data_15700_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15700
_Entry.PDB_ID 2K2C
_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 15
_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 10 . 1 1 1 A 2 2 ALA H H 2 8.220 8.509 -0.289 1
1 11 . 1 1 1 A 2 2 ALA HA H 2 4.321 4.306 0.015 1
1 15 . 1 1 1 A 2 2 ALA C C 2 177.564 177.606 -0.042 1
1 16 . 1 1 1 A 2 2 ALA CA C 2 52.383 51.876 0.507 1
1 17 . 1 1 1 A 2 2 ALA CB C 2 19.290 17.887 1.403 1
1 18 . 1 1 1 A 2 2 ALA N N 2 125.223 122.920 2.303 1
1 19 . 1 1 1 A 3 3 ALA H H 3 8.246 8.010 0.236 1
1 20 . 1 1 1 A 3 3 ALA N N 3 123.250 125.278 -2.028 1
1 21 . 1 1 1 A 5 5 ALA HA H 5 4.415 3.947 0.468 1
1 25 . 1 1 1 A 5 5 ALA C C 5 177.481 178.030 -0.549 1
1 26 . 1 1 1 A 5 5 ALA CA C 5 52.423 55.302 -2.879 1
1 27 . 1 1 1 A 5 5 ALA CB C 5 19.420 18.801 0.619 1
1 28 . 1 1 1 A 6 6 ARG H H 6 8.239 7.411 0.828 1
1 29 . 1 1 1 A 6 6 ARG HA H 6 4.371 3.967 0.404 1
1 36 . 1 1 1 A 6 6 ARG C C 6 176.180 176.041 0.139 1
1 37 . 1 1 1 A 6 6 ARG CA C 6 56.353 57.813 -1.460 1
1 38 . 1 1 1 A 6 6 ARG CB C 6 31.170 27.997 3.173 1
1 41 . 1 1 1 A 6 6 ARG N N 6 120.436 113.280 7.156 1
1 42 . 1 1 1 A 7 7 GLU H H 7 8.535 8.116 0.419 1
1 43 . 1 1 1 A 7 7 GLU HA H 7 4.335 4.492 -0.157 1
1 48 . 1 1 1 A 7 7 GLU C C 7 176.346 175.905 0.441 1
1 49 . 1 1 1 A 7 7 GLU CA C 7 56.740 55.872 0.868 1
1 50 . 1 1 1 A 7 7 GLU CB C 7 30.390 29.968 0.422 1
1 52 . 1 1 1 A 7 7 GLU N N 7 122.189 117.657 4.532 1
1 53 . 1 1 1 A 8 8 ASP H H 8 8.347 7.870 0.477 1
1 54 . 1 1 1 A 8 8 ASP N N 8 121.112 122.288 -1.176 1
1 55 . 1 1 1 A 9 9 GLY HA2 H 9 3.975 4.252 -0.277 1
1 56 . 1 1 1 A 9 9 GLY HA3 H 9 3.975 4.252 -0.277 1
1 57 . 1 1 1 A 9 9 GLY C C 9 174.243 171.704 2.539 1
1 58 . 1 1 1 A 9 9 GLY CA C 9 45.933 46.062 -0.129 1
1 59 . 1 1 1 A 10 10 ALA H H 10 8.111 8.534 -0.423 1
1 60 . 1 1 1 A 10 10 ALA N N 10 123.721 123.503 0.218 1
1 61 . 1 1 1 A 12 12 GLY HA2 H 12 3.992 4.047 -0.055 1
1 62 . 1 1 1 A 12 12 GLY HA3 H 12 3.992 4.047 -0.055 1
1 63 . 1 1 1 A 12 12 GLY C C 12 173.883 174.052 -0.169 1
1 64 . 1 1 1 A 12 12 GLY CA C 12 45.381 45.759 -0.378 1
1 65 . 1 1 1 A 13 13 GLU H H 13 8.224 7.712 0.512 1
1 66 . 1 1 1 A 13 13 GLU HA H 13 4.367 4.480 -0.113 1
1 71 . 1 1 1 A 13 13 GLU C C 13 176.125 175.929 0.196 1
1 72 . 1 1 1 A 13 13 GLU CA C 13 56.349 55.643 0.706 1
1 73 . 1 1 1 A 13 13 GLU CB C 13 29.560 29.086 0.474 1
1 75 . 1 1 1 A 13 13 GLU N N 13 120.148 120.084 0.064 1
1 76 . 1 1 1 A 14 14 GLU H H 14 8.508 8.061 0.447 1
1 77 . 1 1 1 A 14 14 GLU HA H 14 4.302 4.383 -0.081 1
1 82 . 1 1 1 A 14 14 GLU C C 14 176.623 175.582 1.041 1
1 83 . 1 1 1 A 14 14 GLU CA C 14 56.497 56.560 -0.063 1
1 84 . 1 1 1 A 14 14 GLU CB C 14 30.110 30.082 0.028 1
1 86 . 1 1 1 A 14 14 GLU N N 14 122.160 124.705 -2.545 1
1 87 . 1 1 1 A 15 15 ARG H H 15 8.356 8.487 -0.131 1
1 88 . 1 1 1 A 15 15 ARG HA H 15 4.366 4.677 -0.311 1
1 95 . 1 1 1 A 15 15 ARG C C 15 176.844 175.112 1.732 1
1 96 . 1 1 1 A 15 15 ARG CA C 15 56.010 54.708 1.302 1
1 97 . 1 1 1 A 15 15 ARG CB C 15 30.890 34.171 -3.281 1
1 100 . 1 1 1 A 15 15 ARG N N 15 121.945 121.884 0.061 1
1 101 . 1 1 1 A 16 16 GLY H H 16 8.414 8.654 -0.240 1
1 102 . 1 1 1 A 16 16 GLY HA2 H 16 4.022 4.063 -0.041 1
1 103 . 1 1 1 A 16 16 GLY HA3 H 16 4.022 4.064 -0.042 1
1 104 . 1 1 1 A 16 16 GLY C C 16 174.326 175.123 -0.797 1
1 105 . 1 1 1 A 16 16 GLY CA C 16 45.620 45.753 -0.133 1
1 106 . 1 1 1 A 16 16 GLY N N 16 109.734 112.996 -3.262 1
1 107 . 1 1 1 A 17 17 GLN H H 17 8.184 8.778 -0.594 1
1 108 . 1 1 1 A 17 17 GLN HA H 17 4.366 4.276 0.090 1
1 113 . 1 1 1 A 17 17 GLN C C 17 175.544 176.197 -0.653 1
1 114 . 1 1 1 A 17 17 GLN CA C 17 55.749 57.812 -2.063 1
1 115 . 1 1 1 A 17 17 GLN CB C 17 29.367 29.643 -0.276 1
1 117 . 1 1 1 A 17 17 GLN N N 17 119.546 122.345 -2.799 1
1 118 . 1 1 1 A 18 18 ARG H H 18 8.366 7.856 0.510 1
1 119 . 1 1 1 A 18 18 ARG HA H 18 4.487 4.702 -0.215 1
1 126 . 1 1 1 A 18 18 ARG C C 18 176.042 176.132 -0.090 1
1 127 . 1 1 1 A 18 18 ARG CA C 18 55.735 54.655 1.080 1
1 128 . 1 1 1 A 18 18 ARG CB C 18 31.170 32.991 -1.821 1
1 131 . 1 1 1 A 18 18 ARG N N 18 122.330 114.166 8.164 1
1 132 . 1 1 1 A 19 19 GLY H H 19 8.192 8.240 -0.048 1
1 133 . 1 1 1 A 19 19 GLY HA2 H 19 4.852 3.998 0.854 1
1 134 . 1 1 1 A 19 19 GLY HA3 H 19 3.894 4.011 -0.117 1
1 135 . 1 1 1 A 19 19 GLY C C 19 172.361 172.536 -0.175 1
1 136 . 1 1 1 A 19 19 GLY CA C 19 45.580 44.852 0.728 1
1 137 . 1 1 1 A 19 19 GLY N N 19 109.658 108.771 0.887 1
1 138 . 1 1 1 A 20 20 CYS H H 20 8.843 8.138 0.705 1
1 139 . 1 1 1 A 20 20 CYS HA H 20 5.147 5.097 0.050 1
1 142 . 1 1 1 A 20 20 CYS C C 20 175.211 174.545 0.666 1
