 911 . 16 1 1 A 71 71 GLY CA C 71 46.752 47.483 -0.731 1
1 912 . 16 1 1 A 71 71 GLY N N 71 104.509 108.825 -4.316 1
1 913 . 16 1 1 A 72 72 THR H H 72 7.295 8.032 -0.737 1
1 914 . 16 1 1 A 72 72 THR HA H 72 4.014 3.954 0.060 1
1 919 . 16 1 1 A 72 72 THR C C 72 175.135 176.021 -0.886 1
1 920 . 16 1 1 A 72 72 THR CA C 72 65.848 66.475 -0.627 1
1 921 . 16 1 1 A 72 72 THR CB C 72 68.160 67.927 0.233 1
1 923 . 16 1 1 A 72 72 THR N N 72 118.617 117.609 1.008 1
1 924 . 16 1 1 A 73 73 ILE H H 73 7.883 7.892 -0.009 1
1 925 . 16 1 1 A 73 73 ILE HA H 73 3.258 3.578 -0.320 1
1 935 . 16 1 1 A 73 73 ILE C C 73 177.060 178.317 -1.257 1
1 936 . 16 1 1 A 73 73 ILE CA C 73 66.561 65.628 0.933 1
1 937 . 16 1 1 A 73 73 ILE CB C 73 37.339 37.791 -0.452 1
1 941 . 16 1 1 A 73 73 ILE N N 73 121.692 121.633 0.059 1
1 942 . 16 1 1 A 74 74 GLU H H 74 8.723 8.036 0.687 1
1 943 . 16 1 1 A 74 74 GLU HA H 74 3.807 3.983 -0.176 1
1 948 . 16 1 1 A 74 74 GLU C C 74 178.319 179.073 -0.754 1
1 949 . 16 1 1 A 74 74 GLU CA C 74 59.637 59.677 -0.040 1
1 950 . 16 1 1 A 74 74 GLU CB C 74 29.257 29.090 0.167 1
1 952 . 16 1 1 A 74 74 GLU N N 74 117.701 120.646 -2.945 1
1 953 . 16 1 1 A 75 75 LYS H H 75 7.361 7.631 -0.270 1
1 954 . 16 1 1 A 75 75 LYS HA H 75 3.958 4.079 -0.121 1
1 963 . 16 1 1 A 75 75 LYS C C 75 178.554 179.399 -0.845 1
1 964 . 16 1 1 A 75 75 LYS CA C 75 59.764 59.392 0.372 1
1 965 . 16 1 1 A 75 75 LYS CB C 75 32.314 32.452 -0.138 1
1 969 . 16 1 1 A 75 75 LYS N N 75 118.734 119.279 -0.545 1
1 970 . 16 1 1 A 76 76 ILE H H 76 7.713 7.692 0.021 1
1 971 . 16 1 1 A 76 76 ILE HA H 76 3.221 3.838 -0.617 1
1 981 . 16 1 1 A 76 76 ILE C C 76 177.504 178.196 -0.692 1
1 982 . 16 1 1 A 76 76 ILE CA C 76 65.796 64.458 1.338 1
1 983 . 16 1 1 A 76 76 ILE CB C 76 37.732 37.065 0.667 1
1 987 . 16 1 1 A 76 76 ILE N N 76 120.312 116.194 4.118 1
1 988 . 16 1 1 A 77 77 ILE H H 77 8.587 8.143 0.444 1
1 989 . 16 1 1 A 77 77 ILE HA H 77 3.778 3.561 0.217 1
1 999 . 16 1 1 A 77 77 ILE C C 77 177.074 178.220 -1.146 1
1 1000 . 16 1 1 A 77 77 ILE CA C 77 63.168 65.361 -2.193 1
1 1001 . 16 1 1 A 77 77 ILE CB C 77 36.617 37.814 -1.197 1
1 1005 . 16 1 1 A 77 77 ILE N N 77 118.978 121.271 -2.293 1
1 1006 . 16 1 1 A 78 78 LYS H H 78 8.050 7.582 0.468 1
1 1007 . 16 1 1 A 78 78 LYS HA H 78 3.925 4.088 -0.163 1
1 1016 . 16 1 1 A 78 78 LYS C C 78 178.291 178.946 -0.655 1
1 1017 . 16 1 1 A 78 78 LYS CA C 78 60.192 59.073 1.119 1
1 1018 . 16 1 1 A 78 78 LYS CB C 78 31.886 31.738 0.148 1
1 1022 . 16 1 1 A 78 78 LYS N N 78 121.618 119.346 2.272 1
1 1023 . 16 1 1 A 79 79 VAL H H 79 7.619 7.874 -0.255 1
1 1024 . 16 1 1 A 79 79 VAL HA H 79 3.846 3.724 0.122 1
1 1032 . 16 1 1 A 79 79 VAL C C 79 177.712 178.146 -0.434 1
1 1033 . 16 1 1 A 79 79 VAL CA C 79 66.494 66.281 0.213 1
1 1034 . 16 1 1 A 79 79 VAL CB C 79 31.298 31.682 -0.384 1
1 1037 . 16 1 1 A 79 79 VAL N N 79 120.254 119.717 0.537 1
1 1038 . 16 1 1 A 80 80 ILE H H 80 7.885 8.118 -0.233 1
1 1039 . 16 1 1 A 80 80 ILE HA H 80 3.367 3.442 -0.075 1
1 1049 . 16 1 1 A 80 80 ILE C C 80 179.892 177.751 2.141 1
1 1050 . 16 1 1 A 80 80 ILE CA C 80 65.343 65.218 0.125 1
1 1051 . 16 1 1 A 80 80 ILE CB C 80 38.129 37.384 0.745 1
1 1055 . 16 1 1 A 80 80 ILE N N 80 119.666 120.439 -0.773 1
1 1056 . 16 1 1 A 81 81 ARG H H 81 9.384 8.370 1.014 1
1 1057 . 16 1 1 A 81 81 ARG HA H 81 3.834 3.915 -0.081 1
1 1065 . 16 1 1 A 81 81 ARG C C 81 178.204 179.201 -0.997 1
1 1066 . 16 1 1 A 81 81 ARG CA C 81 60.560 59.699 0.861 1
1 1067 . 16 1 1 A 81 81 ARG CB C 81 30.196 29.991 0.205 1
1 1070 . 16 1 1 A 81 81 ARG N N 81 121.030 120.430 0.600 1
1 1072 . 16 1 1 A 82 82 ASN H H 82 8.773 8.134 0.639 1
1 1073 . 16 1 1 A 82 82 ASN HA H 82 4.587 4.653 -0.066 1
1 1078 . 16 1 1 A 82 82 ASN C C 82 178.300 178.028 0.272 1
1 1079 . 16 1 1 A 82 82 ASN CA C 82 56.160 56.094 0.066 1
1 1080 . 16 1 1 A 82 82 ASN CB C 82 38.464 39.080 -0.616 1
1 1081 . 16 1 1 A 82 82 ASN N N 82 118.483 118.593 -0.110 1
1 1083 . 16 1 1 A 83 83 SER H H 83 8.526 7.705 0.821 1
1 1084 . 16 1 1 A 83 83 SER HA H 83 2.765 2.996 -0.231 1
1 1087 . 16 1 1 A 83 83 SER C C 83 176.386 176.326 0.060 1
1 1088 . 16 1 1 A 83 83 SER CA C 83 61.245 61.879 -0.634 1
1 1089 . 16 1 1 A 83 83 SER CB C 83 61.287 62.643 -1.356 1
1 1090 . 16 1 1 A 83 83 SER N N 83 118.286 116.243 2.043 1
1 1091 . 16 1 1 A 84 84 LEU H H 84 7.782 8.259 -0.477 1
1 1092 . 16 1 1 A 84 84 LEU HA H 84 4.221 4.043 0.178 1
1 1102 . 16 1 1 A 84 84 LEU C C 84 177.846 179.419 -1.573 1
1 1103 . 16 1 1 A 84 84 LEU CA C 84 57.166 57.868 -0.702 1
1 1104 . 16 1 1 A 84 84 LEU CB C 84 40.520 40.971 -0.451 1
1 1108 . 16 1 1 A 84 84 LEU N N 84 127.445 121.279 6.166 1
1 1109 . 16 1 1 A 85 85 GLU H H 85 8.264 8.420 -0.156 1
1 1110 . 16 1 1 A 85 85 GLU HA H 85 3.981 3.983 -0.002 1
1 1115 . 16 1 1 A 85 85 GLU C C 85 179.288 179.188 0.100 1
1 1116 . 16 1 1 A 85 85 GLU CA C 85 59.025 59.976 -0.951 1
1 1117 . 16 1 1 A 85 85 GLU CB C 85 29.182 29.263 -0.081 1
1 1119 . 16 1 1 A 85 85 GLU N N 85 121.538 120.375 1.163 1
1 1120 . 16 1 1 A 86 86 HIS H H 86 7.683 8.088 -0.405 1
1 1121 . 16 1 1 A 86 86 HIS HA H 86 4.573 4.343 0.230 1
1 1125 . 16 1 1 A 86 86 HIS C C 86 175.484 177.898 -2.414 1
1 1126 . 16 1 1 A 86 86 HIS CA C 86 58.940 59.703 -0.763 1
1 1127 . 16 1 1 A 86 86 HIS CB C 86 29.267 29.841 -0.574 1
1 1129 . 16 1 1 A 86 86 HIS N N 86 117.087 120.499 -3.412 1
1 1130 . 16 1 1 A 87 87 ALA H H 87 7.197 8.274 -1.077 1
1 1131 . 16 1 1 A 87 87 ALA HA H 87 3.925 3.944 -0.019 1
1 1135 . 16 1 1 A 87 87 ALA C C 87 179.038 180.151 -1.113 1
1 1136 . 16 1 1 A 87 87 ALA CA C 87 54.863 55.090 -0.227 1
1 1137 . 16 1 1 A 87 87 ALA CB C 87 17.034 18.039 -1.005 1
1 1138 . 16 1 1 A 87 87 ALA N N 87 121.510 120.850 0.660 1
1 1139 . 16 1 1 A 88 88 ILE H H 88 7.819 7.760 0.059 1
1 1140 . 16 1 1 A 88 88 ILE HA H 88 4.067 3.607 0.460 1
1 1150 . 16 1 1 A 88 88 ILE C C 88 180.846 177.645 3.201 1
1 1151 . 16 1 1 A 88 88 ILE CA C 88 64.021 65.419 -1.398 1
1 1152 . 16 1 1 A 88 88 ILE CB C 88 37.557 37.608 -0.051 1
1 1156 . 16 1 1 A 88 88 ILE N N 88 120.898 119.291 1.607 1
1 1157 . 16 1 1 A 89 89 ASP H H 89 7.808 8.073 -0.265 1
1 1158 . 16 1 1 A 89 89 ASP HA H 89 4.437 4.327 0.110 1
1 1161 . 16 1 1 A 89 89 ASP C C 89 178.033 178.235 -0.202 1
1 1162 . 16 1 1 A 89 89 ASP CA C 89 57.343 57.728 -0.385 1
1 1163 . 16 1 1 A 89 89 ASP CB C 89 39.689 41.681 -1.992 1
1 1164 . 16 1 1 A 89 89 ASP N N 89 125.174 120.602 4.572 1
1 1165 . 16 1 1 A 90 90 LEU H H 90 7.607 7.634 -0.027 1
1 1166 . 16 1 1 A 90 90 LEU HA H 90 4.198 4.203 -0.005 1
1 1176 . 16 1 1 A 90 90 LEU C C 90 175.416 175.882 -0.466 1
1 1177 . 16 1 1 A 90 90 LEU CA C 90 54.755 55.160 -0.405 1
1 1178 . 16 1 1 A 90 90 LEU CB C 90 42.960 41.841 1.119 1
1 1182 . 16 1 1 A 90 90 LEU N N 90 117.576 117.242 0.334 1
1 1183 . 16 1 1 A 91 91 GLU H H 91 8.143 7.854 0.289 1
1 1184 . 16 1 1 A 91 91 GLU HA H 91 4.005 4.068 -0.063 1
1 1189 . 16 1 1 A 91 91 GLU C C 91 175.792 176.191 -0.399 1
1 1190 . 16 1 1 A 91 91 GLU CA C 91 57.202 57.534 -0.332 1
1 1191 . 16 1 1 A 91 91 GLU CB C 91 26.125 26.562 -0.437 1
1 1193 . 16 1 1 A 91 91 GLU N N 91 113.620 115.225 -1.605 1
1 1194 . 16 1 1 A 92 92 LEU H H 92 8.290 8.043 0.247 1
1 1195 . 16 1 1 A 92 92 LEU HA H 92 4.216 4.146 0.070 1
1 1205 . 16 1 1 A 92 92 LEU C C 92 176.622 176.996 -0.374 1
1 1206 . 16 1 1 A 92 92 LEU CA C 92 56.410 56.368 0.042 1
1 1207 . 16 1 1 A 92 92 LEU CB C 92 43.378 42.410 0.968 1
1 1211 . 16 1 1 A 92 92 LEU N N 92 116.868 118.926 -2.058 1
1 1212 . 16 1 1 A 93 93 ILE H H 93 6.988 6.872 0.116 1
1 1213 . 16 1 1 A 93 93 ILE HA H 93 4.580 4.557 0.023 1
1 1223 . 16 1 1 A 93 93 ILE C C 93 175.145 175.961 -0.816 1
1 1224 . 16 1 1 A 93 93 ILE CA C 93 58.707 58.574 0.133 1
1 1225 . 16 1 1 A 93 93 ILE CB C 93 42.864 41.480 1.384 1
1 1229 . 16 1 1 A 93 93 ILE N N 93 107.565 114.063 -6.498 1
1 1230 . 16 1 1 A 94 94 THR H H 94 8.742 8.491 0.251 1
1 1231 . 16 1 1 A 94 94 THR HA H 94 4.489 4.200 0.289 1
1 1236 . 16 1 1 A 94 94 THR C C 94 173.875 173.759 0.116 1
1 1237 . 16 1 1 A 94 94 THR CA C 94 61.842 63.642 -1.800 1
1 1238 . 16 1 1 A 94 94 THR CB C 94 69.972 69.935 0.037 1
1 1240 . 16 1 1 A 94 94 THR N N 94 107.904 115.984 -8.080 1
1 1241 . 16 1 1 A 95 95 LYS H H 95 7.294 7.515 -0.221 1
1 1242 . 16 1 1 A 95 95 LYS HA H 95 4.566 4.629 -0.063 1
1 1251 . 16 1 1 A 95 95 LYS C C 95 173.791 174.290 -0.499 1
1 1252 . 16 1 1 A 95 95 LYS CA C 95 54.533 55.861 -1.328 1
1 1253 . 16 1 1 A 95 95 LYS CB C 95 35.123 35.897 -0.774 1
1 1257 . 16 1 1 A 95 95 LYS N N 95 119.458 120.219 -0.761 1
1 1258 . 16 1 1 A 96 96 ASN H H 96 9.157 8.828 0.329 1
1 1259 . 16 1 1 A 96 96 ASN HA H 96 4.408 4.795 -0.387 1
1 1264 . 16 1 1 A 96 96 ASN C C 96 176.653 176.116 0.537 1
1 1265 . 16 1 1 A 96 96 ASN CA C 96 51.088 52.605 -1.517 1
1 1266 . 16 1 1 A 96 96 ASN CB C 96 37.292 38.646 -1.354 1
1 1267 . 16 1 1 A 96 96 ASN N N 96 121.031 123.651 -2.620 1
1 1269 . 16 1 1 A 97 97 VAL H H 97 8.193 8.315 -0.122 1
1 1270 . 16 1 1 A 97 97 VAL HA H 97 4.019 3.898 0.121 1
1 1278 . 16 1 1 A 97 97 VAL C C 97 175.089 175.903 -0.814 1
1 1279 . 16 1 1 A 97 97 VAL CA C 97 63.437 63.879 -0.442 1
1 1280 . 16 1 1 A 97 97 VAL CB C 97 29.934 31.576 -1.642 1
1 1283 . 16 1 1 A 97 97 VAL N N 97 118.839 121.952 -3.113 1
1 1284 . 16 1 1 A 98 98 ALA H H 98 7.994 7.557 0.437 1
1 1285 . 16 1 1 A 98 98 ALA HA H 98 5.108 4.401 0.707 1
1 1289 . 16 1 1 A 98 98 ALA C C 98 178.033 178.287 -0.254 1
1 1290 . 16 1 1 A 98 98 ALA CA C 98 50.342 52.340 -1.998 1
1 1291 . 16 1 1 A 98 98 ALA CB C 98 19.659 18.936 0.723 1
1 1292 . 16 1 1 A 98 98 ALA N N 98 121.031 124.369 -3.338 1
1 1293 . 16 1 1 A 99 99 ALA H H 99 7.347 7.453 -0.106 1
1 1294 . 16 1 1 A 99 99 ALA HA H 99 3.818 4.117 -0.299 1
1 1298 . 16 1 1 A 99 99 ALA C C 99 177.712 178.286 -0.574 1
1 1299 . 16 1 1 A 99 99 ALA CA C 99 55.117 54.020 1.097 1
1 1300 . 16 1 1 A 99 99 ALA CB C 99 18.879 18.385 0.494 1
1 1301 . 16 1 1 A 99 99 ALA N N 99 122.816 120.878 1.938 1
1 1302 . 16 1 1 A 100 100 LYS H H 100 8.190 7.750 0.440 1
1 1303 . 16 1 1 A 100 100 LYS HA H 100 4.483 4.334 0.149 1
1 1312 . 16 1 1 A 100 100 LYS C C 100 175.899 177.029 -1.130 1
1 1313 . 16 1 1 A 100 100 LYS CA C 100 54.231 57.398 -3.167 1
1 1314 . 16 1 1 A 100 100 LYS CB C 100 32.066 32.852 -0.786 1
1 1318 . 16 1 1 A 100 100 LYS N N 100 113.197 115.207 -2.010 1
1 1319 . 16 1 1 A 101 101 THR H H 101 7.128 7.512 -0.384 1
1 1320 . 16 1 1 A 101 101 THR HA H 101 3.834 4.296 -0.462 1
1 1325 . 16 1 1 A 101 101 THR C C 101 173.255 173.567 -0.312 1
1 1326 . 16 1 1 A 101 101 THR CA C 101 64.392 62.683 1.709 1
1 1327 . 16 1 1 A 101 101 THR CB C 101 69.160 68.110 1.050 1
1 1329 . 16 1 1 A 101 101 THR N N 101 118.368 116.183 2.185 1
1 1330 . 16 1 1 A 102 102 LYS H H 102 8.753 8.719 0.034 1
1 1331 . 16 1 1 A 102 102 LYS HA H 102 4.438 4.737 -0.299 1
1 1340 . 16 1 1 A 102 102 LYS C C 102 175.627 175.772 -0.145 1
1 1341 . 16 1 1 A 102 102 LYS CA C 102 55.117 54.129 0.988 1
1 1342 . 16 1 1 A 102 102 LYS CB C 102 33.901 34.397 -0.496 1
1 1346 . 16 1 1 A 102 102 LYS N N 102 126.513 127.030 -0.517 1
1 1347 . 16 1 1 A 103 103 LEU H H 103 8.602 8.374 0.228 1
1 1348 . 16 1 1 A 103 103 LEU HA H 103 4.486 4.416 0.070 1
1 1358 . 16 1 1 A 103 103 LEU CA C 103 52.233 53.121 -0.888 1
1 1359 . 16 1 1 A 103 103 LEU CB C 103 41.028 42.840 -1.812 1
1 1363 . 16 1 1 A 103 103 LEU N N 103 124.466 123.908 0.558 1
1 1364 . 16 1 1 A 104 104 PRO HA H 104 4.437 4.616 -0.179 1
1 1371 . 16 1 1 A 104 104 PRO C C 104 175.779 176.001 -0.222 1
1 1372 . 16 1 1 A 104 104 PRO CA C 104 62.322 62.210 0.112 1
1 1373 . 16 1 1 A 104 104 PRO CB C 104 31.899 33.098 -1.199 1
1 1376 . 16 1 1 A 105 105 LYS H H 105 8.460 8.589 -0.129 1
1 1377 . 16 1 1 A 105 105 LYS HA H 105 4.154 4.271 -0.117 1
1 1386 . 16 1 1 A 105 105 LYS C C 105 175.998 176.797 -0.799 1
1 1387 . 16 1 1 A 105 105 LYS CA C 105 56.480 55.558 0.922 1
1 1388 . 16 1 1 A 105 105 LYS CB C 105 32.909 31.487 1.422 1
1 1392 . 16 1 1 A 105 105 LYS N N 105 122.139 120.863 1.276 1
1 1393 . 16 1 1 A 106 106 ALA H H 106 8.448 8.357 0.091 1
1 1394 . 16 1 1 A 106 106 ALA HA H 106 4.309 4.614 -0.305 1
1 1398 . 16 1 1 A 106 106 ALA C C 106 176.828 176.252 0.576 1
1 1399 . 16 1 1 A 106 106 ALA CA C 106 51.862 51.361 0.501 1
1 1400 . 16 1 1 A 106 106 ALA CB C 106 19.323 20.526 -1.203 1
1 1401 . 16 1 1 A 106 106 ALA N N 106 125.278 126.580 -1.302 1
1 1402 . 16 1 1 A 107 107 ASP H H 107 8.428 7.645 0.783 1
1 1403 . 16 1 1 A 107 107 ASP HA H 107 4.574 5.205 -0.631 1
1 1406 . 16 1 1 A 107 107 ASP C C 107 175.951 174.569 1.382 1
1 1407 . 16 1 1 A 107 107 ASP CA C 107 54.214 52.888 1.326 1
1 1408 . 16 1 1 A 107 107 ASP CB C 107 41.141 44.274 -3.133 1
1 1409 . 16 1 1 A 107 107 ASP N N 107 120.771 118.991 1.780 1
1 1410 . 16 1 1 A 108 108 LYS H H 108 8.329 8.412 -0.083 1
1 1411 . 16 1 1 A 108 108 LYS HA H 108 4.203 4.378 -0.175 1
1 1420 . 16 1 1 A 108 108 LYS C C 108 176.483 175.914 0.569 1
1 1421 . 16 1 1 A 108 108 LYS CA C 108 56.831 56.168 0.663 1
1 1422 . 16 1 1 A 108 108 LYS CB C 108 32.648 31.354 1.294 1
1 1426 . 16 1 1 A 108 108 LYS N N 108 120.727 122.482 -1.755 1
1 1427 . 16 1 1 A 109 109 GLU H H 109 8.447 8.350 0.097 1
1 1428 . 16 1 1 A 109 109 GLU HA H 109 4.215 4.594 -0.379 1
1 1433 . 16 1 1 A 109 109 GLU C C 109 176.513 177.425 -0.912 1
1 1434 . 16 1 1 A 109 109 GLU CA C 109 56.936 55.905 1.031 1
1 1435 . 16 1 1 A 109 109 GLU CB C 109 29.833 30.770 -0.937 1
1 1437 . 16 1 1 A 109 109 GLU N N 109 121.471 124.783 -3.312 1
1 1438 . 16 1 1 A 110 110 GLU H H 110 8.352 9.083 -0.731 1
1 1439 . 16 1 1 A 110 110 GLU HA H 110 4.233 4.302 -0.069 1
1 1444 . 16 1 1 A 110 110 GLU C C 110 176.439 178.523 -2.084 1
1 1445 . 16 1 1 A 110 110 GLU CA C 110 56.681 58.565 -1.884 1
1 1446 . 16 1 1 A 110 110 GLU CB C 110 29.860 29.456 0.404 1
1 1448 . 16 1 1 A 110 110 GLU N N 110 121.559 124.047 -2.488 1
1 1449 . 16 1 1 A 111 111 LEU H H 111 8.145 7.787 0.358 1
1 1450 . 16 1 1 A 111 111 LEU HA H 111 4.251 4.003 0.248 1
1 1460 . 16 1 1 A 111 111 LEU C C 111 177.306 177.947 -0.641 1
1 1461 . 16 1 1 A 111 111 LEU CA C 111 55.277 58.076 -2.799 1
1 1462 . 16 1 1 A 111 111 LEU CB C 111 42.054 41.282 0.772 1
1 1466 . 16 1 1 A 111 111 LEU N N 111 122.181 119.245 2.936 1
1 1467 . 16 1 1 A 112 112 GLU H H 112 8.212 7.646 0.566 1
1 1468 . 16 1 1 A 112 112 GLU N N 112 120.291 115.756 4.535 1
1 1469 . 16 1 1 A 114 114 HIS C C 114 176.070 174.654 1.416 1
1 1470 . 16 1 1 A 116 116 HIS H H 116 8.227 8.431 -0.204 1
1 1471 . 16 1 1 A 116 116 HIS C C 116 173.580 174.962 -1.382 1
1 1472 . 16 1 1 A 116 116 HIS N N 116 119.156 125.390 -6.234 1
1 5 . 17 1 1 A 3 3 PRO HA H 3 4.390 4.640 -0.250 1
1 12 . 17 1 1 A 3 3 PRO C C 3 176.847 177.655 -0.808 1
1 13 . 17 1 1 A 3 3 PRO CA C 3 63.449 62.652 0.797 1
1 14 . 17 1 1 A 3 3 PRO CB C 3 31.938 32.556 -0.618 1
1 17 . 17 1 1 A 4 4 SER H H 4 8.531 8.791 -0.260 1
1 18 . 17 1 1 A 4 4 SER HA H 4 4.262 4.215 0.047 1
1 21 . 17 1 1 A 4 4 SER C C 4 175.414 174.664 0.750 1
1 22 . 17 1 1 A 4 4 SER CA C 4 59.163 61.740 -2.577 1
1 23 . 17 1 1 A 4 4 SER CB C 4 63.242 63.035 0.207 1
1 24 . 17 1 1 A 4 4 SER N N 4 114.246 118.502 -4.256 1
1 25 . 17 1 1 A 5 5 LYS H H 5 8.468 7.818 0.650 1
1 26 . 17 1 1 A 5 5 LYS HA H 5 4.433 3.839 0.594 1
1 35 . 17 1 1 A 5 5 LYS C C 5 175.984 174.906 1.078 1
1 36 . 17 1 1 A 5 5 LYS CA C 5 55.724 57.265 -1.541 1
1 37 . 17 1 1 A 5 5 LYS CB C 5 32.881 29.568 3.313 1
1 41 . 17 1 1 A 5 5 LYS N N 5 123.488 117.336 6.152 1
1 42 . 17 1 1 A 6 6 LEU H H 6 7.707 7.889 -0.182 1
1 43 . 17 1 1 A 6 6 LEU HA H 6 4.381 4.669 -0.288 1
1 53 . 17 1 1 A 6 6 LEU C C 6 177.820 175.888 1.932 1
1 54 . 17 1 1 A 6 6 LEU CA C 6 55.507 54.313 1.194 1
1 55 . 17 1 1 A 6 6 LEU CB C 6 43.374 42.599 0.775 1
1 59 . 17 1 1 A 6 6 LEU N N 6 121.233 121.806 -0.573 1
1 60 . 17 1 1 A 7 7 SER H H 7 9.433 8.860 0.573 1
1 61 . 17 1 1 A 7 7 SER HA H 7 4.638 4.780 -0.142 1
1 64 . 17 1 1 A 7 7 SER C C 7 174.120 174.947 -0.827 1
1 65 . 17 1 1 A 7 7 SER CA C 7 57.962 57.493 0.469 1
1 66 . 17 1 1 A 7 7 SER CB C 7 64.197 64.313 -0.116 1
1 67 . 17 1 1 A 7 7 SER N N 7 122.977 118.322 4.655 1
1 68 . 17 1 1 A 8 8 TYR H H 8 9.764 9.225 0.539 1
1 69 . 17 1 1 A 8 8 TYR HA H 8 4.732 4.238 0.494 1
1 76 . 17 1 1 A 8 8 TYR C C 8 177.206 177.607 -0.401 1
1 77 . 17 1 1 A 8 8 TYR CA C 8 58.762 61.792 -3.030 1
1 78 . 17 1 1 A 8 8 TYR CB C 8 36.605 38.863 -2.258 1
1 83 . 17 1 1 A 8 8 TYR N N 8 123.312 122.647 0.665 1
1 84 . 17 1 1 A 9 9 GLY H H 9 10.131 8.171 1.960 1
1 85 . 17 1 1 A 9 9 GLY HA2 H 9 3.983 3.590 0.393 1
1 86 . 17 1 1 A 9 9 GLY HA3 H 9 3.423 3.691 -0.268 1
1 87 . 17 1 1 A 9 9 GLY C C 9 175.163 176.158 -0.995 1
1 88 . 17 1 1 A 9 9 GLY CA C 9 47.153 47.295 -0.142 1
1 89 . 17 1 1 A 9 9 GLY N N 9 107.177 105.879 1.298 1
1 90 . 17 1 1 A 10 10 GLU H H 10 7.876 8.003 -0.127 1
1 91 . 17 1 1 A 10 10 GLU HA H 10 4.107 4.093 0.014 1
1 96 . 17 1 1 A 10 10 GLU C C 10 179.924 178.902 1.022 1
1 97 . 17 1 1 A 10 10 GLU CA C 10 58.890 59.354 -0.464 1
1 98 . 17 1 1 A 10 10 GLU CB C 10 29.750 29.338 0.412 1
1 100 . 17 1 1 A 10 10 GLU N N 10 122.219 121.985 0.234 1
1 101 . 17 1 1 A 11 11 TYR H H 11 8.384 8.272 0.112 1
1 102 . 17 1 1 A 11 11 TYR HA H 11 4.305 4.212 0.093 1
1 107 . 17 1 1 A 11 11 TYR C C 11 176.854 177.139 -0.285 1
1 108 . 17 1 1 A 11 11 TYR CA C 11 61.040 61.529 -0.489 1
1 109 . 17 1 1 A 11 11 TYR CB C 11 37.593 39.071 -1.478 1
1 112 . 17 1 1 A 11 11 TYR N N 11 120.809 123.214 -2.405 1
1 113 . 17 1 1 A 12 12 LEU H H 12 9.027 8.406 0.621 1
1 114 . 17 1 1 A 12 12 LEU HA H 12 3.778 3.804 -0.026 1
1 124 . 17 1 1 A 12 12 LEU C C 12 178.621 179.442 -0.821 1
1 125 . 17 1 1 A 12 12 LEU CA C 12 57.534 57.593 -0.059 1
1 126 . 17 1 1 A 12 12 LEU CB C 12 41.957 40.718 1.239 1
1 130 . 17 1 1 A 12 12 LEU N N 12 121.080 119.193 1.887 1
1 131 . 17 1 1 A 13 13 GLU H H 13 7.614 8.297 -0.683 1
1 132 . 17 1 1 A 13 13 GLU HA H 13 4.102 4.036 0.066 1
1 137 . 17 1 1 A 13 13 GLU C C 13 178.449 179.598 -1.149 1
1 138 . 17 1 1 A 13 13 GLU CA C 13 59.609 59.467 0.142 1
1 139 . 17 1 1 A 13 13 GLU CB C 13 29.124 29.607 -0.483 1
1 141 . 17 1 1 A 13 13 GLU N N 13 118.475 120.799 -2.324 1
1 142 . 17 1 1 A 14 14 SER H H 14 7.329 7.588 -0.259 1
1 143 . 17 1 1 A 14 14 SER HA H 14 4.358 4.166 0.192 1
1 146 . 17 1 1 A 14 14 SER C C 14 176.794 175.875 0.919 1
1 147 . 17 1 1 A 14 14 SER CA C 14 61.064 62.426 -1.362 1
1 148 . 17 1 1 A 14 14 SER CB C 14 62.513 63.099 -0.586 1
1 149 . 17 1 1 A 14 14 SER N N 14 115.209 116.791 -1.582 1
1 150 . 17 1 1 A 15 15 TRP H H 15 8.870 8.119 0.751 1
1 151 . 17 1 1 A 15 15 TRP HA H 15 4.005 4.272 -0.267 1
1 160 . 17 1 1 A 15 15 TRP C C 15 177.547 177.643 -0.096 1
1 161 . 17 1 1 A 15 15 TRP CA C 15 61.210 61.382 -0.172 1
1 162 . 17 1 1 A 15 15 TRP CB C 15 27.341 29.104 -1.763 1
1 168 . 17 1 1 A 15 15 TRP N N 15 124.998 123.860 1.138 1
1 170 . 17 1 1 A 16 16 PHE H H 16 9.087 8.230 0.857 1
1 171 . 17 1 1 A 16 16 PHE HA H 16 3.210 3.837 -0.627 1
1 179 . 17 1 1 A 16 16 PHE C C 16 175.909 177.000 -1.091 1
1 180 . 17 1 1 A 16 16 PHE CA C 16 61.473 61.381 0.092 1
1 181 . 17 1 1 A 16 16 PHE CB C 16 38.506 39.214 -0.708 1
1 187 . 17 1 1 A 16 16 PHE N N 16 119.825 121.316 -1.491 1
1 188 . 17 1 1 A 17 17 ASN H H 17 7.768 8.083 -0.315 1
1 189 . 17 1 1 A 17 17 ASN HA H 17 4.078 4.097 -0.019 1
1 194 . 17 1 1 A 17 17 ASN C C 17 176.604 177.500 -0.896 1
1 195 . 17 1 1 A 17 17 ASN CA C 17 55.621 55.933 -0.312 1
1 196 . 17 1 1 A 17 17 ASN CB C 17 37.830 37.917 -0.087 1
1 197 . 17 1 1 A 17 17 ASN N N 17 115.600 116.862 -1.262 1
1 199 . 17 1 1 A 18 18 THR H H 18 7.454 7.026 0.428 1
1 200 . 17 1 1 A 18 18 THR HA H 18 4.147 3.845 0.302 1
1 205 . 17 1 1 A 18 18 THR C C 18 175.692 176.045 -0.353 1
1 206 . 17 1 1 A 18 18 THR CA C 18 64.679 64.485 0.194 1
1 207 . 17 1 1 A 18 18 THR CB C 18 68.940 68.745 0.195 1
1 209 . 17 1 1 A 18 18 THR N N 18 113.049 115.108 -2.059 1
1 210 . 17 1 1 A 19 19 LYS H H 19 7.918 7.512 0.406 1
1 211 . 17 1 1 A 19 19 LYS HA H 19 3.791 3.649 0.142 1
1 220 . 17 1 1 A 19 19 LYS C C 19 178.120 178.964 -0.844 1
1 221 . 17 1 1 A 19 19 LYS CA C 19 55.985 58.654 -2.669 1
1 222 . 17 1 1 A 19 19 LYS CB C 19 31.130 30.869 0.261 1
1 226 . 17 1 1 A 19 19 LYS N N 19 122.614 120.720 1.894 1
1 227 . 17 1 1 A 20 20 ARG H H 20 7.845 7.594 0.251 1
1 228 . 17 1 1 A 20 20 ARG HA H 20 3.396 3.848 -0.452 1
1 236 . 17 1 1 A 20 20 ARG C C 20 175.601 178.710 -3.109 1
1 237 . 17 1 1 A 20 20 ARG CA C 20 58.182 58.884 -0.702 1
1 238 . 17 1 1 A 20 20 ARG CB C 20 28.045 29.660 -1.615 1
1 241 . 17 1 1 A 20 20 ARG N N 20 116.282 118.210 -1.928 1
1 243 . 17 1 1 A 21 21 HIS H H 21 7.163 7.767 -0.604 1
1 244 . 17 1 1 A 21 21 HIS HA H 21 4.500 4.238 0.262 1
1 249 . 17 1 1 A 21 21 HIS C C 21 175.618 176.747 -1.129 1
1 250 . 17 1 1 A 21 21 HIS CA C 21 56.912 58.955 -2.043 1
1 251 . 17 1 1 A 21 21 HIS CB C 21 29.400 29.410 -0.010 1
1 254 . 17 1 1 A 21 21 HIS N N 21 115.452 118.382 -2.930 1
1 255 . 17 1 1 A 22 22 SER H H 22 7.951 7.806 0.145 1
1 256 . 17 1 1 A 22 22 SER HA H 22 4.573 4.285 0.288 1
1 259 . 17 1 1 A 22 22 SER C C 22 173.948 175.528 -1.580 1
1 260 . 17 1 1 A 22 22 SER CA C 22 58.589 61.882 -3.293 1
1 261 . 17 1 1 A 22 22 SER CB C 22 64.228 63.888 0.340 1
1 262 . 17 1 1 A 22 22 SER N N 22 113.209 115.955 -2.746 1
1 263 . 17 1 1 A 23 23 VAL H H 23 7.179 7.685 -0.506 1
1 264 . 17 1 1 A 23 23 VAL HA H 23 4.626 4.033 0.593 1
1 272 . 17 1 1 A 23 23 VAL C C 23 175.397 175.912 -0.515 1
1 273 . 17 1 1 A 23 23 VAL CA C 23 59.556 63.794 -4.238 1
1 274 . 17 1 1 A 23 23 VAL CB C 23 33.810 32.710 1.100 1
1 277 . 17 1 1 A 23 23 VAL N N 23 113.108 115.008 -1.900 1
1 278 . 17 1 1 A 24 24 GLY H H 24 8.189 7.540 0.649 1
1 279 . 17 1 1 A 24 24 GLY HA2 H 24 4.074 4.002 0.072 1
1 280 . 17 1 1 A 24 24 GLY HA3 H 24 4.195 4.032 0.163 1
1 281 . 17 1 1 A 24 24 GLY C C 24 174.037 175.053 -1.016 1
1 282 . 17 1 1 A 24 24 GLY CA C 24 44.452 44.425 0.027 1
1 283 . 17 1 1 A 24 24 GLY N N 24 108.374 109.983 -1.609 1
1 284 . 17 1 1 A 25 25 ILE H H 25 8.331 8.683 -0.352 1
1 285 . 17 1 1 A 25 25 ILE HA H 25 3.839 3.733 0.106 1
1 295 . 17 1 1 A 25 25 ILE C C 25 178.042 177.595 0.447 1
1 296 . 17 1 1 A 25 25 ILE CA C 25 64.238 64.247 -0.009 1
1 297 . 17 1 1 A 25 25 ILE CB C 25 37.931 37.755 0.176 1
1 301 . 17 1 1 A 25 25 ILE N N 25 119.895 121.074 -1.179 1
1 302 . 17 1 1 A 26 26 GLN H H 26 8.545 8.412 0.133 1
1 303 . 17 1 1 A 26 26 GLN HA H 26 4.129 4.065 0.064 1
1 310 . 17 1 1 A 26 26 GLN C C 26 178.454 178.464 -0.010 1
1 311 . 17 1 1 A 26 26 GLN CA C 26 58.772 58.316 0.456 1
1 312 . 17 1 1 A 26 26 GLN CB C 26 27.346 28.308 -0.962 1
1 314 . 17 1 1 A 26 26 GLN N N 26 120.013 120.005 0.008 1
1 316 . 17 1 1 A 27 27 THR H H 27 7.944 8.168 -0.224 1
1 317 . 17 1 1 A 27 27 THR HA H 27 3.953 3.890 0.063 1
1 322 . 17 1 1 A 27 27 THR C C 27 175.818 176.101 -0.283 1
1 323 . 17 1 1 A 27 27 THR CA C 27 65.855 66.084 -0.229 1
1 324 . 17 1 1 A 27 27 THR CB C 27 68.127 68.282 -0.155 1
1 326 . 17 1 1 A 27 27 THR N N 27 117.645 116.863 0.782 1
1 327 . 17 1 1 A 28 28 ALA H H 28 8.593 8.146 0.447 1
1 328 . 17 1 1 A 28 28 ALA HA H 28 3.899 4.121 -0.222 1
1 332 . 17 1 1 A 28 28 ALA C C 28 178.515 179.696 -1.181 1
1 333 . 17 1 1 A 28 28 ALA CA C 28 55.742 55.641 0.101 1
1 334 . 17 1 1 A 28 28 ALA CB C 28 17.513 18.078 -0.565 1
1 335 . 17 1 1 A 28 28 ALA N N 28 123.917 123.489 0.428 1
1 336 . 17 1 1 A 29 29 LYS H H 29 7.800 7.903 -0.103 1
1 337 . 17 1 1 A 29 29 LYS HA H 29 3.982 4.015 -0.033 1
1 346 . 17 1 1 A 29 29 LYS C C 29 179.527 179.016 0.511 1
1 347 . 17 1 1 A 29 29 LYS CA C 29 59.761 59.650 0.111 1
1 348 . 17 1 1 A 29 29 LYS CB C 29 32.223 32.364 -0.141 1
1 352 . 17 1 1 A 29 29 LYS N N 29 117.474 118.948 -1.474 1
1 353 . 17 1 1 A 30 30 VAL H H 30 7.591 7.201 0.390 1
1 354 . 17 1 1 A 30 30 VAL HA H 30 3.503 3.298 0.205 1
1 362 . 17 1 1 A 30 30 VAL C C 30 178.389 177.830 0.559 1
1 363 . 17 1 1 A 30 30 VAL CA C 30 65.640 65.615 0.025 1
1 364 . 17 1 1 A 30 30 VAL CB C 30 31.644 31.564 0.080 1
1 367 . 17 1 1 A 30 30 VAL N N 30 121.749 120.358 1.391 1
1 368 . 17 1 1 A 31 31 LEU H H 31 8.333 8.139 0.194 1
1 369 . 17 1 1 A 31 31 LEU HA H 31 4.074 4.137 -0.063 1
1 379 . 17 1 1 A 31 31 LEU C C 31 177.780 179.337 -1.557 1
1 380 . 17 1 1 A 31 31 LEU CA C 31 58.157 58.038 0.119 1
1 381 . 17 1 1 A 31 31 LEU CB C 31 42.230 41.264 0.966 1
1 385 . 17 1 1 A 31 31 LEU N N 31 120.901 120.129 0.772 1
1 386 . 17 1 1 A 32 32 LYS H H 32 8.562 8.038 0.524 1
1 387 . 17 1 1 A 32 32 LYS HA H 32 3.290 3.879 -0.589 1
1 395 . 17 1 1 A 32 32 LYS C C 32 178.037 178.750 -0.713 1
1 396 . 17 1 1 A 32 32 LYS CA C 32 58.911 59.731 -0.820 1
1 397 . 17 1 1 A 32 32 LYS CB C 32 31.605 31.656 -0.051 1
1 401 . 17 1 1 A 32 32 LYS N N 32 119.075 119.930 -0.855 1
1 402 . 17 1 1 A 33 33 GLY H H 33 7.694 7.795 -0.101 1
1 403 . 17 1 1 A 33 33 GLY HA2 H 33 3.949 3.494 0.455 1
1 404 . 17 1 1 A 33 33 GLY HA3 H 33 3.826 3.602 0.224 1
1 405 . 17 1 1 A 33 33 GLY C C 33 177.101 176.535 0.566 1
1 406 . 17 1 1 A 33 33 GLY CA C 33 46.928 47.077 -0.149 1
1 407 . 17 1 1 A 33 33 GLY N N 33 105.282 106.483 -1.201 1
1 408 . 17 1 1 A 34 34 TYR H H 34 8.015 7.384 0.631 1
1 409 . 17 1 1 A 34 34 TYR HA H 34 4.558 4.673 -0.115 1
1 416 . 17 1 1 A 34 34 TYR C C 34 179.611 178.066 1.545 1
1 417 . 17 1 1 A 34 34 TYR CA C 34 59.349 60.351 -1.002 1
1 418 . 17 1 1 A 34 34 TYR CB C 34 37.344 38.149 -0.805 1
1 423 . 17 1 1 A 34 34 TYR N N 34 121.781 121.719 0.062 1
1 424 . 17 1 1 A 35 35 LEU H H 35 8.689 8.154 0.535 1
1 425 . 17 1 1 A 35 35 LEU HA H 35 3.977 3.887 0.090 1
1 435 . 17 1 1 A 35 35 LEU C C 35 177.081 179.385 -2.304 1
1 436 . 17 1 1 A 35 35 LEU CA C 35 59.155 58.376 0.779 1
1 437 . 17 1 1 A 35 35 LEU CB C 35 41.103 41.734 -0.631 1
1 441 . 17 1 1 A 35 35 LEU N N 35 120.392 120.595 -0.203 1
1 442 . 17 1 1 A 36 36 ASN H H 36 8.721 7.920 0.801 1
1 443 . 17 1 1 A 36 36 ASN HA H 36 4.435 4.459 -0.024 1
1 448 . 17 1 1 A 36 36 ASN C C 36 176.792 177.995 -1.203 1
1 449 . 17 1 1 A 36 36 ASN CA C 36 55.642 55.953 -0.311 1
1 450 . 17 1 1 A 36 36 ASN CB C 36 38.319 37.805 0.514 1
1 451 . 17 1 1 A 36 36 ASN N N 36 114.623 117.292 -2.669 1
1 453 . 17 1 1 A 37 37 SER H H 37 8.511 7.546 0.965 1
1 454 . 17 1 1 A 37 37 SER HA H 37 4.642 4.197 0.445 1
1 457 . 17 1 1 A 37 37 SER C C 37 175.039 176.461 -1.422 1
1 458 . 17 1 1 A 37 37 SER CA C 37 59.825 61.458 -1.633 1
1 459 . 17 1 1 A 37 37 SER CB C 37 64.056 62.999 1.057 1
1 460 . 17 1 1 A 37 37 SER N N 37 110.941 115.543 -4.602 1
1 461 . 17 1 1 A 38 38 ARG H H 38 7.242 8.134 -0.892 1
1 462 . 17 1 1 A 38 38 ARG HA H 38 4.919 4.438 0.481 1
1 469 . 17 1 1 A 38 38 ARG C C 38 176.514 178.425 -1.911 1
1 470 . 17 1 1 A 38 38 ARG CA C 38 56.687 58.020 -1.333 1
1 471 . 17 1 1 A 38 38 ARG CB C 38 32.434 31.369 1.065 1
1 474 . 17 1 1 A 38 38 ARG N N 38 117.062 120.456 -3.394 1
1 475 . 17 1 1 A 39 39 ILE H H 39 8.462 7.882 0.580 1
1 476 . 17 1 1 A 39 39 ILE HA H 39 3.618 3.839 -0.221 1
1 486 . 17 1 1 A 39 39 ILE C C 39 176.267 178.254 -1.987 1
1 487 . 17 1 1 A 39 39 ILE CA C 39 66.134 64.827 1.307 1
1 488 . 17 1 1 A 39 39 ILE CB C 39 39.787 38.104 1.683 1
1 492 . 17 1 1 A 39 39 ILE N N 39 121.214 120.472 0.742 1
1 493 . 17 1 1 A 40 40 ILE H H 40 9.339 8.264 1.075 1
1 494 . 17 1 1 A 40 40 ILE HA H 40 3.401 3.781 -0.380 1
1 504 . 17 1 1 A 40 40 ILE CA C 40 67.844 66.381 1.463 1
1 505 . 17 1 1 A 40 40 ILE CB C 40 34.406 35.488 -1.082 1
1 509 . 17 1 1 A 40 40 ILE N N 40 119.695 121.453 -1.758 1
1 510 . 17 1 1 A 41 41 PRO HA H 41 4.314 4.424 -0.110 1
1 517 . 17 1 1 A 41 41 PRO C C 41 177.418 178.704 -1.286 1
1 518 . 17 1 1 A 41 41 PRO CA C 41 65.912 65.437 0.475 1
1 519 . 17 1 1 A 41 41 PRO CB C 41 30.686 31.370 -0.684 1
1 522 . 17 1 1 A 42 42 SER H H 42 6.857 8.017 -1.160 1
1 523 . 17 1 1 A 42 42 SER HA H 42 4.558 4.465 0.093 1
1 526 . 17 1 1 A 42 42 SER C C 42 174.813 176.305 -1.492 1
1 527 . 17 1 1 A 42 42 SER CA C 42 61.279 60.516 0.763 1
1 528 . 17 1 1 A 42 42 SER CB C 42 64.285 64.300 -0.015 1
1 529 . 17 1 1 A 42 42 SER N N 42 108.994 113.006 -4.012 1
1 530 . 17 1 1 A 43 43 LEU H H 43 8.230 8.079 0.151 1
1 531 . 17 1 1 A 43 43 LEU HA H 43 4.572 4.400 0.172 1
1 541 . 17 1 1 A 43 43 LEU C C 43 177.301 178.881 -1.580 1
1 542 . 17 1 1 A 43 43 LEU CA C 43 54.113 55.279 -1.166 1
1 543 . 17 1 1 A 43 43 LEU CB C 43 44.800 42.398 2.402 1
1 547 . 17 1 1 A 43 43 LEU N N 43 118.715 120.476 -1.761 1
1 548 . 17 1 1 A 44 44 GLY H H 44 8.498 8.646 -0.148 1
1 549 . 17 1 1 A 44 44 GLY HA2 H 44 4.010 3.764 0.246 1
1 550 . 17 1 1 A 44 44 GLY HA3 H 44 3.613 3.821 -0.208 1
1 551 . 17 1 1 A 44 44 GLY C C 44 174.178 175.886 -1.708 1
1 552 . 17 1 1 A 44 44 GLY CA C 44 46.271 47.404 -1.133 1
1 553 . 17 1 1 A 44 44 GLY N N 44 105.371 107.330 -1.959 1
1 554 . 17 1 1 A 45 45 ASN H H 45 8.385 8.307 0.078 1
1 555 . 17 1 1 A 45 45 ASN HA H 45 4.789 4.528 0.261 1
1 560 . 17 1 1 A 45 45 ASN C C 45 175.386 175.756 -0.370 1
1 561 . 17 1 1 A 45 45 ASN CA C 45 53.144 55.792 -2.648 1
1 562 . 17 1 1 A 45 45 ASN CB C 45 37.928 39.578 -1.650 1
1 563 . 17 1 1 A 45 45 ASN N N 45 114.387 119.285 -4.898 1
1 565 . 17 1 1 A 46 46 ILE H H 46 7.465 7.559 -0.094 1
1 566 . 17 1 1 A 46 46 ILE HA H 46 3.856 4.010 -0.154 1
1 576 . 17 1 1 A 46 46 ILE C C 46 175.997 176.389 -0.392 1
1 577 . 17 1 1 A 46 46 ILE CA C 46 60.853 62.201 -1.348 1
1 578 . 17 1 1 A 46 46 ILE CB C 46 38.042 38.231 -0.189 1
1 582 . 17 1 1 A 46 46 ILE N N 46 123.998 120.845 3.153 1
1 583 . 17 1 1 A 47 47 LYS H H 47 8.717 8.713 0.004 1
1 584 . 17 1 1 A 47 47 LYS HA H 47 4.249 4.326 -0.077 1
1 591 . 17 1 1 A 47 47 LYS C C 47 177.583 177.638 -0.055 1
1 592 . 17 1 1 A 47 47 LYS CA C 47 56.320 56.670 -0.350 1
1 593 . 17 1 1 A 47 47 LYS CB C 47 30.393 32.818 -2.425 1
1 596 . 17 1 1 A 47 47 LYS N N 47 126.114 124.670 1.444 1
1 597 . 17 1 1 A 48 48 LEU H H 48 8.323 8.733 -0.410 1
1 598 . 17 1 1 A 48 48 LEU HA H 48 3.691 4.016 -0.325 1
1 608 . 17 1 1 A 48 48 LEU C C 48 177.274 178.229 -0.955 1
1 609 . 17 1 1 A 48 48 LEU CA C 48 58.443 58.442 0.001 1
1 610 . 17 1 1 A 48 48 LEU CB C 48 42.282 41.198 1.084 1
1 614 . 17 1 1 A 48 48 LEU N N 48 125.857 126.025 -0.168 1
1 615 . 17 1 1 A 49 49 ALA H H 49 8.929 7.951 0.978 1
1 616 . 17 1 1 A 49 49 ALA HA H 49 4.067 4.022 0.045 1
1 620 . 17 1 1 A 49 49 ALA C C 49 177.468 178.553 -1.085 1
1 621 . 17 1 1 A 49 49 ALA CA C 49 53.092 54.540 -1.448 1
1 622 . 17 1 1 A 49 49 ALA CB C 49 18.562 18.240 0.322 1
1 623 . 17 1 1 A 49 49 ALA N N 49 115.543 120.200 -4.657 1
1 624 . 17 1 1 A 50 50 LYS H H 50 7.684 7.511 0.173 1
1 625 . 17 1 1 A 50 50 LYS HA H 50 4.395 4.274 0.121 1
1 634 . 17 1 1 A 50 50 LYS C C 50 174.958 176.870 -1.912 1
1 635 . 17 1 1 A 50 50 LYS CA C 50 53.977 56.957 -2.980 1
1 636 . 17 1 1 A 50 50 LYS CB C 50 32.645 32.561 0.084 1
1 640 . 17 1 1 A 50 50 LYS N N 50 114.788 114.979 -0.191 1
1 641 . 17 1 1 A 51 51 LEU H H 51 6.776 6.948 -0.172 1
1 642 . 17 1 1 A 51 51 LEU HA H 51 4.569 4.011 0.558 1
1 652 . 17 1 1 A 51 51 LEU C C 51 177.953 175.575 2.378 1
1 653 . 17 1 1 A 51 51 LEU CA C 51 55.318 54.679 0.639 1
1 654 . 17 1 1 A 51 51 LEU CB C 51 43.182 40.388 2.794 1
1 658 . 17 1 1 A 51 51 LEU N N 51 121.408 122.089 -0.681 1
1 659 . 17 1 1 A 52 52 THR H H 52 10.680 7.656 3.024 1
1 660 . 17 1 1 A 52 52 THR HA H 52 4.938 4.519 0.419 1
1 665 . 17 1 1 A 52 52 THR C C 52 175.553 174.496 1.057 1
1 666 . 17 1 1 A 52 52 THR CA C 52 59.740 60.000 -0.260 1
1 667 . 17 1 1 A 52 52 THR CB C 52 73.557 70.925 2.632 1
1 669 . 17 1 1 A 52 52 THR N N 52 119.481 119.204 0.277 1
1 670 . 17 1 1 A 53 53 SER H H 53 9.278 9.011 0.267 1
1 671 . 17 1 1 A 53 53 SER HA H 53 4.261 4.148 0.113 1
1 674 . 17 1 1 A 53 53 SER C C 53 176.990 176.237 0.753 1
1 675 . 17 1 1 A 53 53 SER CA C 53 61.025 61.043 -0.018 1
1 676 . 17 1 1 A 53 53 SER CB C 53 62.312 62.907 -0.595 1
1 677 . 17 1 1 A 53 53 SER N N 53 116.343 121.812 -5.469 1
1 678 . 17 1 1 A 54 54 LEU H H 54 7.808 8.133 -0.325 1
1 679 . 17 1 1 A 54 54 LEU HA H 54 4.229 4.069 0.160 1
1 688 . 17 1 1 A 54 54 LEU C C 54 178.505 178.775 -0.270 1
1 689 . 17 1 1 A 54 54 LEU CA C 54 57.719 57.971 -0.252 1
1 690 . 17 1 1 A 54 54 LEU CB C 54 40.997 41.849 -0.852 1
1 694 . 17 1 1 A 54 54 LEU N N 54 126.055 123.330 2.725 1
1 695 . 17 1 1 A 55 55 HIS H H 55 7.798 8.050 -0.252 1
1 696 . 17 1 1 A 55 55 HIS HA H 55 4.311 4.296 0.015 1
1 701 . 17 1 1 A 55 55 HIS C C 55 180.044 177.571 2.473 1
1 702 . 17 1 1 A 55 55 HIS CA C 55 60.583 59.816 0.767 1
1 703 . 17 1 1 A 55 55 HIS CB C 55 31.445 29.776 1.669 1
1 706 . 17 1 1 A 55 55 HIS N N 55 118.683 117.961 0.722 1
1 707 . 17 1 1 A 56 56 MET H H 56 7.375 8.301 -0.926 1
1 708 . 17 1 1 A 56 56 MET HA H 56 4.513 4.033 0.480 1
1 716 . 17 1 1 A 56 56 MET C C 56 177.169 178.555 -1.386 1
1 717 . 17 1 1 A 56 56 MET CA C 56 55.823 59.342 -3.519 1
1 718 . 17 1 1 A 56 56 MET CB C 56 31.303 33.364 -2.061 1
1 721 . 17 1 1 A 56 56 MET N N 56 114.530 117.822 -3.292 1
1 722 . 17 1 1 A 57 57 GLN H H 57 8.387 8.167 0.220 1
1 723 . 17 1 1 A 57 57 GLN HA H 57 3.981 3.994 -0.013 1
1 730 . 17 1 1 A 57 57 GLN C C 57 178.033 178.652 -0.619 1
1 731 . 17 1 1 A 57 57 GLN CA C 57 57.922 59.125 -1.203 1
1 732 . 17 1 1 A 57 57 GLN CB C 57 29.012 28.469 0.543 1
1 734 . 17 1 1 A 57 57 GLN N N 57 120.713 119.487 1.226 1
1 736 . 17 1 1 A 58 58 ASN H H 58 8.765 8.322 0.443 1
1 737 . 17 1 1 A 58 58 ASN HA H 58 4.539 4.544 -0.005 1
1 742 . 17 1 1 A 58 58 ASN C C 58 178.084 177.521 0.563 1
1 743 . 17 1 1 A 58 58 ASN CA C 58 55.345 55.833 -0.488 1
1 744 . 17 1 1 A 58 58 ASN CB C 58 36.924 38.826 -1.902 1
1 745 . 17 1 1 A 58 58 ASN N N 58 117.390 117.770 -0.380 1
1 747 . 17 1 1 A 59 59 TYR H H 59 8.239 7.872 0.367 1
1 748 . 17 1 1 A 59 59 TYR HA H 59 4.586 4.193 0.393 1
1 755 . 17 1 1 A 59 59 TYR C C 59 178.015 176.891 1.124 1
1 756 . 17 1 1 A 59 59 TYR CA C 59 60.779 61.431 -0.652 1
1 757 . 17 1 1 A 59 59 TYR CB C 59 38.047 38.540 -0.493 1
1 762 . 17 1 1 A 59 59 TYR N N 59 122.335 123.040 -0.705 1
1 763 . 17 1 1 A 60 60 VAL H H 60 8.416 8.411 0.005 1
1 764 . 17 1 1 A 60 60 VAL HA H 60 3.244 3.513 -0.269 1
1 772 . 17 1 1 A 60 60 VAL C C 60 177.309 178.102 -0.793 1
1 773 . 17 1 1 A 60 60 VAL CA C 60 67.022 66.392 0.630 1
1 774 . 17 1 1 A 60 60 VAL CB C 60 30.929 31.390 -0.461 1
1 777 . 17 1 1 A 60 60 VAL N N 60 119.842 119.653 0.189 1
1 778 . 17 1 1 A 61 61 ASN H H 61 8.264 8.159 0.105 1
1 779 . 17 1 1 A 61 61 ASN HA H 61 4.305 4.436 -0.131 1
1 784 . 17 1 1 A 61 61 ASN C C 61 177.263 177.821 -0.558 1
1 785 . 17 1 1 A 61 61 ASN CA C 61 55.548 56.165 -0.617 1
1 786 . 17 1 1 A 61 61 ASN CB C 61 36.645 37.207 -0.562 1
1 787 . 17 1 1 A 61 61 ASN N N 61 119.103 120.188 -1.085 1
1 789 . 17 1 1 A 62 62 SER H H 62 8.143 7.588 0.555 1
1 790 . 17 1 1 A 62 62 SER HA H 62 4.343 4.193 0.150 1
1 793 . 17 1 1 A 62 62 SER C C 62 176.409 177.479 -1.070 1
1 794 . 17 1 1 A 62 62 SER CA C 62 61.612 60.933 0.679 1
1 795 . 17 1 1 A 62 62 SER CB C 62 62.219 63.068 -0.849 1
1 796 . 17 1 1 A 62 62 SER N N 62 118.254 115.233 3.021 1
1 797 . 17 1 1 A 63 63 LEU H H 63 7.664 8.122 -0.458 1
1 798 . 17 1 1 A 63 63 LEU HA H 63 4.003 3.845 0.158 1
1 808 . 17 1 1 A 63 63 LEU C C 63 178.748 178.908 -0.160 1
1 809 . 17 1 1 A 63 63 LEU CA C 63 57.171 57.888 -0.717 1
1 810 . 17 1 1 A 63 63 LEU CB C 63 41.134 41.103 0.031 1
1 814 . 17 1 1 A 63 63 LEU N N 63 123.812 122.661 1.151 1
1 815 . 17 1 1 A 64 64 ARG H H 64 7.969 7.502 0.467 1
1 816 . 17 1 1 A 64 64 ARG HA H 64 4.038 3.976 0.062 1
1 824 . 17 1 1 A 64 64 ARG C C 64 180.797 178.025 2.772 1
1 825 . 17 1 1 A 64 64 ARG CA C 64 58.598 58.855 -0.257 1
1 826 . 17 1 1 A 64 64 ARG CB C 64 28.849 29.772 -0.923 1
1 829 . 17 1 1 A 64 64 ARG N N 64 120.376 120.582 -0.206 1
1 831 . 17 1 1 A 65 65 ASP H H 65 8.465 8.038 0.427 1
1 832 . 17 1 1 A 65 65 ASP HA H 65 4.408 4.379 0.029 1
1 835 . 17 1 1 A 65 65 ASP C C 65 177.336 177.979 -0.643 1
1 836 . 17 1 1 A 65 65 ASP CA C 65 56.957 56.983 -0.026 1
1 837 . 17 1 1 A 65 65 ASP CB C 65 39.602 40.940 -1.338 1
1 838 . 17 1 1 A 65 65 ASP N N 65 122.402 120.101 2.301 1
1 839 . 17 1 1 A 66 66 GLU H H 66 7.703 7.917 -0.214 1
1 840 . 17 1 1 A 66 66 GLU HA H 66 4.213 4.325 -0.112 1
1 845 . 17 1 1 A 66 66 GLU C C 66 176.586 177.071 -0.485 1
1 846 . 17 1 1 A 66 66 GLU CA C 66 56.974 56.290 0.684 1
1 847 . 17 1 1 A 66 66 GLU CB C 66 29.821 30.011 -0.190 1
1 849 . 17 1 1 A 66 66 GLU N N 66 119.076 116.002 3.074 1
1 850 . 17 1 1 A 67 67 GLY H H 67 7.861 7.753 0.108 1
1 851 . 17 1 1 A 67 67 GLY HA2 H 67 4.269 3.918 0.351 1
1 852 . 17 1 1 A 67 67 GLY HA3 H 67 3.731 3.923 -0.192 1
1 853 . 17 1 1 A 67 67 GLY C C 67 174.614 174.945 -0.331 1
1 854 . 17 1 1 A 67 67 GLY CA C 67 44.608 46.377 -1.769 1
1 855 . 17 1 1 A 67 67 GLY N N 67 105.730 109.940 -4.210 1
1 856 . 17 1 1 A 68 68 LEU H H 68 7.324 7.855 -0.531 1
1 857 . 17 1 1 A 68 68 LEU HA H 68 4.257 4.183 0.074 1
1 867 . 17 1 1 A 68 68 LEU C C 68 176.136 177.246 -1.110 1
1 868 . 17 1 1 A 68 68 LEU CA C 68 55.659 54.798 0.861 1
1 869 . 17 1 1 A 68 68 LEU CB C 68 41.874 42.175 -0.301 1
1 873 . 17 1 1 A 68 68 LEU N N 68 121.062 121.441 -0.379 1
1 874 . 17 1 1 A 69 69 LYS H H 69 8.368 8.463 -0.095 1
1 875 . 17 1 1 A 69 69 LYS HA H 69 4.281 4.546 -0.265 1
1 884 . 17 1 1 A 69 69 LYS C C 69 177.940 178.177 -0.237 1
1 885 . 17 1 1 A 69 69 LYS CA C 69 55.412 55.440 -0.028 1
1 886 . 17 1 1 A 69 69 LYS CB C 69 32.761 33.448 -0.687 1
1 890 . 17 1 1 A 69 69 LYS N N 69 120.120 122.241 -2.121 1
1 891 . 17 1 1 A 70 70 ARG H H 70 9.095 8.864 0.231 1
1 892 . 17 1 1 A 70 70 ARG HA H 70 3.684 4.070 -0.386 1
1 900 . 17 1 1 A 70 70 ARG C C 70 177.712 178.613 -0.901 1
1 901 . 17 1 1 A 70 70 ARG CA C 70 60.216 58.408 1.808 1
1 902 . 17 1 1 A 70 70 ARG CB C 70 29.539 29.816 -0.277 1
1 905 . 17 1 1 A 70 70 ARG N N 70 123.339 118.722 4.617 1
1 907 . 17 1 1 A 71 71 GLY H H 71 8.985 8.348 0.637 1
1 908 . 17 1 1 A 71 71 GLY HA2 H 71 3.932 3.670 0.262 1
1 909 . 17 1 1 A 71 71 GLY HA3 H 71 3.905 3.671 0.234 1
1 910 . 17 1 1 A 71 71 GLY C C 71 176.324 175.744 0.580 1
1 911 . 17 1 1 A 71 71 GLY CA C 71 46.752 47.432 -0.680 1
1 912 . 17 1 1 A 71 71 GLY N N 71 104.509 108.794 -4.285 1
1 913 . 17 1 1 A 72 72 THR H H 72 7.295 8.057 -0.762 1
1 914 . 17 1 1 A 72 72 THR HA H 72 4.014 3.837 0.177 1
1 919 . 17 1 1 A 72 72 THR C C 72 175.135 176.098 -0.963 1
1 920 . 17 1 1 A 72 72 THR CA C 72 65.848 66.382 -0.534 1
1 921 . 17 1 1 A 72 72 THR CB C 72 68.160 68.316 -0.156 1
1 923 . 17 1 1 A 72 72 THR N N 72 118.617 117.400 1.217 1
1 924 . 17 1 1 A 73 73 ILE H H 73 7.883 7.955 -0.072 1
1 925 . 17 1 1 A 73 73 ILE HA H 73 3.258 3.468 -0.210 1
1 935 . 17 1 1 A 73 73 ILE C C 73 177.060 178.020 -0.960 1
1 936 . 17 1 1 A 73 73 ILE CA C 73 66.561 65.704 0.857 1
1 937 . 17 1 1 A 73 73 ILE CB C 73 37.339 37.623 -0.284 1
1 941 . 17 1 1 A 73 73 ILE N N 73 121.692 121.414 0.278 1
1 942 . 17 1 1 A 74 74 GLU H H 74 8.723 8.282 0.441 1
1 943 . 17 1 1 A 74 74 GLU HA H 74 3.807 3.935 -0.128 1
1 948 . 17 1 1 A 74 74 GLU C C 74 178.319 178.947 -0.628 1
1 949 . 17 1 1 A 74 74 GLU CA C 74 59.637 60.000 -0.363 1
1 950 . 17 1 1 A 74 74 GLU CB C 74 29.257 29.443 -0.186 1
1 952 . 17 1 1 A 74 74 GLU N N 74 117.701 120.286 -2.585 1
1 953 . 17 1 1 A 75 75 LYS H H 75 7.361 7.285 0.076 1
1 954 . 17 1 1 A 75 75 LYS HA H 75 3.958 4.102 -0.144 1
1 963 . 17 1 1 A 75 75 LYS C C 75 178.554 179.771 -1.217 1
1 964 . 17 1 1 A 75 75 LYS CA C 75 59.764 59.346 0.418 1
1 965 . 17 1 1 A 75 75 LYS CB C 75 32.314 32.211 0.103 1
1 969 . 17 1 1 A 75 75 LYS N N 75 118.734 118.396 0.338 1
1 970 . 17 1 1 A 76 76 ILE H H 76 7.713 7.264 0.449 1
1 971 . 17 1 1 A 76 76 ILE HA H 76 3.221 3.943 -0.722 1
1 981 . 17 1 1 A 76 76 ILE C C 76 177.504 178.226 -0.722 1
1 982 . 17 1 1 A 76 76 ILE CA C 76 65.796 64.600 1.196 1
1 983 . 17 1 1 A 76 76 ILE CB C 76 37.732 36.812 0.920 1
1 987 . 17 1 1 A 76 76 ILE N N 76 120.312 116.682 3.630 1
1 988 . 17 1 1 A 77 77 ILE H H 77 8.587 8.156 0.431 1
1 989 . 17 1 1 A 77 77 ILE HA H 77 3.778 3.631 0.147 1
1 999 . 17 1 1 A 77 77 ILE C C 77 177.074 177.771 -0.697 1
1 1000 . 17 1 1 A 77 77 ILE CA C 77 63.168 65.497 -2.329 1
1 1001 . 17 1 1 A 77 77 ILE CB C 77 36.617 37.760 -1.143 1
1 1005 . 17 1 1 A 77 77 ILE N N 77 118.978 120.903 -1.925 1
1 1006 . 17 1 1 A 78 78 LYS H H 78 8.050 7.897 0.153 1
1 1007 . 17 1 1 A 78 78 LYS HA H 78 3.925 4.054 -0.129 1
1 1016 . 17 1 1 A 78 78 LYS C C 78 178.291 179.036 -0.745 1
1 1017 . 17 1 1 A 78 78 LYS CA C 78 60.192 59.514 0.678 1
1 1018 . 17 1 1 A 78 78 LYS CB C 78 31.886 32.514 -0.628 1
1 1022 . 17 1 1 A 78 78 LYS N N 78 121.618 119.345 2.273 1
1 1023 . 17 1 1 A 79 79 VAL H H 79 7.619 7.729 -0.110 1
1 1024 . 17 1 1 A 79 79 VAL HA H 79 3.846 3.908 -0.062 1
1 1032 . 17 1 1 A 79 79 VAL C C 79 177.712 178.157 -0.445 1
1 1033 . 17 1 1 A 79 79 VAL CA C 79 66.494 66.567 -0.073 1
1 1034 . 17 1 1 A 79 79 VAL CB C 79 31.298 31.862 -0.564 1
1 1037 . 17 1 1 A 79 79 VAL N N 79 120.254 119.528 0.726 1
1 1038 . 17 1 1 A 80 80 ILE H H 80 7.885 7.913 -0.028 1
1 1039 . 17 1 1 A 80 80 ILE HA H 80 3.367 3.827 -0.460 1
1 1049 . 17 1 1 A 80 80 ILE C C 80 179.892 177.812 2.080 1
1 1050 . 17 1 1 A 80 80 ILE CA C 80 65.343 65.109 0.234 1
1 1051 . 17 1 1 A 80 80 ILE CB C 80 38.129 37.416 0.713 1
1 1055 . 17 1 1 A 80 80 ILE N N 80 119.666 118.885 0.781 1
1 1056 . 17 1 1 A 81 81 ARG H H 81 9.384 8.365 1.019 1
1 1057 . 17 1 1 A 81 81 ARG HA H 81 3.834 3.946 -0.112 1
1 1065 . 17 1 1 A 81 81 ARG C C 81 178.204 179.129 -0.925 1
1 1066 . 17 1 1 A 81 81 ARG CA C 81 60.560 59.778 0.782 1
1 1067 . 17 1 1 A 81 81 ARG CB C 81 30.196 30.149 0.047 1
1 1070 . 17 1 1 A 81 81 ARG N N 81 121.030 120.759 0.271 1
1 1072 . 17 1 1 A 82 82 ASN H H 82 8.773 7.905 0.868 1
1 1073 . 17 1 1 A 82 82 ASN HA H 82 4.587 4.677 -0.090 1
1 1078 . 17 1 1 A 82 82 ASN C C 82 178.300 178.200 0.100 1
1 1079 . 17 1 1 A 82 82 ASN CA C 82 56.160 56.024 0.136 1
1 1080 . 17 1 1 A 82 82 ASN CB C 82 38.464 38.767 -0.303 1
1 1081 . 17 1 1 A 82 82 ASN N N 82 118.483 118.583 -0.100 1
1 1083 . 17 1 1 A 83 83 SER H H 83 8.526 7.838 0.688 1
1 1084 . 17 1 1 A 83 83 SER HA H 83 2.765 3.205 -0.440 1
1 1087 . 17 1 1 A 83 83 SER C C 83 176.386 176.264 0.122 1
1 1088 . 17 1 1 A 83 83 SER CA C 83 61.245 62.029 -0.784 1
1 1089 . 17 1 1 A 83 83 SER CB C 83 61.287 62.665 -1.378 1
1 1090 . 17 1 1 A 83 83 SER N N 83 118.286 116.469 1.817 1
1 1091 . 17 1 1 A 84 84 LEU H H 84 7.782 8.268 -0.486 1
1 1092 . 17 1 1 A 84 84 LEU HA H 84 4.221 4.022 0.199 1
1 1102 . 17 1 1 A 84 84 LEU C C 84 177.846 179.360 -1.514 1
1 1103 . 17 1 1 A 84 84 LEU CA C 84 57.166 57.720 -0.554 1
1 1104 . 17 1 1 A 84 84 LEU CB C 84 40.520 41.089 -0.569 1
1 1108 . 17 1 1 A 84 84 LEU N N 84 127.445 121.094 6.351 1
1 1109 . 17 1 1 A 85 85 GLU H H 85 8.264 8.301 -0.037 1
1 1110 . 17 1 1 A 85 85 GLU HA H 85 3.981 3.945 0.036 1
1 1115 . 17 1 1 A 85 85 GLU C C 85 179.288 179.466 -0.178 1
1 1116 . 17 1 1 A 85 85 GLU CA C 85 59.025 60.317 -1.292 1
1 1117 . 17 1 1 A 85 85 GLU CB C 85 29.182 29.590 -0.408 1
1 1119 . 17 1 1 A 85 85 GLU N N 85 121.538 120.380 1.158 1
1 1120 . 17 1 1 A 86 86 HIS H H 86 7.683 7.949 -0.266 1
1 1121 . 17 1 1 A 86 86 HIS HA H 86 4.573 4.397 0.176 1
1 1125 . 17 1 1 A 86 86 HIS C C 86 175.484 177.489 -2.005 1
1 1126 . 17 1 1 A 86 86 HIS CA C 86 58.940 59.288 -0.348 1
1 1127 . 17 1 1 A 86 86 HIS CB C 86 29.267 30.128 -0.861 1
1 1129 . 17 1 1 A 86 86 HIS N N 86 117.087 120.197 -3.110 1
1 1130 . 17 1 1 A 87 87 ALA H H 87 7.197 7.970 -0.773 1
1 1131 . 17 1 1 A 87 87 ALA HA H 87 3.925 4.052 -0.127 1
1 1135 . 17 1 1 A 87 87 ALA C C 87 179.038 180.032 -0.994 1
1 1136 . 17 1 1 A 87 87 ALA CA C 87 54.863 54.512 0.351 1
1 1137 . 17 1 1 A 87 87 ALA CB C 87 17.034 18.292 -1.258 1
1 1138 . 17 1 1 A 87 87 ALA N N 87 121.510 120.768 0.742 1
1 1139 . 17 1 1 A 88 88 ILE H H 88 7.819 7.669 0.150 1
1 1140 . 17 1 1 A 88 88 ILE HA H 88 4.067 3.804 0.263 1
1 1150 . 17 1 1 A 88 88 ILE C C 88 180.846 177.303 3.543 1
1 1151 . 17 1 1 A 88 88 ILE CA C 88 64.021 64.825 -0.804 1
1 1152 . 17 1 1 A 88 88 ILE CB C 88 37.557 37.158 0.399 1
1 1156 . 17 1 1 A 88 88 ILE N N 88 120.898 118.934 1.964 1
1 1157 . 17 1 1 A 89 89 ASP H H 89 7.808 7.994 -0.186 1
1 1158 . 17 1 1 A 89 89 ASP HA H 89 4.437 4.317 0.120 1
1 1161 . 17 1 1 A 89 89 ASP C C 89 178.033 178.045 -0.012 1
1 1162 . 17 1 1 A 89 89 ASP CA C 89 57.343 57.784 -0.441 1
1 1163 . 17 1 1 A 89 89 ASP CB C 89 39.689 41.690 -2.001 1
1 1164 . 17 1 1 A 89 89 ASP N N 89 125.174 121.608 3.566 1
1 1165 . 17 1 1 A 90 90 LEU H H 90 7.607 7.632 -0.025 1
1 1166 . 17 1 1 A 90 90 LEU HA H 90 4.198 4.218 -0.020 1
1 1176 . 17 1 1 A 90 90 LEU C C 90 175.416 176.047 -0.631 1
1 1177 . 17 1 1 A 90 90 LEU CA C 90 54.755 55.150 -0.395 1
1 1178 . 17 1 1 A 90 90 LEU CB C 90 42.960 41.967 0.993 1
1 1182 . 17 1 1 A 90 90 LEU N N 90 117.576 117.258 0.318 1
1 1183 . 17 1 1 A 91 91 GLU H H 91 8.143 8.018 0.125 1
1 1184 . 17 1 1 A 91 91 GLU HA H 91 4.005 4.021 -0.016 1
1 1189 . 17 1 1 A 91 91 GLU C C 91 175.792 176.153 -0.361 1
1 1190 . 17 1 1 A 91 91 GLU CA C 91 57.202 57.670 -0.468 1
1 1191 . 17 1 1 A 91 91 GLU CB C 91 26.125 26.964 -0.839 1
1 1193 . 17 1 1 A 91 91 GLU N N 91 113.620 115.308 -1.688 1
1 1194 . 17 1 1 A 92 92 LEU H H 92 8.290 7.906 0.384 1
1 1195 . 17 1 1 A 92 92 LEU HA H 92 4.216 4.132 0.084 1
1 1205 . 17 1 1 A 92 92 LEU C C 92 176.622 176.961 -0.339 1
1 1206 . 17 1 1 A 92 92 LEU CA C 92 56.410 56.745 -0.335 1
1 1207 . 17 1 1 A 92 92 LEU CB C 92 43.378 42.506 0.872 1
1 1211 . 17 1 1 A 92 92 LEU N N 92 116.868 119.565 -2.697 1
1 1212 . 17 1 1 A 93 93 ILE H H 93 6.988 7.074 -0.086 1
1 1213 . 17 1 1 A 93 93 ILE HA H 93 4.580 4.589 -0.009 1
1 1223 . 17 1 1 A 93 93 ILE C C 93 175.145 175.512 -0.367 1
1 1224 . 17 1 1 A 93 93 ILE CA C 93 58.707 58.531 0.176 1
1 1225 . 17 1 1 A 93 93 ILE CB C 93 42.864 41.399 1.465 1
1 1229 . 17 1 1 A 93 93 ILE N N 93 107.565 113.891 -6.326 1
1 1230 . 17 1 1 A 94 94 THR H H 94 8.742 8.626 0.116 1
1 1231 . 17 1 1 A 94 94 THR HA H 94 4.489 4.290 0.199 1
1 1236 . 17 1 1 A 94 94 THR C C 94 173.875 174.491 -0.616 1
1 1237 . 17 1 1 A 94 94 THR CA C 94 61.842 62.946 -1.104 1
1 1238 . 17 1 1 A 94 94 THR CB C 94 69.972 69.158 0.814 1
1 1240 . 17 1 1 A 94 94 THR N N 94 107.904 113.774 -5.870 1
1 1241 . 17 1 1 A 95 95 LYS H H 95 7.294 7.522 -0.228 1
1 1242 . 17 1 1 A 95 95 LYS HA H 95 4.566 4.711 -0.145 1
1 1251 . 17 1 1 A 95 95 LYS C C 95 173.791 174.362 -0.571 1
1 1252 . 17 1 1 A 95 95 LYS CA C 95 54.533 55.911 -1.378 1
1 1253 . 17 1 1 A 95 95 LYS CB C 95 35.123 35.632 -0.509 1
1 1257 . 17 1 1 A 95 95 LYS N N 95 119.458 120.293 -0.835 1
1 1258 . 17 1 1 A 96 96 ASN H H 96 9.157 8.821 0.336 1
1 1259 . 17 1 1 A 96 96 ASN HA H 96 4.408 4.774 -0.366 1
1 1264 . 17 1 1 A 96 96 ASN C C 96 176.653 176.099 0.554 1
1 1265 . 17 1 1 A 96 96 ASN CA C 96 51.088 52.662 -1.574 1
1 1266 . 17 1 1 A 96 96 ASN CB C 96 37.292 38.486 -1.194 1
1 1267 . 17 1 1 A 96 96 ASN N N 96 121.031 124.470 -3.439 1
1 1269 . 17 1 1 A 97 97 VAL H H 97 8.193 8.303 -0.110 1
1 1270 . 17 1 1 A 97 97 VAL HA H 97 4.019 3.858 0.161 1
1 1278 . 17 1 1 A 97 97 VAL C C 97 175.089 176.207 -1.118 1
1 1279 . 17 1 1 A 97 97 VAL CA C 97 63.437 64.070 -0.633 1
1 1280 . 17 1 1 A 97 97 VAL CB C 97 29.934 31.401 -1.467 1
1 1283 . 17 1 1 A 97 97 VAL N N 97 118.839 122.560 -3.721 1
1 1284 . 17 1 1 A 98 98 ALA H H 98 7.994 7.704 0.290 1
1 1285 . 17 1 1 A 98 98 ALA HA H 98 5.108 4.557 0.551 1
1 1289 . 17 1 1 A 98 98 ALA C C 98 178.033 178.308 -0.275 1
1 1290 . 17 1 1 A 98 98 ALA CA C 98 50.342 52.772 -2.430 1
1 1291 . 17 1 1 A 98 98 ALA CB C 98 19.659 18.534 1.125 1
1 1292 . 17 1 1 A 98 98 ALA N N 98 121.031 124.595 -3.564 1
1 1293 . 17 1 1 A 99 99 ALA H H 99 7.347 7.349 -0.002 1
1 1294 . 17 1 1 A 99 99 ALA HA H 99 3.818 4.036 -0.218 1
1 1298 . 17 1 1 A 99 99 ALA C C 99 177.712 178.632 -0.920 1
1 1299 . 17 1 1 A 99 99 ALA CA C 99 55.117 54.912 0.205 1
1 1300 . 17 1 1 A 99 99 ALA CB C 99 18.879 18.494 0.385 1
1 1301 . 17 1 1 A 99 99 ALA N N 99 122.816 121.173 1.643 1
1 1302 . 17 1 1 A 100 100 LYS H H 100 8.190 7.312 0.878 1
1 1303 . 17 1 1 A 100 100 LYS HA H 100 4.483 4.353 0.130 1
1 1312 . 17 1 1 A 100 100 LYS C C 100 175.899 177.147 -1.248 1
1 1313 . 17 1 1 A 100 100 LYS CA C 100 54.231 57.289 -3.058 1
1 1314 . 17 1 1 A 100 100 LYS CB C 100 32.066 32.972 -0.906 1
1 1318 . 17 1 1 A 100 100 LYS N N 100 113.197 115.252 -2.055 1
1 1319 . 17 1 1 A 101 101 THR H H 101 7.128 7.621 -0.493 1
1 1320 . 17 1 1 A 101 101 THR HA H 101 3.834 4.260 -0.426 1
1 1325 . 17 1 1 A 101 101 THR C C 101 173.255 173.731 -0.476 1
1 1326 . 17 1 1 A 101 101 THR CA C 101 64.392 62.718 1.674 1
1 1327 . 17 1 1 A 101 101 THR CB C 101 69.160 67.747 1.413 1
1 1329 . 17 1 1 A 101 101 THR N N 101 118.368 116.164 2.204 1
1 1330 . 17 1 1 A 102 102 LYS H H 102 8.753 8.548 0.205 1
1 1331 . 17 1 1 A 102 102 LYS HA H 102 4.438 4.969 -0.531 1
1 1340 . 17 1 1 A 102 102 LYS C C 102 175.627 174.823 0.804 1
1 1341 . 17 1 1 A 102 102 LYS CA C 102 55.117 54.337 0.780 1
1 1342 . 17 1 1 A 102 102 LYS CB C 102 33.901 36.011 -2.110 1
1 1346 . 17 1 1 A 102 102 LYS N N 102 126.513 126.133 0.380 1
1 1347 . 17 1 1 A 103 103 LEU H H 103 8.602 8.511 0.091 1
1 1348 . 17 1 1 A 103 103 LEU HA H 103 4.486 4.503 -0.017 1
1 1358 . 17 1 1 A 103 103 LEU CA C 103 52.233 52.613 -0.380 1
1 1359 . 17 1 1 A 103 103 LEU CB C 103 41.028 42.851 -1.823 1
1 1363 . 17 1 1 A 103 103 LEU N N 103 124.466 123.161 1.305 1
1 1364 . 17 1 1 A 104 104 PRO HA H 104 4.437 4.395 0.042 1
1 1371 . 17 1 1 A 104 104 PRO C C 104 175.779 176.770 -0.991 1
1 1372 . 17 1 1 A 104 104 PRO CA C 104 62.322 65.647 -3.325 1
1 1373 . 17 1 1 A 104 104 PRO CB C 104 31.899 31.489 0.410 1
1 1376 . 17 1 1 A 105 105 LYS H H 105 8.460 7.867 0.593 1
1 1377 . 17 1 1 A 105 105 LYS HA H 105 4.154 4.545 -0.391 1
1 1386 . 17 1 1 A 105 105 LYS C C 105 175.998 175.454 0.544 1
1 1387 . 17 1 1 A 105 105 LYS CA C 105 56.480 55.242 1.238 1
1 1388 . 17 1 1 A 105 105 LYS CB C 105 32.909 33.417 -0.508 1
1 1392 . 17 1 1 A 105 105 LYS N N 105 122.139 116.234 5.905 1
1 1393 . 17 1 1 A 106 106 ALA H H 106 8.448 8.596 -0.148 1
1 1394 . 17 1 1 A 106 106 ALA HA H 106 4.309 4.525 -0.216 1
1 1398 . 17 1 1 A 106 106 ALA C C 106 176.828 176.291 0.537 1
1 1399 . 17 1 1 A 106 106 ALA CA C 106 51.862 52.875 -1.013 1
1 1400 . 17 1 1 A 106 106 ALA CB C 106 19.323 21.677 -2.354 1
1 1401 . 17 1 1 A 106 106 ALA N N 106 125.278 124.702 0.576 1
1 1402 . 17 1 1 A 107 107 ASP H H 107 8.428 7.849 0.579 1
1 1403 . 17 1 1 A 107 107 ASP HA H 107 4.574 5.012 -0.438 1
1 1406 . 17 1 1 A 107 107 ASP C C 107 175.951 174.437 1.514 1
1 1407 . 17 1 1 A 107 107 ASP CA C 107 54.214 52.749 1.465 1
1 1408 . 17 1 1 A 107 107 ASP CB C 107 41.141 44.735 -3.594 1
1 1409 . 17 1 1 A 107 107 ASP N N 107 120.771 116.200 4.571 1
1 1410 . 17 1 1 A 108 108 LYS H H 108 8.329 8.171 0.158 1
1 1411 . 17 1 1 A 108 108 LYS HA H 108 4.203 4.522 -0.319 1
1 1420 . 17 1 1 A 108 108 LYS C C 108 176.483 176.071 0.412 1
1 1421 . 17 1 1 A 108 108 LYS CA C 108 56.831 56.165 0.666 1
1 1422 . 17 1 1 A 108 108 LYS CB C 108 32.648 33.257 -0.609 1
1 1426 . 17 1 1 A 108 108 LYS N N 108 120.727 119.357 1.370 1
1 1427 . 17 1 1 A 109 109 GLU H H 109 8.447 8.982 -0.535 1
1 1428 . 17 1 1 A 109 109 GLU HA H 109 4.215 4.397 -0.182 1
1 1433 . 17 1 1 A 109 109 GLU C C 109 176.513 177.757 -1.244 1
1 1434 . 17 1 1 A 109 109 GLU CA C 109 56.936 56.529 0.407 1
1 1435 . 17 1 1 A 109 109 GLU CB C 109 29.833 30.099 -0.266 1
1 1437 . 17 1 1 A 109 109 GLU N N 109 121.471 122.409 -0.938 1
1 1438 . 17 1 1 A 110 110 GLU H H 110 8.352 8.860 -0.508 1
1 1439 . 17 1 1 A 110 110 GLU HA H 110 4.233 4.119 0.114 1
1 1444 . 17 1 1 A 110 110 GLU C C 110 176.439 178.571 -2.132 1
1 1445 . 17 1 1 A 110 110 GLU CA C 110 56.681 59.141 -2.460 1
1 1446 . 17 1 1 A 110 110 GLU CB C 110 29.860 29.117 0.743 1
1 1448 . 17 1 1 A 110 110 GLU N N 110 121.559 125.841 -4.282 1
1 1449 . 17 1 1 A 111 111 LEU H H 111 8.145 8.299 -0.154 1