1 143 . 1 1 1 A 20 20 CYS CA C 20 56.712 58.159 -1.447 1
1 144 . 1 1 1 A 20 20 CYS CB C 20 33.530 30.659 2.871 1
1 145 . 1 1 1 A 20 20 CYS N N 20 120.185 118.447 1.738 1
1 146 . 1 1 1 A 21 21 GLU H H 21 8.981 8.946 0.035 1
1 147 . 1 1 1 A 21 21 GLU HA H 21 4.100 4.005 0.095 1
1 152 . 1 1 1 A 21 21 GLU C C 21 176.014 178.323 -2.309 1
1 153 . 1 1 1 A 21 21 GLU CA C 21 57.134 58.948 -1.814 1
1 154 . 1 1 1 A 21 21 GLU CB C 21 28.890 28.909 -0.019 1
1 156 . 1 1 1 A 21 21 GLU N N 21 116.078 124.203 -8.125 1
1 157 . 1 1 1 A 22 22 HIS H H 22 9.342 7.733 1.609 1
1 158 . 1 1 1 A 22 22 HIS HA H 22 4.210 4.212 -0.002 1
1 161 . 1 1 1 A 22 22 HIS C C 22 175.128 174.705 0.423 1
1 162 . 1 1 1 A 22 22 HIS CA C 22 58.945 58.479 0.466 1
1 163 . 1 1 1 A 22 22 HIS CB C 22 33.160 30.811 2.349 1
1 164 . 1 1 1 A 22 22 HIS N N 22 122.296 117.709 4.587 1
1 165 . 1 1 1 A 23 23 TYR H H 23 7.931 7.840 0.091 1
1 166 . 1 1 1 A 23 23 TYR HA H 23 4.856 5.150 -0.294 1
1 171 . 1 1 1 A 23 23 TYR C C 23 173.108 174.542 -1.434 1
1 172 . 1 1 1 A 23 23 TYR CA C 23 57.852 56.232 1.620 1
1 173 . 1 1 1 A 23 23 TYR CB C 23 45.300 42.035 3.265 1
1 175 . 1 1 1 A 23 23 TYR N N 23 115.205 115.549 -0.344 1
1 176 . 1 1 1 A 24 24 ASP H H 24 8.384 8.897 -0.513 1
1 177 . 1 1 1 A 24 24 ASP HA H 24 5.160 4.966 0.194 1
1 180 . 1 1 1 A 24 24 ASP C C 24 174.437 175.417 -0.980 1
1 181 . 1 1 1 A 24 24 ASP CA C 24 53.343 53.840 -0.497 1
1 182 . 1 1 1 A 24 24 ASP CB C 24 41.470 39.845 1.625 1
1 183 . 1 1 1 A 24 24 ASP N N 24 122.016 124.733 -2.717 1
1 184 . 1 1 1 A 25 25 ARG H H 25 7.313 8.421 -1.108 1
1 185 . 1 1 1 A 25 25 ARG HA H 25 5.331 5.362 -0.031 1
1 192 . 1 1 1 A 25 25 ARG C C 25 175.045 175.698 -0.653 1
1 193 . 1 1 1 A 25 25 ARG CA C 25 54.224 54.707 -0.483 1
1 194 . 1 1 1 A 25 25 ARG CB C 25 34.090 33.905 0.185 1
1 197 . 1 1 1 A 25 25 ARG N N 25 115.898 121.484 -5.586 1
1 198 . 1 1 1 A 26 26 GLY H H 26 9.387 8.948 0.439 1
1 199 . 1 1 1 A 26 26 GLY HA2 H 26 4.622 3.883 0.739 1
1 200 . 1 1 1 A 26 26 GLY HA3 H 26 3.788 3.971 -0.183 1
1 201 . 1 1 1 A 26 26 GLY C C 26 170.978 174.663 -3.685 1
1 202 . 1 1 1 A 26 26 GLY CA C 26 44.794 45.910 -1.116 1
1 203 . 1 1 1 A 26 26 GLY N N 26 105.653 107.813 -2.160 1
1 204 . 1 1 1 A 27 27 CYS H H 27 6.864 7.640 -0.776 1
1 205 . 1 1 1 A 27 27 CYS HA H 27 5.195 4.996 0.199 1
1 208 . 1 1 1 A 27 27 CYS C C 27 171.144 172.270 -1.126 1
1 209 . 1 1 1 A 27 27 CYS CA C 27 52.349 57.035 -4.686 1
1 210 . 1 1 1 A 27 27 CYS CB C 27 30.997 30.517 0.480 1
1 211 . 1 1 1 A 27 27 CYS N N 27 110.921 116.942 -6.021 1
1 212 . 1 1 1 A 28 28 LEU H H 28 8.310 8.375 -0.065 1
1 213 . 1 1 1 A 28 28 LEU HA H 28 4.651 4.961 -0.310 1
1 223 . 1 1 1 A 28 28 LEU C C 28 176.827 176.458 0.369 1
1 224 . 1 1 1 A 28 28 LEU CA C 28 53.054 53.122 -0.068 1
1 225 . 1 1 1 A 28 28 LEU CB C 28 44.200 45.130 -0.930 1
1 229 . 1 1 1 A 28 28 LEU N N 28 115.519 121.781 -6.262 1
1 230 . 1 1 1 A 29 29 LEU H H 29 8.800 8.637 0.163 1
1 231 . 1 1 1 A 29 29 LEU HA H 29 4.313 4.272 0.041 1
1 240 . 1 1 1 A 29 29 LEU C C 29 175.571 176.425 -0.854 1
1 241 . 1 1 1 A 29 29 LEU CA C 29 54.388 54.959 -0.571 1
1 242 . 1 1 1 A 29 29 LEU CB C 29 42.780 41.321 1.459 1
1 245 . 1 1 1 A 29 29 LEU N N 29 118.712 125.579 -6.867 1
1 246 . 1 1 1 A 30 30 LYS H H 30 8.009 8.578 -0.569 1
1 247 . 1 1 1 A 30 30 LYS HA H 30 4.592 4.933 -0.341 1
1 256 . 1 1 1 A 30 30 LYS C C 30 174.990 175.238 -0.248 1
1 257 . 1 1 1 A 30 30 LYS CA C 30 54.999 56.277 -1.278 1
1 258 . 1 1 1 A 30 30 LYS CB C 30 32.330 32.806 -0.476 1
1 262 . 1 1 1 A 30 30 LYS N N 30 122.310 125.854 -3.544 1
1 263 . 1 1 1 A 31 31 ALA H H 31 9.238 8.556 0.682 1
1 264 . 1 1 1 A 31 31 ALA HA H 31 4.477 4.397 0.080 1
1 268 . 1 1 1 A 31 31 ALA CA C 31 50.190 49.952 0.238 1
1 269 . 1 1 1 A 31 31 ALA CB C 31 21.637 19.919 1.718 1
1 270 . 1 1 1 A 31 31 ALA N N 31 133.864 130.231 3.633 1
1 271 . 1 1 1 A 32 32 PRO HA H 32 4.637 4.456 0.181 1
1 278 . 1 1 1 A 32 32 PRO C C 32 175.737 177.322 -1.585 1
1 279 . 1 1 1 A 32 32 PRO CA C 32 64.259 64.206 0.053 1
1 280 . 1 1 1 A 32 32 PRO CB C 32 31.740 31.741 -0.001 1
1 283 . 1 1 1 A 33 33 CYS H H 33 8.779 8.324 0.455 1
1 284 . 1 1 1 A 33 33 CYS HA H 33 4.321 4.274 0.047 1
1 287 . 1 1 1 A 33 33 CYS C C 33 176.733 175.177 1.556 1
1 288 . 1 1 1 A 33 33 CYS CA C 33 54.398 61.249 -6.851 1
1 289 . 1 1 1 A 33 33 CYS CB C 33 30.697 27.411 3.286 1
1 290 . 1 1 1 A 33 33 CYS N N 33 120.005 116.250 3.755 1
1 291 . 1 1 1 A 34 34 CYS H H 34 7.424 7.593 -0.169 1
1 292 . 1 1 1 A 34 34 CYS HA H 34 4.896 4.676 0.220 1
1 295 . 1 1 1 A 34 34 CYS C C 34 174.935 174.929 0.006 1
1 296 . 1 1 1 A 34 34 CYS CA C 34 56.962 58.524 -1.562 1
1 297 . 1 1 1 A 34 34 CYS CB C 34 31.067 29.435 1.632 1
1 298 . 1 1 1 A 34 34 CYS N N 34 115.034 117.832 -2.798 1
1 299 . 1 1 1 A 35 35 ASP H H 35 8.368 8.048 0.320 1
1 300 . 1 1 1 A 35 35 ASP HA H 35 4.454 4.252 0.202 1
1 303 . 1 1 1 A 35 35 ASP C C 35 174.354 174.921 -0.567 1
1 304 . 1 1 1 A 35 35 ASP CA C 35 56.222 55.525 0.697 1
1 305 . 1 1 1 A 35 35 ASP CB C 35 39.730 39.592 0.138 1
1 306 . 1 1 1 A 35 35 ASP N N 35 121.381 117.098 4.283 1
1 307 . 1 1 1 A 36 36 LYS H H 36 7.227 7.563 -0.336 1
1 308 . 1 1 1 A 36 36 LYS HA H 36 4.451 4.554 -0.103 1
1 317 . 1 1 1 A 36 36 LYS C C 36 175.433 175.846 -0.413 1
1 318 . 1 1 1 A 36 36 LYS CA C 36 56.270 55.362 0.908 1
1 319 . 1 1 1 A 36 36 LYS CB C 36 36.620 33.740 2.880 1
1 323 . 1 1 1 A 36 36 LYS N N 36 117.673 118.310 -0.637 1
1 324 . 1 1 1 A 37 37 LEU H H 37 8.053 8.259 -0.206 1
1 325 . 1 1 1 A 37 37 LEU HA H 37 5.292 4.877 0.415 1
1 335 . 1 1 1 A 37 37 LEU C C 37 176.484 175.029 1.455 1
1 336 . 1 1 1 A 37 37 LEU CA C 37 53.348 53.113 0.235 1
1 337 . 1 1 1 A 37 37 LEU CB C 37 42.400 43.123 -0.723 1
1 341 . 1 1 1 A 37 37 LEU N N 37 120.994 121.474 -0.480 1
1 342 . 1 1 1 A 38 38 TYR H H 38 8.741 8.841 -0.100 1
1 343 . 1 1 1 A 38 38 TYR HA H 38 5.002 4.837 0.165 1
1 350 . 1 1 1 A 38 38 TYR C C 38 176.374 176.040 0.334 1
1 351 . 1 1 1 A 38 38 TYR CA C 38 57.081 56.992 0.089 1
1 352 . 1 1 1 A 38 38 TYR CB C 38 45.647 42.017 3.630 1
1 355 . 1 1 1 A 38 38 TYR N N 38 121.128 122.334 -1.206 1
1 356 . 1 1 1 A 39 39 THR H H 39 9.402 8.661 0.741 1
1 357 . 1 1 1 A 39 39 THR HA H 39 4.098 4.114 -0.016 1
1 362 . 1 1 1 A 39 39 THR C C 39 173.496 174.918 -1.422 1
1 363 . 1 1 1 A 39 39 THR CA C 39 67.062 65.498 1.564 1
1 364 . 1 1 1 A 39 39 THR CB C 39 68.047 68.673 -0.626 1
1 366 . 1 1 1 A 39 39 THR N N 39 116.641 116.563 0.078 1
1 367 . 1 1 1 A 40 40 CYS H H 40 7.317 7.919 -0.602 1
1 368 . 1 1 1 A 40 40 CYS HA H 40 4.771 4.919 -0.148 1
1 371 . 1 1 1 A 40 40 CYS C C 40 175.128 175.186 -0.058 1
1 372 . 1 1 1 A 40 40 CYS CA C 40 56.577 57.981 -1.404 1
1 373 . 1 1 1 A 40 40 CYS CB C 40 35.087 31.741 3.346 1
1 374 . 1 1 1 A 40 40 CYS N N 40 109.059 118.073 -9.014 1
1 375 . 1 1 1 A 41 41 ARG H H 41 9.201 9.001 0.200 1
1 376 . 1 1 1 A 41 41 ARG HA H 41 3.982 4.044 -0.062 1
1 383 . 1 1 1 A 41 41 ARG C C 41 175.101 177.737 -2.636 1
1 384 . 1 1 1 A 41 41 ARG CA C 41 58.591 58.812 -0.221 1
1 385 . 1 1 1 A 41 41 ARG CB C 41 29.640 29.800 -0.160 1
1 388 . 1 1 1 A 41 41 ARG N N 41 121.737 123.536 -1.799 1
1 389 . 1 1 1 A 42 42 LEU H H 42 9.116 7.705 1.411 1
1 390 . 1 1 1 A 42 42 LEU HA H 42 4.029 4.075 -0.046 1
1 400 . 1 1 1 A 42 42 LEU C C 42 179.943 179.401 0.542 1
1 401 . 1 1 1 A 42 42 LEU CA C 42 58.005 57.615 0.390 1
1 402 . 1 1 1 A 42 42 LEU CB C 42 38.960 41.095 -2.135 1
1 406 . 1 1 1 A 42 42 LEU N N 42 126.364 116.838 9.526 1
1 407 . 1 1 1 A 43 43 CYS H H 43 8.785 8.181 0.604 1
1 408 . 1 1 1 A 43 43 CYS HA H 43 4.187 4.219 -0.032 1
1 411 . 1 1 1 A 43 43 CYS C C 43 177.785 177.176 0.609 1
1 412 . 1 1 1 A 43 43 CYS CA C 43 66.415 62.728 3.687 1
1 413 . 1 1 1 A 43 43 CYS CB C 43 28.870 27.142 1.728 1
1 414 . 1 1 1 A 43 43 CYS N N 43 124.519 117.796 6.723 1
1 415 . 1 1 1 A 44 44 HIS H H 44 7.604 7.543 0.061 1
1 416 . 1 1 1 A 44 44 HIS HA H 44 1.983 2.793 -0.810 1
1 420 . 1 1 1 A 44 44 HIS C C 44 176.429 176.231 0.198 1
1 421 . 1 1 1 A 44 44 HIS CA C 44 58.760 58.804 -0.044 1
1 422 . 1 1 1 A 44 44 HIS CB C 44 27.990 29.363 -1.373 1
1 423 . 1 1 1 A 44 44 HIS N N 44 117.024 121.351 -4.327 1
1 424 . 1 1 1 A 45 45 ASP H H 45 8.750 8.167 0.583 1
1 425 . 1 1 1 A 45 45 ASP HA H 45 4.116 4.120 -0.004 1
1 428 . 1 1 1 A 45 45 ASP C C 45 177.453 177.972 -0.519 1
1 429 . 1 1 1 A 45 45 ASP CA C 45 56.840 57.498 -0.658 1
1 430 . 1 1 1 A 45 45 ASP CB C 45 38.960 41.924 -2.964 1
1 431 . 1 1 1 A 45 45 ASP N N 45 120.440 118.765 1.675 1
1 432 . 1 1 1 A 46 46 ASN H H 46 7.888 8.161 -0.273 1
1 433 . 1 1 1 A 46 46 ASN HA H 46 4.612 4.404 0.208 1
1 438 . 1 1 1 A 46 46 ASN C C 46 175.903 176.682 -0.779 1
1 439 . 1 1 1 A 46 46 ASN CA C 46 54.342 56.863 -2.521 1
1 440 . 1 1 1 A 46 46 ASN CB C 46 38.790 39.071 -0.281 1
1 441 . 1 1 1 A 46 46 ASN N N 46 115.758 117.473 -1.715 1
1 443 . 1 1 1 A 47 47 ASN H H 47 7.384 7.264 0.120 1
1 444 . 1 1 1 A 47 47 ASN HA H 47 4.893 4.625 0.268 1
1 449 . 1 1 1 A 47 47 ASN C C 47 173.579 175.517 -1.938 1
1 450 . 1 1 1 A 47 47 ASN CA C 47 53.937 54.474 -0.537 1
1 451 . 1 1 1 A 47 47 ASN CB C 47 43.130 39.249 3.881 1
1 452 . 1 1 1 A 47 47 ASN N N 47 116.576 114.917 1.659 1
1 454 . 1 1 1 A 48 48 GLU H H 48 7.143 7.353 -0.210 1
1 455 . 1 1 1 A 48 48 GLU HA H 48 4.572 4.523 0.049 1
1 460 . 1 1 1 A 48 48 GLU C C 48 175.627 176.404 -0.777 1