1 1450 . 17 1 1 A 111 111 LEU HA H 111 4.251 4.021 0.230 1
1 1460 . 17 1 1 A 111 111 LEU C C 111 177.306 178.695 -1.389 1
1 1461 . 17 1 1 A 111 111 LEU CA C 111 55.277 58.074 -2.797 1
1 1462 . 17 1 1 A 111 111 LEU CB C 111 42.054 41.210 0.844 1
1 1466 . 17 1 1 A 111 111 LEU N N 111 122.181 121.704 0.477 1
1 1467 . 17 1 1 A 112 112 GLU H H 112 8.212 7.687 0.525 1
1 1468 . 17 1 1 A 112 112 GLU N N 112 120.291 116.173 4.118 1
1 1469 . 17 1 1 A 114 114 HIS C C 114 176.070 175.408 0.662 1
1 1470 . 17 1 1 A 116 116 HIS H H 116 8.227 8.177 0.050 1
1 1471 . 17 1 1 A 116 116 HIS C C 116 173.580 175.323 -1.743 1
1 1472 . 17 1 1 A 116 116 HIS N N 116 119.156 123.891 -4.735 1
1 5 . 18 1 1 A 3 3 PRO HA H 3 4.390 4.648 -0.258 1
1 12 . 18 1 1 A 3 3 PRO C C 3 176.847 177.894 -1.047 1
1 13 . 18 1 1 A 3 3 PRO CA C 3 63.449 62.696 0.753 1
1 14 . 18 1 1 A 3 3 PRO CB C 3 31.938 31.938 0.000 1
1 17 . 18 1 1 A 4 4 SER H H 4 8.531 9.046 -0.515 1
1 18 . 18 1 1 A 4 4 SER HA H 4 4.262 4.173 0.089 1
1 21 . 18 1 1 A 4 4 SER C C 4 175.414 174.378 1.036 1
1 22 . 18 1 1 A 4 4 SER CA C 4 59.163 61.507 -2.344 1
1 23 . 18 1 1 A 4 4 SER CB C 4 63.242 62.828 0.414 1
1 24 . 18 1 1 A 4 4 SER N N 4 114.246 120.290 -6.044 1
1 25 . 18 1 1 A 5 5 LYS H H 5 8.468 7.761 0.707 1
1 26 . 18 1 1 A 5 5 LYS HA H 5 4.433 3.912 0.521 1
1 35 . 18 1 1 A 5 5 LYS C C 5 175.984 175.338 0.646 1
1 36 . 18 1 1 A 5 5 LYS CA C 5 55.724 57.470 -1.746 1
1 37 . 18 1 1 A 5 5 LYS CB C 5 32.881 29.311 3.570 1
1 41 . 18 1 1 A 5 5 LYS N N 5 123.488 119.399 4.089 1
1 42 . 18 1 1 A 6 6 LEU H H 6 7.707 8.132 -0.425 1
1 43 . 18 1 1 A 6 6 LEU HA H 6 4.381 4.295 0.086 1
1 53 . 18 1 1 A 6 6 LEU C C 6 177.820 175.866 1.954 1
1 54 . 18 1 1 A 6 6 LEU CA C 6 55.507 55.782 -0.275 1
1 55 . 18 1 1 A 6 6 LEU CB C 6 43.374 42.763 0.611 1
1 59 . 18 1 1 A 6 6 LEU N N 6 121.233 122.386 -1.153 1
1 60 . 18 1 1 A 7 7 SER H H 7 9.433 9.004 0.429 1
1 61 . 18 1 1 A 7 7 SER HA H 7 4.638 4.675 -0.037 1
1 64 . 18 1 1 A 7 7 SER C C 7 174.120 174.832 -0.712 1
1 65 . 18 1 1 A 7 7 SER CA C 7 57.962 58.357 -0.395 1
1 66 . 18 1 1 A 7 7 SER CB C 7 64.197 64.048 0.149 1
1 67 . 18 1 1 A 7 7 SER N N 7 122.977 121.848 1.129 1
1 68 . 18 1 1 A 8 8 TYR H H 8 9.764 9.007 0.757 1
1 69 . 18 1 1 A 8 8 TYR HA H 8 4.732 4.263 0.469 1
1 76 . 18 1 1 A 8 8 TYR C C 8 177.206 177.745 -0.539 1
1 77 . 18 1 1 A 8 8 TYR CA C 8 58.762 61.875 -3.113 1
1 78 . 18 1 1 A 8 8 TYR CB C 8 36.605 38.837 -2.232 1
1 83 . 18 1 1 A 8 8 TYR N N 8 123.312 127.950 -4.638 1
1 84 . 18 1 1 A 9 9 GLY H H 9 10.131 8.226 1.905 1
1 85 . 18 1 1 A 9 9 GLY HA2 H 9 3.983 3.650 0.333 1
1 86 . 18 1 1 A 9 9 GLY HA3 H 9 3.423 3.728 -0.305 1
1 87 . 18 1 1 A 9 9 GLY C C 9 175.163 176.259 -1.096 1
1 88 . 18 1 1 A 9 9 GLY CA C 9 47.153 47.231 -0.078 1
1 89 . 18 1 1 A 9 9 GLY N N 9 107.177 105.890 1.287 1
1 90 . 18 1 1 A 10 10 GLU H H 10 7.876 8.030 -0.154 1
1 91 . 18 1 1 A 10 10 GLU HA H 10 4.107 4.095 0.012 1
1 96 . 18 1 1 A 10 10 GLU C C 10 179.924 178.769 1.155 1
1 97 . 18 1 1 A 10 10 GLU CA C 10 58.890 59.462 -0.572 1
1 98 . 18 1 1 A 10 10 GLU CB C 10 29.750 29.214 0.536 1
1 100 . 18 1 1 A 10 10 GLU N N 10 122.219 121.900 0.319 1
1 101 . 18 1 1 A 11 11 TYR H H 11 8.384 8.138 0.246 1
1 102 . 18 1 1 A 11 11 TYR HA H 11 4.305 4.237 0.068 1
1 107 . 18 1 1 A 11 11 TYR C C 11 176.854 177.255 -0.401 1
1 108 . 18 1 1 A 11 11 TYR CA C 11 61.040 61.528 -0.488 1
1 109 . 18 1 1 A 11 11 TYR CB C 11 37.593 38.975 -1.382 1
1 112 . 18 1 1 A 11 11 TYR N N 11 120.809 122.886 -2.077 1
1 113 . 18 1 1 A 12 12 LEU H H 12 9.027 8.421 0.606 1
1 114 . 18 1 1 A 12 12 LEU HA H 12 3.778 3.755 0.023 1
1 124 . 18 1 1 A 12 12 LEU C C 12 178.621 179.655 -1.034 1
1 125 . 18 1 1 A 12 12 LEU CA C 12 57.534 57.624 -0.090 1
1 126 . 18 1 1 A 12 12 LEU CB C 12 41.957 40.994 0.963 1
1 130 . 18 1 1 A 12 12 LEU N N 12 121.080 119.051 2.029 1
1 131 . 18 1 1 A 13 13 GLU H H 13 7.614 8.185 -0.571 1
1 132 . 18 1 1 A 13 13 GLU HA H 13 4.102 4.079 0.023 1
1 137 . 18 1 1 A 13 13 GLU C C 13 178.449 179.440 -0.991 1
1 138 . 18 1 1 A 13 13 GLU CA C 13 59.609 59.515 0.094 1
1 139 . 18 1 1 A 13 13 GLU CB C 13 29.124 29.786 -0.662 1
1 141 . 18 1 1 A 13 13 GLU N N 13 118.475 120.501 -2.026 1
1 142 . 18 1 1 A 14 14 SER H H 14 7.329 7.692 -0.363 1
1 143 . 18 1 1 A 14 14 SER HA H 14 4.358 4.187 0.171 1
1 146 . 18 1 1 A 14 14 SER C C 14 176.794 175.914 0.880 1
1 147 . 18 1 1 A 14 14 SER CA C 14 61.064 62.440 -1.376 1
1 148 . 18 1 1 A 14 14 SER CB C 14 62.513 63.031 -0.518 1
1 149 . 18 1 1 A 14 14 SER N N 14 115.209 116.326 -1.117 1
1 150 . 18 1 1 A 15 15 TRP H H 15 8.870 8.265 0.605 1
1 151 . 18 1 1 A 15 15 TRP HA H 15 4.005 4.558 -0.553 1
1 160 . 18 1 1 A 15 15 TRP C C 15 177.547 177.544 0.003 1
1 161 . 18 1 1 A 15 15 TRP CA C 15 61.210 61.660 -0.450 1
1 162 . 18 1 1 A 15 15 TRP CB C 15 27.341 28.960 -1.619 1
1 168 . 18 1 1 A 15 15 TRP N N 15 124.998 123.972 1.026 1
1 170 . 18 1 1 A 16 16 PHE H H 16 9.087 8.275 0.812 1
1 171 . 18 1 1 A 16 16 PHE HA H 16 3.210 3.819 -0.609 1
1 179 . 18 1 1 A 16 16 PHE C C 16 175.909 176.821 -0.912 1
1 180 . 18 1 1 A 16 16 PHE CA C 16 61.473 61.313 0.160 1
1 181 . 18 1 1 A 16 16 PHE CB C 16 38.506 39.177 -0.671 1
1 187 . 18 1 1 A 16 16 PHE N N 16 119.825 121.259 -1.434 1
1 188 . 18 1 1 A 17 17 ASN H H 17 7.768 8.269 -0.501 1
1 189 . 18 1 1 A 17 17 ASN HA H 17 4.078 4.077 0.001 1
1 194 . 18 1 1 A 17 17 ASN C C 17 176.604 177.860 -1.256 1
1 195 . 18 1 1 A 17 17 ASN CA C 17 55.621 55.946 -0.325 1
1 196 . 18 1 1 A 17 17 ASN CB C 17 37.830 38.253 -0.423 1
1 197 . 18 1 1 A 17 17 ASN N N 17 115.600 116.904 -1.304 1
1 199 . 18 1 1 A 18 18 THR H H 18 7.454 7.225 0.229 1
1 200 . 18 1 1 A 18 18 THR HA H 18 4.147 4.084 0.063 1
1 205 . 18 1 1 A 18 18 THR C C 18 175.692 176.070 -0.378 1
1 206 . 18 1 1 A 18 18 THR CA C 18 64.679 64.761 -0.082 1
1 207 . 18 1 1 A 18 18 THR CB C 18 68.940 68.830 0.110 1
1 209 . 18 1 1 A 18 18 THR N N 18 113.049 115.058 -2.009 1
1 210 . 18 1 1 A 19 19 LYS H H 19 7.918 7.579 0.339 1
1 211 . 18 1 1 A 19 19 LYS HA H 19 3.791 3.605 0.186 1
1 220 . 18 1 1 A 19 19 LYS C C 19 178.120 178.535 -0.415 1
1 221 . 18 1 1 A 19 19 LYS CA C 19 55.985 58.861 -2.876 1
1 222 . 18 1 1 A 19 19 LYS CB C 19 31.130 31.243 -0.113 1
1 226 . 18 1 1 A 19 19 LYS N N 19 122.614 120.584 2.030 1
1 227 . 18 1 1 A 20 20 ARG H H 20 7.845 7.609 0.236 1
1 228 . 18 1 1 A 20 20 ARG HA H 20 3.396 3.704 -0.308 1
1 236 . 18 1 1 A 20 20 ARG C C 20 175.601 178.985 -3.384 1
1 237 . 18 1 1 A 20 20 ARG CA C 20 58.182 59.304 -1.122 1
1 238 . 18 1 1 A 20 20 ARG CB C 20 28.045 29.402 -1.357 1
1 241 . 18 1 1 A 20 20 ARG N N 20 116.282 118.047 -1.765 1
1 243 . 18 1 1 A 21 21 HIS H H 21 7.163 7.688 -0.525 1
1 244 . 18 1 1 A 21 21 HIS HA H 21 4.500 4.221 0.279 1
1 249 . 18 1 1 A 21 21 HIS C C 21 175.618 176.927 -1.309 1
1 250 . 18 1 1 A 21 21 HIS CA C 21 56.912 59.091 -2.179 1
1 251 . 18 1 1 A 21 21 HIS CB C 21 29.400 29.594 -0.194 1
1 254 . 18 1 1 A 21 21 HIS N N 21 115.452 119.119 -3.667 1
1 255 . 18 1 1 A 22 22 SER H H 22 7.951 7.538 0.413 1
1 256 . 18 1 1 A 22 22 SER HA H 22 4.573 4.430 0.143 1
1 259 . 18 1 1 A 22 22 SER C C 22 173.948 174.330 -0.382 1
1 260 . 18 1 1 A 22 22 SER CA C 22 58.589 60.318 -1.729 1
1 261 . 18 1 1 A 22 22 SER CB C 22 64.228 64.243 -0.015 1
1 262 . 18 1 1 A 22 22 SER N N 22 113.209 112.693 0.516 1
1 263 . 18 1 1 A 23 23 VAL H H 23 7.179 6.994 0.185 1
1 264 . 18 1 1 A 23 23 VAL HA H 23 4.626 4.458 0.168 1
1 272 . 18 1 1 A 23 23 VAL C C 23 175.397 175.985 -0.588 1
1 273 . 18 1 1 A 23 23 VAL CA C 23 59.556 60.219 -0.663 1
1 274 . 18 1 1 A 23 23 VAL CB C 23 33.810 34.327 -0.517 1
1 277 . 18 1 1 A 23 23 VAL N N 23 113.108 115.488 -2.380 1
1 278 . 18 1 1 A 24 24 GLY H H 24 8.189 8.404 -0.215 1
1 279 . 18 1 1 A 24 24 GLY HA2 H 24 4.074 4.032 0.042 1
1 280 . 18 1 1 A 24 24 GLY HA3 H 24 4.195 4.048 0.147 1
1 281 . 18 1 1 A 24 24 GLY C C 24 174.037 174.671 -0.634 1
1 282 . 18 1 1 A 24 24 GLY CA C 24 44.452 45.056 -0.604 1
1 283 . 18 1 1 A 24 24 GLY N N 24 108.374 108.721 -0.347 1
1 284 . 18 1 1 A 25 25 ILE H H 25 8.331 8.668 -0.337 1
1 285 . 18 1 1 A 25 25 ILE HA H 25 3.839 3.599 0.240 1
1 295 . 18 1 1 A 25 25 ILE C C 25 178.042 178.075 -0.033 1
1 296 . 18 1 1 A 25 25 ILE CA C 25 64.238 64.604 -0.366 1
1 297 . 18 1 1 A 25 25 ILE CB C 25 37.931 37.818 0.113 1
1 301 . 18 1 1 A 25 25 ILE N N 25 119.895 120.062 -0.167 1
1 302 . 18 1 1 A 26 26 GLN H H 26 8.545 8.211 0.334 1
1 303 . 18 1 1 A 26 26 GLN HA H 26 4.129 4.087 0.042 1
1 310 . 18 1 1 A 26 26 GLN C C 26 178.454 177.974 0.480 1
1 311 . 18 1 1 A 26 26 GLN CA C 26 58.772 58.288 0.484 1
1 312 . 18 1 1 A 26 26 GLN CB C 26 27.346 27.972 -0.626 1
1 314 . 18 1 1 A 26 26 GLN N N 26 120.013 119.998 0.015 1
1 316 . 18 1 1 A 27 27 THR H H 27 7.944 7.941 0.003 1
1 317 . 18 1 1 A 27 27 THR HA H 27 3.953 3.885 0.068 1
1 322 . 18 1 1 A 27 27 THR C C 27 175.818 176.202 -0.384 1
1 323 . 18 1 1 A 27 27 THR CA C 27 65.855 66.329 -0.474 1
1 324 . 18 1 1 A 27 27 THR CB C 27 68.127 68.390 -0.263 1
1 326 . 18 1 1 A 27 27 THR N N 27 117.645 117.192 0.453 1
1 327 . 18 1 1 A 28 28 ALA H H 28 8.593 8.152 0.441 1
1 328 . 18 1 1 A 28 28 ALA HA H 28 3.899 3.981 -0.082 1
1 332 . 18 1 1 A 28 28 ALA C C 28 178.515 179.820 -1.305 1
1 333 . 18 1 1 A 28 28 ALA CA C 28 55.742 55.435 0.307 1
1 334 . 18 1 1 A 28 28 ALA CB C 28 17.513 18.217 -0.704 1
1 335 . 18 1 1 A 28 28 ALA N N 28 123.917 123.425 0.492 1
1 336 . 18 1 1 A 29 29 LYS H H 29 7.800 7.582 0.218 1
1 337 . 18 1 1 A 29 29 LYS HA H 29 3.982 4.070 -0.088 1
1 346 . 18 1 1 A 29 29 LYS C C 29 179.527 178.994 0.533 1
1 347 . 18 1 1 A 29 29 LYS CA C 29 59.761 59.269 0.492 1
1 348 . 18 1 1 A 29 29 LYS CB C 29 32.223 32.152 0.071 1
1 352 . 18 1 1 A 29 29 LYS N N 29 117.474 118.749 -1.275 1
1 353 . 18 1 1 A 30 30 VAL H H 30 7.591 7.370 0.221 1
1 354 . 18 1 1 A 30 30 VAL HA H 30 3.503 3.279 0.224 1
1 362 . 18 1 1 A 30 30 VAL C C 30 178.389 177.292 1.097 1
1 363 . 18 1 1 A 30 30 VAL CA C 30 65.640 65.616 0.024 1
1 364 . 18 1 1 A 30 30 VAL CB C 30 31.644 31.544 0.100 1
1 367 . 18 1 1 A 30 30 VAL N N 30 121.749 120.558 1.191 1
1 368 . 18 1 1 A 31 31 LEU H H 31 8.333 8.018 0.315 1
1 369 . 18 1 1 A 31 31 LEU HA H 31 4.074 4.042 0.032 1
1 379 . 18 1 1 A 31 31 LEU C C 31 177.780 179.000 -1.220 1
1 380 . 18 1 1 A 31 31 LEU CA C 31 58.157 58.054 0.103 1
1 381 . 18 1 1 A 31 31 LEU CB C 31 42.230 41.287 0.943 1
1 385 . 18 1 1 A 31 31 LEU N N 31 120.901 119.756 1.145 1
1 386 . 18 1 1 A 32 32 LYS H H 32 8.562 8.026 0.536 1
1 387 . 18 1 1 A 32 32 LYS HA H 32 3.290 3.909 -0.619 1
1 395 . 18 1 1 A 32 32 LYS C C 32 178.037 178.754 -0.717 1
1 396 . 18 1 1 A 32 32 LYS CA C 32 58.911 59.581 -0.670 1
1 397 . 18 1 1 A 32 32 LYS CB C 32 31.605 31.352 0.253 1
1 401 . 18 1 1 A 32 32 LYS N N 32 119.075 119.717 -0.642 1
1 402 . 18 1 1 A 33 33 GLY H H 33 7.694 7.774 -0.080 1
1 403 . 18 1 1 A 33 33 GLY HA2 H 33 3.949 3.613 0.336 1
1 404 . 18 1 1 A 33 33 GLY HA3 H 33 3.826 3.694 0.132 1
1 405 . 18 1 1 A 33 33 GLY C C 33 177.101 176.520 0.581 1
1 406 . 18 1 1 A 33 33 GLY CA C 33 46.928 46.904 0.024 1
1 407 . 18 1 1 A 33 33 GLY N N 33 105.282 106.659 -1.377 1
1 408 . 18 1 1 A 34 34 TYR H H 34 8.015 7.366 0.649 1
1 409 . 18 1 1 A 34 34 TYR HA H 34 4.558 4.706 -0.148 1
1 416 . 18 1 1 A 34 34 TYR C C 34 179.611 178.171 1.440 1
1 417 . 18 1 1 A 34 34 TYR CA C 34 59.349 59.977 -0.628 1
1 418 . 18 1 1 A 34 34 TYR CB C 34 37.344 38.047 -0.703 1
1 423 . 18 1 1 A 34 34 TYR N N 34 121.781 121.757 0.024 1
1 424 . 18 1 1 A 35 35 LEU H H 35 8.689 7.990 0.699 1
1 425 . 18 1 1 A 35 35 LEU HA H 35 3.977 3.860 0.117 1
1 435 . 18 1 1 A 35 35 LEU C C 35 177.081 179.103 -2.022 1
1 436 . 18 1 1 A 35 35 LEU CA C 35 59.155 58.438 0.717 1
1 437 . 18 1 1 A 35 35 LEU CB C 35 41.103 41.642 -0.539 1
1 441 . 18 1 1 A 35 35 LEU N N 35 120.392 120.593 -0.201 1
1 442 . 18 1 1 A 36 36 ASN H H 36 8.721 8.597 0.124 1
1 443 . 18 1 1 A 36 36 ASN HA H 36 4.435 4.477 -0.042 1
1 448 . 18 1 1 A 36 36 ASN C C 36 176.792 177.080 -0.288 1
1 449 . 18 1 1 A 36 36 ASN CA C 36 55.642 55.213 0.429 1
1 450 . 18 1 1 A 36 36 ASN CB C 36 38.319 36.800 1.519 1
1 451 . 18 1 1 A 36 36 ASN N N 36 114.623 115.720 -1.097 1
1 453 . 18 1 1 A 37 37 SER H H 37 8.511 7.890 0.621 1
1 454 . 18 1 1 A 37 37 SER HA H 37 4.642 4.432 0.210 1
1 457 . 18 1 1 A 37 37 SER C C 37 175.039 175.671 -0.632 1
1 458 . 18 1 1 A 37 37 SER CA C 37 59.825 61.640 -1.815 1
1 459 . 18 1 1 A 37 37 SER CB C 37 64.056 63.853 0.203 1
1 460 . 18 1 1 A 37 37 SER N N 37 110.941 117.194 -6.253 1
1 461 . 18 1 1 A 38 38 ARG H H 38 7.242 8.141 -0.899 1
1 462 . 18 1 1 A 38 38 ARG HA H 38 4.919 4.423 0.496 1
1 469 . 18 1 1 A 38 38 ARG C C 38 176.514 178.536 -2.022 1
1 470 . 18 1 1 A 38 38 ARG CA C 38 56.687 58.013 -1.326 1
1 471 . 18 1 1 A 38 38 ARG CB C 38 32.434 31.345 1.089 1
1 474 . 18 1 1 A 38 38 ARG N N 38 117.062 119.582 -2.520 1
1 475 . 18 1 1 A 39 39 ILE H H 39 8.462 7.885 0.577 1
1 476 . 18 1 1 A 39 39 ILE HA H 39 3.618 3.833 -0.215 1
1 486 . 18 1 1 A 39 39 ILE C C 39 176.267 178.346 -2.079 1
1 487 . 18 1 1 A 39 39 ILE CA C 39 66.134 65.290 0.844 1
1 488 . 18 1 1 A 39 39 ILE CB C 39 39.787 38.008 1.779 1
1 492 . 18 1 1 A 39 39 ILE N N 39 121.214 120.609 0.605 1
1 493 . 18 1 1 A 40 40 ILE H H 40 9.339 8.360 0.979 1
1 494 . 18 1 1 A 40 40 ILE HA H 40 3.401 3.730 -0.329 1
1 504 . 18 1 1 A 40 40 ILE CA C 40 67.844 66.332 1.512 1
1 505 . 18 1 1 A 40 40 ILE CB C 40 34.406 35.352 -0.946 1
1 509 . 18 1 1 A 40 40 ILE N N 40 119.695 121.364 -1.669 1
1 510 . 18 1 1 A 41 41 PRO HA H 41 4.314 4.380 -0.066 1
1 517 . 18 1 1 A 41 41 PRO C C 41 177.418 178.706 -1.288 1
1 518 . 18 1 1 A 41 41 PRO CA C 41 65.912 65.500 0.412 1
1 519 . 18 1 1 A 41 41 PRO CB C 41 30.686 31.121 -0.435 1
1 522 . 18 1 1 A 42 42 SER H H 42 6.857 7.802 -0.945 1
1 523 . 18 1 1 A 42 42 SER HA H 42 4.558 4.638 -0.080 1
1 526 . 18 1 1 A 42 42 SER C C 42 174.813 176.181 -1.368 1
1 527 . 18 1 1 A 42 42 SER CA C 42 61.279 59.594 1.685 1
1 528 . 18 1 1 A 42 42 SER CB C 42 64.285 64.550 -0.265 1
1 529 . 18 1 1 A 42 42 SER N N 42 108.994 113.097 -4.103 1
1 530 . 18 1 1 A 43 43 LEU H H 43 8.230 8.220 0.010 1
1 531 . 18 1 1 A 43 43 LEU HA H 43 4.572 4.124 0.448 1
1 541 . 18 1 1 A 43 43 LEU C C 43 177.301 179.340 -2.039 1
1 542 . 18 1 1 A 43 43 LEU CA C 43 54.113 57.630 -3.517 1
1 543 . 18 1 1 A 43 43 LEU CB C 43 44.800 41.963 2.837 1
1 547 . 18 1 1 A 43 43 LEU N N 43 118.715 120.434 -1.719 1
1 548 . 18 1 1 A 44 44 GLY H H 44 8.498 8.414 0.084 1
1 549 . 18 1 1 A 44 44 GLY HA2 H 44 4.010 3.798 0.212 1
1 550 . 18 1 1 A 44 44 GLY HA3 H 44 3.613 3.858 -0.245 1
1 551 . 18 1 1 A 44 44 GLY C C 44 174.178 176.252 -2.074 1
1 552 . 18 1 1 A 44 44 GLY CA C 44 46.271 47.417 -1.146 1
1 553 . 18 1 1 A 44 44 GLY N N 44 105.371 106.885 -1.514 1
1 554 . 18 1 1 A 45 45 ASN H H 45 8.385 7.686 0.699 1
1 555 . 18 1 1 A 45 45 ASN HA H 45 4.789 4.546 0.243 1
1 560 . 18 1 1 A 45 45 ASN C C 45 175.386 176.530 -1.144 1
1 561 . 18 1 1 A 45 45 ASN CA C 45 53.144 55.405 -2.261 1
1 562 . 18 1 1 A 45 45 ASN CB C 45 37.928 38.173 -0.245 1
1 563 . 18 1 1 A 45 45 ASN N N 45 114.387 118.063 -3.676 1
1 565 . 18 1 1 A 46 46 ILE H H 46 7.465 7.519 -0.054 1
1 566 . 18 1 1 A 46 46 ILE HA H 46 3.856 4.045 -0.189 1
1 576 . 18 1 1 A 46 46 ILE C C 46 175.997 176.059 -0.062 1
1 577 . 18 1 1 A 46 46 ILE CA C 46 60.853 61.886 -1.033 1
1 578 . 18 1 1 A 46 46 ILE CB C 46 38.042 38.326 -0.284 1
1 582 . 18 1 1 A 46 46 ILE N N 46 123.998 120.118 3.880 1
1 583 . 18 1 1 A 47 47 LYS H H 47 8.717 8.664 0.053 1
1 584 . 18 1 1 A 47 47 LYS HA H 47 4.249 4.314 -0.065 1
1 591 . 18 1 1 A 47 47 LYS C C 47 177.583 177.677 -0.094 1
1 592 . 18 1 1 A 47 47 LYS CA C 47 56.320 57.056 -0.736 1
1 593 . 18 1 1 A 47 47 LYS CB C 47 30.393 32.719 -2.326 1
1 596 . 18 1 1 A 47 47 LYS N N 47 126.114 124.887 1.227 1
1 597 . 18 1 1 A 48 48 LEU H H 48 8.323 8.617 -0.294 1
1 598 . 18 1 1 A 48 48 LEU HA H 48 3.691 4.018 -0.327 1
1 608 . 18 1 1 A 48 48 LEU C C 48 177.274 178.345 -1.071 1
1 609 . 18 1 1 A 48 48 LEU CA C 48 58.443 58.333 0.110 1
1 610 . 18 1 1 A 48 48 LEU CB C 48 42.282 41.299 0.983 1
1 614 . 18 1 1 A 48 48 LEU N N 48 125.857 125.917 -0.060 1
1 615 . 18 1 1 A 49 49 ALA H H 49 8.929 7.900 1.029 1
1 616 . 18 1 1 A 49 49 ALA HA H 49 4.067 4.028 0.039 1
1 620 . 18 1 1 A 49 49 ALA C C 49 177.468 178.908 -1.440 1
1 621 . 18 1 1 A 49 49 ALA CA C 49 53.092 54.871 -1.779 1
1 622 . 18 1 1 A 49 49 ALA CB C 49 18.562 18.111 0.451 1
1 623 . 18 1 1 A 49 49 ALA N N 49 115.543 120.383 -4.840 1
1 624 . 18 1 1 A 50 50 LYS H H 50 7.684 7.542 0.142 1
1 625 . 18 1 1 A 50 50 LYS HA H 50 4.395 4.336 0.059 1
1 634 . 18 1 1 A 50 50 LYS C C 50 174.958 176.925 -1.967 1
1 635 . 18 1 1 A 50 50 LYS CA C 50 53.977 57.279 -3.302 1
1 636 . 18 1 1 A 50 50 LYS CB C 50 32.645 32.610 0.035 1
1 640 . 18 1 1 A 50 50 LYS N N 50 114.788 115.386 -0.598 1
1 641 . 18 1 1 A 51 51 LEU H H 51 6.776 6.951 -0.175 1
1 642 . 18 1 1 A 51 51 LEU HA H 51 4.569 4.373 0.196 1
1 652 . 18 1 1 A 51 51 LEU C C 51 177.953 175.659 2.294 1
1 653 . 18 1 1 A 51 51 LEU CA C 51 55.318 55.055 0.263 1
1 654 . 18 1 1 A 51 51 LEU CB C 51 43.182 41.295 1.887 1
1 658 . 18 1 1 A 51 51 LEU N N 51 121.408 122.338 -0.930 1
1 659 . 18 1 1 A 52 52 THR H H 52 10.680 8.001 2.679 1
1 660 . 18 1 1 A 52 52 THR HA H 52 4.938 4.538 0.400 1
1 665 . 18 1 1 A 52 52 THR C C 52 175.553 175.715 -0.162 1
1 666 . 18 1 1 A 52 52 THR CA C 52 59.740 60.350 -0.610 1
1 667 . 18 1 1 A 52 52 THR CB C 52 73.557 70.266 3.291 1
1 669 . 18 1 1 A 52 52 THR N N 52 119.481 119.414 0.067 1
1 670 . 18 1 1 A 53 53 SER H H 53 9.278 9.029 0.249 1
1 671 . 18 1 1 A 53 53 SER HA H 53 4.261 4.165 0.096 1
1 674 . 18 1 1 A 53 53 SER C C 53 176.990 176.677 0.313 1
1 675 . 18 1 1 A 53 53 SER CA C 53 61.025 61.213 -0.188 1
1 676 . 18 1 1 A 53 53 SER CB C 53 62.312 63.052 -0.740 1
1 677 . 18 1 1 A 53 53 SER N N 53 116.343 119.467 -3.124 1
1 678 . 18 1 1 A 54 54 LEU H H 54 7.808 8.028 -0.220 1
1 679 . 18 1 1 A 54 54 LEU HA H 54 4.229 4.029 0.200 1
1 688 . 18 1 1 A 54 54 LEU C C 54 178.505 178.858 -0.353 1
1 689 . 18 1 1 A 54 54 LEU CA C 54 57.719 57.850 -0.131 1
1 690 . 18 1 1 A 54 54 LEU CB C 54 40.997 41.469 -0.472 1
1 694 . 18 1 1 A 54 54 LEU N N 54 126.055 124.973 1.082 1
1 695 . 18 1 1 A 55 55 HIS H H 55 7.798 7.723 0.075 1
1 696 . 18 1 1 A 55 55 HIS HA H 55 4.311 4.335 -0.024 1
1 701 . 18 1 1 A 55 55 HIS C C 55 180.044 177.834 2.210 1
1 702 . 18 1 1 A 55 55 HIS CA C 55 60.583 59.793 0.790 1
1 703 . 18 1 1 A 55 55 HIS CB C 55 31.445 29.691 1.754 1
1 706 . 18 1 1 A 55 55 HIS N N 55 118.683 118.338 0.345 1
1 707 . 18 1 1 A 56 56 MET H H 56 7.375 8.225 -0.850 1
1 708 . 18 1 1 A 56 56 MET HA H 56 4.513 4.230 0.283 1
1 716 . 18 1 1 A 56 56 MET C C 56 177.169 178.478 -1.309 1
1 717 . 18 1 1 A 56 56 MET CA C 56 55.823 58.495 -2.672 1
1 718 . 18 1 1 A 56 56 MET CB C 56 31.303 31.738 -0.435 1
1 721 . 18 1 1 A 56 56 MET N N 56 114.530 118.070 -3.540 1
1 722 . 18 1 1 A 57 57 GLN H H 57 8.387 8.138 0.249 1
1 723 . 18 1 1 A 57 57 GLN HA H 57 3.981 4.011 -0.030 1
1 730 . 18 1 1 A 57 57 GLN C C 57 178.033 178.458 -0.425 1
1 731 . 18 1 1 A 57 57 GLN CA C 57 57.922 59.202 -1.280 1
1 732 . 18 1 1 A 57 57 GLN CB C 57 29.012 28.434 0.578 1
1 734 . 18 1 1 A 57 57 GLN N N 57 120.713 120.661 0.052 1
1 736 . 18 1 1 A 58 58 ASN H H 58 8.765 8.481 0.284 1
1 737 . 18 1 1 A 58 58 ASN HA H 58 4.539 4.493 0.046 1
1 742 . 18 1 1 A 58 58 ASN C C 58 178.084 177.580 0.504 1
1 743 . 18 1 1 A 58 58 ASN CA C 58 55.345 56.250 -0.905 1
1 744 . 18 1 1 A 58 58 ASN CB C 58 36.924 38.020 -1.096 1
1 745 . 18 1 1 A 58 58 ASN N N 58 117.390 117.781 -0.391 1
1 747 . 18 1 1 A 59 59 TYR H H 59 8.239 8.044 0.195 1
1 748 . 18 1 1 A 59 59 TYR HA H 59 4.586 4.157 0.429 1
1 755 . 18 1 1 A 59 59 TYR C C 59 178.015 176.872 1.143 1
1 756 . 18 1 1 A 59 59 TYR CA C 59 60.779 61.524 -0.745 1
1 757 . 18 1 1 A 59 59 TYR CB C 59 38.047 38.715 -0.668 1
1 762 . 18 1 1 A 59 59 TYR N N 59 122.335 123.049 -0.714 1
1 763 . 18 1 1 A 60 60 VAL H H 60 8.416 8.447 -0.031 1
1 764 . 18 1 1 A 60 60 VAL HA H 60 3.244 3.540 -0.296 1
1 772 . 18 1 1 A 60 60 VAL C C 60 177.309 178.166 -0.857 1
1 773 . 18 1 1 A 60 60 VAL CA C 60 67.022 66.439 0.583 1
1 774 . 18 1 1 A 60 60 VAL CB C 60 30.929 31.312 -0.383 1
1 777 . 18 1 1 A 60 60 VAL N N 60 119.842 119.582 0.260 1
1 778 . 18 1 1 A 61 61 ASN H H 61 8.264 8.025 0.239 1
1 779 . 18 1 1 A 61 61 ASN HA H 61 4.305 4.462 -0.157 1
1 784 . 18 1 1 A 61 61 ASN C C 61 177.263 177.564 -0.301 1
1 785 . 18 1 1 A 61 61 ASN CA C 61 55.548 56.062 -0.514 1
1 786 . 18 1 1 A 61 61 ASN CB C 61 36.645 37.598 -0.953 1
1 787 . 18 1 1 A 61 61 ASN N N 61 119.103 120.411 -1.308 1
1 789 . 18 1 1 A 62 62 SER H H 62 8.143 7.836 0.307 1
1 790 . 18 1 1 A 62 62 SER HA H 62 4.343 4.194 0.149 1
1 793 . 18 1 1 A 62 62 SER C C 62 176.409 177.672 -1.263 1
1 794 . 18 1 1 A 62 62 SER CA C 62 61.612 61.281 0.331 1
1 795 . 18 1 1 A 62 62 SER CB C 62 62.219 62.515 -0.296 1
1 796 . 18 1 1 A 62 62 SER N N 62 118.254 115.021 3.233 1
1 797 . 18 1 1 A 63 63 LEU H H 63 7.664 7.768 -0.104 1
1 798 . 18 1 1 A 63 63 LEU HA H 63 4.003 3.865 0.138 1
1 808 . 18 1 1 A 63 63 LEU C C 63 178.748 178.976 -0.228 1
1 809 . 18 1 1 A 63 63 LEU CA C 63 57.171 57.818 -0.647 1
1 810 . 18 1 1 A 63 63 LEU CB C 63 41.134 41.232 -0.098 1
1 814 . 18 1 1 A 63 63 LEU N N 63 123.812 122.616 1.196 1
1 815 . 18 1 1 A 64 64 ARG H H 64 7.969 7.730 0.239 1
1 816 . 18 1 1 A 64 64 ARG HA H 64 4.038 3.818 0.220 1
1 824 . 18 1 1 A 64 64 ARG C C 64 180.797 177.787 3.010 1
1 825 . 18 1 1 A 64 64 ARG CA C 64 58.598 59.643 -1.045 1
1 826 . 18 1 1 A 64 64 ARG CB C 64 28.849 29.510 -0.661 1
1 829 . 18 1 1 A 64 64 ARG N N 64 120.376 120.442 -0.066 1
1 831 . 18 1 1 A 65 65 ASP H H 65 8.465 7.890 0.575 1
1 832 . 18 1 1 A 65 65 ASP HA H 65 4.408 4.355 0.053 1
1 835 . 18 1 1 A 65 65 ASP C C 65 177.336 178.476 -1.140 1
1 836 . 18 1 1 A 65 65 ASP CA C 65 56.957 57.538 -0.581 1
1 837 . 18 1 1 A 65 65 ASP CB C 65 39.602 41.125 -1.523 1
1 838 . 18 1 1 A 65 65 ASP N N 65 122.402 119.516 2.886 1
1 839 . 18 1 1 A 66 66 GLU H H 66 7.703 7.936 -0.233 1
1 840 . 18 1 1 A 66 66 GLU HA H 66 4.213 4.232 -0.019 1
1 845 . 18 1 1 A 66 66 GLU C C 66 176.586 177.328 -0.742 1
1 846 . 18 1 1 A 66 66 GLU CA C 66 56.974 56.430 0.544 1
1 847 . 18 1 1 A 66 66 GLU CB C 66 29.821 29.807 0.014 1
1 849 . 18 1 1 A 66 66 GLU N N 66 119.076 115.941 3.135 1
1 850 . 18 1 1 A 67 67 GLY H H 67 7.861 7.934 -0.073 1
1 851 . 18 1 1 A 67 67 GLY HA2 H 67 4.269 3.911 0.358 1
1 852 . 18 1 1 A 67 67 GLY HA3 H 67 3.731 3.916 -0.185 1
1 853 . 18 1 1 A 67 67 GLY C C 67 174.614 174.967 -0.353 1
1 854 . 18 1 1 A 67 67 GLY CA C 67 44.608 46.363 -1.755 1
1 855 . 18 1 1 A 67 67 GLY N N 67 105.730 109.413 -3.683 1
1 856 . 18 1 1 A 68 68 LEU H H 68 7.324 7.801 -0.477 1
1 857 . 18 1 1 A 68 68 LEU HA H 68 4.257 4.189 0.068 1
1 867 . 18 1 1 A 68 68 LEU C C 68 176.136 177.064 -0.928 1
1 868 . 18 1 1 A 68 68 LEU CA C 68 55.659 54.880 0.779 1
1 869 . 18 1 1 A 68 68 LEU CB C 68 41.874 42.065 -0.191 1
1 873 . 18 1 1 A 68 68 LEU N N 68 121.062 121.322 -0.260 1
1 874 . 18 1 1 A 69 69 LYS H H 69 8.368 8.450 -0.082 1
1 875 . 18 1 1 A 69 69 LYS HA H 69 4.281 4.513 -0.232 1
1 884 . 18 1 1 A 69 69 LYS C C 69 177.940 178.179 -0.239 1
1 885 . 18 1 1 A 69 69 LYS CA C 69 55.412 55.399 0.013 1
1 886 . 18 1 1 A 69 69 LYS CB C 69 32.761 33.443 -0.682 1
1 890 . 18 1 1 A 69 69 LYS N N 69 120.120 122.319 -2.199 1
1 891 . 18 1 1 A 70 70 ARG H H 70 9.095 8.858 0.237 1
1 892 . 18 1 1 A 70 70 ARG HA H 70 3.684 4.076 -0.392 1
1 900 . 18 1 1 A 70 70 ARG C C 70 177.712 178.603 -0.891 1
1 901 . 18 1 1 A 70 70 ARG CA C 70 60.216 58.416 1.800 1
1 902 . 18 1 1 A 70 70 ARG CB C 70 29.539 29.766 -0.227 1
1 905 . 18 1 1 A 70 70 ARG N N 70 123.339 118.726 4.613 1
1 907 . 18 1 1 A 71 71 GLY H H 71 8.985 8.397 0.588 1
1 908 . 18 1 1 A 71 71 GLY HA2 H 71 3.932 3.766 0.166 1
1 909 . 18 1 1 A 71 71 GLY HA3 H 71 3.905 3.768 0.137 1
1 910 . 18 1 1 A 71 71 GLY C C 71 176.324 176.240 0.084 1
1 911 . 18 1 1 A 71 71 GLY CA C 71 46.752 47.452 -0.700 1
1 912 . 18 1 1 A 71 71 GLY N N 71 104.509 108.955 -4.446 1
1 913 . 18 1 1 A 72 72 THR H H 72 7.295 7.688 -0.393 1
1 914 . 18 1 1 A 72 72 THR HA H 72 4.014 3.977 0.037 1
1 919 . 18 1 1 A 72 72 THR C C 72 175.135 176.130 -0.995 1
1 920 . 18 1 1 A 72 72 THR CA C 72 65.848 66.156 -0.308 1
1 921 . 18 1 1 A 72 72 THR CB C 72 68.160 68.180 -0.020 1
1 923 . 18 1 1 A 72 72 THR N N 72 118.617 117.175 1.442 1
1 924 . 18 1 1 A 73 73 ILE H H 73 7.883 7.994 -0.111 1
1 925 . 18 1 1 A 73 73 ILE HA H 73 3.258 3.582 -0.324 1
1 935 . 18 1 1 A 73 73 ILE C C 73 177.060 177.939 -0.879 1
1 936 . 18 1 1 A 73 73 ILE CA C 73 66.561 65.492 1.069 1
1 937 . 18 1 1 A 73 73 ILE CB C 73 37.339 37.535 -0.196 1
1 941 . 18 1 1 A 73 73 ILE N N 73 121.692 121.031 0.661 1
1 942 . 18 1 1 A 74 74 GLU H H 74 8.723 8.197 0.526 1
1 943 . 18 1 1 A 74 74 GLU HA H 74 3.807 3.901 -0.094 1
1 948 . 18 1 1 A 74 74 GLU C C 74 178.319 179.283 -0.964 1
1 949 . 18 1 1 A 74 74 GLU CA C 74 59.637 60.045 -0.408 1
1 950 . 18 1 1 A 74 74 GLU CB C 74 29.257 29.197 0.060 1
1 952 . 18 1 1 A 74 74 GLU N N 74 117.701 120.860 -3.159 1
1 953 . 18 1 1 A 75 75 LYS H H 75 7.361 7.316 0.045 1
1 954 . 18 1 1 A 75 75 LYS HA H 75 3.958 4.020 -0.062 1
1 963 . 18 1 1 A 75 75 LYS C C 75 178.554 179.678 -1.124 1
1 964 . 18 1 1 A 75 75 LYS CA C 75 59.764 59.376 0.388 1
1 965 . 18 1 1 A 75 75 LYS CB C 75 32.314 32.344 -0.030 1
1 969 . 18 1 1 A 75 75 LYS N N 75 118.734 118.188 0.546 1
1 970 . 18 1 1 A 76 76 ILE H H 76 7.713 7.550 0.163 1
1 971 . 18 1 1 A 76 76 ILE HA H 76 3.221 3.789 -0.568 1
1 981 . 18 1 1 A 76 76 ILE C C 76 177.504 178.286 -0.782 1
1 982 . 18 1 1 A 76 76 ILE CA C 76 65.796 64.508 1.288 1
1 983 . 18 1 1 A 76 76 ILE CB C 76 37.732 37.325 0.407 1
1 987 . 18 1 1 A 76 76 ILE N N 76 120.312 116.544 3.768 1
1 988 . 18 1 1 A 77 77 ILE H H 77 8.587 8.083 0.504 1