1 461 . 1 1 1 A 48 48 GLU CA C 48 53.727 54.402 -0.675 1
1 462 . 1 1 1 A 48 48 GLU CB C 48 32.480 30.787 1.693 1
1 464 . 1 1 1 A 48 48 GLU N N 48 116.967 117.827 -0.860 1
1 465 . 1 1 1 A 49 49 ASP H H 49 8.748 8.974 -0.226 1
1 466 . 1 1 1 A 49 49 ASP HA H 49 4.576 4.455 0.121 1
1 469 . 1 1 1 A 49 49 ASP C C 49 174.796 176.006 -1.210 1
1 470 . 1 1 1 A 49 49 ASP CA C 49 53.027 55.399 -2.372 1
1 471 . 1 1 1 A 49 49 ASP CB C 49 40.340 40.865 -0.525 1
1 472 . 1 1 1 A 49 49 ASP N N 49 119.296 120.968 -1.672 1
1 473 . 1 1 1 A 50 50 HIS H H 50 6.919 7.280 -0.361 1
1 474 . 1 1 1 A 50 50 HIS HA H 50 4.880 5.232 -0.352 1
1 477 . 1 1 1 A 50 50 HIS C C 50 172.942 174.449 -1.507 1
1 478 . 1 1 1 A 50 50 HIS CA C 50 53.978 53.169 0.809 1
1 479 . 1 1 1 A 50 50 HIS CB C 50 30.330 32.908 -2.578 1
1 480 . 1 1 1 A 50 50 HIS N N 50 113.709 113.948 -0.239 1
1 481 . 1 1 1 A 51 51 GLN H H 51 8.646 8.551 0.095 1
1 482 . 1 1 1 A 51 51 GLN HA H 51 4.896 4.836 0.060 1
1 487 . 1 1 1 A 51 51 GLN C C 51 176.512 174.605 1.907 1
1 488 . 1 1 1 A 51 51 GLN CA C 51 54.872 54.934 -0.062 1
1 489 . 1 1 1 A 51 51 GLN CB C 51 30.950 30.040 0.910 1
1 491 . 1 1 1 A 51 51 GLN N N 51 119.379 118.240 1.139 1
1 492 . 1 1 1 A 52 52 LEU H H 52 9.646 8.498 1.148 1
1 493 . 1 1 1 A 52 52 LEU HA H 52 4.206 4.687 -0.481 1
1 503 . 1 1 1 A 52 52 LEU C C 52 175.793 174.608 1.185 1
1 504 . 1 1 1 A 52 52 LEU CA C 52 55.450 53.677 1.773 1
1 505 . 1 1 1 A 52 52 LEU CB C 52 41.407 44.125 -2.718 1
1 509 . 1 1 1 A 52 52 LEU N N 52 128.069 124.633 3.436 1
1 510 . 1 1 1 A 53 53 ASP H H 53 9.281 8.511 0.770 1
1 511 . 1 1 1 A 53 53 ASP HA H 53 4.725 5.056 -0.331 1
1 514 . 1 1 1 A 53 53 ASP C C 53 176.401 176.878 -0.477 1
1 515 . 1 1 1 A 53 53 ASP CA C 53 52.590 52.656 -0.066 1
1 516 . 1 1 1 A 53 53 ASP CB C 53 39.990 43.643 -3.653 1
1 517 . 1 1 1 A 53 53 ASP N N 53 128.783 127.003 1.780 1
1 518 . 1 1 1 A 54 54 ARG H H 54 8.496 8.794 -0.298 1
1 519 . 1 1 1 A 54 54 ARG HA H 54 3.859 3.950 -0.091 1
1 526 . 1 1 1 A 54 54 ARG C C 54 176.346 175.271 1.075 1
1 527 . 1 1 1 A 54 54 ARG CA C 54 57.357 57.749 -0.392 1
1 528 . 1 1 1 A 54 54 ARG CB C 54 28.890 29.098 -0.208 1
1 531 . 1 1 1 A 54 54 ARG N N 54 125.813 123.717 2.096 1
1 532 . 1 1 1 A 55 55 PHE H H 55 8.005 7.541 0.464 1
1 533 . 1 1 1 A 55 55 PHE HA H 55 4.712 4.686 0.026 1
1 540 . 1 1 1 A 55 55 PHE C C 55 177.481 177.006 0.475 1
1 541 . 1 1 1 A 55 55 PHE CA C 55 59.080 58.815 0.265 1
1 542 . 1 1 1 A 55 55 PHE CB C 55 37.447 40.977 -3.530 1
1 545 . 1 1 1 A 55 55 PHE N N 55 120.168 117.323 2.845 1
1 546 . 1 1 1 A 56 56 LYS H H 56 7.681 7.467 0.214 1
1 547 . 1 1 1 A 56 56 LYS HA H 56 4.411 4.349 0.062 1
1 556 . 1 1 1 A 56 56 LYS C C 56 175.959 176.525 -0.566 1
1 557 . 1 1 1 A 56 56 LYS CA C 56 55.459 57.751 -2.292 1
1 558 . 1 1 1 A 56 56 LYS CB C 56 33.590 33.202 0.388 1
1 562 . 1 1 1 A 56 56 LYS N N 56 116.937 117.662 -0.725 1
1 563 . 1 1 1 A 57 57 VAL H H 57 6.553 6.901 -0.348 1
1 564 . 1 1 1 A 57 57 VAL HA H 57 3.408 3.889 -0.481 1
1 572 . 1 1 1 A 57 57 VAL C C 57 173.911 175.121 -1.210 1
1 573 . 1 1 1 A 57 57 VAL CA C 57 65.025 61.834 3.191 1
1 574 . 1 1 1 A 57 57 VAL CB C 57 32.663 32.295 0.368 1
1 577 . 1 1 1 A 57 57 VAL N N 57 119.519 117.396 2.123 1
1 578 . 1 1 1 A 58 58 LYS H H 58 9.182 8.992 0.190 1
1 579 . 1 1 1 A 58 58 LYS HA H 58 4.489 4.568 -0.079 1
1 588 . 1 1 1 A 58 58 LYS C C 58 176.927 175.821 1.106 1
1 589 . 1 1 1 A 58 58 LYS CA C 58 55.913 57.373 -1.460 1
1 590 . 1 1 1 A 58 58 LYS CB C 58 36.340 35.875 0.465 1
1 594 . 1 1 1 A 58 58 LYS N N 58 124.985 125.109 -0.124 1
1 595 . 1 1 1 A 59 59 GLU H H 59 8.799 7.892 0.907 1
1 596 . 1 1 1 A 59 59 GLU HA H 59 5.209 4.906 0.303 1
1 601 . 1 1 1 A 59 59 GLU C C 59 173.911 175.751 -1.840 1
1 602 . 1 1 1 A 59 59 GLU CA C 59 54.670 54.984 -0.314 1
1 603 . 1 1 1 A 59 59 GLU CB C 59 35.180 31.920 3.260 1
1 605 . 1 1 1 A 59 59 GLU N N 59 121.493 117.920 3.573 1
1 606 . 1 1 1 A 60 60 VAL H H 60 8.917 8.892 0.025 1
1 607 . 1 1 1 A 60 60 VAL HA H 60 4.983 5.044 -0.061 1
1 615 . 1 1 1 A 60 60 VAL C C 60 173.441 174.433 -0.992 1
1 616 . 1 1 1 A 60 60 VAL CA C 60 57.497 59.030 -1.533 1
1 617 . 1 1 1 A 60 60 VAL CB C 60 35.460 36.271 -0.811 1
1 620 . 1 1 1 A 60 60 VAL N N 60 109.266 117.780 -8.514 1
1 621 . 1 1 1 A 61 61 GLN H H 61 8.970 8.420 0.550 1
1 622 . 1 1 1 A 61 61 GLN HA H 61 5.024 4.997 0.027 1
1 629 . 1 1 1 A 61 61 GLN C C 61 175.045 173.625 1.420 1
1 630 . 1 1 1 A 61 61 GLN CA C 61 53.128 53.726 -0.598 1
1 631 . 1 1 1 A 61 61 GLN CB C 61 33.980 31.041 2.939 1
1 633 . 1 1 1 A 61 61 GLN N N 61 118.525 120.053 -1.528 1
1 635 . 1 1 1 A 62 62 CYS H H 62 7.688 8.285 -0.597 1