1 989 . 18 1 1 A 77 77 ILE HA H 77 3.778 3.575 0.203 1
1 999 . 18 1 1 A 77 77 ILE C C 77 177.074 177.837 -0.763 1
1 1000 . 18 1 1 A 77 77 ILE CA C 77 63.168 65.145 -1.977 1
1 1001 . 18 1 1 A 77 77 ILE CB C 77 36.617 37.262 -0.645 1
1 1005 . 18 1 1 A 77 77 ILE N N 77 118.978 121.937 -2.959 1
1 1006 . 18 1 1 A 78 78 LYS H H 78 8.050 7.707 0.343 1
1 1007 . 18 1 1 A 78 78 LYS HA H 78 3.925 4.073 -0.148 1
1 1016 . 18 1 1 A 78 78 LYS C C 78 178.291 179.327 -1.036 1
1 1017 . 18 1 1 A 78 78 LYS CA C 78 60.192 59.979 0.213 1
1 1018 . 18 1 1 A 78 78 LYS CB C 78 31.886 32.647 -0.761 1
1 1022 . 18 1 1 A 78 78 LYS N N 78 121.618 119.638 1.980 1
1 1023 . 18 1 1 A 79 79 VAL H H 79 7.619 7.552 0.067 1
1 1024 . 18 1 1 A 79 79 VAL HA H 79 3.846 3.669 0.177 1
1 1032 . 18 1 1 A 79 79 VAL C C 79 177.712 178.288 -0.576 1
1 1033 . 18 1 1 A 79 79 VAL CA C 79 66.494 66.363 0.131 1
1 1034 . 18 1 1 A 79 79 VAL CB C 79 31.298 31.701 -0.403 1
1 1037 . 18 1 1 A 79 79 VAL N N 79 120.254 119.634 0.620 1
1 1038 . 18 1 1 A 80 80 ILE H H 80 7.885 8.251 -0.366 1
1 1039 . 18 1 1 A 80 80 ILE HA H 80 3.367 3.704 -0.337 1
1 1049 . 18 1 1 A 80 80 ILE C C 80 179.892 177.852 2.040 1
1 1050 . 18 1 1 A 80 80 ILE CA C 80 65.343 65.539 -0.196 1
1 1051 . 18 1 1 A 80 80 ILE CB C 80 38.129 37.521 0.608 1
1 1055 . 18 1 1 A 80 80 ILE N N 80 119.666 120.813 -1.147 1
1 1056 . 18 1 1 A 81 81 ARG H H 81 9.384 8.484 0.900 1
1 1057 . 18 1 1 A 81 81 ARG HA H 81 3.834 3.907 -0.073 1
1 1065 . 18 1 1 A 81 81 ARG C C 81 178.204 179.157 -0.953 1
1 1066 . 18 1 1 A 81 81 ARG CA C 81 60.560 59.803 0.757 1
1 1067 . 18 1 1 A 81 81 ARG CB C 81 30.196 30.020 0.176 1
1 1070 . 18 1 1 A 81 81 ARG N N 81 121.030 119.699 1.331 1
1 1072 . 18 1 1 A 82 82 ASN H H 82 8.773 8.365 0.408 1
1 1073 . 18 1 1 A 82 82 ASN HA H 82 4.587 4.592 -0.005 1
1 1078 . 18 1 1 A 82 82 ASN C C 82 178.300 177.847 0.453 1
1 1079 . 18 1 1 A 82 82 ASN CA C 82 56.160 56.484 -0.324 1
1 1080 . 18 1 1 A 82 82 ASN CB C 82 38.464 39.461 -0.997 1
1 1081 . 18 1 1 A 82 82 ASN N N 82 118.483 118.612 -0.129 1
1 1083 . 18 1 1 A 83 83 SER H H 83 8.526 7.683 0.843 1
1 1084 . 18 1 1 A 83 83 SER HA H 83 2.765 3.229 -0.464 1
1 1087 . 18 1 1 A 83 83 SER C C 83 176.386 176.431 -0.045 1
1 1088 . 18 1 1 A 83 83 SER CA C 83 61.245 62.041 -0.796 1
1 1089 . 18 1 1 A 83 83 SER CB C 83 61.287 62.820 -1.533 1
1 1090 . 18 1 1 A 83 83 SER N N 83 118.286 116.477 1.809 1
1 1091 . 18 1 1 A 84 84 LEU H H 84 7.782 8.368 -0.586 1
1 1092 . 18 1 1 A 84 84 LEU HA H 84 4.221 4.006 0.215 1
1 1102 . 18 1 1 A 84 84 LEU C C 84 177.846 179.612 -1.766 1
1 1103 . 18 1 1 A 84 84 LEU CA C 84 57.166 57.903 -0.737 1
1 1104 . 18 1 1 A 84 84 LEU CB C 84 40.520 40.825 -0.305 1
1 1108 . 18 1 1 A 84 84 LEU N N 84 127.445 121.161 6.284 1
1 1109 . 18 1 1 A 85 85 GLU H H 85 8.264 8.537 -0.273 1
1 1110 . 18 1 1 A 85 85 GLU HA H 85 3.981 3.974 0.007 1
1 1115 . 18 1 1 A 85 85 GLU C C 85 179.288 179.484 -0.196 1
1 1116 . 18 1 1 A 85 85 GLU CA C 85 59.025 59.866 -0.841 1
1 1117 . 18 1 1 A 85 85 GLU CB C 85 29.182 29.286 -0.104 1
1 1119 . 18 1 1 A 85 85 GLU N N 85 121.538 120.369 1.169 1
1 1120 . 18 1 1 A 86 86 HIS H H 86 7.683 8.117 -0.434 1
1 1121 . 18 1 1 A 86 86 HIS HA H 86 4.573 4.332 0.241 1
1 1125 . 18 1 1 A 86 86 HIS C C 86 175.484 177.588 -2.104 1
1 1126 . 18 1 1 A 86 86 HIS CA C 86 58.940 59.384 -0.444 1
1 1127 . 18 1 1 A 86 86 HIS CB C 86 29.267 30.146 -0.879 1
1 1129 . 18 1 1 A 86 86 HIS N N 86 117.087 120.416 -3.329 1
1 1130 . 18 1 1 A 87 87 ALA H H 87 7.197 8.205 -1.008 1
1 1131 . 18 1 1 A 87 87 ALA HA H 87 3.925 3.812 0.113 1
1 1135 . 18 1 1 A 87 87 ALA C C 87 179.038 180.406 -1.368 1
1 1136 . 18 1 1 A 87 87 ALA CA C 87 54.863 54.887 -0.024 1
1 1137 . 18 1 1 A 87 87 ALA CB C 87 17.034 18.360 -1.326 1
1 1138 . 18 1 1 A 87 87 ALA N N 87 121.510 120.986 0.524 1
1 1139 . 18 1 1 A 88 88 ILE H H 88 7.819 7.610 0.209 1
1 1140 . 18 1 1 A 88 88 ILE HA H 88 4.067 3.878 0.189 1
1 1150 . 18 1 1 A 88 88 ILE C C 88 180.846 177.352 3.494 1
1 1151 . 18 1 1 A 88 88 ILE CA C 88 64.021 65.273 -1.252 1
1 1152 . 18 1 1 A 88 88 ILE CB C 88 37.557 37.652 -0.095 1
1 1156 . 18 1 1 A 88 88 ILE N N 88 120.898 119.262 1.636 1
1 1157 . 18 1 1 A 89 89 ASP H H 89 7.808 8.165 -0.357 1
1 1158 . 18 1 1 A 89 89 ASP HA H 89 4.437 4.324 0.113 1
1 1161 . 18 1 1 A 89 89 ASP C C 89 178.033 178.111 -0.078 1
1 1162 . 18 1 1 A 89 89 ASP CA C 89 57.343 57.898 -0.555 1
1 1163 . 18 1 1 A 89 89 ASP CB C 89 39.689 41.932 -2.243 1
1 1164 . 18 1 1 A 89 89 ASP N N 89 125.174 121.351 3.823 1
1 1165 . 18 1 1 A 90 90 LEU H H 90 7.607 7.685 -0.078 1
1 1166 . 18 1 1 A 90 90 LEU HA H 90 4.198 4.209 -0.011 1
1 1176 . 18 1 1 A 90 90 LEU C C 90 175.416 175.958 -0.542 1
1 1177 . 18 1 1 A 90 90 LEU CA C 90 54.755 54.987 -0.232 1
1 1178 . 18 1 1 A 90 90 LEU CB C 90 42.960 42.031 0.929 1
1 1182 . 18 1 1 A 90 90 LEU N N 90 117.576 117.372 0.204 1
1 1183 . 18 1 1 A 91 91 GLU H H 91 8.143 7.990 0.153 1
1 1184 . 18 1 1 A 91 91 GLU HA H 91 4.005 4.070 -0.065 1
1 1189 . 18 1 1 A 91 91 GLU C C 91 175.792 176.078 -0.286 1
1 1190 . 18 1 1 A 91 91 GLU CA C 91 57.202 57.553 -0.351 1
1 1191 . 18 1 1 A 91 91 GLU CB C 91 26.125 27.072 -0.947 1
1 1193 . 18 1 1 A 91 91 GLU N N 91 113.620 115.148 -1.528 1
1 1194 . 18 1 1 A 92 92 LEU H H 92 8.290 7.957 0.333 1
1 1195 . 18 1 1 A 92 92 LEU HA H 92 4.216 4.057 0.159 1
1 1205 . 18 1 1 A 92 92 LEU C C 92 176.622 177.050 -0.428 1
1 1206 . 18 1 1 A 92 92 LEU CA C 92 56.410 57.281 -0.871 1
1 1207 . 18 1 1 A 92 92 LEU CB C 92 43.378 42.444 0.934 1
1 1211 . 18 1 1 A 92 92 LEU N N 92 116.868 120.032 -3.164 1
1 1212 . 18 1 1 A 93 93 ILE H H 93 6.988 6.966 0.022 1
1 1213 . 18 1 1 A 93 93 ILE HA H 93 4.580 4.628 -0.048 1
1 1223 . 18 1 1 A 93 93 ILE C C 93 175.145 175.779 -0.634 1
1 1224 . 18 1 1 A 93 93 ILE CA C 93 58.707 58.398 0.309 1
1 1225 . 18 1 1 A 93 93 ILE CB C 93 42.864 40.725 2.139 1
1 1229 . 18 1 1 A 93 93 ILE N N 93 107.565 114.475 -6.910 1
1 1230 . 18 1 1 A 94 94 THR H H 94 8.742 8.686 0.056 1
1 1231 . 18 1 1 A 94 94 THR HA H 94 4.489 4.284 0.205 1
1 1236 . 18 1 1 A 94 94 THR C C 94 173.875 174.392 -0.517 1
1 1237 . 18 1 1 A 94 94 THR CA C 94 61.842 63.074 -1.232 1
1 1238 . 18 1 1 A 94 94 THR CB C 94 69.972 69.127 0.845 1
1 1240 . 18 1 1 A 94 94 THR N N 94 107.904 113.874 -5.970 1
1 1241 . 18 1 1 A 95 95 LYS H H 95 7.294 7.739 -0.445 1
1 1242 . 18 1 1 A 95 95 LYS HA H 95 4.566 4.831 -0.265 1
1 1251 . 18 1 1 A 95 95 LYS C C 95 173.791 174.498 -0.707 1
1 1252 . 18 1 1 A 95 95 LYS CA C 95 54.533 55.057 -0.524 1
1 1253 . 18 1 1 A 95 95 LYS CB C 95 35.123 35.904 -0.781 1
1 1257 . 18 1 1 A 95 95 LYS N N 95 119.458 120.635 -1.177 1
1 1258 . 18 1 1 A 96 96 ASN H H 96 9.157 8.812 0.345 1
1 1259 . 18 1 1 A 96 96 ASN HA H 96 4.408 4.871 -0.463 1
1 1264 . 18 1 1 A 96 96 ASN C C 96 176.653 176.337 0.316 1
1 1265 . 18 1 1 A 96 96 ASN CA C 96 51.088 52.705 -1.617 1
1 1266 . 18 1 1 A 96 96 ASN CB C 96 37.292 38.707 -1.415 1
1 1267 . 18 1 1 A 96 96 ASN N N 96 121.031 123.665 -2.634 1
1 1269 . 18 1 1 A 97 97 VAL H H 97 8.193 8.419 -0.226 1
1 1270 . 18 1 1 A 97 97 VAL HA H 97 4.019 3.980 0.039 1
1 1278 . 18 1 1 A 97 97 VAL C C 97 175.089 176.500 -1.411 1
1 1279 . 18 1 1 A 97 97 VAL CA C 97 63.437 63.544 -0.107 1
1 1280 . 18 1 1 A 97 97 VAL CB C 97 29.934 31.753 -1.819 1
1 1283 . 18 1 1 A 97 97 VAL N N 97 118.839 121.043 -2.204 1
1 1284 . 18 1 1 A 98 98 ALA H H 98 7.994 7.600 0.394 1
1 1285 . 18 1 1 A 98 98 ALA HA H 98 5.108 4.154 0.954 1
1 1289 . 18 1 1 A 98 98 ALA C C 98 178.033 179.935 -1.902 1
1 1290 . 18 1 1 A 98 98 ALA CA C 98 50.342 53.259 -2.917 1
1 1291 . 18 1 1 A 98 98 ALA CB C 98 19.659 19.096 0.563 1
1 1292 . 18 1 1 A 98 98 ALA N N 98 121.031 124.569 -3.538 1
1 1293 . 18 1 1 A 99 99 ALA H H 99 7.347 7.810 -0.463 1
1 1294 . 18 1 1 A 99 99 ALA HA H 99 3.818 4.052 -0.234 1
1 1298 . 18 1 1 A 99 99 ALA C C 99 177.712 178.705 -0.993 1
1 1299 . 18 1 1 A 99 99 ALA CA C 99 55.117 54.502 0.615 1
1 1300 . 18 1 1 A 99 99 ALA CB C 99 18.879 18.423 0.456 1
1 1301 . 18 1 1 A 99 99 ALA N N 99 122.816 119.757 3.059 1
1 1302 . 18 1 1 A 100 100 LYS H H 100 8.190 7.934 0.256 1
1 1303 . 18 1 1 A 100 100 LYS HA H 100 4.483 4.307 0.176 1
1 1312 . 18 1 1 A 100 100 LYS C C 100 175.899 176.349 -0.450 1
1 1313 . 18 1 1 A 100 100 LYS CA C 100 54.231 57.628 -3.397 1
1 1314 . 18 1 1 A 100 100 LYS CB C 100 32.066 33.044 -0.978 1
1 1318 . 18 1 1 A 100 100 LYS N N 100 113.197 115.100 -1.903 1
1 1319 . 18 1 1 A 101 101 THR H H 101 7.128 7.644 -0.516 1
1 1320 . 18 1 1 A 101 101 THR HA H 101 3.834 4.473 -0.639 1
1 1325 . 18 1 1 A 101 101 THR C C 101 173.255 173.929 -0.674 1
1 1326 . 18 1 1 A 101 101 THR CA C 101 64.392 61.986 2.406 1
1 1327 . 18 1 1 A 101 101 THR CB C 101 69.160 68.637 0.523 1
1 1329 . 18 1 1 A 101 101 THR N N 101 118.368 115.254 3.114 1
1 1330 . 18 1 1 A 102 102 LYS H H 102 8.753 8.684 0.069 1
1 1331 . 18 1 1 A 102 102 LYS HA H 102 4.438 4.365 0.073 1
1 1340 . 18 1 1 A 102 102 LYS C C 102 175.627 176.173 -0.546 1
1 1341 . 18 1 1 A 102 102 LYS CA C 102 55.117 56.011 -0.894 1
1 1342 . 18 1 1 A 102 102 LYS CB C 102 33.901 33.334 0.567 1
1 1346 . 18 1 1 A 102 102 LYS N N 102 126.513 126.936 -0.423 1
1 1347 . 18 1 1 A 103 103 LEU H H 103 8.602 8.181 0.421 1
1 1348 . 18 1 1 A 103 103 LEU HA H 103 4.486 4.403 0.083 1
1 1358 . 18 1 1 A 103 103 LEU CA C 103 52.233 53.116 -0.883 1
1 1359 . 18 1 1 A 103 103 LEU CB C 103 41.028 42.769 -1.741 1
1 1363 . 18 1 1 A 103 103 LEU N N 103 124.466 123.742 0.724 1
1 1364 . 18 1 1 A 104 104 PRO HA H 104 4.437 4.656 -0.219 1
1 1371 . 18 1 1 A 104 104 PRO C C 104 175.779 175.823 -0.044 1
1 1372 . 18 1 1 A 104 104 PRO CA C 104 62.322 62.170 0.152 1
1 1373 . 18 1 1 A 104 104 PRO CB C 104 31.899 32.743 -0.844 1
1 1376 . 18 1 1 A 105 105 LYS H H 105 8.460 8.523 -0.063 1
1 1377 . 18 1 1 A 105 105 LYS HA H 105 4.154 4.340 -0.186 1
1 1386 . 18 1 1 A 105 105 LYS C C 105 175.998 176.563 -0.565 1
1 1387 . 18 1 1 A 105 105 LYS CA C 105 56.480 55.545 0.935 1
1 1388 . 18 1 1 A 105 105 LYS CB C 105 32.909 32.019 0.890 1
1 1392 . 18 1 1 A 105 105 LYS N N 105 122.139 120.671 1.468 1
1 1393 . 18 1 1 A 106 106 ALA H H 106 8.448 8.636 -0.188 1
1 1394 . 18 1 1 A 106 106 ALA HA H 106 4.309 4.450 -0.141 1
1 1398 . 18 1 1 A 106 106 ALA C C 106 176.828 176.084 0.744 1
1 1399 . 18 1 1 A 106 106 ALA CA C 106 51.862 52.266 -0.404 1
1 1400 . 18 1 1 A 106 106 ALA CB C 106 19.323 19.005 0.318 1
1 1401 . 18 1 1 A 106 106 ALA N N 106 125.278 128.037 -2.759 1
1 1402 . 18 1 1 A 107 107 ASP H H 107 8.428 7.495 0.933 1
1 1403 . 18 1 1 A 107 107 ASP HA H 107 4.574 5.301 -0.727 1
1 1406 . 18 1 1 A 107 107 ASP C C 107 175.951 174.872 1.079 1
1 1407 . 18 1 1 A 107 107 ASP CA C 107 54.214 52.685 1.529 1
1 1408 . 18 1 1 A 107 107 ASP CB C 107 41.141 44.353 -3.212 1
1 1409 . 18 1 1 A 107 107 ASP N N 107 120.771 119.523 1.248 1
1 1410 . 18 1 1 A 108 108 LYS H H 108 8.329 8.601 -0.272 1
1 1411 . 18 1 1 A 108 108 LYS HA H 108 4.203 4.447 -0.244 1
1 1420 . 18 1 1 A 108 108 LYS C C 108 176.483 176.428 0.055 1
1 1421 . 18 1 1 A 108 108 LYS CA C 108 56.831 56.407 0.424 1
1 1422 . 18 1 1 A 108 108 LYS CB C 108 32.648 33.384 -0.736 1
1 1426 . 18 1 1 A 108 108 LYS N N 108 120.727 125.704 -4.977 1
1 1427 . 18 1 1 A 109 109 GLU H H 109 8.447 8.903 -0.456 1
1 1428 . 18 1 1 A 109 109 GLU HA H 109 4.215 4.907 -0.692 1
1 1433 . 18 1 1 A 109 109 GLU C C 109 176.513 176.228 0.285 1
1 1434 . 18 1 1 A 109 109 GLU CA C 109 56.936 54.605 2.331 1
1 1435 . 18 1 1 A 109 109 GLU CB C 109 29.833 33.349 -3.516 1
1 1437 . 18 1 1 A 109 109 GLU N N 109 121.471 122.098 -0.627 1
1 1438 . 18 1 1 A 110 110 GLU H H 110 8.352 8.603 -0.251 1
1 1439 . 18 1 1 A 110 110 GLU HA H 110 4.233 4.415 -0.182 1
1 1444 . 18 1 1 A 110 110 GLU C C 110 176.439 176.730 -0.291 1
1 1445 . 18 1 1 A 110 110 GLU CA C 110 56.681 56.870 -0.189 1
1 1446 . 18 1 1 A 110 110 GLU CB C 110 29.860 29.750 0.110 1
1 1448 . 18 1 1 A 110 110 GLU N N 110 121.559 122.786 -1.227 1
1 1449 . 18 1 1 A 111 111 LEU H H 111 8.145 7.732 0.413 1
1 1450 . 18 1 1 A 111 111 LEU HA H 111 4.251 4.514 -0.263 1
1 1460 . 18 1 1 A 111 111 LEU C C 111 177.306 176.926 0.380 1
1 1461 . 18 1 1 A 111 111 LEU CA C 111 55.277 54.201 1.076 1
1 1462 . 18 1 1 A 111 111 LEU CB C 111 42.054 40.453 1.601 1
1 1466 . 18 1 1 A 111 111 LEU N N 111 122.181 120.037 2.144 1
1 1467 . 18 1 1 A 112 112 GLU H H 112 8.212 7.986 0.226 1
1 1468 . 18 1 1 A 112 112 GLU N N 112 120.291 118.172 2.119 1
1 1469 . 18 1 1 A 114 114 HIS C C 114 176.070 174.476 1.594 1
1 1470 . 18 1 1 A 116 116 HIS H H 116 8.227 8.739 -0.512 1
1 1471 . 18 1 1 A 116 116 HIS C C 116 173.580 175.248 -1.668 1
1 1472 . 18 1 1 A 116 116 HIS N N 116 119.156 125.274 -6.118 1
1 5 . 19 1 1 A 3 3 PRO HA H 3 4.390 4.626 -0.236 1
1 12 . 19 1 1 A 3 3 PRO C C 3 176.847 176.718 0.129 1
1 13 . 19 1 1 A 3 3 PRO CA C 3 63.449 62.328 1.121 1
1 14 . 19 1 1 A 3 3 PRO CB C 3 31.938 30.022 1.916 1
1 17 . 19 1 1 A 4 4 SER H H 4 8.531 8.133 0.398 1
1 18 . 19 1 1 A 4 4 SER HA H 4 4.262 4.532 -0.270 1
1 21 . 19 1 1 A 4 4 SER C C 4 175.414 174.128 1.286 1
1 22 . 19 1 1 A 4 4 SER CA C 4 59.163 57.871 1.292 1
1 23 . 19 1 1 A 4 4 SER CB C 4 63.242 62.482 0.760 1
1 24 . 19 1 1 A 4 4 SER N N 4 114.246 118.746 -4.500 1
1 25 . 19 1 1 A 5 5 LYS H H 5 8.468 7.930 0.538 1
1 26 . 19 1 1 A 5 5 LYS HA H 5 4.433 4.412 0.021 1
1 35 . 19 1 1 A 5 5 LYS C C 5 175.984 176.773 -0.789 1
1 36 . 19 1 1 A 5 5 LYS CA C 5 55.724 56.785 -1.061 1
1 37 . 19 1 1 A 5 5 LYS CB C 5 32.881 33.190 -0.309 1
1 41 . 19 1 1 A 5 5 LYS N N 5 123.488 125.926 -2.438 1
1 42 . 19 1 1 A 6 6 LEU H H 6 7.707 7.370 0.337 1
1 43 . 19 1 1 A 6 6 LEU HA H 6 4.381 4.332 0.049 1
1 53 . 19 1 1 A 6 6 LEU C C 6 177.820 176.667 1.153 1
1 54 . 19 1 1 A 6 6 LEU CA C 6 55.507 55.383 0.124 1
1 55 . 19 1 1 A 6 6 LEU CB C 6 43.374 42.620 0.754 1
1 59 . 19 1 1 A 6 6 LEU N N 6 121.233 123.110 -1.877 1
1 60 . 19 1 1 A 7 7 SER H H 7 9.433 8.952 0.481 1
1 61 . 19 1 1 A 7 7 SER HA H 7 4.638 4.596 0.042 1
1 64 . 19 1 1 A 7 7 SER C C 7 174.120 175.151 -1.031 1
1 65 . 19 1 1 A 7 7 SER CA C 7 57.962 58.754 -0.792 1
1 66 . 19 1 1 A 7 7 SER CB C 7 64.197 64.204 -0.007 1
1 67 . 19 1 1 A 7 7 SER N N 7 122.977 122.590 0.387 1
1 68 . 19 1 1 A 8 8 TYR H H 8 9.764 9.221 0.543 1
1 69 . 19 1 1 A 8 8 TYR HA H 8 4.732 4.289 0.443 1
1 76 . 19 1 1 A 8 8 TYR C C 8 177.206 177.789 -0.583 1
1 77 . 19 1 1 A 8 8 TYR CA C 8 58.762 61.872 -3.110 1
1 78 . 19 1 1 A 8 8 TYR CB C 8 36.605 38.861 -2.256 1
1 83 . 19 1 1 A 8 8 TYR N N 8 123.312 124.452 -1.140 1
1 84 . 19 1 1 A 9 9 GLY H H 9 10.131 8.385 1.746 1
1 85 . 19 1 1 A 9 9 GLY HA2 H 9 3.983 3.620 0.363 1
1 86 . 19 1 1 A 9 9 GLY HA3 H 9 3.423 3.716 -0.293 1
1 87 . 19 1 1 A 9 9 GLY C C 9 175.163 176.171 -1.008 1
1 88 . 19 1 1 A 9 9 GLY CA C 9 47.153 47.349 -0.196 1
1 89 . 19 1 1 A 9 9 GLY N N 9 107.177 105.651 1.526 1
1 90 . 19 1 1 A 10 10 GLU H H 10 7.876 8.009 -0.133 1
1 91 . 19 1 1 A 10 10 GLU HA H 10 4.107 4.080 0.027 1
1 96 . 19 1 1 A 10 10 GLU C C 10 179.924 178.869 1.055 1
1 97 . 19 1 1 A 10 10 GLU CA C 10 58.890 59.531 -0.641 1
1 98 . 19 1 1 A 10 10 GLU CB C 10 29.750 29.391 0.359 1
1 100 . 19 1 1 A 10 10 GLU N N 10 122.219 121.608 0.611 1
1 101 . 19 1 1 A 11 11 TYR H H 11 8.384 8.367 0.017 1
1 102 . 19 1 1 A 11 11 TYR HA H 11 4.305 4.194 0.111 1
1 107 . 19 1 1 A 11 11 TYR C C 11 176.854 177.049 -0.195 1
1 108 . 19 1 1 A 11 11 TYR CA C 11 61.040 61.552 -0.512 1
1 109 . 19 1 1 A 11 11 TYR CB C 11 37.593 39.001 -1.408 1
1 112 . 19 1 1 A 11 11 TYR N N 11 120.809 122.666 -1.857 1
1 113 . 19 1 1 A 12 12 LEU H H 12 9.027 8.211 0.816 1
1 114 . 19 1 1 A 12 12 LEU HA H 12 3.778 3.832 -0.054 1
1 124 . 19 1 1 A 12 12 LEU C C 12 178.621 179.409 -0.788 1
1 125 . 19 1 1 A 12 12 LEU CA C 12 57.534 57.439 0.095 1
1 126 . 19 1 1 A 12 12 LEU CB C 12 41.957 40.947 1.010 1
1 130 . 19 1 1 A 12 12 LEU N N 12 121.080 118.983 2.097 1
1 131 . 19 1 1 A 13 13 GLU H H 13 7.614 7.949 -0.335 1
1 132 . 19 1 1 A 13 13 GLU HA H 13 4.102 4.009 0.093 1
1 137 . 19 1 1 A 13 13 GLU C C 13 178.449 178.939 -0.490 1
1 138 . 19 1 1 A 13 13 GLU CA C 13 59.609 59.420 0.189 1
1 139 . 19 1 1 A 13 13 GLU CB C 13 29.124 29.726 -0.602 1
1 141 . 19 1 1 A 13 13 GLU N N 13 118.475 120.854 -2.379 1
1 142 . 19 1 1 A 14 14 SER H H 14 7.329 7.558 -0.229 1
1 143 . 19 1 1 A 14 14 SER HA H 14 4.358 4.251 0.107 1
1 146 . 19 1 1 A 14 14 SER C C 14 176.794 176.877 -0.083 1
1 147 . 19 1 1 A 14 14 SER CA C 14 61.064 61.514 -0.450 1
1 148 . 19 1 1 A 14 14 SER CB C 14 62.513 63.130 -0.617 1
1 149 . 19 1 1 A 14 14 SER N N 14 115.209 114.824 0.385 1
1 150 . 19 1 1 A 15 15 TRP H H 15 8.870 8.126 0.744 1
1 151 . 19 1 1 A 15 15 TRP HA H 15 4.005 4.250 -0.245 1
1 160 . 19 1 1 A 15 15 TRP C C 15 177.547 177.841 -0.294 1
1 161 . 19 1 1 A 15 15 TRP CA C 15 61.210 61.232 -0.022 1
1 162 . 19 1 1 A 15 15 TRP CB C 15 27.341 29.247 -1.906 1
1 168 . 19 1 1 A 15 15 TRP N N 15 124.998 123.768 1.230 1
1 170 . 19 1 1 A 16 16 PHE H H 16 9.087 8.062 1.025 1
1 171 . 19 1 1 A 16 16 PHE HA H 16 3.210 3.633 -0.423 1
1 179 . 19 1 1 A 16 16 PHE C C 16 175.909 177.496 -1.587 1
1 180 . 19 1 1 A 16 16 PHE CA C 16 61.473 61.376 0.097 1
1 181 . 19 1 1 A 16 16 PHE CB C 16 38.506 38.827 -0.321 1
1 187 . 19 1 1 A 16 16 PHE N N 16 119.825 121.103 -1.278 1
1 188 . 19 1 1 A 17 17 ASN H H 17 7.768 7.941 -0.173 1
1 189 . 19 1 1 A 17 17 ASN HA H 17 4.078 4.134 -0.056 1
1 194 . 19 1 1 A 17 17 ASN C C 17 176.604 177.316 -0.712 1
1 195 . 19 1 1 A 17 17 ASN CA C 17 55.621 56.152 -0.531 1
1 196 . 19 1 1 A 17 17 ASN CB C 17 37.830 38.128 -0.298 1
1 197 . 19 1 1 A 17 17 ASN N N 17 115.600 117.345 -1.745 1
1 199 . 19 1 1 A 18 18 THR H H 18 7.454 7.129 0.325 1
1 200 . 19 1 1 A 18 18 THR HA H 18 4.147 4.078 0.069 1
1 205 . 19 1 1 A 18 18 THR C C 18 175.692 176.095 -0.403 1
1 206 . 19 1 1 A 18 18 THR CA C 18 64.679 64.245 0.434 1
1 207 . 19 1 1 A 18 18 THR CB C 18 68.940 68.818 0.122 1
1 209 . 19 1 1 A 18 18 THR N N 18 113.049 115.254 -2.205 1
1 210 . 19 1 1 A 19 19 LYS H H 19 7.918 7.566 0.352 1
1 211 . 19 1 1 A 19 19 LYS HA H 19 3.791 3.665 0.126 1
1 220 . 19 1 1 A 19 19 LYS C C 19 178.120 179.047 -0.927 1
1 221 . 19 1 1 A 19 19 LYS CA C 19 55.985 58.792 -2.807 1
1 222 . 19 1 1 A 19 19 LYS CB C 19 31.130 31.061 0.069 1
1 226 . 19 1 1 A 19 19 LYS N N 19 122.614 121.113 1.501 1
1 227 . 19 1 1 A 20 20 ARG H H 20 7.845 7.546 0.299 1
1 228 . 19 1 1 A 20 20 ARG HA H 20 3.396 3.785 -0.389 1
1 236 . 19 1 1 A 20 20 ARG C C 20 175.601 177.812 -2.211 1
1 237 . 19 1 1 A 20 20 ARG CA C 20 58.182 58.264 -0.082 1
1 238 . 19 1 1 A 20 20 ARG CB C 20 28.045 29.878 -1.833 1
1 241 . 19 1 1 A 20 20 ARG N N 20 116.282 118.458 -2.176 1
1 243 . 19 1 1 A 21 21 HIS H H 21 7.163 7.364 -0.201 1
1 244 . 19 1 1 A 21 21 HIS HA H 21 4.500 4.354 0.146 1
1 249 . 19 1 1 A 21 21 HIS C C 21 175.618 177.080 -1.462 1
1 250 . 19 1 1 A 21 21 HIS CA C 21 56.912 59.011 -2.099 1
1 251 . 19 1 1 A 21 21 HIS CB C 21 29.400 29.863 -0.463 1
1 254 . 19 1 1 A 21 21 HIS N N 21 115.452 117.852 -2.400 1
1 255 . 19 1 1 A 22 22 SER H H 22 7.951 7.435 0.516 1
1 256 . 19 1 1 A 22 22 SER HA H 22 4.573 4.216 0.357 1
1 259 . 19 1 1 A 22 22 SER C C 22 173.948 173.994 -0.046 1
1 260 . 19 1 1 A 22 22 SER CA C 22 58.589 61.148 -2.559 1
1 261 . 19 1 1 A 22 22 SER CB C 22 64.228 63.529 0.699 1
1 262 . 19 1 1 A 22 22 SER N N 22 113.209 114.136 -0.927 1
1 263 . 19 1 1 A 23 23 VAL H H 23 7.179 7.126 0.053 1
1 264 . 19 1 1 A 23 23 VAL HA H 23 4.626 4.577 0.049 1
1 272 . 19 1 1 A 23 23 VAL C C 23 175.397 175.851 -0.454 1
1 273 . 19 1 1 A 23 23 VAL CA C 23 59.556 60.055 -0.499 1
1 274 . 19 1 1 A 23 23 VAL CB C 23 33.810 34.589 -0.779 1
1 277 . 19 1 1 A 23 23 VAL N N 23 113.108 116.940 -3.832 1
1 278 . 19 1 1 A 24 24 GLY H H 24 8.189 8.560 -0.371 1
1 279 . 19 1 1 A 24 24 GLY HA2 H 24 4.074 4.031 0.043 1
1 280 . 19 1 1 A 24 24 GLY HA3 H 24 4.195 4.055 0.140 1
1 281 . 19 1 1 A 24 24 GLY C C 24 174.037 174.458 -0.421 1
1 282 . 19 1 1 A 24 24 GLY CA C 24 44.452 44.961 -0.509 1
1 283 . 19 1 1 A 24 24 GLY N N 24 108.374 108.657 -0.283 1
1 284 . 19 1 1 A 25 25 ILE H H 25 8.331 8.596 -0.265 1
1 285 . 19 1 1 A 25 25 ILE HA H 25 3.839 3.589 0.250 1
1 295 . 19 1 1 A 25 25 ILE C C 25 178.042 177.819 0.223 1
1 296 . 19 1 1 A 25 25 ILE CA C 25 64.238 64.433 -0.195 1
1 297 . 19 1 1 A 25 25 ILE CB C 25 37.931 37.413 0.518 1
1 301 . 19 1 1 A 25 25 ILE N N 25 119.895 120.467 -0.572 1
1 302 . 19 1 1 A 26 26 GLN H H 26 8.545 8.441 0.104 1
1 303 . 19 1 1 A 26 26 GLN HA H 26 4.129 4.054 0.075 1
1 310 . 19 1 1 A 26 26 GLN C C 26 178.454 178.300 0.154 1
1 311 . 19 1 1 A 26 26 GLN CA C 26 58.772 58.162 0.610 1
1 312 . 19 1 1 A 26 26 GLN CB C 26 27.346 28.479 -1.133 1
1 314 . 19 1 1 A 26 26 GLN N N 26 120.013 119.850 0.163 1
1 316 . 19 1 1 A 27 27 THR H H 27 7.944 8.083 -0.139 1
1 317 . 19 1 1 A 27 27 THR HA H 27 3.953 3.851 0.102 1
1 322 . 19 1 1 A 27 27 THR C C 27 175.818 176.063 -0.245 1
1 323 . 19 1 1 A 27 27 THR CA C 27 65.855 66.310 -0.455 1
1 324 . 19 1 1 A 27 27 THR CB C 27 68.127 68.427 -0.300 1
1 326 . 19 1 1 A 27 27 THR N N 27 117.645 116.763 0.882 1
1 327 . 19 1 1 A 28 28 ALA H H 28 8.593 8.192 0.401 1
1 328 . 19 1 1 A 28 28 ALA HA H 28 3.899 4.025 -0.126 1
1 332 . 19 1 1 A 28 28 ALA C C 28 178.515 179.807 -1.292 1
1 333 . 19 1 1 A 28 28 ALA CA C 28 55.742 55.605 0.137 1
1 334 . 19 1 1 A 28 28 ALA CB C 28 17.513 18.168 -0.655 1
1 335 . 19 1 1 A 28 28 ALA N N 28 123.917 123.544 0.373 1
1 336 . 19 1 1 A 29 29 LYS H H 29 7.800 7.756 0.044 1
1 337 . 19 1 1 A 29 29 LYS HA H 29 3.982 4.092 -0.110 1
1 346 . 19 1 1 A 29 29 LYS C C 29 179.527 178.697 0.830 1
1 347 . 19 1 1 A 29 29 LYS CA C 29 59.761 59.101 0.660 1
1 348 . 19 1 1 A 29 29 LYS CB C 29 32.223 32.131 0.092 1
1 352 . 19 1 1 A 29 29 LYS N N 29 117.474 118.942 -1.468 1
1 353 . 19 1 1 A 30 30 VAL H H 30 7.591 7.270 0.321 1
1 354 . 19 1 1 A 30 30 VAL HA H 30 3.503 3.505 -0.002 1
1 362 . 19 1 1 A 30 30 VAL C C 30 178.389 177.880 0.509 1
1 363 . 19 1 1 A 30 30 VAL CA C 30 65.640 65.949 -0.309 1
1 364 . 19 1 1 A 30 30 VAL CB C 30 31.644 31.625 0.019 1
1 367 . 19 1 1 A 30 30 VAL N N 30 121.749 120.270 1.479 1
1 368 . 19 1 1 A 31 31 LEU H H 31 8.333 8.243 0.090 1
1 369 . 19 1 1 A 31 31 LEU HA H 31 4.074 4.180 -0.106 1
1 379 . 19 1 1 A 31 31 LEU C C 31 177.780 178.706 -0.926 1
1 380 . 19 1 1 A 31 31 LEU CA C 31 58.157 58.001 0.156 1
1 381 . 19 1 1 A 31 31 LEU CB C 31 42.230 41.187 1.043 1
1 385 . 19 1 1 A 31 31 LEU N N 31 120.901 120.025 0.876 1
1 386 . 19 1 1 A 32 32 LYS H H 32 8.562 8.039 0.523 1
1 387 . 19 1 1 A 32 32 LYS HA H 32 3.290 3.889 -0.599 1
1 395 . 19 1 1 A 32 32 LYS C C 32 178.037 178.759 -0.722 1
1 396 . 19 1 1 A 32 32 LYS CA C 32 58.911 59.462 -0.551 1
1 397 . 19 1 1 A 32 32 LYS CB C 32 31.605 31.223 0.382 1
1 401 . 19 1 1 A 32 32 LYS N N 32 119.075 119.806 -0.731 1
1 402 . 19 1 1 A 33 33 GLY H H 33 7.694 7.619 0.075 1
1 403 . 19 1 1 A 33 33 GLY HA2 H 33 3.949 3.475 0.474 1
1 404 . 19 1 1 A 33 33 GLY HA3 H 33 3.826 3.581 0.245 1
1 405 . 19 1 1 A 33 33 GLY C C 33 177.101 176.420 0.681 1
1 406 . 19 1 1 A 33 33 GLY CA C 33 46.928 47.072 -0.144 1
1 407 . 19 1 1 A 33 33 GLY N N 33 105.282 106.963 -1.681 1
1 408 . 19 1 1 A 34 34 TYR H H 34 8.015 7.427 0.588 1
1 409 . 19 1 1 A 34 34 TYR HA H 34 4.558 4.708 -0.150 1
1 416 . 19 1 1 A 34 34 TYR C C 34 179.611 178.065 1.546 1
1 417 . 19 1 1 A 34 34 TYR CA C 34 59.349 60.070 -0.721 1
1 418 . 19 1 1 A 34 34 TYR CB C 34 37.344 38.181 -0.837 1
1 423 . 19 1 1 A 34 34 TYR N N 34 121.781 121.836 -0.055 1
1 424 . 19 1 1 A 35 35 LEU H H 35 8.689 8.204 0.485 1
1 425 . 19 1 1 A 35 35 LEU HA H 35 3.977 3.919 0.058 1
1 435 . 19 1 1 A 35 35 LEU C C 35 177.081 178.727 -1.646 1
1 436 . 19 1 1 A 35 35 LEU CA C 35 59.155 58.480 0.675 1
1 437 . 19 1 1 A 35 35 LEU CB C 35 41.103 41.817 -0.714 1
1 441 . 19 1 1 A 35 35 LEU N N 35 120.392 120.593 -0.201 1
1 442 . 19 1 1 A 36 36 ASN H H 36 8.721 8.476 0.245 1
1 443 . 19 1 1 A 36 36 ASN HA H 36 4.435 4.405 0.030 1
1 448 . 19 1 1 A 36 36 ASN C C 36 176.792 178.036 -1.244 1
1 449 . 19 1 1 A 36 36 ASN CA C 36 55.642 56.656 -1.014 1
1 450 . 19 1 1 A 36 36 ASN CB C 36 38.319 38.208 0.111 1
1 451 . 19 1 1 A 36 36 ASN N N 36 114.623 116.988 -2.365 1
1 453 . 19 1 1 A 37 37 SER H H 37 8.511 7.988 0.523 1
1 454 . 19 1 1 A 37 37 SER HA H 37 4.642 4.196 0.446 1
1 457 . 19 1 1 A 37 37 SER C C 37 175.039 176.649 -1.610 1
1 458 . 19 1 1 A 37 37 SER CA C 37 59.825 61.529 -1.704 1
1 459 . 19 1 1 A 37 37 SER CB C 37 64.056 62.998 1.058 1
1 460 . 19 1 1 A 37 37 SER N N 37 110.941 114.876 -3.935 1
1 461 . 19 1 1 A 38 38 ARG H H 38 7.242 7.979 -0.737 1
1 462 . 19 1 1 A 38 38 ARG HA H 38 4.919 4.396 0.523 1
1 469 . 19 1 1 A 38 38 ARG C C 38 176.514 178.462 -1.948 1
1 470 . 19 1 1 A 38 38 ARG CA C 38 56.687 58.170 -1.483 1
1 471 . 19 1 1 A 38 38 ARG CB C 38 32.434 31.269 1.165 1
1 474 . 19 1 1 A 38 38 ARG N N 38 117.062 120.668 -3.606 1
1 475 . 19 1 1 A 39 39 ILE H H 39 8.462 8.041 0.421 1
1 476 . 19 1 1 A 39 39 ILE HA H 39 3.618 4.009 -0.391 1
1 486 . 19 1 1 A 39 39 ILE C C 39 176.267 178.279 -2.012 1
1 487 . 19 1 1 A 39 39 ILE CA C 39 66.134 64.893 1.241 1
1 488 . 19 1 1 A 39 39 ILE CB C 39 39.787 37.835 1.952 1
1 492 . 19 1 1 A 39 39 ILE N N 39 121.214 120.534 0.680 1
1 493 . 19 1 1 A 40 40 ILE H H 40 9.339 8.310 1.029 1
1 494 . 19 1 1 A 40 40 ILE HA H 40 3.401 3.782 -0.381 1
1 504 . 19 1 1 A 40 40 ILE CA C 40 67.844 66.415 1.429 1
1 505 . 19 1 1 A 40 40 ILE CB C 40 34.406 35.562 -1.156 1
1 509 . 19 1 1 A 40 40 ILE N N 40 119.695 121.524 -1.829 1
1 510 . 19 1 1 A 41 41 PRO HA H 41 4.314 4.425 -0.111 1
1 517 . 19 1 1 A 41 41 PRO C C 41 177.418 178.741 -1.323 1
1 518 . 19 1 1 A 41 41 PRO CA C 41 65.912 65.217 0.695 1
1 519 . 19 1 1 A 41 41 PRO CB C 41 30.686 31.296 -0.610 1
1 522 . 19 1 1 A 42 42 SER H H 42 6.857 8.072 -1.215 1
1 523 . 19 1 1 A 42 42 SER HA H 42 4.558 4.429 0.129 1
1 526 . 19 1 1 A 42 42 SER C C 42 174.813 176.627 -1.814 1