1 636 . 1 1 1 A 62 62 CYS HA H 62 4.210 4.746 -0.536 1
1 639 . 1 1 1 A 62 62 CYS C C 62 177.951 175.590 2.361 1
1 640 . 1 1 1 A 62 62 CYS CA C 62 59.845 57.054 2.791 1
1 641 . 1 1 1 A 62 62 CYS CB C 62 33.120 30.038 3.082 1
1 642 . 1 1 1 A 62 62 CYS N N 62 128.772 119.700 9.072 1
1 643 . 1 1 1 A 63 63 ILE H H 63 8.192 8.593 -0.401 1
1 644 . 1 1 1 A 63 63 ILE HA H 63 3.984 3.943 0.041 1
1 654 . 1 1 1 A 63 63 ILE C C 63 175.433 177.323 -1.890 1
1 655 . 1 1 1 A 63 63 ILE CA C 63 63.657 64.227 -0.570 1
1 656 . 1 1 1 A 63 63 ILE CB C 63 38.506 37.761 0.745 1
1 660 . 1 1 1 A 63 63 ILE N N 63 127.455 127.836 -0.381 1
1 661 . 1 1 1 A 64 64 ASN H H 64 9.181 8.061 1.120 1
1 662 . 1 1 1 A 64 64 ASN HA H 64 4.810 4.782 0.028 1
1 667 . 1 1 1 A 64 64 ASN C C 64 175.931 175.281 0.650 1
1 668 . 1 1 1 A 64 64 ASN CA C 64 55.617 52.184 3.433 1
1 669 . 1 1 1 A 64 64 ASN CB C 64 40.640 37.004 3.636 1
1 670 . 1 1 1 A 64 64 ASN N N 64 122.104 118.677 3.427 1
1 672 . 1 1 1 A 65 65 CYS H H 65 9.065 7.769 1.296 1
1 673 . 1 1 1 A 65 65 CYS HA H 65 4.979 4.492 0.487 1
1 676 . 1 1 1 A 65 65 CYS C C 65 176.291 175.264 1.027 1
1 677 . 1 1 1 A 65 65 CYS CA C 65 59.027 59.746 -0.719 1
1 678 . 1 1 1 A 65 65 CYS CB C 65 32.030 29.552 2.478 1
1 679 . 1 1 1 A 65 65 CYS N N 65 120.368 120.009 0.359 1
1 680 . 1 1 1 A 66 66 GLU H H 66 7.281 8.406 -1.125 1
1 681 . 1 1 1 A 66 66 GLU HA H 66 4.046 4.151 -0.105 1
1 686 . 1 1 1 A 66 66 GLU C C 66 175.211 175.390 -0.179 1
1 687 . 1 1 1 A 66 66 GLU CA C 66 58.591 58.003 0.588 1
1 688 . 1 1 1 A 66 66 GLU CB C 66 27.067 27.110 -0.043 1
1 690 . 1 1 1 A 66 66 GLU N N 66 115.012 116.535 -1.523 1
1 691 . 1 1 1 A 67 67 LYS H H 67 8.481 7.492 0.989 1
1 692 . 1 1 1 A 67 67 LYS HA H 67 4.326 4.272 0.054 1
1 701 . 1 1 1 A 67 67 LYS C C 67 177.923 176.252 1.671 1
1 702 . 1 1 1 A 67 67 LYS CA C 67 57.628 56.594 1.034 1
1 703 . 1 1 1 A 67 67 LYS CB C 67 33.617 33.078 0.539 1
1 707 . 1 1 1 A 67 67 LYS N N 67 123.514 121.057 2.457 1
1 708 . 1 1 1 A 68 68 ILE H H 68 8.867 8.468 0.399 1
1 709 . 1 1 1 A 68 68 ILE HA H 68 4.976 4.486 0.490 1
1 719 . 1 1 1 A 68 68 ILE C C 68 175.018 175.157 -0.139 1
1 720 . 1 1 1 A 68 68 ILE CA C 68 60.919 60.454 0.465 1
1 721 . 1 1 1 A 68 68 ILE CB C 68 37.090 38.081 -0.991 1
1 725 . 1 1 1 A 68 68 ILE N N 68 133.478 126.899 6.579 1
1 726 . 1 1 1 A 69 69 GLN H H 69 9.269 8.789 0.480 1
1 727 . 1 1 1 A 69 69 GLN HA H 69 5.036 4.869 0.167 1
1 732 . 1 1 1 A 69 69 GLN C C 69 173.607 174.630 -1.023 1
1 733 . 1 1 1 A 69 69 GLN CA C 69 53.419 53.910 -0.491 1
1 734 . 1 1 1 A 69 69 GLN CB C 69 34.997 32.153 2.844 1
1 736 . 1 1 1 A 69 69 GLN N N 69 125.104 123.575 1.529 1
1 737 . 1 1 1 A 70 70 HIS H H 70 8.829 8.712 0.117 1
1 738 . 1 1 1 A 70 70 HIS HA H 70 4.865 4.752 0.113 1
1 741 . 1 1 1 A 70 70 HIS C C 70 174.852 175.234 -0.382 1
1 742 . 1 1 1 A 70 70 HIS CA C 70 56.304 56.726 -0.422 1
1 743 . 1 1 1 A 70 70 HIS CB C 70 30.050 30.520 -0.470 1
1 744 . 1 1 1 A 70 70 HIS N N 70 118.576 119.423 -0.847 1
1 745 . 1 1 1 A 71 71 ALA H H 71 7.768 8.520 -0.752 1
1 746 . 1 1 1 A 71 71 ALA HA H 71 3.977 4.618 -0.641 1
1 750 . 1 1 1 A 71 71 ALA C C 71 175.433 177.259 -1.826 1
1 751 . 1 1 1 A 71 71 ALA CA C 71 54.393 52.567 1.826 1
1 752 . 1 1 1 A 71 71 ALA CB C 71 18.000 18.808 -0.808 1
1 753 . 1 1 1 A 71 71 ALA N N 71 121.438 124.501 -3.063 1
1 754 . 1 1 1 A 72 72 GLN H H 72 7.227 8.553 -1.326 1
1 755 . 1 1 1 A 72 72 GLN HA H 72 4.371 4.663 -0.292 1
1 762 . 1 1 1 A 72 72 GLN C C 72 173.053 175.173 -2.120 1
1 763 . 1 1 1 A 72 72 GLN CA C 72 54.290 53.974 0.316 1
1 764 . 1 1 1 A 72 72 GLN CB C 72 28.623 32.232 -3.609 1
1 766 . 1 1 1 A 72 72 GLN N N 72 115.858 122.628 -6.770 1
1 768 . 1 1 1 A 73 73 GLN H H 73 8.481 8.461 0.020 1
1 769 . 1 1 1 A 73 73 GLN HA H 73 3.570 3.679 -0.109 1
1 776 . 1 1 1 A 73 73 GLN C C 73 174.243 174.809 -0.566 1
1 777 . 1 1 1 A 73 73 GLN CA C 73 60.206 57.380 2.826 1
1 778 . 1 1 1 A 73 73 GLN CB C 73 28.850 29.126 -0.276 1
1 780 . 1 1 1 A 73 73 GLN N N 73 116.433 121.922 -5.489 1
1 782 . 1 1 1 A 74 74 THR H H 74 7.211 7.423 -0.212 1
1 783 . 1 1 1 A 74 74 THR HA H 74 4.160 4.473 -0.313 1
1 788 . 1 1 1 A 74 74 THR C C 74 171.836 172.832 -0.996 1
1 789 . 1 1 1 A 74 74 THR CA C 74 59.072 60.423 -1.351 1
1 790 . 1 1 1 A 74 74 THR CB C 74 71.560 71.676 -0.116 1
1 792 . 1 1 1 A 74 74 THR N N 74 108.717 110.223 -1.506 1
1 793 . 1 1 1 A 75 75 CYS H H 75 7.676 8.005 -0.329 1
1 794 . 1 1 1 A 75 75 CYS HA H 75 4.158 4.778 -0.620 1
1 797 . 1 1 1 A 75 75 CYS C C 75 178.781 175.534 3.247 1
1 798 . 1 1 1 A 75 75 CYS CA C 75 58.661 58.965 -0.304 1
1 799 . 1 1 1 A 75 75 CYS CB C 75 30.840 27.510 3.330 1
1 800 . 1 1 1 A 75 75 CYS N N 75 123.108 124.709 -1.601 1