1 527 . 19 1 1 A 42 42 SER CA C 42 61.279 60.614 0.665 1
1 528 . 19 1 1 A 42 42 SER CB C 42 64.285 64.174 0.111 1
1 529 . 19 1 1 A 42 42 SER N N 42 108.994 113.255 -4.261 1
1 530 . 19 1 1 A 43 43 LEU H H 43 8.230 8.121 0.109 1
1 531 . 19 1 1 A 43 43 LEU HA H 43 4.572 4.316 0.256 1
1 541 . 19 1 1 A 43 43 LEU C C 43 177.301 179.083 -1.782 1
1 542 . 19 1 1 A 43 43 LEU CA C 43 54.113 55.983 -1.870 1
1 543 . 19 1 1 A 43 43 LEU CB C 43 44.800 42.428 2.372 1
1 547 . 19 1 1 A 43 43 LEU N N 43 118.715 120.497 -1.782 1
1 548 . 19 1 1 A 44 44 GLY H H 44 8.498 8.559 -0.061 1
1 549 . 19 1 1 A 44 44 GLY HA2 H 44 4.010 3.833 0.177 1
1 550 . 19 1 1 A 44 44 GLY HA3 H 44 3.613 3.873 -0.260 1
1 551 . 19 1 1 A 44 44 GLY C C 44 174.178 176.248 -2.070 1
1 552 . 19 1 1 A 44 44 GLY CA C 44 46.271 47.314 -1.043 1
1 553 . 19 1 1 A 44 44 GLY N N 44 105.371 106.787 -1.416 1
1 554 . 19 1 1 A 45 45 ASN H H 45 8.385 7.570 0.815 1
1 555 . 19 1 1 A 45 45 ASN HA H 45 4.789 4.692 0.097 1
1 560 . 19 1 1 A 45 45 ASN C C 45 175.386 176.266 -0.880 1
1 561 . 19 1 1 A 45 45 ASN CA C 45 53.144 54.658 -1.514 1
1 562 . 19 1 1 A 45 45 ASN CB C 45 37.928 38.541 -0.613 1
1 563 . 19 1 1 A 45 45 ASN N N 45 114.387 118.669 -4.282 1
1 565 . 19 1 1 A 46 46 ILE H H 46 7.465 7.440 0.025 1
1 566 . 19 1 1 A 46 46 ILE HA H 46 3.856 4.098 -0.242 1
1 576 . 19 1 1 A 46 46 ILE C C 46 175.997 176.336 -0.339 1
1 577 . 19 1 1 A 46 46 ILE CA C 46 60.853 61.580 -0.727 1
1 578 . 19 1 1 A 46 46 ILE CB C 46 38.042 38.631 -0.589 1
1 582 . 19 1 1 A 46 46 ILE N N 46 123.998 120.792 3.206 1
1 583 . 19 1 1 A 47 47 LYS H H 47 8.717 8.621 0.096 1
1 584 . 19 1 1 A 47 47 LYS HA H 47 4.249 4.328 -0.079 1
1 591 . 19 1 1 A 47 47 LYS C C 47 177.583 177.617 -0.034 1
1 592 . 19 1 1 A 47 47 LYS CA C 47 56.320 57.089 -0.769 1
1 593 . 19 1 1 A 47 47 LYS CB C 47 30.393 32.840 -2.447 1
1 596 . 19 1 1 A 47 47 LYS N N 47 126.114 124.583 1.531 1
1 597 . 19 1 1 A 48 48 LEU H H 48 8.323 8.320 0.003 1
1 598 . 19 1 1 A 48 48 LEU HA H 48 3.691 4.079 -0.388 1
1 608 . 19 1 1 A 48 48 LEU C C 48 177.274 178.361 -1.087 1
1 609 . 19 1 1 A 48 48 LEU CA C 48 58.443 58.307 0.136 1
1 610 . 19 1 1 A 48 48 LEU CB C 48 42.282 41.150 1.132 1
1 614 . 19 1 1 A 48 48 LEU N N 48 125.857 125.596 0.261 1
1 615 . 19 1 1 A 49 49 ALA H H 49 8.929 7.961 0.968 1
1 616 . 19 1 1 A 49 49 ALA HA H 49 4.067 4.027 0.040 1
1 620 . 19 1 1 A 49 49 ALA C C 49 177.468 178.464 -0.996 1
1 621 . 19 1 1 A 49 49 ALA CA C 49 53.092 54.647 -1.555 1
1 622 . 19 1 1 A 49 49 ALA CB C 49 18.562 18.186 0.376 1
1 623 . 19 1 1 A 49 49 ALA N N 49 115.543 120.260 -4.717 1
1 624 . 19 1 1 A 50 50 LYS H H 50 7.684 7.341 0.343 1
1 625 . 19 1 1 A 50 50 LYS HA H 50 4.395 4.294 0.101 1
1 634 . 19 1 1 A 50 50 LYS C C 50 174.958 176.714 -1.756 1
1 635 . 19 1 1 A 50 50 LYS CA C 50 53.977 56.647 -2.670 1
1 636 . 19 1 1 A 50 50 LYS CB C 50 32.645 32.785 -0.140 1
1 640 . 19 1 1 A 50 50 LYS N N 50 114.788 114.859 -0.071 1
1 641 . 19 1 1 A 51 51 LEU H H 51 6.776 7.021 -0.245 1
1 642 . 19 1 1 A 51 51 LEU HA H 51 4.569 4.508 0.061 1
1 652 . 19 1 1 A 51 51 LEU C C 51 177.953 175.675 2.278 1
1 653 . 19 1 1 A 51 51 LEU CA C 51 55.318 54.947 0.371 1
1 654 . 19 1 1 A 51 51 LEU CB C 51 43.182 40.906 2.276 1
1 658 . 19 1 1 A 51 51 LEU N N 51 121.408 122.080 -0.672 1
1 659 . 19 1 1 A 52 52 THR H H 52 10.680 8.059 2.621 1
1 660 . 19 1 1 A 52 52 THR HA H 52 4.938 4.605 0.333 1
1 665 . 19 1 1 A 52 52 THR C C 52 175.553 174.459 1.094 1
1 666 . 19 1 1 A 52 52 THR CA C 52 59.740 59.916 -0.176 1
1 667 . 19 1 1 A 52 52 THR CB C 52 73.557 71.135 2.422 1
1 669 . 19 1 1 A 52 52 THR N N 52 119.481 119.449 0.032 1
1 670 . 19 1 1 A 53 53 SER H H 53 9.278 8.966 0.312 1
1 671 . 19 1 1 A 53 53 SER HA H 53 4.261 4.167 0.094 1
1 674 . 19 1 1 A 53 53 SER C C 53 176.990 176.200 0.790 1
1 675 . 19 1 1 A 53 53 SER CA C 53 61.025 61.096 -0.071 1
1 676 . 19 1 1 A 53 53 SER CB C 53 62.312 62.914 -0.602 1
1 677 . 19 1 1 A 53 53 SER N N 53 116.343 121.842 -5.499 1
1 678 . 19 1 1 A 54 54 LEU H H 54 7.808 8.052 -0.244 1
1 679 . 19 1 1 A 54 54 LEU HA H 54 4.229 4.045 0.184 1
1 688 . 19 1 1 A 54 54 LEU C C 54 178.505 178.585 -0.080 1
1 689 . 19 1 1 A 54 54 LEU CA C 54 57.719 58.051 -0.332 1
1 690 . 19 1 1 A 54 54 LEU CB C 54 40.997 41.580 -0.583 1
1 694 . 19 1 1 A 54 54 LEU N N 54 126.055 123.193 2.862 1
1 695 . 19 1 1 A 55 55 HIS H H 55 7.798 8.213 -0.415 1
1 696 . 19 1 1 A 55 55 HIS HA H 55 4.311 4.336 -0.025 1
1 701 . 19 1 1 A 55 55 HIS C C 55 180.044 177.763 2.281 1
1 702 . 19 1 1 A 55 55 HIS CA C 55 60.583 59.659 0.924 1
1 703 . 19 1 1 A 55 55 HIS CB C 55 31.445 29.822 1.623 1
1 706 . 19 1 1 A 55 55 HIS N N 55 118.683 117.770 0.913 1
1 707 . 19 1 1 A 56 56 MET H H 56 7.375 7.948 -0.573 1
1 708 . 19 1 1 A 56 56 MET HA H 56 4.513 3.946 0.567 1
1 716 . 19 1 1 A 56 56 MET C C 56 177.169 178.617 -1.448 1
1 717 . 19 1 1 A 56 56 MET CA C 56 55.823 59.294 -3.471 1
1 718 . 19 1 1 A 56 56 MET CB C 56 31.303 33.022 -1.719 1
1 721 . 19 1 1 A 56 56 MET N N 56 114.530 117.333 -2.803 1
1 722 . 19 1 1 A 57 57 GLN H H 57 8.387 8.331 0.056 1
1 723 . 19 1 1 A 57 57 GLN HA H 57 3.981 4.012 -0.031 1
1 730 . 19 1 1 A 57 57 GLN C C 57 178.033 178.287 -0.254 1
1 731 . 19 1 1 A 57 57 GLN CA C 57 57.922 59.326 -1.404 1
1 732 . 19 1 1 A 57 57 GLN CB C 57 29.012 28.396 0.616 1
1 734 . 19 1 1 A 57 57 GLN N N 57 120.713 119.591 1.122 1
1 736 . 19 1 1 A 58 58 ASN H H 58 8.765 8.550 0.215 1
1 737 . 19 1 1 A 58 58 ASN HA H 58 4.539 4.497 0.042 1
1 742 . 19 1 1 A 58 58 ASN C C 58 178.084 177.604 0.480 1
1 743 . 19 1 1 A 58 58 ASN CA C 58 55.345 56.257 -0.912 1
1 744 . 19 1 1 A 58 58 ASN CB C 58 36.924 38.157 -1.233 1
1 745 . 19 1 1 A 58 58 ASN N N 58 117.390 117.945 -0.555 1
1 747 . 19 1 1 A 59 59 TYR H H 59 8.239 7.945 0.294 1
1 748 . 19 1 1 A 59 59 TYR HA H 59 4.586 4.184 0.402 1
1 755 . 19 1 1 A 59 59 TYR C C 59 178.015 176.943 1.072 1
1 756 . 19 1 1 A 59 59 TYR CA C 59 60.779 61.572 -0.793 1
1 757 . 19 1 1 A 59 59 TYR CB C 59 38.047 38.733 -0.686 1
1 762 . 19 1 1 A 59 59 TYR N N 59 122.335 122.975 -0.640 1
1 763 . 19 1 1 A 60 60 VAL H H 60 8.416 8.360 0.056 1
1 764 . 19 1 1 A 60 60 VAL HA H 60 3.244 3.606 -0.362 1
1 772 . 19 1 1 A 60 60 VAL C C 60 177.309 178.406 -1.097 1
1 773 . 19 1 1 A 60 60 VAL CA C 60 67.022 66.507 0.515 1
1 774 . 19 1 1 A 60 60 VAL CB C 60 30.929 31.373 -0.444 1
1 777 . 19 1 1 A 60 60 VAL N N 60 119.842 119.585 0.257 1
1 778 . 19 1 1 A 61 61 ASN H H 61 8.264 8.316 -0.052 1
1 779 . 19 1 1 A 61 61 ASN HA H 61 4.305 4.434 -0.129 1
1 784 . 19 1 1 A 61 61 ASN C C 61 177.263 177.849 -0.586 1
1 785 . 19 1 1 A 61 61 ASN CA C 61 55.548 56.600 -1.052 1
1 786 . 19 1 1 A 61 61 ASN CB C 61 36.645 38.267 -1.622 1
1 787 . 19 1 1 A 61 61 ASN N N 61 119.103 119.746 -0.643 1
1 789 . 19 1 1 A 62 62 SER H H 62 8.143 7.948 0.195 1
1 790 . 19 1 1 A 62 62 SER HA H 62 4.343 4.125 0.218 1
1 793 . 19 1 1 A 62 62 SER C C 62 176.409 177.529 -1.120 1
1 794 . 19 1 1 A 62 62 SER CA C 62 61.612 61.437 0.175 1
1 795 . 19 1 1 A 62 62 SER CB C 62 62.219 62.506 -0.287 1
1 796 . 19 1 1 A 62 62 SER N N 62 118.254 115.028 3.226 1
1 797 . 19 1 1 A 63 63 LEU H H 63 7.664 7.621 0.043 1
1 798 . 19 1 1 A 63 63 LEU HA H 63 4.003 3.906 0.097 1
1 808 . 19 1 1 A 63 63 LEU C C 63 178.748 179.141 -0.393 1
1 809 . 19 1 1 A 63 63 LEU CA C 63 57.171 57.842 -0.671 1
1 810 . 19 1 1 A 63 63 LEU CB C 63 41.134 40.691 0.443 1
1 814 . 19 1 1 A 63 63 LEU N N 63 123.812 122.654 1.158 1
1 815 . 19 1 1 A 64 64 ARG H H 64 7.969 7.665 0.304 1
1 816 . 19 1 1 A 64 64 ARG HA H 64 4.038 3.878 0.160 1
1 824 . 19 1 1 A 64 64 ARG C C 64 180.797 178.958 1.839 1
1 825 . 19 1 1 A 64 64 ARG CA C 64 58.598 59.778 -1.180 1
1 826 . 19 1 1 A 64 64 ARG CB C 64 28.849 29.907 -1.058 1
1 829 . 19 1 1 A 64 64 ARG N N 64 120.376 121.244 -0.868 1
1 831 . 19 1 1 A 65 65 ASP H H 65 8.465 7.769 0.696 1
1 832 . 19 1 1 A 65 65 ASP HA H 65 4.408 4.444 -0.036 1
1 835 . 19 1 1 A 65 65 ASP C C 65 177.336 178.458 -1.122 1
1 836 . 19 1 1 A 65 65 ASP CA C 65 56.957 56.773 0.184 1
1 837 . 19 1 1 A 65 65 ASP CB C 65 39.602 40.086 -0.484 1
1 838 . 19 1 1 A 65 65 ASP N N 65 122.402 119.425 2.977 1
1 839 . 19 1 1 A 66 66 GLU H H 66 7.703 7.735 -0.032 1
1 840 . 19 1 1 A 66 66 GLU HA H 66 4.213 4.305 -0.092 1
1 845 . 19 1 1 A 66 66 GLU C C 66 176.586 177.384 -0.798 1
1 846 . 19 1 1 A 66 66 GLU CA C 66 56.974 56.455 0.519 1
1 847 . 19 1 1 A 66 66 GLU CB C 66 29.821 30.198 -0.377 1
1 849 . 19 1 1 A 66 66 GLU N N 66 119.076 116.789 2.287 1
1 850 . 19 1 1 A 67 67 GLY H H 67 7.861 7.608 0.253 1
1 851 . 19 1 1 A 67 67 GLY HA2 H 67 4.269 3.925 0.344 1
1 852 . 19 1 1 A 67 67 GLY HA3 H 67 3.731 3.927 -0.196 1
1 853 . 19 1 1 A 67 67 GLY C C 67 174.614 174.964 -0.350 1
1 854 . 19 1 1 A 67 67 GLY CA C 67 44.608 46.559 -1.951 1
1 855 . 19 1 1 A 67 67 GLY N N 67 105.730 109.475 -3.745 1
1 856 . 19 1 1 A 68 68 LEU H H 68 7.324 7.963 -0.639 1
1 857 . 19 1 1 A 68 68 LEU HA H 68 4.257 4.226 0.031 1
1 867 . 19 1 1 A 68 68 LEU C C 68 176.136 176.997 -0.861 1
1 868 . 19 1 1 A 68 68 LEU CA C 68 55.659 54.549 1.110 1
1 869 . 19 1 1 A 68 68 LEU CB C 68 41.874 42.076 -0.202 1
1 873 . 19 1 1 A 68 68 LEU N N 68 121.062 121.112 -0.050 1
1 874 . 19 1 1 A 69 69 LYS H H 69 8.368 8.357 0.011 1
1 875 . 19 1 1 A 69 69 LYS HA H 69 4.281 4.597 -0.316 1
1 884 . 19 1 1 A 69 69 LYS C C 69 177.940 178.056 -0.116 1
1 885 . 19 1 1 A 69 69 LYS CA C 69 55.412 55.558 -0.146 1
1 886 . 19 1 1 A 69 69 LYS CB C 69 32.761 33.630 -0.869 1
1 890 . 19 1 1 A 69 69 LYS N N 69 120.120 122.304 -2.184 1
1 891 . 19 1 1 A 70 70 ARG H H 70 9.095 8.862 0.233 1
1 892 . 19 1 1 A 70 70 ARG HA H 70 3.684 4.107 -0.423 1
1 900 . 19 1 1 A 70 70 ARG C C 70 177.712 178.623 -0.911 1
1 901 . 19 1 1 A 70 70 ARG CA C 70 60.216 58.443 1.773 1
1 902 . 19 1 1 A 70 70 ARG CB C 70 29.539 29.855 -0.316 1
1 905 . 19 1 1 A 70 70 ARG N N 70 123.339 119.019 4.320 1
1 907 . 19 1 1 A 71 71 GLY H H 71 8.985 8.337 0.648 1
1 908 . 19 1 1 A 71 71 GLY HA2 H 71 3.932 3.655 0.277 1
1 909 . 19 1 1 A 71 71 GLY HA3 H 71 3.905 3.658 0.247 1
1 910 . 19 1 1 A 71 71 GLY C C 71 176.324 175.959 0.365 1
1 911 . 19 1 1 A 71 71 GLY CA C 71 46.752 47.468 -0.716 1
1 912 . 19 1 1 A 71 71 GLY N N 71 104.509 108.794 -4.285 1
1 913 . 19 1 1 A 72 72 THR H H 72 7.295 7.718 -0.423 1
1 914 . 19 1 1 A 72 72 THR HA H 72 4.014 3.962 0.052 1
1 919 . 19 1 1 A 72 72 THR C C 72 175.135 176.072 -0.937 1
1 920 . 19 1 1 A 72 72 THR CA C 72 65.848 66.446 -0.598 1
1 921 . 19 1 1 A 72 72 THR CB C 72 68.160 68.453 -0.293 1
1 923 . 19 1 1 A 72 72 THR N N 72 118.617 117.579 1.038 1
1 924 . 19 1 1 A 73 73 ILE H H 73 7.883 8.016 -0.133 1
1 925 . 19 1 1 A 73 73 ILE HA H 73 3.258 3.611 -0.353 1
1 935 . 19 1 1 A 73 73 ILE C C 73 177.060 177.949 -0.889 1
1 936 . 19 1 1 A 73 73 ILE CA C 73 66.561 65.524 1.037 1
1 937 . 19 1 1 A 73 73 ILE CB C 73 37.339 37.659 -0.320 1
1 941 . 19 1 1 A 73 73 ILE N N 73 121.692 121.228 0.464 1
1 942 . 19 1 1 A 74 74 GLU H H 74 8.723 8.261 0.462 1
1 943 . 19 1 1 A 74 74 GLU HA H 74 3.807 3.885 -0.078 1
1 948 . 19 1 1 A 74 74 GLU C C 74 178.319 178.941 -0.622 1
1 949 . 19 1 1 A 74 74 GLU CA C 74 59.637 60.068 -0.431 1
1 950 . 19 1 1 A 74 74 GLU CB C 74 29.257 29.334 -0.077 1
1 952 . 19 1 1 A 74 74 GLU N N 74 117.701 120.777 -3.076 1
1 953 . 19 1 1 A 75 75 LYS H H 75 7.361 7.357 0.004 1
1 954 . 19 1 1 A 75 75 LYS HA H 75 3.958 4.039 -0.081 1
1 963 . 19 1 1 A 75 75 LYS C C 75 178.554 179.379 -0.825 1
1 964 . 19 1 1 A 75 75 LYS CA C 75 59.764 59.313 0.451 1
1 965 . 19 1 1 A 75 75 LYS CB C 75 32.314 32.138 0.176 1
1 969 . 19 1 1 A 75 75 LYS N N 75 118.734 117.950 0.784 1
1 970 . 19 1 1 A 76 76 ILE H H 76 7.713 7.420 0.293 1
1 971 . 19 1 1 A 76 76 ILE HA H 76 3.221 3.807 -0.586 1
1 981 . 19 1 1 A 76 76 ILE C C 76 177.504 178.176 -0.672 1
1 982 . 19 1 1 A 76 76 ILE CA C 76 65.796 64.399 1.397 1
1 983 . 19 1 1 A 76 76 ILE CB C 76 37.732 37.231 0.501 1
1 987 . 19 1 1 A 76 76 ILE N N 76 120.312 116.924 3.388 1
1 988 . 19 1 1 A 77 77 ILE H H 77 8.587 8.045 0.542 1
1 989 . 19 1 1 A 77 77 ILE HA H 77 3.778 3.571 0.207 1
1 999 . 19 1 1 A 77 77 ILE C C 77 177.074 178.119 -1.045 1
1 1000 . 19 1 1 A 77 77 ILE CA C 77 63.168 65.029 -1.861 1
1 1001 . 19 1 1 A 77 77 ILE CB C 77 36.617 37.690 -1.073 1
1 1005 . 19 1 1 A 77 77 ILE N N 77 118.978 121.353 -2.375 1
1 1006 . 19 1 1 A 78 78 LYS H H 78 8.050 7.987 0.063 1
1 1007 . 19 1 1 A 78 78 LYS HA H 78 3.925 4.018 -0.093 1
1 1016 . 19 1 1 A 78 78 LYS C C 78 178.291 179.241 -0.950 1
1 1017 . 19 1 1 A 78 78 LYS CA C 78 60.192 59.191 1.001 1
1 1018 . 19 1 1 A 78 78 LYS CB C 78 31.886 31.996 -0.110 1
1 1022 . 19 1 1 A 78 78 LYS N N 78 121.618 119.354 2.264 1
1 1023 . 19 1 1 A 79 79 VAL H H 79 7.619 7.926 -0.307 1
1 1024 . 19 1 1 A 79 79 VAL HA H 79 3.846 3.792 0.054 1
1 1032 . 19 1 1 A 79 79 VAL C C 79 177.712 178.459 -0.747 1
1 1033 . 19 1 1 A 79 79 VAL CA C 79 66.494 66.427 0.067 1
1 1034 . 19 1 1 A 79 79 VAL CB C 79 31.298 31.719 -0.421 1
1 1037 . 19 1 1 A 79 79 VAL N N 79 120.254 119.677 0.577 1
1 1038 . 19 1 1 A 80 80 ILE H H 80 7.885 7.895 -0.010 1
1 1039 . 19 1 1 A 80 80 ILE HA H 80 3.367 3.659 -0.292 1
1 1049 . 19 1 1 A 80 80 ILE C C 80 179.892 177.634 2.258 1
1 1050 . 19 1 1 A 80 80 ILE CA C 80 65.343 65.066 0.277 1
1 1051 . 19 1 1 A 80 80 ILE CB C 80 38.129 37.238 0.891 1
1 1055 . 19 1 1 A 80 80 ILE N N 80 119.666 120.816 -1.150 1
1 1056 . 19 1 1 A 81 81 ARG H H 81 9.384 8.382 1.002 1
1 1057 . 19 1 1 A 81 81 ARG HA H 81 3.834 3.890 -0.056 1
1 1065 . 19 1 1 A 81 81 ARG C C 81 178.204 179.171 -0.967 1
1 1066 . 19 1 1 A 81 81 ARG CA C 81 60.560 59.775 0.785 1
1 1067 . 19 1 1 A 81 81 ARG CB C 81 30.196 30.102 0.094 1
1 1070 . 19 1 1 A 81 81 ARG N N 81 121.030 120.316 0.714 1
1 1072 . 19 1 1 A 82 82 ASN H H 82 8.773 8.393 0.380 1
1 1073 . 19 1 1 A 82 82 ASN HA H 82 4.587 4.545 0.042 1
1 1078 . 19 1 1 A 82 82 ASN C C 82 178.300 177.545 0.755 1
1 1079 . 19 1 1 A 82 82 ASN CA C 82 56.160 56.674 -0.514 1
1 1080 . 19 1 1 A 82 82 ASN CB C 82 38.464 38.969 -0.505 1
1 1081 . 19 1 1 A 82 82 ASN N N 82 118.483 118.785 -0.302 1
1 1083 . 19 1 1 A 83 83 SER H H 83 8.526 7.463 1.063 1
1 1084 . 19 1 1 A 83 83 SER HA H 83 2.765 2.975 -0.210 1
1 1087 . 19 1 1 A 83 83 SER C C 83 176.386 177.273 -0.887 1
1 1088 . 19 1 1 A 83 83 SER CA C 83 61.245 60.853 0.392 1
1 1089 . 19 1 1 A 83 83 SER CB C 83 61.287 62.494 -1.207 1
1 1090 . 19 1 1 A 83 83 SER N N 83 118.286 113.980 4.306 1
1 1091 . 19 1 1 A 84 84 LEU H H 84 7.782 8.325 -0.543 1
1 1092 . 19 1 1 A 84 84 LEU HA H 84 4.221 4.015 0.206 1
1 1102 . 19 1 1 A 84 84 LEU C C 84 177.846 179.367 -1.521 1
1 1103 . 19 1 1 A 84 84 LEU CA C 84 57.166 57.519 -0.353 1
1 1104 . 19 1 1 A 84 84 LEU CB C 84 40.520 41.077 -0.557 1
1 1108 . 19 1 1 A 84 84 LEU N N 84 127.445 121.507 5.938 1
1 1109 . 19 1 1 A 85 85 GLU H H 85 8.264 8.332 -0.068 1
1 1110 . 19 1 1 A 85 85 GLU HA H 85 3.981 3.948 0.033 1
1 1115 . 19 1 1 A 85 85 GLU C C 85 179.288 179.151 0.137 1
1 1116 . 19 1 1 A 85 85 GLU CA C 85 59.025 59.689 -0.664 1
1 1117 . 19 1 1 A 85 85 GLU CB C 85 29.182 29.233 -0.051 1
1 1119 . 19 1 1 A 85 85 GLU N N 85 121.538 120.368 1.170 1
1 1120 . 19 1 1 A 86 86 HIS H H 86 7.683 8.203 -0.520 1
1 1121 . 19 1 1 A 86 86 HIS HA H 86 4.573 4.337 0.236 1
1 1125 . 19 1 1 A 86 86 HIS C C 86 175.484 177.518 -2.034 1
1 1126 . 19 1 1 A 86 86 HIS CA C 86 58.940 59.316 -0.376 1
1 1127 . 19 1 1 A 86 86 HIS CB C 86 29.267 30.042 -0.775 1
1 1129 . 19 1 1 A 86 86 HIS N N 86 117.087 120.427 -3.340 1
1 1130 . 19 1 1 A 87 87 ALA H H 87 7.197 8.129 -0.932 1
1 1131 . 19 1 1 A 87 87 ALA HA H 87 3.925 3.784 0.141 1
1 1135 . 19 1 1 A 87 87 ALA C C 87 179.038 180.357 -1.319 1
1 1136 . 19 1 1 A 87 87 ALA CA C 87 54.863 54.866 -0.003 1
1 1137 . 19 1 1 A 87 87 ALA CB C 87 17.034 18.267 -1.233 1
1 1138 . 19 1 1 A 87 87 ALA N N 87 121.510 120.875 0.635 1
1 1139 . 19 1 1 A 88 88 ILE H H 88 7.819 7.654 0.165 1
1 1140 . 19 1 1 A 88 88 ILE HA H 88 4.067 3.825 0.242 1
1 1150 . 19 1 1 A 88 88 ILE C C 88 180.846 177.354 3.492 1
1 1151 . 19 1 1 A 88 88 ILE CA C 88 64.021 65.315 -1.294 1
1 1152 . 19 1 1 A 88 88 ILE CB C 88 37.557 37.706 -0.149 1
1 1156 . 19 1 1 A 88 88 ILE N N 88 120.898 119.604 1.294 1
1 1157 . 19 1 1 A 89 89 ASP H H 89 7.808 8.223 -0.415 1
1 1158 . 19 1 1 A 89 89 ASP HA H 89 4.437 4.271 0.166 1
1 1161 . 19 1 1 A 89 89 ASP C C 89 178.033 178.367 -0.334 1
1 1162 . 19 1 1 A 89 89 ASP CA C 89 57.343 57.650 -0.307 1
1 1163 . 19 1 1 A 89 89 ASP CB C 89 39.689 41.629 -1.940 1
1 1164 . 19 1 1 A 89 89 ASP N N 89 125.174 121.182 3.992 1
1 1165 . 19 1 1 A 90 90 LEU H H 90 7.607 7.664 -0.057 1
1 1166 . 19 1 1 A 90 90 LEU HA H 90 4.198 4.160 0.038 1
1 1176 . 19 1 1 A 90 90 LEU C C 90 175.416 175.927 -0.511 1
1 1177 . 19 1 1 A 90 90 LEU CA C 90 54.755 54.952 -0.197 1
1 1178 . 19 1 1 A 90 90 LEU CB C 90 42.960 42.190 0.770 1
1 1182 . 19 1 1 A 90 90 LEU N N 90 117.576 117.291 0.285 1
1 1183 . 19 1 1 A 91 91 GLU H H 91 8.143 7.947 0.196 1
1 1184 . 19 1 1 A 91 91 GLU HA H 91 4.005 4.078 -0.073 1
1 1189 . 19 1 1 A 91 91 GLU C C 91 175.792 176.146 -0.354 1
1 1190 . 19 1 1 A 91 91 GLU CA C 91 57.202 57.510 -0.308 1
1 1191 . 19 1 1 A 91 91 GLU CB C 91 26.125 26.888 -0.763 1
1 1193 . 19 1 1 A 91 91 GLU N N 91 113.620 114.996 -1.376 1
1 1194 . 19 1 1 A 92 92 LEU H H 92 8.290 7.926 0.364 1
1 1195 . 19 1 1 A 92 92 LEU HA H 92 4.216 4.105 0.111 1
1 1205 . 19 1 1 A 92 92 LEU C C 92 176.622 176.982 -0.360 1
1 1206 . 19 1 1 A 92 92 LEU CA C 92 56.410 56.939 -0.529 1
1 1207 . 19 1 1 A 92 92 LEU CB C 92 43.378 42.456 0.922 1
1 1211 . 19 1 1 A 92 92 LEU N N 92 116.868 119.775 -2.907 1
1 1212 . 19 1 1 A 93 93 ILE H H 93 6.988 6.867 0.121 1
1 1213 . 19 1 1 A 93 93 ILE HA H 93 4.580 4.566 0.014 1
1 1223 . 19 1 1 A 93 93 ILE C C 93 175.145 175.489 -0.344 1
1 1224 . 19 1 1 A 93 93 ILE CA C 93 58.707 58.444 0.263 1
1 1225 . 19 1 1 A 93 93 ILE CB C 93 42.864 41.492 1.372 1
1 1229 . 19 1 1 A 93 93 ILE N N 93 107.565 113.909 -6.344 1
1 1230 . 19 1 1 A 94 94 THR H H 94 8.742 8.540 0.202 1
1 1231 . 19 1 1 A 94 94 THR HA H 94 4.489 4.376 0.113 1
1 1236 . 19 1 1 A 94 94 THR C C 94 173.875 174.197 -0.322 1
1 1237 . 19 1 1 A 94 94 THR CA C 94 61.842 62.398 -0.556 1
1 1238 . 19 1 1 A 94 94 THR CB C 94 69.972 69.357 0.615 1
1 1240 . 19 1 1 A 94 94 THR N N 94 107.904 113.306 -5.402 1
1 1241 . 19 1 1 A 95 95 LYS H H 95 7.294 7.687 -0.393 1
1 1242 . 19 1 1 A 95 95 LYS HA H 95 4.566 4.824 -0.258 1
1 1251 . 19 1 1 A 95 95 LYS C C 95 173.791 175.050 -1.259 1
1 1252 . 19 1 1 A 95 95 LYS CA C 95 54.533 54.906 -0.373 1
1 1253 . 19 1 1 A 95 95 LYS CB C 95 35.123 35.853 -0.730 1
1 1257 . 19 1 1 A 95 95 LYS N N 95 119.458 121.324 -1.866 1
1 1258 . 19 1 1 A 96 96 ASN H H 96 9.157 8.680 0.477 1
1 1259 . 19 1 1 A 96 96 ASN HA H 96 4.408 4.831 -0.423 1
1 1264 . 19 1 1 A 96 96 ASN C C 96 176.653 176.460 0.193 1
1 1265 . 19 1 1 A 96 96 ASN CA C 96 51.088 52.677 -1.589 1
1 1266 . 19 1 1 A 96 96 ASN CB C 96 37.292 38.864 -1.572 1
1 1267 . 19 1 1 A 96 96 ASN N N 96 121.031 124.545 -3.514 1
1 1269 . 19 1 1 A 97 97 VAL H H 97 8.193 8.403 -0.210 1
1 1270 . 19 1 1 A 97 97 VAL HA H 97 4.019 3.878 0.141 1
1 1278 . 19 1 1 A 97 97 VAL C C 97 175.089 176.050 -0.961 1
1 1279 . 19 1 1 A 97 97 VAL CA C 97 63.437 64.034 -0.597 1
1 1280 . 19 1 1 A 97 97 VAL CB C 97 29.934 31.578 -1.644 1
1 1283 . 19 1 1 A 97 97 VAL N N 97 118.839 122.206 -3.367 1
1 1284 . 19 1 1 A 98 98 ALA H H 98 7.994 7.731 0.263 1
1 1285 . 19 1 1 A 98 98 ALA HA H 98 5.108 4.529 0.579 1
1 1289 . 19 1 1 A 98 98 ALA C C 98 178.033 178.394 -0.361 1
1 1290 . 19 1 1 A 98 98 ALA CA C 98 50.342 52.350 -2.008 1
1 1291 . 19 1 1 A 98 98 ALA CB C 98 19.659 19.023 0.636 1
1 1292 . 19 1 1 A 98 98 ALA N N 98 121.031 124.190 -3.159 1
1 1293 . 19 1 1 A 99 99 ALA H H 99 7.347 7.802 -0.455 1
1 1294 . 19 1 1 A 99 99 ALA HA H 99 3.818 4.003 -0.185 1
1 1298 . 19 1 1 A 99 99 ALA C C 99 177.712 179.031 -1.319 1
1 1299 . 19 1 1 A 99 99 ALA CA C 99 55.117 54.978 0.139 1
1 1300 . 19 1 1 A 99 99 ALA CB C 99 18.879 18.541 0.338 1
1 1301 . 19 1 1 A 99 99 ALA N N 99 122.816 121.175 1.641 1
1 1302 . 19 1 1 A 100 100 LYS H H 100 8.190 7.871 0.319 1
1 1303 . 19 1 1 A 100 100 LYS HA H 100 4.483 4.345 0.138 1
1 1312 . 19 1 1 A 100 100 LYS C C 100 175.899 177.168 -1.269 1
1 1313 . 19 1 1 A 100 100 LYS CA C 100 54.231 57.542 -3.311 1
1 1314 . 19 1 1 A 100 100 LYS CB C 100 32.066 32.729 -0.663 1
1 1318 . 19 1 1 A 100 100 LYS N N 100 113.197 115.744 -2.547 1
1 1319 . 19 1 1 A 101 101 THR H H 101 7.128 7.612 -0.484 1
1 1320 . 19 1 1 A 101 101 THR HA H 101 3.834 4.305 -0.471 1
1 1325 . 19 1 1 A 101 101 THR C C 101 173.255 173.457 -0.202 1
1 1326 . 19 1 1 A 101 101 THR CA C 101 64.392 62.576 1.816 1
1 1327 . 19 1 1 A 101 101 THR CB C 101 69.160 67.805 1.355 1
1 1329 . 19 1 1 A 101 101 THR N N 101 118.368 116.128 2.240 1
1 1330 . 19 1 1 A 102 102 LYS H H 102 8.753 8.003 0.750 1
1 1331 . 19 1 1 A 102 102 LYS HA H 102 4.438 4.905 -0.467 1
1 1340 . 19 1 1 A 102 102 LYS C C 102 175.627 176.023 -0.396 1
1 1341 . 19 1 1 A 102 102 LYS CA C 102 55.117 54.969 0.148 1
1 1342 . 19 1 1 A 102 102 LYS CB C 102 33.901 34.562 -0.661 1
1 1346 . 19 1 1 A 102 102 LYS N N 102 126.513 124.698 1.815 1
1 1347 . 19 1 1 A 103 103 LEU H H 103 8.602 8.426 0.176 1
1 1348 . 19 1 1 A 103 103 LEU HA H 103 4.486 4.392 0.094 1
1 1358 . 19 1 1 A 103 103 LEU CA C 103 52.233 53.092 -0.859 1
1 1359 . 19 1 1 A 103 103 LEU CB C 103 41.028 42.834 -1.806 1
1 1363 . 19 1 1 A 103 103 LEU N N 103 124.466 123.279 1.187 1
1 1364 . 19 1 1 A 104 104 PRO HA H 104 4.437 4.535 -0.098 1
1 1371 . 19 1 1 A 104 104 PRO C C 104 175.779 176.308 -0.529 1
1 1372 . 19 1 1 A 104 104 PRO CA C 104 62.322 62.666 -0.344 1
1 1373 . 19 1 1 A 104 104 PRO CB C 104 31.899 32.329 -0.430 1
1 1376 . 19 1 1 A 105 105 LYS H H 105 8.460 8.367 0.093 1
1 1377 . 19 1 1 A 105 105 LYS HA H 105 4.154 4.397 -0.243 1
1 1386 . 19 1 1 A 105 105 LYS C C 105 175.998 175.306 0.692 1
1 1387 . 19 1 1 A 105 105 LYS CA C 105 56.480 55.458 1.022 1
1 1388 . 19 1 1 A 105 105 LYS CB C 105 32.909 31.512 1.397 1
1 1392 . 19 1 1 A 105 105 LYS N N 105 122.139 121.284 0.855 1
1 1393 . 19 1 1 A 106 106 ALA H H 106 8.448 8.347 0.101 1
1 1394 . 19 1 1 A 106 106 ALA HA H 106 4.309 4.333 -0.024 1
1 1398 . 19 1 1 A 106 106 ALA C C 106 176.828 176.168 0.660 1
1 1399 . 19 1 1 A 106 106 ALA CA C 106 51.862 51.687 0.175 1
1 1400 . 19 1 1 A 106 106 ALA CB C 106 19.323 17.709 1.614 1
1 1401 . 19 1 1 A 106 106 ALA N N 106 125.278 128.154 -2.876 1
1 1402 . 19 1 1 A 107 107 ASP H H 107 8.428 8.649 -0.221 1
1 1403 . 19 1 1 A 107 107 ASP HA H 107 4.574 4.773 -0.199 1
1 1406 . 19 1 1 A 107 107 ASP C C 107 175.951 175.592 0.359 1
1 1407 . 19 1 1 A 107 107 ASP CA C 107 54.214 54.135 0.079 1
1 1408 . 19 1 1 A 107 107 ASP CB C 107 41.141 41.809 -0.668 1
1 1409 . 19 1 1 A 107 107 ASP N N 107 120.771 123.479 -2.708 1
1 1410 . 19 1 1 A 108 108 LYS H H 108 8.329 8.576 -0.247 1
1 1411 . 19 1 1 A 108 108 LYS HA H 108 4.203 4.857 -0.654 1
1 1420 . 19 1 1 A 108 108 LYS C C 108 176.483 175.889 0.594 1
1 1421 . 19 1 1 A 108 108 LYS CA C 108 56.831 54.277 2.554 1
1 1422 . 19 1 1 A 108 108 LYS CB C 108 32.648 35.356 -2.708 1
1 1426 . 19 1 1 A 108 108 LYS N N 108 120.727 123.223 -2.496 1
1 1427 . 19 1 1 A 109 109 GLU H H 109 8.447 8.554 -0.107 1
1 1428 . 19 1 1 A 109 109 GLU HA H 109 4.215 4.568 -0.353 1
1 1433 . 19 1 1 A 109 109 GLU C C 109 176.513 176.250 0.263 1
1 1434 . 19 1 1 A 109 109 GLU CA C 109 56.936 56.519 0.417 1
1 1435 . 19 1 1 A 109 109 GLU CB C 109 29.833 30.046 -0.213 1
1 1437 . 19 1 1 A 109 109 GLU N N 109 121.471 122.280 -0.809 1
1 1438 . 19 1 1 A 110 110 GLU H H 110 8.352 8.585 -0.233 1
1 1439 . 19 1 1 A 110 110 GLU HA H 110 4.233 4.957 -0.724 1
1 1444 . 19 1 1 A 110 110 GLU C C 110 176.439 176.634 -0.195 1
1 1445 . 19 1 1 A 110 110 GLU CA C 110 56.681 55.278 1.403 1
1 1446 . 19 1 1 A 110 110 GLU CB C 110 29.860 29.949 -0.089 1
1 1448 . 19 1 1 A 110 110 GLU N N 110 121.559 122.753 -1.194 1
1 1449 . 19 1 1 A 111 111 LEU H H 111 8.145 8.594 -0.449 1
1 1450 . 19 1 1 A 111 111 LEU HA H 111 4.251 4.291 -0.040 1
1 1460 . 19 1 1 A 111 111 LEU C C 111 177.306 176.939 0.367 1
1 1461 . 19 1 1 A 111 111 LEU CA C 111 55.277 56.622 -1.345 1
1 1462 . 19 1 1 A 111 111 LEU CB C 111 42.054 42.474 -0.420 1
1 1466 . 19 1 1 A 111 111 LEU N N 111 122.181 126.052 -3.871 1
1 1467 . 19 1 1 A 112 112 GLU H H 112 8.212 7.931 0.281 1
1 1468 . 19 1 1 A 112 112 GLU N N 112 120.291 117.125 3.166 1
1 1469 . 19 1 1 A 114 114 HIS C C 114 176.070 174.617 1.453 1
1 1470 . 19 1 1 A 116 116 HIS H H 116 8.227 7.469 0.758 1
1 1471 . 19 1 1 A 116 116 HIS C C 116 173.580 173.807 -0.227 1
1 1472 . 19 1 1 A 116 116 HIS N N 116 119.156 119.363 -0.207 1
1 5 . 20 1 1 A 3 3 PRO HA H 3 4.390 4.791 -0.401 1
1 12 . 20 1 1 A 3 3 PRO C C 3 176.847 176.682 0.165 1
1 13 . 20 1 1 A 3 3 PRO CA C 3 63.449 62.223 1.226 1
1 14 . 20 1 1 A 3 3 PRO CB C 3 31.938 33.185 -1.247 1
1 17 . 20 1 1 A 4 4 SER H H 4 8.531 8.685 -0.154 1
1 18 . 20 1 1 A 4 4 SER HA H 4 4.262 4.399 -0.137 1
1 21 . 20 1 1 A 4 4 SER C C 4 175.414 174.681 0.733 1
1 22 . 20 1 1 A 4 4 SER CA C 4 59.163 59.630 -0.467 1
1 23 . 20 1 1 A 4 4 SER CB C 4 63.242 63.126 0.116 1
1 24 . 20 1 1 A 4 4 SER N N 4 114.246 116.310 -2.064 1
1 25 . 20 1 1 A 5 5 LYS H H 5 8.468 7.765 0.703 1
1 26 . 20 1 1 A 5 5 LYS HA H 5 4.433 4.261 0.172 1
1 35 . 20 1 1 A 5 5 LYS C C 5 175.984 175.989 -0.005 1
1 36 . 20 1 1 A 5 5 LYS CA C 5 55.724 56.470 -0.746 1
1 37 . 20 1 1 A 5 5 LYS CB C 5 32.881 31.514 1.367 1
1 41 . 20 1 1 A 5 5 LYS N N 5 123.488 121.346 2.142 1
1 42 . 20 1 1 A 6 6 LEU H H 6 7.707 7.978 -0.271 1
1 43 . 20 1 1 A 6 6 LEU HA H 6 4.381 4.628 -0.247 1
1 53 . 20 1 1 A 6 6 LEU C C 6 177.820 174.984 2.836 1
1 54 . 20 1 1 A 6 6 LEU CA C 6 55.507 54.587 0.920 1
1 55 . 20 1 1 A 6 6 LEU CB C 6 43.374 45.212 -1.838 1
1 59 . 20 1 1 A 6 6 LEU N N 6 121.233 125.518 -4.285 1