1 801 . 1 1 1 A 76 76 GLU H H 76 9.203 8.754 0.449 1
1 802 . 1 1 1 A 76 76 GLU HA H 76 4.187 3.992 0.195 1
1 807 . 1 1 1 A 76 76 GLU C C 76 175.488 178.745 -3.257 1
1 808 . 1 1 1 A 76 76 GLU CA C 76 57.306 58.973 -1.667 1
1 809 . 1 1 1 A 76 76 GLU CB C 76 29.347 28.925 0.422 1
1 811 . 1 1 1 A 76 76 GLU N N 76 129.817 127.182 2.635 1
1 812 . 1 1 1 A 77 77 GLU H H 77 9.496 7.795 1.701 1
1 813 . 1 1 1 A 77 77 GLU HA H 77 4.599 4.097 0.502 1
1 818 . 1 1 1 A 77 77 GLU C C 77 177.148 177.866 -0.718 1
1 819 . 1 1 1 A 77 77 GLU CA C 77 57.554 59.089 -1.535 1
1 820 . 1 1 1 A 77 77 GLU CB C 77 31.980 30.053 1.927 1
1 822 . 1 1 1 A 77 77 GLU N N 77 124.795 119.943 4.852 1
1 823 . 1 1 1 A 78 78 CYS H H 78 8.967 7.476 1.491 1
1 824 . 1 1 1 A 78 78 CYS HA H 78 5.073 4.608 0.465 1
1 827 . 1 1 1 A 78 78 CYS C C 78 176.374 174.281 2.093 1
1 828 . 1 1 1 A 78 78 CYS CA C 78 58.537 57.864 0.673 1
1 829 . 1 1 1 A 78 78 CYS CB C 78 31.597 27.782 3.815 1
1 830 . 1 1 1 A 78 78 CYS N N 78 119.692 115.207 4.485 1
1 831 . 1 1 1 A 79 79 SER H H 79 7.474 8.158 -0.684 1
1 832 . 1 1 1 A 79 79 SER HA H 79 4.113 4.059 0.054 1
1 835 . 1 1 1 A 79 79 SER C C 79 172.915 173.446 -0.531 1
1 836 . 1 1 1 A 79 79 SER CA C 79 60.440 59.310 1.130 1
1 837 . 1 1 1 A 79 79 SER CB C 79 61.421 61.027 0.394 1
1 838 . 1 1 1 A 79 79 SER N N 79 113.385 112.339 1.046 1
1 839 . 1 1 1 A 80 80 THR H H 80 7.907 7.832 0.075 1
1 840 . 1 1 1 A 80 80 THR HA H 80 3.913 4.196 -0.283 1
1 845 . 1 1 1 A 80 80 THR C C 80 172.306 173.715 -1.409 1
1 846 . 1 1 1 A 80 80 THR CA C 80 65.262 63.288 1.974 1
1 847 . 1 1 1 A 80 80 THR CB C 80 69.910 69.097 0.813 1
1 849 . 1 1 1 A 80 80 THR N N 80 120.005 115.992 4.013 1
1 850 . 1 1 1 A 81 81 LEU H H 81 8.556 8.546 0.010 1
1 851 . 1 1 1 A 81 81 LEU HA H 81 4.172 4.413 -0.241 1
1 861 . 1 1 1 A 81 81 LEU C C 81 177.121 176.429 0.692 1
1 862 . 1 1 1 A 81 81 LEU CA C 81 54.996 54.863 0.133 1
1 863 . 1 1 1 A 81 81 LEU CB C 81 42.147 42.236 -0.089 1
1 867 . 1 1 1 A 81 81 LEU N N 81 128.272 128.754 -0.482 1
1 868 . 1 1 1 A 82 82 PHE H H 82 9.251 8.824 0.427 1
1 869 . 1 1 1 A 82 82 PHE HA H 82 4.576 4.439 0.137 1
1 874 . 1 1 1 A 82 82 PHE C C 82 177.785 176.118 1.667 1
1 875 . 1 1 1 A 82 82 PHE CA C 82 56.470 60.111 -3.641 1
1 876 . 1 1 1 A 82 82 PHE CB C 82 38.210 39.041 -0.831 1
1 878 . 1 1 1 A 82 82 PHE N N 82 129.268 126.139 3.129 1
1 879 . 1 1 1 A 83 83 GLY H H 83 7.047 7.481 -0.434 1
1 880 . 1 1 1 A 83 83 GLY HA2 H 83 4.783 4.159 0.624 1
1 881 . 1 1 1 A 83 83 GLY HA3 H 83 3.876 4.216 -0.340 1
1 882 . 1 1 1 A 83 83 GLY C C 83 171.642 174.553 -2.911 1
1 883 . 1 1 1 A 83 83 GLY CA C 83 45.826 45.893 -0.067 1
1 884 . 1 1 1 A 83 83 GLY N N 83 102.168 104.070 -1.902 1
1 885 . 1 1 1 A 84 84 GLU H H 84 8.444 9.010 -0.566 1
1 886 . 1 1 1 A 84 84 GLU HA H 84 4.111 4.348 -0.237 1
1 891 . 1 1 1 A 84 84 GLU C C 84 177.259 176.372 0.887 1
1 892 . 1 1 1 A 84 84 GLU CA C 84 59.438 58.266 1.172 1
1 893 . 1 1 1 A 84 84 GLU CB C 84 30.670 31.000 -0.330 1
1 895 . 1 1 1 A 84 84 GLU N N 84 127.546 118.922 8.624 1
1 896 . 1 1 1 A 85 85 TYR H H 85 9.344 8.218 1.126 1
1 897 . 1 1 1 A 85 85 TYR HA H 85 4.599 4.951 -0.352 1
1 902 . 1 1 1 A 85 85 TYR C C 85 173.302 174.218 -0.916 1
1 903 . 1 1 1 A 85 85 TYR CA C 85 57.261 57.891 -0.630 1
1 904 . 1 1 1 A 85 85 TYR CB C 85 40.850 40.614 0.236 1
1 906 . 1 1 1 A 85 85 TYR N N 85 118.936 120.722 -1.786 1
1 907 . 1 1 1 A 86 86 TYR H H 86 7.323 8.430 -1.107 1
1 908 . 1 1 1 A 86 86 TYR HA H 86 5.298 6.093 -0.795 1
1 911 . 1 1 1 A 86 86 TYR C C 86 172.804 173.605 -0.801 1
1 912 . 1 1 1 A 86 86 TYR CA C 86 54.041 55.749 -1.708 1
1 913 . 1 1 1 A 86 86 TYR CB C 86 40.987 42.199 -1.212 1
1 914 . 1 1 1 A 86 86 TYR N N 86 124.965 121.161 3.804 1
1 915 . 1 1 1 A 87 87 CYS H H 87 7.046 8.606 -1.560 1
1 916 . 1 1 1 A 87 87 CYS HA H 87 3.842 4.900 -1.058 1
1 919 . 1 1 1 A 87 87 CYS C C 87 174.243 174.280 -0.037 1
1 920 . 1 1 1 A 87 87 CYS CA C 87 56.377 58.885 -2.508 1
1 921 . 1 1 1 A 87 87 CYS CB C 87 33.230 30.416 2.814 1
1 922 . 1 1 1 A 87 87 CYS N N 87 128.735 118.599 10.136 1
1 923 . 1 1 1 A 88 88 ASP H H 88 8.002 8.986 -0.984 1
1 924 . 1 1 1 A 88 88 ASP HA H 88 3.761 4.265 -0.504 1
1 927 . 1 1 1 A 88 88 ASP C C 88 173.579 177.561 -3.982 1
1 928 . 1 1 1 A 88 88 ASP CA C 88 53.958 56.941 -2.983 1
1 929 . 1 1 1 A 88 88 ASP CB C 88 41.240 40.580 0.660 1
1 930 . 1 1 1 A 88 88 ASP N N 88 127.013 127.091 -0.078 1
1 931 . 1 1 1 A 89 89 ILE H H 89 7.972 7.907 0.065 1
1 932 . 1 1 1 A 89 89 ILE HA H 89 3.660 3.697 -0.037 1
1 942 . 1 1 1 A 89 89 ILE C C 89 177.259 177.377 -0.118 1
1 943 . 1 1 1 A 89 89 ILE CA C 89 63.107 65.055 -1.948 1
1 944 . 1 1 1 A 89 89 ILE CB C 89 39.430 38.229 1.201 1
1 948 . 1 1 1 A 89 89 ILE N N 89 120.357 118.921 1.436 1
1 949 . 1 1 1 A 90 90 CYS H H 90 8.554 7.792 0.762 1
1 950 . 1 1 1 A 90 90 CYS HA H 90 3.677 4.139 -0.462 1
1 953 . 1 1 1 A 90 90 CYS C C 90 175.128 174.013 1.115 1
1 954 . 1 1 1 A 90 90 CYS CA C 90 60.791 59.633 1.158 1
1 955 . 1 1 1 A 90 90 CYS CB C 90 30.427 27.906 2.521 1
1 956 . 1 1 1 A 90 90 CYS N N 90 119.564 117.173 2.391 1
1 957 . 1 1 1 A 91 91 HIS H H 91 7.364 7.754 -0.390 1
1 958 . 1 1 1 A 91 91 HIS HA H 91 3.512 3.810 -0.298 1
1 963 . 1 1 1 A 91 91 HIS C C 91 170.590 173.047 -2.457 1
1 964 . 1 1 1 A 91 91 HIS CA C 91 58.739 56.319 2.420 1
1 965 . 1 1 1 A 91 91 HIS CB C 91 24.810 26.397 -1.587 1
1 968 . 1 1 1 A 91 91 HIS N N 91 111.440 115.810 -4.370 1
1 969 . 1 1 1 A 92 92 LEU H H 92 6.214 7.023 -0.809 1
1 970 . 1 1 1 A 92 92 LEU HA H 92 4.191 4.669 -0.478 1
1 980 . 1 1 1 A 92 92 LEU C C 92 173.911 175.425 -1.514 1
1 981 . 1 1 1 A 92 92 LEU CA C 92 53.717 52.813 0.904 1
1 982 . 1 1 1 A 92 92 LEU CB C 92 45.360 44.557 0.803 1
1 986 . 1 1 1 A 92 92 LEU N N 92 115.684 115.023 0.661 1
1 987 . 1 1 1 A 93 93 PHE H H 93 6.669 8.604 -1.935 1
1 988 . 1 1 1 A 93 93 PHE HA H 93 5.622 5.323 0.299 1
1 995 . 1 1 1 A 93 93 PHE C C 93 175.765 174.558 1.207 1
1 996 . 1 1 1 A 93 93 PHE CA C 93 55.387 56.601 -1.214 1
1 997 . 1 1 1 A 93 93 PHE CB C 93 42.700 41.139 1.561 1
1 1000 . 1 1 1 A 93 93 PHE N N 93 121.535 120.508 1.027 1
1 1001 . 1 1 1 A 94 94 ASP H H 94 9.209 8.922 0.287 1
1 1002 . 1 1 1 A 94 94 ASP HA H 94 5.819 5.241 0.578 1
1 1005 . 1 1 1 A 94 94 ASP C C 94 175.654 175.230 0.424 1
1 1006 . 1 1 1 A 94 94 ASP CA C 94 53.330 53.357 -0.027 1
1 1007 . 1 1 1 A 94 94 ASP CB C 94 44.720 43.916 0.804 1
1 1008 . 1 1 1 A 94 94 ASP N N 94 123.504 120.689 2.815 1
1 1009 . 1 1 1 A 95 95 LYS H H 95 9.043 8.284 0.759 1
1 1010 . 1 1 1 A 95 95 LYS HA H 95 4.527 4.352 0.175 1
1 1019 . 1 1 1 A 95 95 LYS C C 95 174.879 176.542 -1.663 1
1 1020 . 1 1 1 A 95 95 LYS CA C 95 56.620 57.494 -0.874 1
1 1021 . 1 1 1 A 95 95 LYS CB C 95 33.720 32.969 0.751 1
1 1025 . 1 1 1 A 95 95 LYS N N 95 120.380 119.665 0.715 1
1 1026 . 1 1 1 A 96 96 ASP H H 96 8.999 8.701 0.298 1
1 1027 . 1 1 1 A 96 96 ASP HA H 96 4.724 4.735 -0.011 1
1 1030 . 1 1 1 A 96 96 ASP C C 96 176.401 175.548 0.853 1
1 1031 . 1 1 1 A 96 96 ASP CA C 96 56.147 53.801 2.346 1
1 1032 . 1 1 1 A 96 96 ASP CB C 96 40.790 41.137 -0.347 1
1 1033 . 1 1 1 A 96 96 ASP N N 96 120.784 124.597 -3.813 1
1 1034 . 1 1 1 A 97 97 LYS H H 97 9.382 8.634 0.748 1
1 1035 . 1 1 1 A 97 97 LYS HA H 97 4.473 4.641 -0.168 1
1 1044 . 1 1 1 A 97 97 LYS C C 97 175.903 175.882 0.021 1
1 1045 . 1 1 1 A 97 97 LYS CA C 97 54.771 55.410 -0.639 1
1 1046 . 1 1 1 A 97 97 LYS CB C 97 33.270 32.497 0.773 1
1 1050 . 1 1 1 A 97 97 LYS N N 97 131.617 126.737 4.880 1
1 1051 . 1 1 1 A 98 98 LYS H H 98 8.940 8.087 0.853 1
1 1052 . 1 1 1 A 98 98 LYS HA H 98 4.118 3.906 0.212 1
1 1061 . 1 1 1 A 98 98 LYS C C 98 177.065 175.268 1.797 1
1 1062 . 1 1 1 A 98 98 LYS CA C 98 56.297 57.667 -1.370 1
1 1063 . 1 1 1 A 98 98 LYS CB C 98 28.467 29.402 -0.935 1
1 1067 . 1 1 1 A 98 98 LYS N N 98 115.034 113.587 1.447 1
1 1068 . 1 1 1 A 99 99 GLN H H 99 9.266 7.940 1.326 1
1 1069 . 1 1 1 A 99 99 GLN HA H 99 4.460 4.592 -0.132 1
1 1074 . 1 1 1 A 99 99 GLN C C 99 174.990 174.917 0.073 1
1 1075 . 1 1 1 A 99 99 GLN CA C 99 57.563 55.354 2.209 1
1 1076 . 1 1 1 A 99 99 GLN CB C 99 27.280 29.787 -2.507 1
1 1078 . 1 1 1 A 99 99 GLN N N 99 117.717 118.231 -0.514 1
1 1079 . 1 1 1 A 100 100 TYR H H 100 8.402 8.705 -0.303 1
1 1080 . 1 1 1 A 100 100 TYR HA H 100 4.935 5.363 -0.428 1
1 1087 . 1 1 1 A 100 100 TYR C C 100 171.504 172.799 -1.295 1
1 1088 . 1 1 1 A 100 100 TYR CA C 100 55.786 55.818 -0.032 1
1 1089 . 1 1 1 A 100 100 TYR CB C 100 41.090 41.608 -0.518 1
1 1092 . 1 1 1 A 100 100 TYR N N 100 115.081 116.273 -1.192 1
1 1093 . 1 1 1 A 101 101 HIS H H 101 8.829 8.768 0.061 1
1 1094 . 1 1 1 A 101 101 HIS HA H 101 4.525 4.958 -0.433 1
1 1099 . 1 1 1 A 101 101 HIS C C 101 174.935 173.900 1.035 1
1 1100 . 1 1 1 A 101 101 HIS CA C 101 56.327 55.020 1.307 1
1 1101 . 1 1 1 A 101 101 HIS CB C 101 31.020 29.989 1.031 1
1 1104 . 1 1 1 A 101 101 HIS N N 101 120.894 121.775 -0.881 1
1 1105 . 1 1 1 A 102 102 CYS H H 102 7.427 8.293 -0.866 1
1 1106 . 1 1 1 A 102 102 CYS HA H 102 4.561 4.433 0.128 1
1 1109 . 1 1 1 A 102 102 CYS C C 102 175.765 175.673 0.092 1
1 1110 . 1 1 1 A 102 102 CYS CA C 102 57.707 59.037 -1.330 1
1 1111 . 1 1 1 A 102 102 CYS CB C 102 29.130 28.815 0.315 1
1 1112 . 1 1 1 A 102 102 CYS N N 102 131.256 126.589 4.667 1