1 60 . 20 1 1 A 7 7 SER H H 7 9.433 8.843 0.590 1
1 61 . 20 1 1 A 7 7 SER HA H 7 4.638 4.617 0.021 1
1 64 . 20 1 1 A 7 7 SER C C 7 174.120 175.014 -0.894 1
1 65 . 20 1 1 A 7 7 SER CA C 7 57.962 59.009 -1.047 1
1 66 . 20 1 1 A 7 7 SER CB C 7 64.197 63.644 0.553 1
1 67 . 20 1 1 A 7 7 SER N N 7 122.977 122.810 0.167 1
1 68 . 20 1 1 A 8 8 TYR H H 8 9.764 9.132 0.632 1
1 69 . 20 1 1 A 8 8 TYR HA H 8 4.732 4.254 0.478 1
1 76 . 20 1 1 A 8 8 TYR C C 8 177.206 177.632 -0.426 1
1 77 . 20 1 1 A 8 8 TYR CA C 8 58.762 61.812 -3.050 1
1 78 . 20 1 1 A 8 8 TYR CB C 8 36.605 38.978 -2.373 1
1 83 . 20 1 1 A 8 8 TYR N N 8 123.312 125.182 -1.870 1
1 84 . 20 1 1 A 9 9 GLY H H 9 10.131 8.304 1.827 1
1 85 . 20 1 1 A 9 9 GLY HA2 H 9 3.983 3.627 0.356 1
1 86 . 20 1 1 A 9 9 GLY HA3 H 9 3.423 3.723 -0.300 1
1 87 . 20 1 1 A 9 9 GLY C C 9 175.163 176.684 -1.521 1
1 88 . 20 1 1 A 9 9 GLY CA C 9 47.153 47.606 -0.453 1
1 89 . 20 1 1 A 9 9 GLY N N 9 107.177 105.963 1.214 1
1 90 . 20 1 1 A 10 10 GLU H H 10 7.876 8.101 -0.225 1
1 91 . 20 1 1 A 10 10 GLU HA H 10 4.107 4.091 0.016 1
1 96 . 20 1 1 A 10 10 GLU C C 10 179.924 179.060 0.864 1
1 97 . 20 1 1 A 10 10 GLU CA C 10 58.890 59.508 -0.618 1
1 98 . 20 1 1 A 10 10 GLU CB C 10 29.750 29.368 0.382 1
1 100 . 20 1 1 A 10 10 GLU N N 10 122.219 121.781 0.438 1
1 101 . 20 1 1 A 11 11 TYR H H 11 8.384 8.261 0.123 1
1 102 . 20 1 1 A 11 11 TYR HA H 11 4.305 4.207 0.098 1
1 107 . 20 1 1 A 11 11 TYR C C 11 176.854 177.262 -0.408 1
1 108 . 20 1 1 A 11 11 TYR CA C 11 61.040 61.159 -0.119 1
1 109 . 20 1 1 A 11 11 TYR CB C 11 37.593 38.944 -1.351 1
1 112 . 20 1 1 A 11 11 TYR N N 11 120.809 122.887 -2.078 1
1 113 . 20 1 1 A 12 12 LEU H H 12 9.027 8.144 0.883 1
1 114 . 20 1 1 A 12 12 LEU HA H 12 3.778 3.831 -0.053 1
1 124 . 20 1 1 A 12 12 LEU C C 12 178.621 179.531 -0.910 1
1 125 . 20 1 1 A 12 12 LEU CA C 12 57.534 57.223 0.311 1
1 126 . 20 1 1 A 12 12 LEU CB C 12 41.957 41.130 0.827 1
1 130 . 20 1 1 A 12 12 LEU N N 12 121.080 119.252 1.828 1
1 131 . 20 1 1 A 13 13 GLU H H 13 7.614 7.790 -0.176 1
1 132 . 20 1 1 A 13 13 GLU HA H 13 4.102 4.051 0.051 1
1 137 . 20 1 1 A 13 13 GLU C C 13 178.449 178.853 -0.404 1
1 138 . 20 1 1 A 13 13 GLU CA C 13 59.609 59.395 0.214 1
1 139 . 20 1 1 A 13 13 GLU CB C 13 29.124 29.740 -0.616 1
1 141 . 20 1 1 A 13 13 GLU N N 13 118.475 120.966 -2.491 1
1 142 . 20 1 1 A 14 14 SER H H 14 7.329 7.427 -0.098 1
1 143 . 20 1 1 A 14 14 SER HA H 14 4.358 4.243 0.115 1
1 146 . 20 1 1 A 14 14 SER C C 14 176.794 176.816 -0.022 1
1 147 . 20 1 1 A 14 14 SER CA C 14 61.064 61.527 -0.463 1
1 148 . 20 1 1 A 14 14 SER CB C 14 62.513 63.143 -0.630 1
1 149 . 20 1 1 A 14 14 SER N N 14 115.209 114.834 0.375 1
1 150 . 20 1 1 A 15 15 TRP H H 15 8.870 8.002 0.868 1
1 151 . 20 1 1 A 15 15 TRP HA H 15 4.005 4.318 -0.313 1
1 160 . 20 1 1 A 15 15 TRP C C 15 177.547 177.994 -0.447 1
1 161 . 20 1 1 A 15 15 TRP CA C 15 61.210 61.120 0.090 1
1 162 . 20 1 1 A 15 15 TRP CB C 15 27.341 29.459 -2.118 1
1 168 . 20 1 1 A 15 15 TRP N N 15 124.998 123.780 1.218 1
1 170 . 20 1 1 A 16 16 PHE H H 16 9.087 7.985 1.102 1
1 171 . 20 1 1 A 16 16 PHE HA H 16 3.210 3.688 -0.478 1
1 179 . 20 1 1 A 16 16 PHE C C 16 175.909 177.411 -1.502 1
1 180 . 20 1 1 A 16 16 PHE CA C 16 61.473 61.192 0.281 1
1 181 . 20 1 1 A 16 16 PHE CB C 16 38.506 39.267 -0.761 1
1 187 . 20 1 1 A 16 16 PHE N N 16 119.825 121.131 -1.306 1
1 188 . 20 1 1 A 17 17 ASN H H 17 7.768 8.192 -0.424 1
1 189 . 20 1 1 A 17 17 ASN HA H 17 4.078 4.106 -0.028 1
1 194 . 20 1 1 A 17 17 ASN C C 17 176.604 177.691 -1.087 1
1 195 . 20 1 1 A 17 17 ASN CA C 17 55.621 56.287 -0.666 1
1 196 . 20 1 1 A 17 17 ASN CB C 17 37.830 37.723 0.107 1
1 197 . 20 1 1 A 17 17 ASN N N 17 115.600 117.114 -1.514 1
1 199 . 20 1 1 A 18 18 THR H H 18 7.454 7.489 -0.035 1
1 200 . 20 1 1 A 18 18 THR HA H 18 4.147 3.976 0.171 1
1 205 . 20 1 1 A 18 18 THR C C 18 175.692 175.817 -0.125 1
1 206 . 20 1 1 A 18 18 THR CA C 18 64.679 66.972 -2.293 1
1 207 . 20 1 1 A 18 18 THR CB C 18 68.940 68.041 0.899 1
1 209 . 20 1 1 A 18 18 THR N N 18 113.049 116.763 -3.714 1
1 210 . 20 1 1 A 19 19 LYS H H 19 7.918 7.731 0.187 1
1 211 . 20 1 1 A 19 19 LYS HA H 19 3.791 3.591 0.200 1
1 220 . 20 1 1 A 19 19 LYS C C 19 178.120 178.741 -0.621 1
1 221 . 20 1 1 A 19 19 LYS CA C 19 55.985 58.781 -2.796 1
1 222 . 20 1 1 A 19 19 LYS CB C 19 31.130 30.876 0.254 1
1 226 . 20 1 1 A 19 19 LYS N N 19 122.614 120.430 2.184 1
1 227 . 20 1 1 A 20 20 ARG H H 20 7.845 7.651 0.194 1
1 228 . 20 1 1 A 20 20 ARG HA H 20 3.396 3.733 -0.337 1
1 236 . 20 1 1 A 20 20 ARG C C 20 175.601 178.766 -3.165 1
1 237 . 20 1 1 A 20 20 ARG CA C 20 58.182 59.210 -1.028 1
1 238 . 20 1 1 A 20 20 ARG CB C 20 28.045 29.577 -1.532 1
1 241 . 20 1 1 A 20 20 ARG N N 20 116.282 117.960 -1.678 1
1 243 . 20 1 1 A 21 21 HIS H H 21 7.163 7.467 -0.304 1
1 244 . 20 1 1 A 21 21 HIS HA H 21 4.500 4.239 0.261 1
1 249 . 20 1 1 A 21 21 HIS C C 21 175.618 175.925 -0.307 1
1 250 . 20 1 1 A 21 21 HIS CA C 21 56.912 58.933 -2.021 1
1 251 . 20 1 1 A 21 21 HIS CB C 21 29.400 29.768 -0.368 1
1 254 . 20 1 1 A 21 21 HIS N N 21 115.452 118.925 -3.473 1
1 255 . 20 1 1 A 22 22 SER H H 22 7.951 7.617 0.334 1
1 256 . 20 1 1 A 22 22 SER HA H 22 4.573 4.371 0.202 1
1 259 . 20 1 1 A 22 22 SER C C 22 173.948 174.118 -0.170 1
1 260 . 20 1 1 A 22 22 SER CA C 22 58.589 58.681 -0.092 1
1 261 . 20 1 1 A 22 22 SER CB C 22 64.228 64.076 0.152 1
1 262 . 20 1 1 A 22 22 SER N N 22 113.209 112.351 0.858 1
1 263 . 20 1 1 A 23 23 VAL H H 23 7.179 6.787 0.392 1
1 264 . 20 1 1 A 23 23 VAL HA H 23 4.626 4.705 -0.079 1
1 272 . 20 1 1 A 23 23 VAL C C 23 175.397 175.620 -0.223 1
1 273 . 20 1 1 A 23 23 VAL CA C 23 59.556 59.611 -0.055 1
1 274 . 20 1 1 A 23 23 VAL CB C 23 33.810 34.884 -1.074 1
1 277 . 20 1 1 A 23 23 VAL N N 23 113.108 117.927 -4.819 1
1 278 . 20 1 1 A 24 24 GLY H H 24 8.189 8.538 -0.349 1
1 279 . 20 1 1 A 24 24 GLY HA2 H 24 4.074 4.035 0.039 1
1 280 . 20 1 1 A 24 24 GLY HA3 H 24 4.195 4.052 0.143 1
1 281 . 20 1 1 A 24 24 GLY C C 24 174.037 174.382 -0.345 1
1 282 . 20 1 1 A 24 24 GLY CA C 24 44.452 44.766 -0.314 1
1 283 . 20 1 1 A 24 24 GLY N N 24 108.374 108.748 -0.374 1
1 284 . 20 1 1 A 25 25 ILE H H 25 8.331 8.570 -0.239 1
1 285 . 20 1 1 A 25 25 ILE HA H 25 3.839 3.621 0.218 1
1 295 . 20 1 1 A 25 25 ILE C C 25 178.042 177.756 0.286 1
1 296 . 20 1 1 A 25 25 ILE CA C 25 64.238 64.673 -0.435 1
1 297 . 20 1 1 A 25 25 ILE CB C 25 37.931 37.896 0.035 1
1 301 . 20 1 1 A 25 25 ILE N N 25 119.895 119.252 0.643 1
1 302 . 20 1 1 A 26 26 GLN H H 26 8.545 8.407 0.138 1
1 303 . 20 1 1 A 26 26 GLN HA H 26 4.129 4.043 0.086 1
1 310 . 20 1 1 A 26 26 GLN C C 26 178.454 178.290 0.164 1
1 311 . 20 1 1 A 26 26 GLN CA C 26 58.772 58.157 0.615 1
1 312 . 20 1 1 A 26 26 GLN CB C 26 27.346 28.131 -0.785 1
1 314 . 20 1 1 A 26 26 GLN N N 26 120.013 120.069 -0.056 1
1 316 . 20 1 1 A 27 27 THR H H 27 7.944 8.078 -0.134 1
1 317 . 20 1 1 A 27 27 THR HA H 27 3.953 3.875 0.078 1
1 322 . 20 1 1 A 27 27 THR C C 27 175.818 176.515 -0.697 1
1 323 . 20 1 1 A 27 27 THR CA C 27 65.855 66.424 -0.569 1
1 324 . 20 1 1 A 27 27 THR CB C 27 68.127 68.523 -0.396 1
1 326 . 20 1 1 A 27 27 THR N N 27 117.645 116.741 0.904 1
1 327 . 20 1 1 A 28 28 ALA H H 28 8.593 8.142 0.451 1
1 328 . 20 1 1 A 28 28 ALA HA H 28 3.899 4.062 -0.163 1
1 332 . 20 1 1 A 28 28 ALA C C 28 178.515 179.594 -1.079 1
1 333 . 20 1 1 A 28 28 ALA CA C 28 55.742 55.572 0.170 1
1 334 . 20 1 1 A 28 28 ALA CB C 28 17.513 18.088 -0.575 1
1 335 . 20 1 1 A 28 28 ALA N N 28 123.917 123.545 0.372 1
1 336 . 20 1 1 A 29 29 LYS H H 29 7.800 7.828 -0.028 1
1 337 . 20 1 1 A 29 29 LYS HA H 29 3.982 3.957 0.025 1
1 346 . 20 1 1 A 29 29 LYS C C 29 179.527 178.940 0.587 1
1 347 . 20 1 1 A 29 29 LYS CA C 29 59.761 59.691 0.070 1
1 348 . 20 1 1 A 29 29 LYS CB C 29 32.223 32.227 -0.004 1
1 352 . 20 1 1 A 29 29 LYS N N 29 117.474 118.867 -1.393 1
1 353 . 20 1 1 A 30 30 VAL H H 30 7.591 7.571 0.020 1
1 354 . 20 1 1 A 30 30 VAL HA H 30 3.503 3.320 0.183 1
1 362 . 20 1 1 A 30 30 VAL C C 30 178.389 177.828 0.561 1
1 363 . 20 1 1 A 30 30 VAL CA C 30 65.640 65.848 -0.208 1
1 364 . 20 1 1 A 30 30 VAL CB C 30 31.644 31.452 0.192 1
1 367 . 20 1 1 A 30 30 VAL N N 30 121.749 120.009 1.740 1
1 368 . 20 1 1 A 31 31 LEU H H 31 8.333 8.282 0.051 1
1 369 . 20 1 1 A 31 31 LEU HA H 31 4.074 4.062 0.012 1
1 379 . 20 1 1 A 31 31 LEU C C 31 177.780 178.909 -1.129 1
1 380 . 20 1 1 A 31 31 LEU CA C 31 58.157 57.984 0.173 1
1 381 . 20 1 1 A 31 31 LEU CB C 31 42.230 41.272 0.958 1
1 385 . 20 1 1 A 31 31 LEU N N 31 120.901 120.136 0.765 1
1 386 . 20 1 1 A 32 32 LYS H H 32 8.562 7.967 0.595 1
1 387 . 20 1 1 A 32 32 LYS HA H 32 3.290 3.738 -0.448 1
1 395 . 20 1 1 A 32 32 LYS C C 32 178.037 178.710 -0.673 1
1 396 . 20 1 1 A 32 32 LYS CA C 32 58.911 59.491 -0.580 1
1 397 . 20 1 1 A 32 32 LYS CB C 32 31.605 31.263 0.342 1
1 401 . 20 1 1 A 32 32 LYS N N 32 119.075 119.699 -0.624 1
1 402 . 20 1 1 A 33 33 GLY H H 33 7.694 7.882 -0.188 1
1 403 . 20 1 1 A 33 33 GLY HA2 H 33 3.949 3.550 0.399 1
1 404 . 20 1 1 A 33 33 GLY HA3 H 33 3.826 3.623 0.203 1
1 405 . 20 1 1 A 33 33 GLY C C 33 177.101 176.632 0.469 1
1 406 . 20 1 1 A 33 33 GLY CA C 33 46.928 47.037 -0.109 1
1 407 . 20 1 1 A 33 33 GLY N N 33 105.282 106.799 -1.517 1
1 408 . 20 1 1 A 34 34 TYR H H 34 8.015 7.646 0.369 1
1 409 . 20 1 1 A 34 34 TYR HA H 34 4.558 4.705 -0.147 1
1 416 . 20 1 1 A 34 34 TYR C C 34 179.611 178.102 1.509 1
1 417 . 20 1 1 A 34 34 TYR CA C 34 59.349 59.983 -0.634 1
1 418 . 20 1 1 A 34 34 TYR CB C 34 37.344 38.170 -0.826 1
1 423 . 20 1 1 A 34 34 TYR N N 34 121.781 121.859 -0.078 1
1 424 . 20 1 1 A 35 35 LEU H H 35 8.689 8.290 0.399 1
1 425 . 20 1 1 A 35 35 LEU HA H 35 3.977 3.891 0.086 1
1 435 . 20 1 1 A 35 35 LEU C C 35 177.081 179.172 -2.091 1
1 436 . 20 1 1 A 35 35 LEU CA C 35 59.155 58.483 0.672 1
1 437 . 20 1 1 A 35 35 LEU CB C 35 41.103 41.867 -0.764 1
1 441 . 20 1 1 A 35 35 LEU N N 35 120.392 120.502 -0.110 1
1 442 . 20 1 1 A 36 36 ASN H H 36 8.721 8.327 0.394 1
1 443 . 20 1 1 A 36 36 ASN HA H 36 4.435 4.430 0.005 1
1 448 . 20 1 1 A 36 36 ASN C C 36 176.792 177.945 -1.153 1
1 449 . 20 1 1 A 36 36 ASN CA C 36 55.642 55.905 -0.263 1
1 450 . 20 1 1 A 36 36 ASN CB C 36 38.319 37.767 0.552 1
1 451 . 20 1 1 A 36 36 ASN N N 36 114.623 117.290 -2.667 1
1 453 . 20 1 1 A 37 37 SER H H 37 8.511 7.942 0.569 1
1 454 . 20 1 1 A 37 37 SER HA H 37 4.642 4.314 0.328 1
1 457 . 20 1 1 A 37 37 SER C C 37 175.039 176.235 -1.196 1
1 458 . 20 1 1 A 37 37 SER CA C 37 59.825 61.295 -1.470 1
1 459 . 20 1 1 A 37 37 SER CB C 37 64.056 62.929 1.127 1
1 460 . 20 1 1 A 37 37 SER N N 37 110.941 115.666 -4.725 1
1 461 . 20 1 1 A 38 38 ARG H H 38 7.242 8.038 -0.796 1
1 462 . 20 1 1 A 38 38 ARG HA H 38 4.919 4.475 0.444 1
1 469 . 20 1 1 A 38 38 ARG C C 38 176.514 178.250 -1.736 1
1 470 . 20 1 1 A 38 38 ARG CA C 38 56.687 57.975 -1.288 1
1 471 . 20 1 1 A 38 38 ARG CB C 38 32.434 31.016 1.418 1
1 474 . 20 1 1 A 38 38 ARG N N 38 117.062 120.893 -3.831 1
1 475 . 20 1 1 A 39 39 ILE H H 39 8.462 7.818 0.644 1
1 476 . 20 1 1 A 39 39 ILE HA H 39 3.618 3.773 -0.155 1
1 486 . 20 1 1 A 39 39 ILE C C 39 176.267 178.649 -2.382 1
1 487 . 20 1 1 A 39 39 ILE CA C 39 66.134 65.351 0.783 1
1 488 . 20 1 1 A 39 39 ILE CB C 39 39.787 37.813 1.974 1
1 492 . 20 1 1 A 39 39 ILE N N 39 121.214 120.201 1.013 1
1 493 . 20 1 1 A 40 40 ILE H H 40 9.339 8.190 1.149 1
1 494 . 20 1 1 A 40 40 ILE HA H 40 3.401 3.764 -0.363 1
1 504 . 20 1 1 A 40 40 ILE CA C 40 67.844 66.182 1.662 1
1 505 . 20 1 1 A 40 40 ILE CB C 40 34.406 35.224 -0.818 1
1 509 . 20 1 1 A 40 40 ILE N N 40 119.695 121.784 -2.089 1
1 510 . 20 1 1 A 41 41 PRO HA H 41 4.314 4.566 -0.252 1
1 517 . 20 1 1 A 41 41 PRO C C 41 177.418 178.830 -1.412 1
1 518 . 20 1 1 A 41 41 PRO CA C 41 65.912 65.663 0.249 1
1 519 . 20 1 1 A 41 41 PRO CB C 41 30.686 30.942 -0.256 1
1 522 . 20 1 1 A 42 42 SER H H 42 6.857 7.899 -1.042 1
1 523 . 20 1 1 A 42 42 SER HA H 42 4.558 4.346 0.212 1
1 526 . 20 1 1 A 42 42 SER C C 42 174.813 176.329 -1.516 1
1 527 . 20 1 1 A 42 42 SER CA C 42 61.279 61.137 0.142 1
1 528 . 20 1 1 A 42 42 SER CB C 42 64.285 63.707 0.578 1
1 529 . 20 1 1 A 42 42 SER N N 42 108.994 112.788 -3.794 1
1 530 . 20 1 1 A 43 43 LEU H H 43 8.230 8.077 0.153 1
1 531 . 20 1 1 A 43 43 LEU HA H 43 4.572 4.468 0.104 1
1 541 . 20 1 1 A 43 43 LEU C C 43 177.301 179.227 -1.926 1
1 542 . 20 1 1 A 43 43 LEU CA C 43 54.113 54.787 -0.674 1
1 543 . 20 1 1 A 43 43 LEU CB C 43 44.800 42.705 2.095 1
1 547 . 20 1 1 A 43 43 LEU N N 43 118.715 120.008 -1.293 1
1 548 . 20 1 1 A 44 44 GLY H H 44 8.498 8.543 -0.045 1
1 549 . 20 1 1 A 44 44 GLY HA2 H 44 4.010 3.843 0.167 1
1 550 . 20 1 1 A 44 44 GLY HA3 H 44 3.613 3.962 -0.349 1
1 551 . 20 1 1 A 44 44 GLY C C 44 174.178 175.948 -1.770 1
1 552 . 20 1 1 A 44 44 GLY CA C 44 46.271 47.351 -1.080 1
1 553 . 20 1 1 A 44 44 GLY N N 44 105.371 107.686 -2.315 1
1 554 . 20 1 1 A 45 45 ASN H H 45 8.385 7.892 0.493 1
1 555 . 20 1 1 A 45 45 ASN HA H 45 4.789 4.748 0.041 1
1 560 . 20 1 1 A 45 45 ASN C C 45 175.386 176.231 -0.845 1
1 561 . 20 1 1 A 45 45 ASN CA C 45 53.144 54.574 -1.430 1
1 562 . 20 1 1 A 45 45 ASN CB C 45 37.928 38.529 -0.601 1
1 563 . 20 1 1 A 45 45 ASN N N 45 114.387 117.563 -3.176 1
1 565 . 20 1 1 A 46 46 ILE H H 46 7.465 7.494 -0.029 1
1 566 . 20 1 1 A 46 46 ILE HA H 46 3.856 4.159 -0.303 1
1 576 . 20 1 1 A 46 46 ILE C C 46 175.997 176.267 -0.270 1
1 577 . 20 1 1 A 46 46 ILE CA C 46 60.853 61.165 -0.312 1
1 578 . 20 1 1 A 46 46 ILE CB C 46 38.042 38.739 -0.697 1
1 582 . 20 1 1 A 46 46 ILE N N 46 123.998 119.475 4.523 1
1 583 . 20 1 1 A 47 47 LYS H H 47 8.717 8.632 0.085 1
1 584 . 20 1 1 A 47 47 LYS HA H 47 4.249 4.336 -0.087 1
1 591 . 20 1 1 A 47 47 LYS C C 47 177.583 177.757 -0.174 1
1 592 . 20 1 1 A 47 47 LYS CA C 47 56.320 57.049 -0.729 1
1 593 . 20 1 1 A 47 47 LYS CB C 47 30.393 32.900 -2.507 1
1 596 . 20 1 1 A 47 47 LYS N N 47 126.114 124.361 1.753 1
1 597 . 20 1 1 A 48 48 LEU H H 48 8.323 8.575 -0.252 1
1 598 . 20 1 1 A 48 48 LEU HA H 48 3.691 3.991 -0.300 1
1 608 . 20 1 1 A 48 48 LEU C C 48 177.274 178.296 -1.022 1
1 609 . 20 1 1 A 48 48 LEU CA C 48 58.443 58.598 -0.155 1
1 610 . 20 1 1 A 48 48 LEU CB C 48 42.282 41.486 0.796 1
1 614 . 20 1 1 A 48 48 LEU N N 48 125.857 125.630 0.227 1
1 615 . 20 1 1 A 49 49 ALA H H 49 8.929 8.072 0.857 1
1 616 . 20 1 1 A 49 49 ALA HA H 49 4.067 4.022 0.045 1
1 620 . 20 1 1 A 49 49 ALA C C 49 177.468 178.710 -1.242 1
1 621 . 20 1 1 A 49 49 ALA CA C 49 53.092 54.501 -1.409 1
1 622 . 20 1 1 A 49 49 ALA CB C 49 18.562 18.374 0.188 1
1 623 . 20 1 1 A 49 49 ALA N N 49 115.543 120.185 -4.642 1
1 624 . 20 1 1 A 50 50 LYS H H 50 7.684 7.430 0.254 1
1 625 . 20 1 1 A 50 50 LYS HA H 50 4.395 4.249 0.146 1
1 634 . 20 1 1 A 50 50 LYS C C 50 174.958 176.889 -1.931 1
1 635 . 20 1 1 A 50 50 LYS CA C 50 53.977 57.341 -3.364 1
1 636 . 20 1 1 A 50 50 LYS CB C 50 32.645 32.500 0.145 1
1 640 . 20 1 1 A 50 50 LYS N N 50 114.788 115.091 -0.303 1
1 641 . 20 1 1 A 51 51 LEU H H 51 6.776 7.257 -0.481 1
1 642 . 20 1 1 A 51 51 LEU HA H 51 4.569 4.277 0.292 1
1 652 . 20 1 1 A 51 51 LEU C C 51 177.953 175.679 2.274 1
1 653 . 20 1 1 A 51 51 LEU CA C 51 55.318 54.778 0.540 1
1 654 . 20 1 1 A 51 51 LEU CB C 51 43.182 40.974 2.208 1
1 658 . 20 1 1 A 51 51 LEU N N 51 121.408 122.053 -0.645 1
1 659 . 20 1 1 A 52 52 THR H H 52 10.680 7.402 3.278 1
1 660 . 20 1 1 A 52 52 THR HA H 52 4.938 4.543 0.395 1
1 665 . 20 1 1 A 52 52 THR C C 52 175.553 174.705 0.848 1
1 666 . 20 1 1 A 52 52 THR CA C 52 59.740 60.016 -0.276 1
1 667 . 20 1 1 A 52 52 THR CB C 52 73.557 70.910 2.647 1
1 669 . 20 1 1 A 52 52 THR N N 52 119.481 119.160 0.321 1
1 670 . 20 1 1 A 53 53 SER H H 53 9.278 9.066 0.212 1
1 671 . 20 1 1 A 53 53 SER HA H 53 4.261 4.111 0.150 1
1 674 . 20 1 1 A 53 53 SER C C 53 176.990 176.314 0.676 1
1 675 . 20 1 1 A 53 53 SER CA C 53 61.025 61.110 -0.085 1
1 676 . 20 1 1 A 53 53 SER CB C 53 62.312 63.005 -0.693 1
1 677 . 20 1 1 A 53 53 SER N N 53 116.343 121.808 -5.465 1
1 678 . 20 1 1 A 54 54 LEU H H 54 7.808 8.053 -0.245 1
1 679 . 20 1 1 A 54 54 LEU HA H 54 4.229 4.045 0.184 1
1 688 . 20 1 1 A 54 54 LEU C C 54 178.505 178.664 -0.159 1
1 689 . 20 1 1 A 54 54 LEU CA C 54 57.719 57.942 -0.223 1
1 690 . 20 1 1 A 54 54 LEU CB C 54 40.997 41.801 -0.804 1
1 694 . 20 1 1 A 54 54 LEU N N 54 126.055 122.587 3.468 1
1 695 . 20 1 1 A 55 55 HIS H H 55 7.798 8.180 -0.382 1
1 696 . 20 1 1 A 55 55 HIS HA H 55 4.311 4.299 0.012 1
1 701 . 20 1 1 A 55 55 HIS C C 55 180.044 177.632 2.412 1
1 702 . 20 1 1 A 55 55 HIS CA C 55 60.583 59.805 0.778 1
1 703 . 20 1 1 A 55 55 HIS CB C 55 31.445 29.530 1.915 1
1 706 . 20 1 1 A 55 55 HIS N N 55 118.683 117.914 0.769 1
1 707 . 20 1 1 A 56 56 MET H H 56 7.375 7.813 -0.438 1
1 708 . 20 1 1 A 56 56 MET HA H 56 4.513 4.025 0.488 1
1 716 . 20 1 1 A 56 56 MET C C 56 177.169 178.571 -1.402 1
1 717 . 20 1 1 A 56 56 MET CA C 56 55.823 59.194 -3.371 1
1 718 . 20 1 1 A 56 56 MET CB C 56 31.303 32.983 -1.680 1
1 721 . 20 1 1 A 56 56 MET N N 56 114.530 117.519 -2.989 1
1 722 . 20 1 1 A 57 57 GLN H H 57 8.387 7.955 0.432 1
1 723 . 20 1 1 A 57 57 GLN HA H 57 3.981 4.014 -0.033 1
1 730 . 20 1 1 A 57 57 GLN C C 57 178.033 178.075 -0.042 1
1 731 . 20 1 1 A 57 57 GLN CA C 57 57.922 59.334 -1.412 1
1 732 . 20 1 1 A 57 57 GLN CB C 57 29.012 28.598 0.414 1
1 734 . 20 1 1 A 57 57 GLN N N 57 120.713 119.702 1.011 1
1 736 . 20 1 1 A 58 58 ASN H H 58 8.765 8.519 0.246 1
1 737 . 20 1 1 A 58 58 ASN HA H 58 4.539 4.379 0.160 1
1 742 . 20 1 1 A 58 58 ASN C C 58 178.084 177.956 0.128 1
1 743 . 20 1 1 A 58 58 ASN CA C 58 55.345 56.414 -1.069 1
1 744 . 20 1 1 A 58 58 ASN CB C 58 36.924 38.177 -1.253 1
1 745 . 20 1 1 A 58 58 ASN N N 58 117.390 118.455 -1.065 1
1 747 . 20 1 1 A 59 59 TYR H H 59 8.239 7.882 0.357 1
1 748 . 20 1 1 A 59 59 TYR HA H 59 4.586 4.167 0.419 1
1 755 . 20 1 1 A 59 59 TYR C C 59 178.015 177.127 0.888 1
1 756 . 20 1 1 A 59 59 TYR CA C 59 60.779 61.420 -0.641 1
1 757 . 20 1 1 A 59 59 TYR CB C 59 38.047 38.529 -0.482 1
1 762 . 20 1 1 A 59 59 TYR N N 59 122.335 122.112 0.223 1
1 763 . 20 1 1 A 60 60 VAL H H 60 8.416 8.461 -0.045 1
1 764 . 20 1 1 A 60 60 VAL HA H 60 3.244 3.552 -0.308 1
1 772 . 20 1 1 A 60 60 VAL C C 60 177.309 178.103 -0.794 1
1 773 . 20 1 1 A 60 60 VAL CA C 60 67.022 66.609 0.413 1
1 774 . 20 1 1 A 60 60 VAL CB C 60 30.929 31.447 -0.518 1
1 777 . 20 1 1 A 60 60 VAL N N 60 119.842 119.621 0.221 1
1 778 . 20 1 1 A 61 61 ASN H H 61 8.264 8.250 0.014 1
1 779 . 20 1 1 A 61 61 ASN HA H 61 4.305 4.455 -0.150 1
1 784 . 20 1 1 A 61 61 ASN C C 61 177.263 177.995 -0.732 1
1 785 . 20 1 1 A 61 61 ASN CA C 61 55.548 56.219 -0.671 1
1 786 . 20 1 1 A 61 61 ASN CB C 61 36.645 37.301 -0.656 1
1 787 . 20 1 1 A 61 61 ASN N N 61 119.103 119.518 -0.415 1
1 789 . 20 1 1 A 62 62 SER H H 62 8.143 7.790 0.353 1
1 790 . 20 1 1 A 62 62 SER HA H 62 4.343 4.116 0.227 1
1 793 . 20 1 1 A 62 62 SER C C 62 176.409 176.345 0.064 1
1 794 . 20 1 1 A 62 62 SER CA C 62 61.612 62.084 -0.472 1
1 795 . 20 1 1 A 62 62 SER CB C 62 62.219 62.775 -0.556 1
1 796 . 20 1 1 A 62 62 SER N N 62 118.254 116.552 1.702 1
1 797 . 20 1 1 A 63 63 LEU H H 63 7.664 8.054 -0.390 1
1 798 . 20 1 1 A 63 63 LEU HA H 63 4.003 3.894 0.109 1
1 808 . 20 1 1 A 63 63 LEU C C 63 178.748 178.848 -0.100 1
1 809 . 20 1 1 A 63 63 LEU CA C 63 57.171 58.041 -0.870 1
1 810 . 20 1 1 A 63 63 LEU CB C 63 41.134 41.207 -0.073 1
1 814 . 20 1 1 A 63 63 LEU N N 63 123.812 121.269 2.543 1
1 815 . 20 1 1 A 64 64 ARG H H 64 7.969 7.719 0.250 1
1 816 . 20 1 1 A 64 64 ARG HA H 64 4.038 3.905 0.133 1
1 824 . 20 1 1 A 64 64 ARG C C 64 180.797 177.774 3.023 1
1 825 . 20 1 1 A 64 64 ARG CA C 64 58.598 59.421 -0.823 1
1 826 . 20 1 1 A 64 64 ARG CB C 64 28.849 29.889 -1.040 1
1 829 . 20 1 1 A 64 64 ARG N N 64 120.376 119.902 0.474 1
1 831 . 20 1 1 A 65 65 ASP H H 65 8.465 7.830 0.635 1
1 832 . 20 1 1 A 65 65 ASP HA H 65 4.408 4.365 0.043 1
1 835 . 20 1 1 A 65 65 ASP C C 65 177.336 178.690 -1.354 1
1 836 . 20 1 1 A 65 65 ASP CA C 65 56.957 56.896 0.061 1
1 837 . 20 1 1 A 65 65 ASP CB C 65 39.602 40.600 -0.998 1
1 838 . 20 1 1 A 65 65 ASP N N 65 122.402 120.019 2.383 1
1 839 . 20 1 1 A 66 66 GLU H H 66 7.703 7.901 -0.198 1
1 840 . 20 1 1 A 66 66 GLU HA H 66 4.213 4.243 -0.030 1
1 845 . 20 1 1 A 66 66 GLU C C 66 176.586 177.251 -0.665 1
1 846 . 20 1 1 A 66 66 GLU CA C 66 56.974 56.435 0.539 1
1 847 . 20 1 1 A 66 66 GLU CB C 66 29.821 29.812 0.009 1
1 849 . 20 1 1 A 66 66 GLU N N 66 119.076 115.911 3.165 1
1 850 . 20 1 1 A 67 67 GLY H H 67 7.861 7.870 -0.009 1
1 851 . 20 1 1 A 67 67 GLY HA2 H 67 4.269 3.887 0.382 1
1 852 . 20 1 1 A 67 67 GLY HA3 H 67 3.731 3.891 -0.160 1
1 853 . 20 1 1 A 67 67 GLY C C 67 174.614 174.937 -0.323 1
1 854 . 20 1 1 A 67 67 GLY CA C 67 44.608 46.175 -1.567 1
1 855 . 20 1 1 A 67 67 GLY N N 67 105.730 109.333 -3.603 1
1 856 . 20 1 1 A 68 68 LEU H H 68 7.324 7.753 -0.429 1
1 857 . 20 1 1 A 68 68 LEU HA H 68 4.257 4.197 0.060 1
1 867 . 20 1 1 A 68 68 LEU C C 68 176.136 177.082 -0.946 1
1 868 . 20 1 1 A 68 68 LEU CA C 68 55.659 54.858 0.801 1
1 869 . 20 1 1 A 68 68 LEU CB C 68 41.874 42.070 -0.196 1
1 873 . 20 1 1 A 68 68 LEU N N 68 121.062 121.288 -0.226 1
1 874 . 20 1 1 A 69 69 LYS H H 69 8.368 8.542 -0.174 1
1 875 . 20 1 1 A 69 69 LYS HA H 69 4.281 4.479 -0.198 1
1 884 . 20 1 1 A 69 69 LYS C C 69 177.940 178.059 -0.119 1
1 885 . 20 1 1 A 69 69 LYS CA C 69 55.412 55.828 -0.416 1
1 886 . 20 1 1 A 69 69 LYS CB C 69 32.761 33.438 -0.677 1
1 890 . 20 1 1 A 69 69 LYS N N 69 120.120 122.425 -2.305 1
1 891 . 20 1 1 A 70 70 ARG H H 70 9.095 8.888 0.207 1
1 892 . 20 1 1 A 70 70 ARG HA H 70 3.684 4.099 -0.415 1
1 900 . 20 1 1 A 70 70 ARG C C 70 177.712 178.545 -0.833 1
1 901 . 20 1 1 A 70 70 ARG CA C 70 60.216 58.448 1.768 1
1 902 . 20 1 1 A 70 70 ARG CB C 70 29.539 29.998 -0.459 1
1 905 . 20 1 1 A 70 70 ARG N N 70 123.339 118.997 4.342 1
1 907 . 20 1 1 A 71 71 GLY H H 71 8.985 8.362 0.623 1
1 908 . 20 1 1 A 71 71 GLY HA2 H 71 3.932 3.609 0.323 1
1 909 . 20 1 1 A 71 71 GLY HA3 H 71 3.905 3.612 0.293 1
1 910 . 20 1 1 A 71 71 GLY C C 71 176.324 175.754 0.570 1
1 911 . 20 1 1 A 71 71 GLY CA C 71 46.752 47.396 -0.644 1
1 912 . 20 1 1 A 71 71 GLY N N 71 104.509 108.874 -4.365 1
1 913 . 20 1 1 A 72 72 THR H H 72 7.295 8.080 -0.785 1
1 914 . 20 1 1 A 72 72 THR HA H 72 4.014 3.921 0.093 1
1 919 . 20 1 1 A 72 72 THR C C 72 175.135 176.039 -0.904 1
1 920 . 20 1 1 A 72 72 THR CA C 72 65.848 66.523 -0.675 1
1 921 . 20 1 1 A 72 72 THR CB C 72 68.160 68.511 -0.351 1
1 923 . 20 1 1 A 72 72 THR N N 72 118.617 117.555 1.062 1
1 924 . 20 1 1 A 73 73 ILE H H 73 7.883 7.984 -0.101 1
1 925 . 20 1 1 A 73 73 ILE HA H 73 3.258 3.576 -0.318 1
1 935 . 20 1 1 A 73 73 ILE C C 73 177.060 178.206 -1.146 1
1 936 . 20 1 1 A 73 73 ILE CA C 73 66.561 65.598 0.963 1
1 937 . 20 1 1 A 73 73 ILE CB C 73 37.339 37.671 -0.332 1
1 941 . 20 1 1 A 73 73 ILE N N 73 121.692 121.218 0.474 1
1 942 . 20 1 1 A 74 74 GLU H H 74 8.723 7.975 0.748 1
1 943 . 20 1 1 A 74 74 GLU HA H 74 3.807 3.925 -0.118 1
1 948 . 20 1 1 A 74 74 GLU C C 74 178.319 179.289 -0.970 1
1 949 . 20 1 1 A 74 74 GLU CA C 74 59.637 59.926 -0.289 1
1 950 . 20 1 1 A 74 74 GLU CB C 74 29.257 29.150 0.107 1
1 952 . 20 1 1 A 74 74 GLU N N 74 117.701 120.797 -3.096 1
1 953 . 20 1 1 A 75 75 LYS H H 75 7.361 7.583 -0.222 1
1 954 . 20 1 1 A 75 75 LYS HA H 75 3.958 4.070 -0.112 1
1 963 . 20 1 1 A 75 75 LYS C C 75 178.554 179.806 -1.252 1
1 964 . 20 1 1 A 75 75 LYS CA C 75 59.764 59.251 0.513 1
1 965 . 20 1 1 A 75 75 LYS CB C 75 32.314 32.086 0.228 1
1 969 . 20 1 1 A 75 75 LYS N N 75 118.734 118.883 -0.149 1
1 970 . 20 1 1 A 76 76 ILE H H 76 7.713 7.499 0.214 1
1 971 . 20 1 1 A 76 76 ILE HA H 76 3.221 3.866 -0.645 1
1 981 . 20 1 1 A 76 76 ILE C C 76 177.504 178.211 -0.707 1
1 982 . 20 1 1 A 76 76 ILE CA C 76 65.796 64.372 1.424 1
1 983 . 20 1 1 A 76 76 ILE CB C 76 37.732 36.843 0.889 1
1 987 . 20 1 1 A 76 76 ILE N N 76 120.312 116.659 3.653 1
1 988 . 20 1 1 A 77 77 ILE H H 77 8.587 7.893 0.694 1
1 989 . 20 1 1 A 77 77 ILE HA H 77 3.778 3.661 0.117 1
1 999 . 20 1 1 A 77 77 ILE C C 77 177.074 178.003 -0.929 1
1 1000 . 20 1 1 A 77 77 ILE CA C 77 63.168 65.137 -1.969 1
1 1001 . 20 1 1 A 77 77 ILE CB C 77 36.617 37.598 -0.981 1
1 1005 . 20 1 1 A 77 77 ILE N N 77 118.978 120.791 -1.813 1
1 1006 . 20 1 1 A 78 78 LYS H H 78 8.050 7.659 0.391 1
1 1007 . 20 1 1 A 78 78 LYS HA H 78 3.925 4.074 -0.149 1
1 1016 . 20 1 1 A 78 78 LYS C C 78 178.291 179.085 -0.794 1
1 1017 . 20 1 1 A 78 78 LYS CA C 78 60.192 59.127 1.065 1
1 1018 . 20 1 1 A 78 78 LYS CB C 78 31.886 31.760 0.126 1
1 1022 . 20 1 1 A 78 78 LYS N N 78 121.618 119.341 2.277 1
1 1023 . 20 1 1 A 79 79 VAL H H 79 7.619 7.803 -0.184 1
1 1024 . 20 1 1 A 79 79 VAL HA H 79 3.846 3.756 0.090 1
1 1032 . 20 1 1 A 79 79 VAL C C 79 177.712 178.235 -0.523 1
1 1033 . 20 1 1 A 79 79 VAL CA C 79 66.494 66.382 0.112 1
1 1034 . 20 1 1 A 79 79 VAL CB C 79 31.298 31.666 -0.368 1
1 1037 . 20 1 1 A 79 79 VAL N N 79 120.254 119.578 0.676 1
1 1038 . 20 1 1 A 80 80 ILE H H 80 7.885 7.908 -0.023 1
1 1039 . 20 1 1 A 80 80 ILE HA H 80 3.367 3.740 -0.373 1
1 1049 . 20 1 1 A 80 80 ILE C C 80 179.892 177.690 2.202 1
1 1050 . 20 1 1 A 80 80 ILE CA C 80 65.343 65.096 0.247 1
1 1051 . 20 1 1 A 80 80 ILE CB C 80 38.129 37.364 0.765 1
1 1055 . 20 1 1 A 80 80 ILE N N 80 119.666 120.295 -0.629 1
1 1056 . 20 1 1 A 81 81 ARG H H 81 9.384 8.469 0.915 1
1 1057 . 20 1 1 A 81 81 ARG HA H 81 3.834 3.953 -0.119 1
1 1065 . 20 1 1 A 81 81 ARG C C 81 178.204 179.176 -0.972 1
1 1066 . 20 1 1 A 81 81 ARG CA C 81 60.560 59.795 0.765 1
1 1067 . 20 1 1 A 81 81 ARG CB C 81 30.196 30.248 -0.052 1
1 1070 . 20 1 1 A 81 81 ARG N N 81 121.030 120.396 0.634 1
1 1072 . 20 1 1 A 82 82 ASN H H 82 8.773 8.322 0.451 1
1 1073 . 20 1 1 A 82 82 ASN HA H 82 4.587 4.588 -0.001 1
1 1078 . 20 1 1 A 82 82 ASN C C 82 178.300 177.806 0.494 1
1 1079 . 20 1 1 A 82 82 ASN CA C 82 56.160 56.618 -0.458 1
1 1080 . 20 1 1 A 82 82 ASN CB C 82 38.464 39.377 -0.913 1
1 1081 . 20 1 1 A 82 82 ASN N N 82 118.483 118.693 -0.210 1
1 1083 . 20 1 1 A 83 83 SER H H 83 8.526 7.717 0.809 1
1 1084 . 20 1 1 A 83 83 SER HA H 83 2.765 3.267 -0.502 1
1 1087 . 20 1 1 A 83 83 SER C C 83 176.386 176.336 0.050 1
1 1088 . 20 1 1 A 83 83 SER CA C 83 61.245 61.936 -0.691 1
1 1089 . 20 1 1 A 83 83 SER CB C 83 61.287 62.720 -1.433 1
1 1090 . 20 1 1 A 83 83 SER N N 83 118.286 116.480 1.806 1
1 1091 . 20 1 1 A 84 84 LEU H H 84 7.782 8.362 -0.580 1
1 1092 . 20 1 1 A 84 84 LEU HA H 84 4.221 4.017 0.204 1
1 1102 . 20 1 1 A 84 84 LEU C C 84 177.846 179.427 -1.581 1
1 1103 . 20 1 1 A 84 84 LEU CA C 84 57.166 57.744 -0.578 1
1 1104 . 20 1 1 A 84 84 LEU CB C 84 40.520 40.959 -0.439 1
1 1108 . 20 1 1 A 84 84 LEU N N 84 127.445 121.157 6.288 1
1 1109 . 20 1 1 A 85 85 GLU H H 85 8.264 8.480 -0.216 1
1 1110 . 20 1 1 A 85 85 GLU HA H 85 3.981 3.956 0.025 1
1 1115 . 20 1 1 A 85 85 GLU C C 85 179.288 179.159 0.129 1
1 1116 . 20 1 1 A 85 85 GLU CA C 85 59.025 59.806 -0.781 1
1 1117 . 20 1 1 A 85 85 GLU CB C 85 29.182 29.151 0.031 1
1 1119 . 20 1 1 A 85 85 GLU N N 85 121.538 120.462 1.076 1
1 1120 . 20 1 1 A 86 86 HIS H H 86 7.683 8.188 -0.505 1
1 1121 . 20 1 1 A 86 86 HIS HA H 86 4.573 4.350 0.223 1
1 1125 . 20 1 1 A 86 86 HIS C C 86 175.484 177.685 -2.201 1
1 1126 . 20 1 1 A 86 86 HIS CA C 86 58.940 59.541 -0.601 1
1 1127 . 20 1 1 A 86 86 HIS CB C 86 29.267 29.985 -0.718 1
1 1129 . 20 1 1 A 86 86 HIS N N 86 117.087 120.313 -3.226 1
1 1130 . 20 1 1 A 87 87 ALA H H 87 7.197 8.233 -1.036 1
1 1131 . 20 1 1 A 87 87 ALA HA H 87 3.925 3.848 0.077 1
1 1135 . 20 1 1 A 87 87 ALA C C 87 179.038 180.032 -0.994 1
1 1136 . 20 1 1 A 87 87 ALA CA C 87 54.863 54.976 -0.113 1
1 1137 . 20 1 1 A 87 87 ALA CB C 87 17.034 18.020 -0.986 1
1 1138 . 20 1 1 A 87 87 ALA N N 87 121.510 120.811 0.699 1
1 1139 . 20 1 1 A 88 88 ILE H H 88 7.819 7.497 0.322 1
1 1140 . 20 1 1 A 88 88 ILE HA H 88 4.067 3.818 0.249 1
1 1150 . 20 1 1 A 88 88 ILE C C 88 180.846 177.381 3.465 1
1 1151 . 20 1 1 A 88 88 ILE CA C 88 64.021 65.359 -1.338 1
1 1152 . 20 1 1 A 88 88 ILE CB C 88 37.557 37.617 -0.060 1
1 1156 . 20 1 1 A 88 88 ILE N N 88 120.898 119.148 1.750 1
1 1157 . 20 1 1 A 89 89 ASP H H 89 7.808 8.025 -0.217 1
1 1158 . 20 1 1 A 89 89 ASP HA H 89 4.437 4.302 0.135 1
1 1161 . 20 1 1 A 89 89 ASP C C 89 178.033 177.970 0.063 1
1 1162 . 20 1 1 A 89 89 ASP CA C 89 57.343 57.788 -0.445 1
1 1163 . 20 1 1 A 89 89 ASP CB C 89 39.689 41.906 -2.217 1
1 1164 . 20 1 1 A 89 89 ASP N N 89 125.174 120.849 4.325 1
1 1165 . 20 1 1 A 90 90 LEU H H 90 7.607 7.660 -0.053 1
1 1166 . 20 1 1 A 90 90 LEU HA H 90 4.198 4.211 -0.013 1
1 1176 . 20 1 1 A 90 90 LEU C C 90 175.416 175.969 -0.553 1
1 1177 . 20 1 1 A 90 90 LEU CA C 90 54.755 55.114 -0.359 1
1 1178 . 20 1 1 A 90 90 LEU CB C 90 42.960 41.805 1.155 1
1 1182 . 20 1 1 A 90 90 LEU N N 90 117.576 117.379 0.197 1
1 1183 . 20 1 1 A 91 91 GLU H H 91 8.143 7.871 0.272 1
1 1184 . 20 1 1 A 91 91 GLU HA H 91 4.005 4.056 -0.051 1
1 1189 . 20 1 1 A 91 91 GLU C C 91 175.792 176.196 -0.404 1
1 1190 . 20 1 1 A 91 91 GLU CA C 91 57.202 57.530 -0.328 1
1 1191 . 20 1 1 A 91 91 GLU CB C 91 26.125 27.033 -0.908 1
1 1193 . 20 1 1 A 91 91 GLU N N 91 113.620 115.181 -1.561 1
1 1194 . 20 1 1 A 92 92 LEU H H 92 8.290 7.990 0.300 1
1 1195 . 20 1 1 A 92 92 LEU HA H 92 4.216 4.184 0.032 1
1 1205 . 20 1 1 A 92 92 LEU C C 92 176.622 176.779 -0.157 1
1 1206 . 20 1 1 A 92 92 LEU CA C 92 56.410 56.053 0.357 1
1 1207 . 20 1 1 A 92 92 LEU CB C 92 43.378 42.470 0.908 1
1 1211 . 20 1 1 A 92 92 LEU N N 92 116.868 119.239 -2.371 1
1 1212 . 20 1 1 A 93 93 ILE H H 93 6.988 6.793 0.195 1
1 1213 . 20 1 1 A 93 93 ILE HA H 93 4.580 4.569 0.011 1
1 1223 . 20 1 1 A 93 93 ILE C C 93 175.145 175.933 -0.788 1
1 1224 . 20 1 1 A 93 93 ILE CA C 93 58.707 58.514 0.193 1
1 1225 . 20 1 1 A 93 93 ILE CB C 93 42.864 41.604 1.260 1
1 1229 . 20 1 1 A 93 93 ILE N N 93 107.565 113.807 -6.242 1
1 1230 . 20 1 1 A 94 94 THR H H 94 8.742 8.584 0.158 1
1 1231 . 20 1 1 A 94 94 THR HA H 94 4.489 4.216 0.273 1
1 1236 . 20 1 1 A 94 94 THR C C 94 173.875 174.329 -0.454 1
1 1237 . 20 1 1 A 94 94 THR CA C 94 61.842 64.000 -2.158 1
1 1238 . 20 1 1 A 94 94 THR CB C 94 69.972 69.088 0.884 1
1 1240 . 20 1 1 A 94 94 THR N N 94 107.904 114.295 -6.391 1
1 1241 . 20 1 1 A 95 95 LYS H H 95 7.294 7.673 -0.379 1
1 1242 . 20 1 1 A 95 95 LYS HA H 95 4.566 4.851 -0.285 1
1 1251 . 20 1 1 A 95 95 LYS C C 95 173.791 174.333 -0.542 1
1 1252 . 20 1 1 A 95 95 LYS CA C 95 54.533 55.444 -0.911 1
1 1253 . 20 1 1 A 95 95 LYS CB C 95 35.123 36.063 -0.940 1
1 1257 . 20 1 1 A 95 95 LYS N N 95 119.458 120.529 -1.071 1
1 1258 . 20 1 1 A 96 96 ASN H H 96 9.157 8.401 0.756 1
1 1259 . 20 1 1 A 96 96 ASN HA H 96 4.408 5.130 -0.722 1
1 1264 . 20 1 1 A 96 96 ASN C C 96 176.653 175.881 0.772 1
1 1265 . 20 1 1 A 96 96 ASN CA C 96 51.088 51.626 -0.538 1
1 1266 . 20 1 1 A 96 96 ASN CB C 96 37.292 40.921 -3.629 1
1 1267 . 20 1 1 A 96 96 ASN N N 96 121.031 123.284 -2.253 1
1 1269 . 20 1 1 A 97 97 VAL H H 97 8.193 8.525 -0.332 1
1 1270 . 20 1 1 A 97 97 VAL HA H 97 4.019 4.138 -0.119 1
1 1278 . 20 1 1 A 97 97 VAL C C 97 175.089 175.820 -0.731 1
1 1279 . 20 1 1 A 97 97 VAL CA C 97 63.437 62.525 0.912 1
1 1280 . 20 1 1 A 97 97 VAL CB C 97 29.934 31.719 -1.785 1
1 1283 . 20 1 1 A 97 97 VAL N N 97 118.839 117.009 1.830 1
1 1284 . 20 1 1 A 98 98 ALA H H 98 7.994 7.579 0.415 1
1 1285 . 20 1 1 A 98 98 ALA HA H 98 5.108 4.477 0.631 1
1 1289 . 20 1 1 A 98 98 ALA C C 98 178.033 179.148 -1.115 1
1 1290 . 20 1 1 A 98 98 ALA CA C 98 50.342 52.609 -2.267 1
1 1291 . 20 1 1 A 98 98 ALA CB C 98 19.659 19.238 0.421 1
1 1292 . 20 1 1 A 98 98 ALA N N 98 121.031 124.919 -3.888 1
1 1293 . 20 1 1 A 99 99 ALA H H 99 7.347 7.521 -0.174 1
1 1294 . 20 1 1 A 99 99 ALA HA H 99 3.818 4.010 -0.192 1
1 1298 . 20 1 1 A 99 99 ALA C C 99 177.712 179.297 -1.585 1
1 1299 . 20 1 1 A 99 99 ALA CA C 99 55.117 55.195 -0.078 1
1 1300 . 20 1 1 A 99 99 ALA CB C 99 18.879 18.615 0.264 1
1 1301 . 20 1 1 A 99 99 ALA N N 99 122.816 121.224 1.592 1
1 1302 . 20 1 1 A 100 100 LYS H H 100 8.190 7.609 0.581 1
1 1303 . 20 1 1 A 100 100 LYS HA H 100 4.483 4.302 0.181 1
1 1312 . 20 1 1 A 100 100 LYS C C 100 175.899 176.518 -0.619 1
1 1313 . 20 1 1 A 100 100 LYS CA C 100 54.231 56.440 -2.209 1
1 1314 . 20 1 1 A 100 100 LYS CB C 100 32.066 32.607 -0.541 1
1 1318 . 20 1 1 A 100 100 LYS N N 100 113.197 115.260 -2.063 1
1 1319 . 20 1 1 A 101 101 THR H H 101 7.128 7.201 -0.073 1
1 1320 . 20 1 1 A 101 101 THR HA H 101 3.834 4.214 -0.380 1
1 1325 . 20 1 1 A 101 101 THR C C 101 173.255 173.597 -0.342 1
1 1326 . 20 1 1 A 101 101 THR CA C 101 64.392 62.794 1.598 1
1 1327 . 20 1 1 A 101 101 THR CB C 101 69.160 67.999 1.161 1
1 1329 . 20 1 1 A 101 101 THR N N 101 118.368 116.047 2.321 1
1 1330 . 20 1 1 A 102 102 LYS H H 102 8.753 8.258 0.495 1
1 1331 . 20 1 1 A 102 102 LYS HA H 102 4.438 4.737 -0.299 1
1 1340 . 20 1 1 A 102 102 LYS C C 102 175.627 175.847 -0.220 1
1 1341 . 20 1 1 A 102 102 LYS CA C 102 55.117 54.004 1.113 1
1 1342 . 20 1 1 A 102 102 LYS CB C 102 33.901 34.421 -0.520 1
1 1346 . 20 1 1 A 102 102 LYS N N 102 126.513 126.321 0.192 1
1 1347 . 20 1 1 A 103 103 LEU H H 103 8.602 8.295 0.307 1
1 1348 . 20 1 1 A 103 103 LEU HA H 103 4.486 4.437 0.049 1
1 1358 . 20 1 1 A 103 103 LEU CA C 103 52.233 53.216 -0.983 1
1 1359 . 20 1 1 A 103 103 LEU CB C 103 41.028 42.904 -1.876 1
1 1363 . 20 1 1 A 103 103 LEU N N 103 124.466 123.528 0.938 1
1 1364 . 20 1 1 A 104 104 PRO HA H 104 4.437 4.573 -0.136 1
1 1371 . 20 1 1 A 104 104 PRO C C 104 175.779 176.133 -0.354 1
1 1372 . 20 1 1 A 104 104 PRO CA C 104 62.322 62.244 0.078 1
1 1373 . 20 1 1 A 104 104 PRO CB C 104 31.899 32.951 -1.052 1
1 1376 . 20 1 1 A 105 105 LYS H H 105 8.460 8.295 0.165 1
1 1377 . 20 1 1 A 105 105 LYS HA H 105 4.154 4.209 -0.055 1
1 1386 . 20 1 1 A 105 105 LYS C C 105 175.998 175.805 0.193 1
1 1387 . 20 1 1 A 105 105 LYS CA C 105 56.480 56.152 0.328 1
1 1388 . 20 1 1 A 105 105 LYS CB C 105 32.909 31.608 1.301 1
1 1392 . 20 1 1 A 105 105 LYS N N 105 122.139 121.654 0.485 1
1 1393 . 20 1 1 A 106 106 ALA H H 106 8.448 8.351 0.097 1
1 1394 . 20 1 1 A 106 106 ALA HA H 106 4.309 4.904 -0.595 1
1 1398 . 20 1 1 A 106 106 ALA C C 106 176.828 177.121 -0.293 1
1 1399 . 20 1 1 A 106 106 ALA CA C 106 51.862 50.714 1.148 1
1 1400 . 20 1 1 A 106 106 ALA CB C 106 19.323 20.969 -1.646 1
1 1401 . 20 1 1 A 106 106 ALA N N 106 125.278 128.027 -2.749 1
1 1402 . 20 1 1 A 107 107 ASP H H 107 8.428 8.462 -0.034 1
1 1403 . 20 1 1 A 107 107 ASP HA H 107 4.574 4.610 -0.036 1
1 1406 . 20 1 1 A 107 107 ASP C C 107 175.951 176.832 -0.881 1
1 1407 . 20 1 1 A 107 107 ASP CA C 107 54.214 54.829 -0.615 1
1 1408 . 20 1 1 A 107 107 ASP CB C 107 41.141 41.467 -0.326 1
1 1409 . 20 1 1 A 107 107 ASP N N 107 120.771 120.813 -0.042 1
1 1410 . 20 1 1 A 108 108 LYS H H 108 8.329 8.766 -0.437 1
1 1411 . 20 1 1 A 108 108 LYS HA H 108 4.203 4.319 -0.116 1
1 1420 . 20 1 1 A 108 108 LYS C C 108 176.483 177.719 -1.236 1
1 1421 . 20 1 1 A 108 108 LYS CA C 108 56.831 56.612 0.219 1
1 1422 . 20 1 1 A 108 108 LYS CB C 108 32.648 32.595 0.053 1
1 1426 . 20 1 1 A 108 108 LYS N N 108 120.727 121.680 -0.953 1
1 1427 . 20 1 1 A 109 109 GLU H H 109 8.447 9.025 -0.578 1
1 1428 . 20 1 1 A 109 109 GLU HA H 109 4.215 4.047 0.168 1
1 1433 . 20 1 1 A 109 109 GLU C C 109 176.513 176.025 0.488 1
1 1434 . 20 1 1 A 109 109 GLU CA C 109 56.936 57.267 -0.331 1
1 1435 . 20 1 1 A 109 109 GLU CB C 109 29.833 29.736 0.097 1
1 1437 . 20 1 1 A 109 109 GLU N N 109 121.471 123.235 -1.764 1
1 1438 . 20 1 1 A 110 110 GLU H H 110 8.352 7.985 0.367 1
1 1439 . 20 1 1 A 110 110 GLU HA H 110 4.233 4.216 0.017 1
1 1444 . 20 1 1 A 110 110 GLU C C 110 176.439 176.244 0.195 1
1 1445 . 20 1 1 A 110 110 GLU CA C 110 56.681 57.488 -0.807 1
1 1446 . 20 1 1 A 110 110 GLU CB C 110 29.860 26.904 2.956 1
1 1448 . 20 1 1 A 110 110 GLU N N 110 121.559 115.687 5.872 1
1 1449 . 20 1 1 A 111 111 LEU H H 111 8.145 7.957 0.188 1
1 1450 . 20 1 1 A 111 111 LEU HA H 111 4.251 4.077 0.174 1
1 1460 . 20 1 1 A 111 111 LEU C C 111 177.306 177.188 0.118 1
1 1461 . 20 1 1 A 111 111 LEU CA C 111 55.277 57.385 -2.108 1
1 1462 . 20 1 1 A 111 111 LEU CB C 111 42.054 42.011 0.043 1
1 1466 . 20 1 1 A 111 111 LEU N N 111 122.181 120.058 2.123 1
1 1467 . 20 1 1 A 112 112 GLU H H 112 8.212 7.961 0.251 1
1 1468 . 20 1 1 A 112 112 GLU N N 112 120.291 114.502 5.789 1
1 1469 . 20 1 1 A 114 114 HIS C C 114 176.070 175.318 0.752 1
1 1470 . 20 1 1 A 116 116 HIS H H 116 8.227 9.003 -0.776 1
1 1471 . 20 1 1 A 116 116 HIS C C 116 173.580 174.305 -0.725 1
1 1472 . 20 1 1 A 116 116 HIS N N 116 119.156 124.522 -5.366 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 109 1.187 1
2 1 1 1 "RMS(OBS, PRED)" CA 109 1.213 1
3 1 1 1 "RMS(OBS, PRED)" CB 103 1.124 1
4 1 1 1 "RMS(OBS, PRED)" H 108 0.591 1
5 1 1 1 "RMS(OBS, PRED)" HA 115 0.257 1
6 1 1 1 "RMS(OBS, PRED)" N 108 2.516 1
7 1 2 1 "RMS(OBS, PRED)" C 109 1.084 1
8 1 2 1 "RMS(OBS, PRED)" CA 109 1.198 1
9 1 2 1 "RMS(OBS, PRED)" CB 103 1.123 1
10 1 2 1 "RMS(OBS, PRED)" H 108 0.564 1
11 1 2 1 "RMS(OBS, PRED)" HA 115 0.264 1
12 1 2 1 "RMS(OBS, PRED)" N 108 2.488 1
13 1 3 1 "RMS(OBS, PRED)" C 109 1.160 1
14 1 3 1 "RMS(OBS, PRED)" CA 109 1.243 1
15 1 3 1 "RMS(OBS, PRED)" CB 103 1.059 1
16 1 3 1 "RMS(OBS, PRED)" H 108 0.592 1
17 1 3 1 "RMS(OBS, PRED)" HA 115 0.273 1
18 1 3 1 "RMS(OBS, PRED)" N 108 2.540 1
19 1 4 1 "RMS(OBS, PRED)" C 109 1.142 1
20 1 4 1 "RMS(OBS, PRED)" CA 109 1.214 1
21 1 4 1 "RMS(OBS, PRED)" CB 103 1.188 1
22 1 4 1 "RMS(OBS, PRED)" H 108 0.593 1
23 1 4 1 "RMS(OBS, PRED)" HA 115 0.292 1
24 1 4 1 "RMS(OBS, PRED)" N 108 2.575 1
25 1 5 1 "RMS(OBS, PRED)" C 109 1.163 1
26 1 5 1 "RMS(OBS, PRED)" CA 109 1.155 1
27 1 5 1 "RMS(OBS, PRED)" CB 103 1.104 1
28 1 5 1 "RMS(OBS, PRED)" H 108 0.568 1
29 1 5 1 "RMS(OBS, PRED)" HA 115 0.269 1
30 1 5 1 "RMS(OBS, PRED)" N 108 2.576 1
31 1 6 1 "RMS(OBS, PRED)" C 109 1.081 1
32 1 6 1 "RMS(OBS, PRED)" CA 109 1.231 1
33 1 6 1 "RMS(OBS, PRED)" CB 103 1.112 1
34 1 6 1 "RMS(OBS, PRED)" H 108 0.543 1
35 1 6 1 "RMS(OBS, PRED)" HA 115 0.280 1
36 1 6 1 "RMS(OBS, PRED)" N 108 2.552 1
37 1 7 1 "RMS(OBS, PRED)" C 109 1.168 1
38 1 7 1 "RMS(OBS, PRED)" CA 109 1.145 1
39 1 7 1 "RMS(OBS, PRED)" CB 103 1.121 1
40 1 7 1 "RMS(OBS, PRED)" H 108 0.573 1
41 1 7 1 "RMS(OBS, PRED)" HA 115 0.256 1
42 1 7 1 "RMS(OBS, PRED)" N 108 2.712 1
43 1 8 1 "RMS(OBS, PRED)" C 109 1.153 1
44 1 8 1 "RMS(OBS, PRED)" CA 109 1.185 1
45 1 8 1 "RMS(OBS, PRED)" CB 103 1.059 1
46 1 8 1 "RMS(OBS, PRED)" H 108 0.562 1
47 1 8 1 "RMS(OBS, PRED)" HA 115 0.270 1
48 1 8 1 "RMS(OBS, PRED)" N 108 2.710 1
49 1 9 1 "RMS(OBS, PRED)" C 109 1.209 1
50 1 9 1 "RMS(OBS, PRED)" CA 109 1.272 1
51 1 9 1 "RMS(OBS, PRED)" CB 103 1.120 1
52 1 9 1 "RMS(OBS, PRED)" H 108 0.602 1
53 1 9 1 "RMS(OBS, PRED)" HA 115 0.315 1
54 1 9 1 "RMS(OBS, PRED)" N 108 2.553 1
55 1 10 1 "RMS(OBS, PRED)" C 109 1.095 1
56 1 10 1 "RMS(OBS, PRED)" CA 109 1.144 1
57 1 10 1 "RMS(OBS, PRED)" CB 103 1.097 1
58 1 10 1 "RMS(OBS, PRED)" H 108 0.547 1
59 1 10 1 "RMS(OBS, PRED)" HA 115 0.257 1
60 1 10 1 "RMS(OBS, PRED)" N 108 2.625 1
61 1 11 1 "RMS(OBS, PRED)" C 109 1.176 1
62 1 11 1 "RMS(OBS, PRED)" CA 109 1.182 1
63 1 11 1 "RMS(OBS, PRED)" CB 103 1.195 1
64 1 11 1 "RMS(OBS, PRED)" H 108 0.575 1
65 1 11 1 "RMS(OBS, PRED)" HA 115 0.273 1
66 1 11 1 "RMS(OBS, PRED)" N 108 2.521 1
67 1 12 1 "RMS(OBS, PRED)" C 109 1.095 1
68 1 12 1 "RMS(OBS, PRED)" CA 109 1.088 1
69 1 12 1 "RMS(OBS, PRED)" CB 103 0.975 1
70 1 12 1 "RMS(OBS, PRED)" H 108 0.550 1
71 1 12 1 "RMS(OBS, PRED)" HA 115 0.263 1
72 1 12 1 "RMS(OBS, PRED)" N 108 2.434 1
73 1 13 1 "RMS(OBS, PRED)" C 109 1.130 1
74 1 13 1 "RMS(OBS, PRED)" CA 109 1.120 1
75 1 13 1 "RMS(OBS, PRED)" CB 103 1.052 1
76 1 13 1 "RMS(OBS, PRED)" H 108 0.514 1
77 1 13 1 "RMS(OBS, PRED)" HA 115 0.240 1
78 1 13 1 "RMS(OBS, PRED)" N 108 2.526 1
79 1 14 1 "RMS(OBS, PRED)" C 109 1.172 1
80 1 14 1 "RMS(OBS, PRED)" CA 109 1.196 1
81 1 14 1 "RMS(OBS, PRED)" CB 103 1.052 1
82 1 14 1 "RMS(OBS, PRED)" H 108 0.581 1
83 1 14 1 "RMS(OBS, PRED)" HA 115 0.282 1
84 1 14 1 "RMS(OBS, PRED)" N 108 2.588 1
85 1 15 1 "RMS(OBS, PRED)" C 109 1.124 1
86 1 15 1 "RMS(OBS, PRED)" CA 109 1.183 1
87 1 15 1 "RMS(OBS, PRED)" CB 103 1.197 1
88 1 15 1 "RMS(OBS, PRED)" H 108 0.549 1
89 1 15 1 "RMS(OBS, PRED)" HA 115 0.268 1
90 1 15 1 "RMS(OBS, PRED)" N 108 2.416 1
91 1 16 1 "RMS(OBS, PRED)" C 109 1.150 1
92 1 16 1 "RMS(OBS, PRED)" CA 109 1.190 1
93 1 16 1 "RMS(OBS, PRED)" CB 103 1.012 1
94 1 16 1 "RMS(OBS, PRED)" H 108 0.566 1
95 1 16 1 "RMS(OBS, PRED)" HA 115 0.245 1
96 1 16 1 "RMS(OBS, PRED)" N 108 2.657 1
97 1 17 1 "RMS(OBS, PRED)" C 109 1.186 1
98 1 17 1 "RMS(OBS, PRED)" CA 109 1.334 1
99 1 17 1 "RMS(OBS, PRED)" CB 103 1.176 1
100 1 17 1 "RMS(OBS, PRED)" H 108 0.586 1
101 1 17 1 "RMS(OBS, PRED)" HA 115 0.272 1
102 1 17 1 "RMS(OBS, PRED)" N 108 2.678 1
103 1 18 1 "RMS(OBS, PRED)" C 109 1.180 1
104 1 18 1 "RMS(OBS, PRED)" CA 109 1.235 1
105 1 18 1 "RMS(OBS, PRED)" CB 103 1.158 1
106 1 18 1 "RMS(OBS, PRED)" H 108 0.549 1
107 1 18 1 "RMS(OBS, PRED)" HA 115 0.273 1
108 1 18 1 "RMS(OBS, PRED)" N 108 2.600 1
109 1 19 1 "RMS(OBS, PRED)" C 109 1.099 1
110 1 19 1 "RMS(OBS, PRED)" CA 109 1.143 1
111 1 19 1 "RMS(OBS, PRED)" CB 103 1.056 1
112 1 19 1 "RMS(OBS, PRED)" H 108 0.538 1
113 1 19 1 "RMS(OBS, PRED)" HA 115 0.259 1
114 1 19 1 "RMS(OBS, PRED)" N 108 2.464 1
115 1 20 1 "RMS(OBS, PRED)" C 109 1.150 1
116 1 20 1 "RMS(OBS, PRED)" CA 109 1.089 1
117 1 20 1 "RMS(OBS, PRED)" CB 103 1.130 1
118 1 20 1 "RMS(OBS, PRED)" H 108 0.583 1
119 1 20 1 "RMS(OBS, PRED)" HA 115 0.251 1
120 1 20 1 "RMS(OBS, PRED)" N 108 2.613 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 A 3 3 PRO HA H 3 4.390 4.621 -0.231 2
1 12 . 1 1 A 3 3 PRO C C 3 176.847 176.859 -0.012 2
1 13 . 1 1 A 3 3 PRO CA C 3 63.449 62.575 0.874 2
1 14 . 1 1 A 3 3 PRO CB C 3 31.938 32.035 -0.097 2
1 17 . 1 1 A 4 4 SER H H 4 8.531 8.597 -0.066 2
1 18 . 1 1 A 4 4 SER HA H 4 4.262 4.453 -0.191 2
1 21 . 1 1 A 4 4 SER C C 4 175.414 174.316 1.098 2
1 22 . 1 1 A 4 4 SER CA C 4 59.163 58.688 0.475 2
1 23 . 1 1 A 4 4 SER CB C 4 63.242 62.531 0.711 2
1 24 . 1 1 A 4 4 SER N N 4 114.246 118.068 -3.822 2
1 25 . 1 1 A 5 5 LYS H H 5 8.468 7.941 0.527 2
1 26 . 1 1 A 5 5 LYS HA H 5 4.433 4.245 0.188 2
1 35 . 1 1 A 5 5 LYS C C 5 175.984 176.337 -0.353 2
1 36 . 1 1 A 5 5 LYS CA C 5 55.724 57.130 -1.406 2
1 37 . 1 1 A 5 5 LYS CB C 5 32.881 31.990 0.891 2
1 41 . 1 1 A 5 5 LYS N N 5 123.488 122.918 0.570 2
1 42 . 1 1 A 6 6 LEU H H 6 7.707 7.586 0.121 2
1 43 . 1 1 A 6 6 LEU HA H 6 4.381 4.410 -0.029 2
1 53 . 1 1 A 6 6 LEU C C 6 177.820 175.993 1.827 2
1 54 . 1 1 A 6 6 LEU CA C 6 55.507 55.020 0.487 2
1 55 . 1 1 A 6 6 LEU CB C 6 43.374 43.047 0.327 2
1 59 . 1 1 A 6 6 LEU N N 6 121.233 122.828 -1.595 2
1 60 . 1 1 A 7 7 SER H H 7 9.433 8.801 0.632 2
1 61 . 1 1 A 7 7 SER HA H 7 4.638 4.643 -0.005 2
1 64 . 1 1 A 7 7 SER C C 7 174.120 175.003 -0.883 2
1 65 . 1 1 A 7 7 SER CA C 7 57.962 58.370 -0.408 2
1 66 . 1 1 A 7 7 SER CB C 7 64.197 64.173 0.024 2
1 67 . 1 1 A 7 7 SER N N 7 122.977 121.050 1.927 2
1 68 . 1 1 A 8 8 TYR H H 8 9.764 9.183 0.581 2
1 69 . 1 1 A 8 8 TYR HA H 8 4.732 4.254 0.478 2
1 76 . 1 1 A 8 8 TYR C C 8 177.206 177.656 -0.450 2
1 77 . 1 1 A 8 8 TYR CA C 8 58.762 61.809 -3.047 2
1 78 . 1 1 A 8 8 TYR CB C 8 36.605 38.870 -2.265 2
1 83 . 1 1 A 8 8 TYR N N 8 123.312 124.858 -1.546 2
1 84 . 1 1 A 9 9 GLY H H 9 10.131 8.344 1.787 2
1 85 . 1 1 A 9 9 GLY HA2 H 9 3.983 3.602 0.381 2
1 86 . 1 1 A 9 9 GLY HA3 H 9 3.423 3.695 -0.272 2
1 87 . 1 1 A 9 9 GLY C C 9 175.163 176.175 -1.012 2
1 88 . 1 1 A 9 9 GLY CA C 9 47.153 47.326 -0.173 2
1 89 . 1 1 A 9 9 GLY N N 9 107.177 105.843 1.334 2
1 90 . 1 1 A 10 10 GLU H H 10 7.876 7.975 -0.099 2
1 91 . 1 1 A 10 10 GLU HA H 10 4.107 4.093 0.014 2
1 96 . 1 1 A 10 10 GLU C C 10 179.924 178.924 1.000 2
1 97 . 1 1 A 10 10 GLU CA C 10 58.890 59.430 -0.540 2
1 98 . 1 1 A 10 10 GLU CB C 10 29.750 29.406 0.344 2
1 100 . 1 1 A 10 10 GLU N N 10 122.219 121.798 0.421 2
1 101 . 1 1 A 11 11 TYR H H 11 8.384 8.199 0.185 2
1 102 . 1 1 A 11 11 TYR HA H 11 4.305 4.223 0.082 2
1 107 . 1 1 A 11 11 TYR C C 11 176.854 177.095 -0.241 2
1 108 . 1 1 A 11 11 TYR CA C 11 61.040 61.440 -0.400 2
1 109 . 1 1 A 11 11 TYR CB C 11 37.593 39.008 -1.415 2
1 112 . 1 1 A 11 11 TYR N N 11 120.809 122.844 -2.035 2
1 113 . 1 1 A 12 12 LEU H H 12 9.027 8.258 0.769 2
1 114 . 1 1 A 12 12 LEU HA H 12 3.778 3.802 -0.024 2
1 124 . 1 1 A 12 12 LEU C C 12 178.621 179.447 -0.826 2
1 125 . 1 1 A 12 12 LEU CA C 12 57.534 57.511 0.023 2
1 126 . 1 1 A 12 12 LEU CB C 12 41.957 40.965 0.992 2
1 130 . 1 1 A 12 12 LEU N N 12 121.080 119.107 1.973 2
1 131 . 1 1 A 13 13 GLU H H 13 7.614 8.034 -0.420 2
1 132 . 1 1 A 13 13 GLU HA H 13 4.102 4.060 0.042 2
1 137 . 1 1 A 13 13 GLU C C 13 178.449 179.140 -0.691 2
1 138 . 1 1 A 13 13 GLU CA C 13 59.609 59.550 0.059 2
1 139 . 1 1 A 13 13 GLU CB C 13 29.124 29.589 -0.465 2
1 141 . 1 1 A 13 13 GLU N N 13 118.475 120.604 -2.129 2
1 142 . 1 1 A 14 14 SER H H 14 7.329 7.700 -0.371 2
1 143 . 1 1 A 14 14 SER HA H 14 4.358 4.226 0.132 2
1 146 . 1 1 A 14 14 SER C C 14 176.794 176.417 0.377 2
1 147 . 1 1 A 14 14 SER CA C 14 61.064 61.823 -0.759 2
1 148 . 1 1 A 14 14 SER CB C 14 62.513 62.990 -0.477 2
1 149 . 1 1 A 14 14 SER N N 14 115.209 115.642 -0.433 2
1 150 . 1 1 A 15 15 TRP H H 15 8.870 8.097 0.773 2
1 151 . 1 1 A 15 15 TRP HA H 15 4.005 4.287 -0.282 2
1 160 . 1 1 A 15 15 TRP C C 15 177.547 177.881 -0.334 2
1 161 . 1 1 A 15 15 TRP CA C 15 61.210 61.244 -0.034 2
1 162 . 1 1 A 15 15 TRP CB C 15 27.341 29.223 -1.882 2
1 168 . 1 1 A 15 15 TRP N N 15 124.998 123.801 1.197 2
1 170 . 1 1 A 16 16 PHE H H 16 9.087 8.215 0.872 2
1 171 . 1 1 A 16 16 PHE HA H 16 3.210 3.749 -0.539 2
1 179 . 1 1 A 16 16 PHE C C 16 175.909 177.247 -1.338 2
1 180 . 1 1 A 16 16 PHE CA C 16 61.473 61.391 0.082 2
1 181 . 1 1 A 16 16 PHE CB C 16 38.506 39.082 -0.576 2
1 187 . 1 1 A 16 16 PHE N N 16 119.825 121.069 -1.244 2
1 188 . 1 1 A 17 17 ASN H H 17 7.768 8.071 -0.303 2
1 189 . 1 1 A 17 17 ASN HA H 17 4.078 4.123 -0.045 2
1 194 . 1 1 A 17 17 ASN C C 17 176.604 177.632 -1.028 2
1 195 . 1 1 A 17 17 ASN CA C 17 55.621 56.149 -0.528 2
1 196 . 1 1 A 17 17 ASN CB C 17 37.830 38.186 -0.356 2
1 197 . 1 1 A 17 17 ASN N N 17 115.600 117.150 -1.550 2
1 199 . 1 1 A 18 18 THR H H 18 7.454 7.361 0.093 2
1 200 . 1 1 A 18 18 THR HA H 18 4.147 3.954 0.193 2
1 205 . 1 1 A 18 18 THR C C 18 175.692 176.014 -0.322 2
1 206 . 1 1 A 18 18 THR CA C 18 64.679 65.575 -0.896 2
1 207 . 1 1 A 18 18 THR CB C 18 68.940 68.428 0.512 2
1 209 . 1 1 A 18 18 THR N N 18 113.049 115.628 -2.579 2
1 210 . 1 1 A 19 19 LYS H H 19 7.918 7.565 0.353 2
1 211 . 1 1 A 19 19 LYS HA H 19 3.791 3.645 0.146 2
1 220 . 1 1 A 19 19 LYS C C 19 178.120 178.819 -0.699 2
1 221 . 1 1 A 19 19 LYS CA C 19 55.985 58.777 -2.792 2
1 222 . 1 1 A 19 19 LYS CB C 19 31.130 31.063 0.067 2
1 226 . 1 1 A 19 19 LYS N N 19 122.614 120.509 2.105 2
1 227 . 1 1 A 20 20 ARG H H 20 7.845 7.590 0.255 2
1 228 . 1 1 A 20 20 ARG HA H 20 3.396 3.799 -0.403 2
1 236 . 1 1 A 20 20 ARG C C 20 175.601 178.350 -2.749 2
1 237 . 1 1 A 20 20 ARG CA C 20 58.182 58.599 -0.417 2
1 238 . 1 1 A 20 20 ARG CB C 20 28.045 29.773 -1.728 2
1 241 . 1 1 A 20 20 ARG N N 20 116.282 118.149 -1.867 2
1 243 . 1 1 A 21 21 HIS H H 21 7.163 7.571 -0.408 2
1 244 . 1 1 A 21 21 HIS HA H 21 4.500 4.270 0.230 2
1 249 . 1 1 A 21 21 HIS C C 21 175.618 176.590 -0.972 2
1 250 . 1 1 A 21 21 HIS CA C 21 56.912 59.066 -2.154 2
1 251 . 1 1 A 21 21 HIS CB C 21 29.400 29.825 -0.425 2
1 254 . 1 1 A 21 21 HIS N N 21 115.452 118.363 -2.911 2
1 255 . 1 1 A 22 22 SER H H 22 7.951 7.621 0.330 2
1 256 . 1 1 A 22 22 SER HA H 22 4.573 4.366 0.207 2
1 259 . 1 1 A 22 22 SER C C 22 173.948 174.511 -0.563 2
1 260 . 1 1 A 22 22 SER CA C 22 58.589 60.347 -1.758 2
1 261 . 1 1 A 22 22 SER CB C 22 64.228 64.024 0.204 2
1 262 . 1 1 A 22 22 SER N N 22 113.209 113.274 -0.065 2
1 263 . 1 1 A 23 23 VAL H H 23 7.179 7.307 -0.128 2
1 264 . 1 1 A 23 23 VAL HA H 23 4.626 4.412 0.214 2
1 272 . 1 1 A 23 23 VAL C C 23 175.397 175.877 -0.480 2
1 273 . 1 1 A 23 23 VAL CA C 23 59.556 60.951 -1.395 2
1 274 . 1 1 A 23 23 VAL CB C 23 33.810 33.947 -0.137 2
1 277 . 1 1 A 23 23 VAL N N 23 113.108 116.213 -3.105 2
1 278 . 1 1 A 24 24 GLY H H 24 8.189 8.283 -0.094 2
1 279 . 1 1 A 24 24 GLY HA2 H 24 4.074 4.025 0.049 2
1 280 . 1 1 A 24 24 GLY HA3 H 24 4.195 4.048 0.147 2
1 281 . 1 1 A 24 24 GLY C C 24 174.037 174.681 -0.644 2
1 282 . 1 1 A 24 24 GLY CA C 24 44.452 44.930 -0.478 2
1 283 . 1 1 A 24 24 GLY N N 24 108.374 109.165 -0.791 2
1 284 . 1 1 A 25 25 ILE H H 25 8.331 8.629 -0.298 2
1 285 . 1 1 A 25 25 ILE HA H 25 3.839 3.643 0.196 2
1 295 . 1 1 A 25 25 ILE C C 25 178.042 177.753 0.289 2
1 296 . 1 1 A 25 25 ILE CA C 25 64.238 64.441 -0.203 2
1 297 . 1 1 A 25 25 ILE CB C 25 37.931 37.572 0.359 2
1 301 . 1 1 A 25 25 ILE N N 25 119.895 120.346 -0.451 2
1 302 . 1 1 A 26 26 GLN H H 26 8.545 8.520 0.025 2
1 303 . 1 1 A 26 26 GLN HA H 26 4.129 4.054 0.075 2
1 310 . 1 1 A 26 26 GLN C C 26 178.454 178.022 0.432 2
1 311 . 1 1 A 26 26 GLN CA C 26 58.772 58.174 0.598 2
1 312 . 1 1 A 26 26 GLN CB C 26 27.346 27.959 -0.613 2
1 314 . 1 1 A 26 26 GLN N N 26 120.013 119.957 0.056 2
1 316 . 1 1 A 27 27 THR H H 27 7.944 7.945 -0.001 2
1 317 . 1 1 A 27 27 THR HA H 27 3.953 3.918 0.035 2
1 322 . 1 1 A 27 27 THR C C 27 175.818 176.128 -0.310 2
1 323 . 1 1 A 27 27 THR CA C 27 65.855 66.298 -0.443 2
1 324 . 1 1 A 27 27 THR CB C 27 68.127 68.564 -0.437 2
1 326 . 1 1 A 27 27 THR N N 27 117.645 116.803 0.842 2
1 327 . 1 1 A 28 28 ALA H H 28 8.593 8.199 0.394 2
1 328 . 1 1 A 28 28 ALA HA H 28 3.899 4.083 -0.184 2
1 332 . 1 1 A 28 28 ALA C C 28 178.515 179.724 -1.209 2
1 333 . 1 1 A 28 28 ALA CA C 28 55.742 55.549 0.193 2
1 334 . 1 1 A 28 28 ALA CB C 28 17.513 18.236 -0.723 2
1 335 . 1 1 A 28 28 ALA N N 28 123.917 123.562 0.355 2
1 336 . 1 1 A 29 29 LYS H H 29 7.800 7.845 -0.045 2
1 337 . 1 1 A 29 29 LYS HA H 29 3.982 3.990 -0.008 2
1 346 . 1 1 A 29 29 LYS C C 29 179.527 178.982 0.545 2
1 347 . 1 1 A 29 29 LYS CA C 29 59.761 59.533 0.228 2
1 348 . 1 1 A 29 29 LYS CB C 29 32.223 32.282 -0.059 2
1 352 . 1 1 A 29 29 LYS N N 29 117.474 118.869 -1.395 2
1 353 . 1 1 A 30 30 VAL H H 30 7.591 7.457 0.134 2
1 354 . 1 1 A 30 30 VAL HA H 30 3.503 3.345 0.158 2
1 362 . 1 1 A 30 30 VAL C C 30 178.389 177.724 0.665 2
1 363 . 1 1 A 30 30 VAL CA C 30 65.640 65.831 -0.191 2
1 364 . 1 1 A 30 30 VAL CB C 30 31.644 31.549 0.095 2
1 367 . 1 1 A 30 30 VAL N N 30 121.749 120.372 1.377 2
1 368 . 1 1 A 31 31 LEU H H 31 8.333 8.142 0.191 2
1 369 . 1 1 A 31 31 LEU HA H 31 4.074 4.091 -0.017 2
1 379 . 1 1 A 31 31 LEU C C 31 177.780 179.149 -1.369 2
1 380 . 1 1 A 31 31 LEU CA C 31 58.157 58.166 -0.009 2
1 381 . 1 1 A 31 31 LEU CB C 31 42.230 41.310 0.920 2
1 385 . 1 1 A 31 31 LEU N N 31 120.901 119.860 1.041 2
1 386 . 1 1 A 32 32 LYS H H 32 8.562 8.014 0.548 2
1 387 . 1 1 A 32 32 LYS HA H 32 3.290 3.857 -0.567 2
1 395 . 1 1 A 32 32 LYS C C 32 178.037 178.757 -0.720 2
1 396 . 1 1 A 32 32 LYS CA C 32 58.911 59.566 -0.654 2
1 397 . 1 1 A 32 32 LYS CB C 32 31.605 31.372 0.233 2
1 401 . 1 1 A 32 32 LYS N N 32 119.075 119.489 -0.414 2
1 402 . 1 1 A 33 33 GLY H H 33 7.694 7.880 -0.186 2
1 403 . 1 1 A 33 33 GLY HA2 H 33 3.949 3.570 0.379 2
1 404 . 1 1 A 33 33 GLY HA3 H 33 3.826 3.652 0.174 2
1 405 . 1 1 A 33 33 GLY C C 33 177.101 176.489 0.612 2
1 406 . 1 1 A 33 33 GLY CA C 33 46.928 47.023 -0.095 2
1 407 . 1 1 A 33 33 GLY N N 33 105.282 106.759 -1.477 2
1 408 . 1 1 A 34 34 TYR H H 34 8.015 7.563 0.452 2
1 409 . 1 1 A 34 34 TYR HA H 34 4.558 4.687 -0.129 2
1 416 . 1 1 A 34 34 TYR C C 34 179.611 178.123 1.488 2
1 417 . 1 1 A 34 34 TYR CA C 34 59.349 60.133 -0.784 2
1 418 . 1 1 A 34 34 TYR CB C 34 37.344 38.247 -0.903 2
1 423 . 1 1 A 34 34 TYR N N 34 121.781 121.795 -0.014 2
1 424 . 1 1 A 35 35 LEU H H 35 8.689 8.167 0.522 2
1 425 . 1 1 A 35 35 LEU HA H 35 3.977 3.876 0.101 2
1 435 . 1 1 A 35 35 LEU C C 35 177.081 179.016 -1.935 2
1 436 . 1 1 A 35 35 LEU CA C 35 59.155 58.439 0.716 2
1 437 . 1 1 A 35 35 LEU CB C 35 41.103 41.715 -0.612 2
1 441 . 1 1 A 35 35 LEU N N 35 120.392 120.599 -0.207 2
1 442 . 1 1 A 36 36 ASN H H 36 8.721 8.406 0.315 2
1 443 . 1 1 A 36 36 ASN HA H 36 4.435 4.450 -0.015 2
1 448 . 1 1 A 36 36 ASN C C 36 176.792 177.675 -0.883 2
1 449 . 1 1 A 36 36 ASN CA C 36 55.642 55.815 -0.172 2
1 450 . 1 1 A 36 36 ASN CB C 36 38.319 37.638 0.681 2
1 451 . 1 1 A 36 36 ASN N N 36 114.623 116.509 -1.886 2
1 453 . 1 1 A 37 37 SER H H 37 8.511 7.908 0.603 2
1 454 . 1 1 A 37 37 SER HA H 37 4.642 4.320 0.322 2
1 457 . 1 1 A 37 37 SER C C 37 175.039 176.226 -1.187 2
1 458 . 1 1 A 37 37 SER CA C 37 59.825 61.358 -1.533 2
1 459 . 1 1 A 37 37 SER CB C 37 64.056 63.118 0.938 2
1 460 . 1 1 A 37 37 SER N N 37 110.941 115.543 -4.602 2
1 461 . 1 1 A 38 38 ARG H H 38 7.242 8.025 -0.783 2
1 462 . 1 1 A 38 38 ARG HA H 38 4.919 4.443 0.476 2
1 469 . 1 1 A 38 38 ARG C C 38 176.514 178.365 -1.851 2
1 470 . 1 1 A 38 38 ARG CA C 38 56.687 57.997 -1.310 2
1 471 . 1 1 A 38 38 ARG CB C 38 32.434 31.256 1.178 2
1 474 . 1 1 A 38 38 ARG N N 38 117.062 120.446 -3.384 2
1 475 . 1 1 A 39 39 ILE H H 39 8.462 7.954 0.508 2
1 476 . 1 1 A 39 39 ILE HA H 39 3.618 3.871 -0.253 2
1 486 . 1 1 A 39 39 ILE C C 39 176.267 178.342 -2.075 2
1 487 . 1 1 A 39 39 ILE CA C 39 66.134 64.944 1.190 2
1 488 . 1 1 A 39 39 ILE CB C 39 39.787 37.693 2.094 2
1 492 . 1 1 A 39 39 ILE N N 39 121.214 120.465 0.749 2
1 493 . 1 1 A 40 40 ILE H H 40 9.339 8.195 1.144 2
1 494 . 1 1 A 40 40 ILE HA H 40 3.401 3.751 -0.350 2
1 504 . 1 1 A 40 40 ILE CA C 40 67.844 66.355 1.489 2
1 505 . 1 1 A 40 40 ILE CB C 40 34.406 35.462 -1.056 2
1 509 . 1 1 A 40 40 ILE N N 40 119.695 121.510 -1.815 2
1 510 . 1 1 A 41 41 PRO HA H 41 4.314 4.414 -0.100 2
1 517 . 1 1 A 41 41 PRO C C 41 177.418 178.486 -1.068 2
1 518 . 1 1 A 41 41 PRO CA C 41 65.912 65.399 0.513 2
1 519 . 1 1 A 41 41 PRO CB C 41 30.686 31.215 -0.529 2
1 522 . 1 1 A 42 42 SER H H 42 6.857 8.093 -1.236 2
1 523 . 1 1 A 42 42 SER HA H 42 4.558 4.492 0.066 2
1 526 . 1 1 A 42 42 SER C C 42 174.813 176.091 -1.278 2
1 527 . 1 1 A 42 42 SER CA C 42 61.279 60.724 0.554 2
1 528 . 1 1 A 42 42 SER CB C 42 64.285 64.141 0.144 2
1 529 . 1 1 A 42 42 SER N N 42 108.994 113.115 -4.121 2
1 530 . 1 1 A 43 43 LEU H H 43 8.230 8.107 0.123 2
1 531 . 1 1 A 43 43 LEU HA H 43 4.572 4.352 0.220 2
1 541 . 1 1 A 43 43 LEU C C 43 177.301 178.804 -1.503 2
1 542 . 1 1 A 43 43 LEU CA C 43 54.113 55.442 -1.329 2
1 543 . 1 1 A 43 43 LEU CB C 43 44.800 42.367 2.433 2
1 547 . 1 1 A 43 43 LEU N N 43 118.715 120.207 -1.492 2
1 548 . 1 1 A 44 44 GLY H H 44 8.498 8.362 0.136 2
1 549 . 1 1 A 44 44 GLY HA2 H 44 4.010 3.784 0.226 2
1 550 . 1 1 A 44 44 GLY HA3 H 44 3.613 3.830 -0.217 2
1 551 . 1 1 A 44 44 GLY C C 44 174.178 176.039 -1.861 2
1 552 . 1 1 A 44 44 GLY CA C 44 46.271 47.368 -1.097 2
1 553 . 1 1 A 44 44 GLY N N 44 105.371 107.395 -2.024 2
1 554 . 1 1 A 45 45 ASN H H 45 8.385 7.857 0.528 2
1 555 . 1 1 A 45 45 ASN HA H 45 4.789 4.668 0.121 2
1 560 . 1 1 A 45 45 ASN C C 45 175.386 176.216 -0.830 2
1 561 . 1 1 A 45 45 ASN CA C 45 53.144 54.876 -1.732 2
1 562 . 1 1 A 45 45 ASN CB C 45 37.928 38.608 -0.680 2
1 563 . 1 1 A 45 45 ASN N N 45 114.387 118.475 -4.088 2
1 565 . 1 1 A 46 46 ILE H H 46 7.465 7.478 -0.013 2
1 566 . 1 1 A 46 46 ILE HA H 46 3.856 4.074 -0.218 2
1 576 . 1 1 A 46 46 ILE C C 46 175.997 176.227 -0.230 2
1 577 . 1 1 A 46 46 ILE CA C 46 60.853 61.731 -0.878 2
1 578 . 1 1 A 46 46 ILE CB C 46 38.042 38.358 -0.316 2
1 582 . 1 1 A 46 46 ILE N N 46 123.998 120.774 3.224 2
1 583 . 1 1 A 47 47 LYS H H 47 8.717 8.676 0.041 2
1 584 . 1 1 A 47 47 LYS HA H 47 4.249 4.322 -0.073 2
1 591 . 1 1 A 47 47 LYS C C 47 177.583 177.668 -0.085 2
1 592 . 1 1 A 47 47 LYS CA C 47 56.320 56.837 -0.517 2
1 593 . 1 1 A 47 47 LYS CB C 47 30.393 32.838 -2.445 2
1 596 . 1 1 A 47 47 LYS N N 47 126.114 124.750 1.364 2
1 597 . 1 1 A 48 48 LEU H H 48 8.323 8.527 -0.204 2
1 598 . 1 1 A 48 48 LEU HA H 48 3.691 4.000 -0.309 2
1 608 . 1 1 A 48 48 LEU C C 48 177.274 178.310 -1.036 2
1 609 . 1 1 A 48 48 LEU CA C 48 58.443 58.403 0.040 2
1 610 . 1 1 A 48 48 LEU CB C 48 42.282 41.265 1.017 2
1 614 . 1 1 A 48 48 LEU N N 48 125.857 126.021 -0.164 2
1 615 . 1 1 A 49 49 ALA H H 49 8.929 7.928 1.001 2
1 616 . 1 1 A 49 49 ALA HA H 49 4.067 4.010 0.057 2
1 620 . 1 1 A 49 49 ALA C C 49 177.468 178.711 -1.243 2
1 621 . 1 1 A 49 49 ALA CA C 49 53.092 54.646 -1.554 2
1 622 . 1 1 A 49 49 ALA CB C 49 18.562 18.217 0.345 2
1 623 . 1 1 A 49 49 ALA N N 49 115.543 120.267 -4.724 2
1 624 . 1 1 A 50 50 LYS H H 50 7.684 7.464 0.220 2
1 625 . 1 1 A 50 50 LYS HA H 50 4.395 4.279 0.116 2
1 634 . 1 1 A 50 50 LYS C C 50 174.958 176.754 -1.796 2
1 635 . 1 1 A 50 50 LYS CA C 50 53.977 56.917 -2.940 2
1 636 . 1 1 A 50 50 LYS CB C 50 32.645 32.653 -0.008 2
1 640 . 1 1 A 50 50 LYS N N 50 114.788 115.071 -0.283 2
1 641 . 1 1 A 51 51 LEU H H 51 6.776 7.064 -0.288 2
1 642 . 1 1 A 51 51 LEU HA H 51 4.569 4.263 0.306 2
1 652 . 1 1 A 51 51 LEU C C 51 177.953 175.677 2.276 2
1 653 . 1 1 A 51 51 LEU CA C 51 55.318 54.941 0.377 2
1 654 . 1 1 A 51 51 LEU CB C 51 43.182 40.948 2.234 2
1 658 . 1 1 A 51 51 LEU N N 51 121.408 121.994 -0.586 2
1 659 . 1 1 A 52 52 THR H H 52 10.680 7.791 2.889 2
1 660 . 1 1 A 52 52 THR HA H 52 4.938 4.576 0.362 2
1 665 . 1 1 A 52 52 THR C C 52 175.553 174.719 0.834 2
1 666 . 1 1 A 52 52 THR CA C 52 59.740 59.946 -0.206 2
1 667 . 1 1 A 52 52 THR CB C 52 73.557 70.904 2.653 2
1 669 . 1 1 A 52 52 THR N N 52 119.481 119.379 0.102 2
1 670 . 1 1 A 53 53 SER H H 53 9.278 9.026 0.252 2
1 671 . 1 1 A 53 53 SER HA H 53 4.261 4.146 0.115 2
1 674 . 1 1 A 53 53 SER C C 53 176.990 176.351 0.639 2
1 675 . 1 1 A 53 53 SER CA C 53 61.025 61.226 -0.201 2
1 676 . 1 1 A 53 53 SER CB C 53 62.312 62.950 -0.638 2
1 677 . 1 1 A 53 53 SER N N 53 116.343 121.234 -4.891 2
1 678 . 1 1 A 54 54 LEU H H 54 7.808 8.020 -0.212 2
1 679 . 1 1 A 54 54 LEU HA H 54 4.229 4.053 0.176 2
1 688 . 1 1 A 54 54 LEU C C 54 178.505 178.711 -0.206 2
1 689 . 1 1 A 54 54 LEU CA C 54 57.719 57.951 -0.232 2
1 690 . 1 1 A 54 54 LEU CB C 54 40.997 41.682 -0.685 2
1 694 . 1 1 A 54 54 LEU N N 54 126.055 123.283 2.772 2
1 695 . 1 1 A 55 55 HIS H H 55 7.798 8.089 -0.291 2
1 696 . 1 1 A 55 55 HIS HA H 55 4.311 4.332 -0.021 2
1 701 . 1 1 A 55 55 HIS C C 55 180.044 177.748 2.296 2
1 702 . 1 1 A 55 55 HIS CA C 55 60.583 59.666 0.917 2
1 703 . 1 1 A 55 55 HIS CB C 55 31.445 29.730 1.715 2
1 706 . 1 1 A 55 55 HIS N N 55 118.683 117.993 0.690 2
1 707 . 1 1 A 56 56 MET H H 56 7.375 8.015 -0.640 2
1 708 . 1 1 A 56 56 MET HA H 56 4.513 4.075 0.438 2
1 716 . 1 1 A 56 56 MET C C 56 177.169 178.468 -1.299 2
1 717 . 1 1 A 56 56 MET CA C 56 55.823 59.067 -3.244 2
1 718 . 1 1 A 56 56 MET CB C 56 31.303 32.789 -1.486 2
1 721 . 1 1 A 56 56 MET N N 56 114.530 117.739 -3.209 2
1 722 . 1 1 A 57 57 GLN H H 57 8.387 8.235 0.152 2
1 723 . 1 1 A 57 57 GLN HA H 57 3.981 4.007 -0.026 2
1 730 . 1 1 A 57 57 GLN C C 57 178.033 178.430 -0.397 2
1 731 . 1 1 A 57 57 GLN CA C 57 57.922 59.197 -1.274 2
1 732 . 1 1 A 57 57 GLN CB C 57 29.012 28.472 0.540 2
1 734 . 1 1 A 57 57 GLN N N 57 120.713 119.961 0.752 2
1 736 . 1 1 A 58 58 ASN H H 58 8.765 8.422 0.343 2
1 737 . 1 1 A 58 58 ASN HA H 58 4.539 4.477 0.062 2
1 742 . 1 1 A 58 58 ASN C C 58 178.084 177.629 0.455 2
1 743 . 1 1 A 58 58 ASN CA C 58 55.345 56.229 -0.884 2
1 744 . 1 1 A 58 58 ASN CB C 58 36.924 38.163 -1.239 2
1 745 . 1 1 A 58 58 ASN N N 58 117.390 117.826 -0.436 2
1 747 . 1 1 A 59 59 TYR H H 59 8.239 7.916 0.323 2
1 748 . 1 1 A 59 59 TYR HA H 59 4.586 4.170 0.416 2
1 755 . 1 1 A 59 59 TYR C C 59 178.015 176.923 1.092 2
1 756 . 1 1 A 59 59 TYR CA C 59 60.779 61.523 -0.744 2
1 757 . 1 1 A 59 59 TYR CB C 59 38.047 38.687 -0.640 2
1 762 . 1 1 A 59 59 TYR N N 59 122.335 122.886 -0.551 2
1 763 . 1 1 A 60 60 VAL H H 60 8.416 8.434 -0.018 2
1 764 . 1 1 A 60 60 VAL HA H 60 3.244 3.532 -0.288 2
1 772 . 1 1 A 60 60 VAL C C 60 177.309 178.223 -0.914 2
1 773 . 1 1 A 60 60 VAL CA C 60 67.022 66.451 0.571 2
1 774 . 1 1 A 60 60 VAL CB C 60 30.929 31.396 -0.467 2
1 777 . 1 1 A 60 60 VAL N N 60 119.842 119.538 0.304 2
1 778 . 1 1 A 61 61 ASN H H 61 8.264 8.175 0.089 2
1 779 . 1 1 A 61 61 ASN HA H 61 4.305 4.452 -0.147 2
1 784 . 1 1 A 61 61 ASN C C 61 177.263 177.883 -0.620 2
1 785 . 1 1 A 61 61 ASN CA C 61 55.548 56.313 -0.766 2
1 786 . 1 1 A 61 61 ASN CB C 61 36.645 37.710 -1.065 2
1 787 . 1 1 A 61 61 ASN N N 61 119.103 119.889 -0.786 2
1 789 . 1 1 A 62 62 SER H H 62 8.143 7.785 0.358 2
1 790 . 1 1 A 62 62 SER HA H 62 4.343 4.169 0.174 2
1 793 . 1 1 A 62 62 SER C C 62 176.409 176.863 -0.454 2
1 794 . 1 1 A 62 62 SER CA C 62 61.612 61.677 -0.065 2
1 795 . 1 1 A 62 62 SER CB C 62 62.219 62.843 -0.624 2
1 796 . 1 1 A 62 62 SER N N 62 118.254 115.665 2.589 2
1 797 . 1 1 A 63 63 LEU H H 63 7.664 7.985 -0.321 2
1 798 . 1 1 A 63 63 LEU HA H 63 4.003 3.860 0.143 2
1 808 . 1 1 A 63 63 LEU C C 63 178.748 178.953 -0.205 2
1 809 . 1 1 A 63 63 LEU CA C 63 57.171 57.917 -0.746 2
1 810 . 1 1 A 63 63 LEU CB C 63 41.134 41.188 -0.054 2
1 814 . 1 1 A 63 63 LEU N N 63 123.812 121.831 1.981 2
1 815 . 1 1 A 64 64 ARG H H 64 7.969 7.640 0.329 2
1 816 . 1 1 A 64 64 ARG HA H 64 4.038 3.908 0.130 2
1 824 . 1 1 A 64 64 ARG C C 64 180.797 178.392 2.405 2
1 825 . 1 1 A 64 64 ARG CA C 64 58.598 59.431 -0.833 2
1 826 . 1 1 A 64 64 ARG CB C 64 28.849 29.782 -0.933 2
1 829 . 1 1 A 64 64 ARG N N 64 120.376 120.487 -0.111 2
1 831 . 1 1 A 65 65 ASP H H 65 8.465 7.956 0.509 2
1 832 . 1 1 A 65 65 ASP HA H 65 4.408 4.402 0.006 2
1 835 . 1 1 A 65 65 ASP C C 65 177.336 178.382 -1.046 2
1 836 . 1 1 A 65 65 ASP CA C 65 56.957 56.827 0.130 2
1 837 . 1 1 A 65 65 ASP CB C 65 39.602 40.415 -0.813 2
1 838 . 1 1 A 65 65 ASP N N 65 122.402 119.530 2.872 2
1 839 . 1 1 A 66 66 GLU H H 66 7.703 7.843 -0.140 2
1 840 . 1 1 A 66 66 GLU HA H 66 4.213 4.292 -0.079 2
1 845 . 1 1 A 66 66 GLU C C 66 176.586 177.246 -0.660 2
1 846 . 1 1 A 66 66 GLU CA C 66 56.974 56.358 0.616 2
1 847 . 1 1 A 66 66 GLU CB C 66 29.821 30.009 -0.188 2
1 849 . 1 1 A 66 66 GLU N N 66 119.076 116.518 2.558 2
1 850 . 1 1 A 67 67 GLY H H 67 7.861 7.764 0.097 2
1 851 . 1 1 A 67 67 GLY HA2 H 67 4.269 3.918 0.351 2
1 852 . 1 1 A 67 67 GLY HA3 H 67 3.731 3.922 -0.192 2
1 853 . 1 1 A 67 67 GLY C C 67 174.614 174.949 -0.335 2
1 854 . 1 1 A 67 67 GLY CA C 67 44.608 46.373 -1.765 2
1 855 . 1 1 A 67 67 GLY N N 67 105.730 109.549 -3.819 2
1 856 . 1 1 A 68 68 LEU H H 68 7.324 7.832 -0.508 2
1 857 . 1 1 A 68 68 LEU HA H 68 4.257 4.215 0.042 2
1 867 . 1 1 A 68 68 LEU C C 68 176.136 177.010 -0.874 2
1 868 . 1 1 A 68 68 LEU CA C 68 55.659 54.739 0.920 2
1 869 . 1 1 A 68 68 LEU CB C 68 41.874 42.013 -0.139 2
1 873 . 1 1 A 68 68 LEU N N 68 121.062 121.307 -0.245 2
1 874 . 1 1 A 69 69 LYS H H 69 8.368 8.468 -0.100 2
1 875 . 1 1 A 69 69 LYS HA H 69 4.281 4.445 -0.164 2
1 884 . 1 1 A 69 69 LYS C C 69 177.940 177.914 0.026 2
1 885 . 1 1 A 69 69 LYS CA C 69 55.412 55.837 -0.425 2
1 886 . 1 1 A 69 69 LYS CB C 69 32.761 33.352 -0.591 2
1 890 . 1 1 A 69 69 LYS N N 69 120.120 122.320 -2.200 2
1 891 . 1 1 A 70 70 ARG H H 70 9.095 8.832 0.263 2
1 892 . 1 1 A 70 70 ARG HA H 70 3.684 4.092 -0.408 2
1 900 . 1 1 A 70 70 ARG C C 70 177.712 178.618 -0.906 2
1 901 . 1 1 A 70 70 ARG CA C 70 60.216 58.364 1.852 2
1 902 . 1 1 A 70 70 ARG CB C 70 29.539 29.817 -0.278 2
1 905 . 1 1 A 70 70 ARG N N 70 123.339 119.524 3.815 2
1 907 . 1 1 A 71 71 GLY H H 71 8.985 8.286 0.699 2
1 908 . 1 1 A 71 71 GLY HA2 H 71 3.932 3.653 0.279 2
1 909 . 1 1 A 71 71 GLY HA3 H 71 3.905 3.656 0.249 2
1 910 . 1 1 A 71 71 GLY C C 71 176.324 175.807 0.517 2
1 911 . 1 1 A 71 71 GLY CA C 71 46.752 47.433 -0.681 2
1 912 . 1 1 A 71 71 GLY N N 71 104.509 109.047 -4.538 2
1 913 . 1 1 A 72 72 THR H H 72 7.295 7.971 -0.676 2
1 914 . 1 1 A 72 72 THR HA H 72 4.014 3.904 0.110 2
1 919 . 1 1 A 72 72 THR C C 72 175.135 176.065 -0.930 2
1 920 . 1 1 A 72 72 THR CA C 72 65.848 66.457 -0.609 2
1 921 . 1 1 A 72 72 THR CB C 72 68.160 68.273 -0.113 2
1 923 . 1 1 A 72 72 THR N N 72 118.617 117.465 1.152 2
1 924 . 1 1 A 73 73 ILE H H 73 7.883 7.927 -0.044 2
1 925 . 1 1 A 73 73 ILE HA H 73 3.258 3.558 -0.300 2
1 935 . 1 1 A 73 73 ILE C C 73 177.060 178.117 -1.057 2
1 936 . 1 1 A 73 73 ILE CA C 73 66.561 65.547 1.014 2
1 937 . 1 1 A 73 73 ILE CB C 73 37.339 37.681 -0.342 2
1 941 . 1 1 A 73 73 ILE N N 73 121.692 121.331 0.361 2
1 942 . 1 1 A 74 74 GLU H H 74 8.723 8.095 0.628 2
1 943 . 1 1 A 74 74 GLU HA H 74 3.807 3.920 -0.113 2
1 948 . 1 1 A 74 74 GLU C C 74 178.319 179.067 -0.748 2
1 949 . 1 1 A 74 74 GLU CA C 74 59.637 59.939 -0.302 2
1 950 . 1 1 A 74 74 GLU CB C 74 29.257 29.167 0.090 2
1 952 . 1 1 A 74 74 GLU N N 74 117.701 120.857 -3.156 2
1 953 . 1 1 A 75 75 LYS H H 75 7.361 7.528 -0.167 2
1 954 . 1 1 A 75 75 LYS HA H 75 3.958 4.066 -0.108 2
1 963 . 1 1 A 75 75 LYS C C 75 178.554 179.541 -0.987 2
1 964 . 1 1 A 75 75 LYS CA C 75 59.764 59.340 0.424 2
1 965 . 1 1 A 75 75 LYS CB C 75 32.314 32.286 0.028 2
1 969 . 1 1 A 75 75 LYS N N 75 118.734 118.533 0.201 2
1 970 . 1 1 A 76 76 ILE H H 76 7.713 7.452 0.261 2
1 971 . 1 1 A 76 76 ILE HA H 76 3.221 3.844 -0.623 2
1 981 . 1 1 A 76 76 ILE C C 76 177.504 178.252 -0.748 2
1 982 . 1 1 A 76 76 ILE CA C 76 65.796 64.508 1.288 2
1 983 . 1 1 A 76 76 ILE CB C 76 37.732 37.066 0.666 2
1 987 . 1 1 A 76 76 ILE N N 76 120.312 116.677 3.635 2
1 988 . 1 1 A 77 77 ILE H H 77 8.587 8.053 0.534 2
1 989 . 1 1 A 77 77 ILE HA H 77 3.778 3.614 0.164 2
1 999 . 1 1 A 77 77 ILE C C 77 177.074 177.900 -0.826 2
1 1000 . 1 1 A 77 77 ILE CA C 77 63.168 65.202 -2.034 2
1 1001 . 1 1 A 77 77 ILE CB C 77 36.617 37.460 -0.843 2
1 1005 . 1 1 A 77 77 ILE N N 77 118.978 121.477 -2.499 2
1 1006 . 1 1 A 78 78 LYS H H 78 8.050 7.824 0.226 2
1 1007 . 1 1 A 78 78 LYS HA H 78 3.925 4.040 -0.115 2
1 1016 . 1 1 A 78 78 LYS C C 78 178.291 179.249 -0.958 2
1 1017 . 1 1 A 78 78 LYS CA C 78 60.192 59.464 0.728 2
1 1018 . 1 1 A 78 78 LYS CB C 78 31.886 32.356 -0.470 2
1 1022 . 1 1 A 78 78 LYS N N 78 121.618 119.448 2.170 2
1 1023 . 1 1 A 79 79 VAL H H 79 7.619 7.712 -0.093 2
1 1024 . 1 1 A 79 79 VAL HA H 79 3.846 3.736 0.110 2
1 1032 . 1 1 A 79 79 VAL C C 79 177.712 178.296 -0.584 2
1 1033 . 1 1 A 79 79 VAL CA C 79 66.494 66.368 0.126 2
1 1034 . 1 1 A 79 79 VAL CB C 79 31.298 31.708 -0.410 2
1 1037 . 1 1 A 79 79 VAL N N 79 120.254 119.571 0.683 2
1 1038 . 1 1 A 80 80 ILE H H 80 7.885 8.127 -0.242 2
1 1039 . 1 1 A 80 80 ILE HA H 80 3.367 3.732 -0.365 2
1 1049 . 1 1 A 80 80 ILE C C 80 179.892 177.833 2.059 2
1 1050 . 1 1 A 80 80 ILE CA C 80 65.343 65.267 0.076 2
1 1051 . 1 1 A 80 80 ILE CB C 80 38.129 37.452 0.677 2
1 1055 . 1 1 A 80 80 ILE N N 80 119.666 120.484 -0.818 2
1 1056 . 1 1 A 81 81 ARG H H 81 9.384 8.419 0.965 2
1 1057 . 1 1 A 81 81 ARG HA H 81 3.834 3.946 -0.112 2
1 1065 . 1 1 A 81 81 ARG C C 81 178.204 179.132 -0.928 2
1 1066 . 1 1 A 81 81 ARG CA C 81 60.560 59.766 0.794 2
1 1067 . 1 1 A 81 81 ARG CB C 81 30.196 30.104 0.092 2
1 1070 . 1 1 A 81 81 ARG N N 81 121.030 120.270 0.760 2
1 1072 . 1 1 A 82 82 ASN H H 82 8.773 8.228 0.545 2
1 1073 . 1 1 A 82 82 ASN HA H 82 4.587 4.606 -0.019 2
1 1078 . 1 1 A 82 82 ASN C C 82 178.300 177.818 0.482 2
1 1079 . 1 1 A 82 82 ASN CA C 82 56.160 56.274 -0.114 2
1 1080 . 1 1 A 82 82 ASN CB C 82 38.464 38.844 -0.380 2
1 1081 . 1 1 A 82 82 ASN N N 82 118.483 118.631 -0.148 2
1 1083 . 1 1 A 83 83 SER H H 83 8.526 7.689 0.837 2
1 1084 . 1 1 A 83 83 SER HA H 83 2.765 3.253 -0.488 2
1 1087 . 1 1 A 83 83 SER C C 83 176.386 177.015 -0.629 2
1 1088 . 1 1 A 83 83 SER CA C 83 61.245 61.383 -0.138 2
1 1089 . 1 1 A 83 83 SER CB C 83 61.287 62.376 -1.089 2
1 1090 . 1 1 A 83 83 SER N N 83 118.286 115.364 2.922 2
1 1091 . 1 1 A 84 84 LEU H H 84 7.782 8.282 -0.500 2
1 1092 . 1 1 A 84 84 LEU HA H 84 4.221 4.022 0.199 2
1 1102 . 1 1 A 84 84 LEU C C 84 177.846 179.412 -1.566 2
1 1103 . 1 1 A 84 84 LEU CA C 84 57.166 57.712 -0.546 2
1 1104 . 1 1 A 84 84 LEU CB C 84 40.520 41.045 -0.525 2
1 1108 . 1 1 A 84 84 LEU N N 84 127.445 121.518 5.927 2
1 1109 . 1 1 A 85 85 GLU H H 85 8.264 8.441 -0.176 2
1 1110 . 1 1 A 85 85 GLU HA H 85 3.981 3.970 0.011 2
1 1115 . 1 1 A 85 85 GLU C C 85 179.288 179.247 0.041 2
1 1116 . 1 1 A 85 85 GLU CA C 85 59.025 59.970 -0.945 2
1 1117 . 1 1 A 85 85 GLU CB C 85 29.182 29.351 -0.169 2
1 1119 . 1 1 A 85 85 GLU N N 85 121.538 120.361 1.177 2
1 1120 . 1 1 A 86 86 HIS H H 86 7.683 8.097 -0.414 2
1 1121 . 1 1 A 86 86 HIS HA H 86 4.573 4.356 0.217 2
1 1125 . 1 1 A 86 86 HIS C C 86 175.484 177.637 -2.153 2
1 1126 . 1 1 A 86 86 HIS CA C 86 58.940 59.424 -0.484 2
1 1127 . 1 1 A 86 86 HIS CB C 86 29.267 30.036 -0.769 2
1 1129 . 1 1 A 86 86 HIS N N 86 117.087 120.450 -3.363 2
1 1130 . 1 1 A 87 87 ALA H H 87 7.197 8.127 -0.930 2
1 1131 . 1 1 A 87 87 ALA HA H 87 3.925 3.879 0.046 2
1 1135 . 1 1 A 87 87 ALA C C 87 179.038 180.230 -1.192 2
1 1136 . 1 1 A 87 87 ALA CA C 87 54.863 54.931 -0.068 2
1 1137 . 1 1 A 87 87 ALA CB C 87 17.034 18.252 -1.218 2
1 1138 . 1 1 A 87 87 ALA N N 87 121.510 120.881 0.629 2
1 1139 . 1 1 A 88 88 ILE H H 88 7.819 7.636 0.183 2
1 1140 . 1 1 A 88 88 ILE HA H 88 4.067 3.872 0.195 2
1 1150 . 1 1 A 88 88 ILE C C 88 180.846 177.443 3.403 2
1 1151 . 1 1 A 88 88 ILE CA C 88 64.021 65.256 -1.235 2
1 1152 . 1 1 A 88 88 ILE CB C 88 37.557 37.552 0.005 2
1 1156 . 1 1 A 88 88 ILE N N 88 120.898 119.350 1.548 2
1 1157 . 1 1 A 89 89 ASP H H 89 7.808 8.070 -0.262 2
1 1158 . 1 1 A 89 89 ASP HA H 89 4.437 4.333 0.104 2
1 1161 . 1 1 A 89 89 ASP C C 89 178.033 178.018 0.016 2
1 1162 . 1 1 A 89 89 ASP CA C 89 57.343 57.597 -0.254 2
1 1163 . 1 1 A 89 89 ASP CB C 89 39.689 41.663 -1.975 2
1 1164 . 1 1 A 89 89 ASP N N 89 125.174 121.364 3.810 2
1 1165 . 1 1 A 90 90 LEU H H 90 7.607 7.615 -0.008 2
1 1166 . 1 1 A 90 90 LEU HA H 90 4.198 4.204 -0.006 2
1 1176 . 1 1 A 90 90 LEU C C 90 175.416 175.952 -0.536 2
1 1177 . 1 1 A 90 90 LEU CA C 90 54.755 55.033 -0.278 2
1 1178 . 1 1 A 90 90 LEU CB C 90 42.960 41.968 0.992 2
1 1182 . 1 1 A 90 90 LEU N N 90 117.576 117.311 0.265 2
1 1183 . 1 1 A 91 91 GLU H H 91 8.143 7.916 0.227 2
1 1184 . 1 1 A 91 91 GLU HA H 91 4.005 4.062 -0.057 2
1 1189 . 1 1 A 91 91 GLU C C 91 175.792 176.145 -0.353 2
1 1190 . 1 1 A 91 91 GLU CA C 91 57.202 57.547 -0.345 2
1 1191 . 1 1 A 91 91 GLU CB C 91 26.125 26.845 -0.720 2
1 1193 . 1 1 A 91 91 GLU N N 91 113.620 115.106 -1.486 2
1 1194 . 1 1 A 92 92 LEU H H 92 8.290 7.946 0.344 2
1 1195 . 1 1 A 92 92 LEU HA H 92 4.216 4.126 0.090 2
1 1205 . 1 1 A 92 92 LEU C C 92 176.622 176.978 -0.356 2
1 1206 . 1 1 A 92 92 LEU CA C 92 56.410 56.644 -0.233 2
1 1207 . 1 1 A 92 92 LEU CB C 92 43.378 42.467 0.911 2
1 1211 . 1 1 A 92 92 LEU N N 92 116.868 119.378 -2.510 2
1 1212 . 1 1 A 93 93 ILE H H 93 6.988 6.928 0.060 2
1 1213 . 1 1 A 93 93 ILE HA H 93 4.580 4.598 -0.018 2
1 1223 . 1 1 A 93 93 ILE C C 93 175.145 175.610 -0.465 2
1 1224 . 1 1 A 93 93 ILE CA C 93 58.707 58.560 0.147 2
1 1225 . 1 1 A 93 93 ILE CB C 93 42.864 41.327 1.537 2
1 1229 . 1 1 A 93 93 ILE N N 93 107.565 114.018 -6.453 2
1 1230 . 1 1 A 94 94 THR H H 94 8.742 8.578 0.164 2
1 1231 . 1 1 A 94 94 THR HA H 94 4.489 4.391 0.097 2
1 1236 . 1 1 A 94 94 THR C C 94 173.875 174.236 -0.361 2
1 1237 . 1 1 A 94 94 THR CA C 94 61.842 62.667 -0.825 2
1 1238 . 1 1 A 94 94 THR CB C 94 69.972 69.535 0.437 2
1 1240 . 1 1 A 94 94 THR N N 94 107.904 113.943 -6.039 2
1 1241 . 1 1 A 95 95 LYS H H 95 7.294 7.563 -0.269 2
1 1242 . 1 1 A 95 95 LYS HA H 95 4.566 4.775 -0.209 2
1 1251 . 1 1 A 95 95 LYS C C 95 173.791 174.292 -0.502 2
1 1252 . 1 1 A 95 95 LYS CA C 95 54.533 55.612 -1.079 2
1 1253 . 1 1 A 95 95 LYS CB C 95 35.123 35.773 -0.650 2
1 1257 . 1 1 A 95 95 LYS N N 95 119.458 120.965 -1.507 2
1 1258 . 1 1 A 96 96 ASN H H 96 9.157 8.672 0.485 2
1 1259 . 1 1 A 96 96 ASN HA H 96 4.408 4.946 -0.538 2
1 1264 . 1 1 A 96 96 ASN C C 96 176.653 176.030 0.623 2
1 1265 . 1 1 A 96 96 ASN CA C 96 51.088 52.177 -1.089 2
1 1266 . 1 1 A 96 96 ASN CB C 96 37.292 39.221 -1.929 2
1 1267 . 1 1 A 96 96 ASN N N 96 121.031 124.075 -3.044 2
1 1269 . 1 1 A 97 97 VAL H H 97 8.193 8.412 -0.219 2
1 1270 . 1 1 A 97 97 VAL HA H 97 4.019 3.993 0.026 2
1 1278 . 1 1 A 97 97 VAL C C 97 175.089 176.290 -1.201 2
1 1279 . 1 1 A 97 97 VAL CA C 97 63.437 63.399 0.038 2
1 1280 . 1 1 A 97 97 VAL CB C 97 29.934 31.620 -1.686 2
1 1283 . 1 1 A 97 97 VAL N N 97 118.839 120.795 -1.956 2
1 1284 . 1 1 A 98 98 ALA H H 98 7.994 7.638 0.356 2
1 1285 . 1 1 A 98 98 ALA HA H 98 5.108 4.296 0.812 2
1 1289 . 1 1 A 98 98 ALA C C 98 178.033 179.167 -1.134 2
1 1290 . 1 1 A 98 98 ALA CA C 98 50.342 53.034 -2.692 2
1 1291 . 1 1 A 98 98 ALA CB C 98 19.659 19.020 0.639 2
1 1292 . 1 1 A 98 98 ALA N N 98 121.031 124.576 -3.545 2
1 1293 . 1 1 A 99 99 ALA H H 99 7.347 7.688 -0.341 2
1 1294 . 1 1 A 99 99 ALA HA H 99 3.818 4.033 -0.215 2
1 1298 . 1 1 A 99 99 ALA C C 99 177.712 178.834 -1.122 2
1 1299 . 1 1 A 99 99 ALA CA C 99 55.117 54.752 0.365 2
1 1300 . 1 1 A 99 99 ALA CB C 99 18.879 18.500 0.379 2
1 1301 . 1 1 A 99 99 ALA N N 99 122.816 120.419 2.397 2
1 1302 . 1 1 A 100 100 LYS H H 100 8.190 7.731 0.459 2
1 1303 . 1 1 A 100 100 LYS HA H 100 4.483 4.333 0.150 2
1 1312 . 1 1 A 100 100 LYS C C 100 175.899 176.604 -0.705 2
1 1313 . 1 1 A 100 100 LYS CA C 100 54.231 57.306 -3.075 2
1 1314 . 1 1 A 100 100 LYS CB C 100 32.066 32.860 -0.794 2
1 1318 . 1 1 A 100 100 LYS N N 100 113.197 115.271 -2.074 2
1 1319 . 1 1 A 101 101 THR H H 101 7.128 7.615 -0.487 2
1 1320 . 1 1 A 101 101 THR HA H 101 3.834 4.396 -0.562 2
1 1325 . 1 1 A 101 101 THR C C 101 173.255 173.752 -0.497 2
1 1326 . 1 1 A 101 101 THR CA C 101 64.392 62.365 2.027 2
1 1327 . 1 1 A 101 101 THR CB C 101 69.160 68.404 0.756 2
1 1329 . 1 1 A 101 101 THR N N 101 118.368 115.775 2.593 2
1 1330 . 1 1 A 102 102 LYS H H 102 8.753 8.510 0.243 2
1 1331 . 1 1 A 102 102 LYS HA H 102 4.438 4.747 -0.309 2
1 1340 . 1 1 A 102 102 LYS C C 102 175.627 175.829 -0.202 2
1 1341 . 1 1 A 102 102 LYS CA C 102 55.117 54.939 0.178 2
1 1342 . 1 1 A 102 102 LYS CB C 102 33.901 34.302 -0.401 2
1 1346 . 1 1 A 102 102 LYS N N 102 126.513 125.528 0.985 2
1 1347 . 1 1 A 103 103 LEU H H 103 8.602 8.289 0.313 2
1 1348 . 1 1 A 103 103 LEU HA H 103 4.486 4.439 0.047 2
1 1358 . 1 1 A 103 103 LEU CA C 103 52.233 53.063 -0.830 2
1 1359 . 1 1 A 103 103 LEU CB C 103 41.028 42.864 -1.837 2
1 1363 . 1 1 A 103 103 LEU N N 103 124.466 123.301 1.165 2
1 1364 . 1 1 A 104 104 PRO HA H 104 4.437 4.555 -0.118 2
1 1371 . 1 1 A 104 104 PRO C C 104 175.779 176.322 -0.543 2
1 1372 . 1 1 A 104 104 PRO CA C 104 62.322 62.881 -0.559 2
1 1373 . 1 1 A 104 104 PRO CB C 104 31.899 32.308 -0.409 2
1 1376 . 1 1 A 105 105 LYS H H 105 8.460 8.379 0.081 2
1 1377 . 1 1 A 105 105 LYS HA H 105 4.154 4.367 -0.213 2
1 1386 . 1 1 A 105 105 LYS C C 105 175.998 176.208 -0.210 2
1 1387 . 1 1 A 105 105 LYS CA C 105 56.480 55.834 0.646 2
1 1388 . 1 1 A 105 105 LYS CB C 105 32.909 32.099 0.810 2
1 1392 . 1 1 A 105 105 LYS N N 105 122.139 120.964 1.175 2
1 1393 . 1 1 A 106 106 ALA H H 106 8.448 8.422 0.025 2
1 1394 . 1 1 A 106 106 ALA HA H 106 4.309 4.623 -0.315 2
1 1398 . 1 1 A 106 106 ALA C C 106 176.828 176.361 0.467 2
1 1399 . 1 1 A 106 106 ALA CA C 106 51.862 51.427 0.435 2
1 1400 . 1 1 A 106 106 ALA CB C 106 19.323 20.292 -0.969 2
1 1401 . 1 1 A 106 106 ALA N N 106 125.278 126.739 -1.461 2
1 1402 . 1 1 A 107 107 ASP H H 107 8.428 8.124 0.304 2
1 1403 . 1 1 A 107 107 ASP HA H 107 4.574 4.858 -0.284 2
1 1406 . 1 1 A 107 107 ASP C C 107 175.951 175.185 0.766 2
1 1407 . 1 1 A 107 107 ASP CA C 107 54.214 53.720 0.494 2
1 1408 . 1 1 A 107 107 ASP CB C 107 41.141 42.181 -1.040 2
1 1409 . 1 1 A 107 107 ASP N N 107 120.771 118.850 1.921 2
1 1410 . 1 1 A 108 108 LYS H H 108 8.329 8.494 -0.165 2
1 1411 . 1 1 A 108 108 LYS HA H 108 4.203 4.631 -0.428 2
1 1420 . 1 1 A 108 108 LYS C C 108 176.483 175.773 0.710 2
1 1421 . 1 1 A 108 108 LYS CA C 108 56.831 55.436 1.395 2
1 1422 . 1 1 A 108 108 LYS CB C 108 32.648 33.687 -1.039 2
1 1426 . 1 1 A 108 108 LYS N N 108 120.727 121.452 -0.725 2
1 1427 . 1 1 A 109 109 GLU H H 109 8.447 8.571 -0.124 2
1 1428 . 1 1 A 109 109 GLU HA H 109 4.215 4.510 -0.295 2
1 1433 . 1 1 A 109 109 GLU C C 109 176.513 176.919 -0.406 2
1 1434 . 1 1 A 109 109 GLU CA C 109 56.936 56.149 0.787 2
1 1435 . 1 1 A 109 109 GLU CB C 109 29.833 30.453 -0.620 2
1 1437 . 1 1 A 109 109 GLU N N 109 121.471 122.579 -1.108 2
1 1438 . 1 1 A 110 110 GLU H H 110 8.352 8.606 -0.254 2
1 1439 . 1 1 A 110 110 GLU HA H 110 4.233 4.310 -0.077 2
1 1444 . 1 1 A 110 110 GLU C C 110 176.439 176.962 -0.523 2
1 1445 . 1 1 A 110 110 GLU CA C 110 56.681 57.293 -0.612 2
1 1446 . 1 1 A 110 110 GLU CB C 110 29.860 28.953 0.907 2
1 1448 . 1 1 A 110 110 GLU N N 110 121.559 121.862 -0.303 2
1 1449 . 1 1 A 111 111 LEU H H 111 8.145 7.928 0.217 2
1 1450 . 1 1 A 111 111 LEU HA H 111 4.251 4.165 0.086 2
1 1460 . 1 1 A 111 111 LEU C C 111 177.306 177.225 0.081 2
1 1461 . 1 1 A 111 111 LEU CA C 111 55.277 56.322 -1.045 2
1 1462 . 1 1 A 111 111 LEU CB C 111 42.054 41.286 0.768 2
1 1466 . 1 1 A 111 111 LEU N N 111 122.181 120.789 1.392 2
1 1467 . 1 1 A 112 112 GLU H H 112 8.212 7.889 0.323 2
1 1468 . 1 1 A 112 112 GLU N N 112 120.291 118.625 1.666 2
1 1469 . 1 1 A 114 114 HIS C C 114 176.070 174.729 1.341 2
1 1470 . 1 1 A 116 116 HIS H H 116 8.227 8.555 -0.328 2
1 1471 . 1 1 A 116 116 HIS C C 116 173.580 174.877 -1.297 2
1 1472 . 1 1 A 116 116 HIS N N 116 119.156 122.661 -3.505 2
stop_
save_