1 1113 . 1 1 1 A 103 103 GLU H H 103 9.497 8.904 0.593 1
1 1114 . 1 1 1 A 103 103 GLU HA H 103 4.003 4.008 -0.005 1
1 1119 . 1 1 1 A 103 103 GLU C C 103 176.540 178.944 -2.404 1
1 1120 . 1 1 1 A 103 103 GLU CA C 103 58.796 59.600 -0.804 1
1 1121 . 1 1 1 A 103 103 GLU CB C 103 29.280 29.655 -0.375 1
1 1123 . 1 1 1 A 103 103 GLU N N 103 129.829 127.759 2.070 1
1 1124 . 1 1 1 A 104 104 ASN H H 104 7.832 7.870 -0.038 1
1 1125 . 1 1 1 A 104 104 ASN HA H 104 4.457 4.397 0.060 1
1 1130 . 1 1 1 A 104 104 ASN C C 104 176.401 177.770 -1.369 1
1 1131 . 1 1 1 A 104 104 ASN CA C 104 56.053 55.775 0.278 1
1 1132 . 1 1 1 A 104 104 ASN CB C 104 38.400 38.175 0.225 1
1 1133 . 1 1 1 A 104 104 ASN N N 104 117.703 117.541 0.162 1
1 1135 . 1 1 1 A 105 105 CYS H H 105 9.415 7.784 1.631 1
1 1136 . 1 1 1 A 105 105 CYS HA H 105 4.137 4.448 -0.311 1
1 1139 . 1 1 1 A 105 105 CYS C C 105 176.844 175.259 1.585 1
1 1140 . 1 1 1 A 105 105 CYS CA C 105 64.328 59.219 5.109 1
1 1141 . 1 1 1 A 105 105 CYS CB C 105 30.350 27.863 2.487 1
1 1142 . 1 1 1 A 105 105 CYS N N 105 124.939 115.629 9.310 1
1 1143 . 1 1 1 A 106 106 GLY H H 106 8.145 8.735 -0.590 1
1 1144 . 1 1 1 A 106 106 GLY HA2 H 106 3.980 3.823 0.157 1
1 1145 . 1 1 1 A 106 106 GLY HA3 H 106 3.502 3.877 -0.375 1
1 1146 . 1 1 1 A 106 106 GLY C C 106 172.500 173.366 -0.866 1
1 1147 . 1 1 1 A 106 106 GLY CA C 106 44.968 45.877 -0.909 1
1 1148 . 1 1 1 A 106 106 GLY N N 106 106.090 109.630 -3.540 1
1 1149 . 1 1 1 A 107 107 ILE H H 107 6.465 7.201 -0.736 1
1 1150 . 1 1 1 A 107 107 ILE HA H 107 4.878 5.010 -0.132 1
1 1160 . 1 1 1 A 107 107 ILE C C 107 174.824 174.022 0.802 1
1 1161 . 1 1 1 A 107 107 ILE CA C 107 58.226 58.525 -0.299 1
1 1162 . 1 1 1 A 107 107 ILE CB C 107 44.460 42.296 2.164 1
1 1166 . 1 1 1 A 107 107 ILE N N 107 107.914 114.788 -6.874 1
1 1167 . 1 1 1 A 108 108 CYS H H 108 7.041 8.849 -1.808 1
1 1168 . 1 1 1 A 108 108 CYS HA H 108 5.018 5.465 -0.447 1
1 1171 . 1 1 1 A 108 108 CYS C C 108 175.461 172.896 2.565 1
1 1172 . 1 1 1 A 108 108 CYS CA C 108 62.097 56.646 5.451 1
1 1173 . 1 1 1 A 108 108 CYS CB C 108 31.353 31.155 0.198 1
1 1174 . 1 1 1 A 108 108 CYS N N 108 122.441 120.897 1.544 1
1 1175 . 1 1 1 A 109 109 ARG H H 109 8.561 8.386 0.175 1
1 1176 . 1 1 1 A 109 109 ARG HA H 109 4.239 4.506 -0.267 1
1 1183 . 1 1 1 A 109 109 ARG C C 109 174.271 174.088 0.183 1
1 1184 . 1 1 1 A 109 109 ARG CA C 109 52.962 55.043 -2.081 1
1 1185 . 1 1 1 A 109 109 ARG CB C 109 33.903 34.235 -0.332 1
1 1188 . 1 1 1 A 109 109 ARG N N 109 121.163 120.558 0.605 1
1 1189 . 1 1 1 A 110 110 ILE H H 110 7.847 8.348 -0.501 1
1 1190 . 1 1 1 A 110 110 ILE HA H 110 3.531 3.842 -0.311 1
1 1200 . 1 1 1 A 110 110 ILE C C 110 175.405 175.930 -0.525 1
1 1201 . 1 1 1 A 110 110 ILE CA C 110 62.201 62.787 -0.586 1
1 1202 . 1 1 1 A 110 110 ILE CB C 110 36.860 36.832 0.028 1
1 1206 . 1 1 1 A 110 110 ILE N N 110 118.955 124.875 -5.920 1
1 1207 . 1 1 1 A 111 111 GLY H H 111 6.928 8.266 -1.338 1
1 1208 . 1 1 1 A 111 111 GLY HA2 H 111 4.564 4.019 0.545 1
1 1209 . 1 1 1 A 111 111 GLY HA3 H 111 4.135 4.106 0.029 1
1 1210 . 1 1 1 A 111 111 GLY CA C 111 43.068 45.200 -2.132 1
1 1211 . 1 1 1 A 111 111 GLY N N 111 113.782 114.581 -0.799 1
1 1212 . 1 1 1 A 112 112 PRO HA H 112 4.990 4.851 0.139 1
1 1219 . 1 1 1 A 112 112 PRO C C 112 177.342 177.781 -0.439 1
1 1220 . 1 1 1 A 112 112 PRO CA C 112 62.920 63.243 -0.323 1
1 1221 . 1 1 1 A 112 112 PRO CB C 112 34.807 31.838 2.969 1
1 1224 . 1 1 1 A 113 113 LYS H H 113 8.989 8.095 0.894 1
1 1225 . 1 1 1 A 113 113 LYS HA H 113 3.144 4.047 -0.903 1
1 1234 . 1 1 1 A 113 113 LYS C C 113 177.536 178.086 -0.550 1
1 1235 . 1 1 1 A 113 113 LYS CA C 113 59.883 58.790 1.093 1
1 1236 . 1 1 1 A 113 113 LYS CB C 113 32.260 31.642 0.618 1
1 1240 . 1 1 1 A 113 113 LYS N N 113 123.545 123.405 0.140 1
1 1241 . 1 1 1 A 114 114 GLU H H 114 9.080 9.105 -0.025 1
1 1242 . 1 1 1 A 114 114 GLU HA H 114 4.199 4.098 0.101 1
1 1247 . 1 1 1 A 114 114 GLU C C 114 176.374 177.729 -1.355 1
1 1248 . 1 1 1 A 114 114 GLU CA C 114 58.733 58.804 -0.071 1
1 1249 . 1 1 1 A 114 114 GLU CB C 114 28.077 28.616 -0.539 1
1 1251 . 1 1 1 A 114 114 GLU N N 114 114.832 120.598 -5.766 1
1 1252 . 1 1 1 A 115 115 ASP H H 115 7.799 7.998 -0.199 1
1 1253 . 1 1 1 A 115 115 ASP HA H 115 4.642 4.668 -0.026 1
1 1256 . 1 1 1 A 115 115 ASP C C 115 176.374 175.665 0.709 1
1 1257 . 1 1 1 A 115 115 ASP CA C 115 54.470 55.066 -0.596 1
1 1258 . 1 1 1 A 115 115 ASP CB C 115 40.850 42.332 -1.482 1
1 1259 . 1 1 1 A 115 115 ASP N N 115 118.858 118.012 0.846 1
1 1260 . 1 1 1 A 116 116 PHE H H 116 8.063 7.931 0.132 1
1 1261 . 1 1 1 A 116 116 PHE HA H 116 5.239 5.628 -0.389 1
1 1264 . 1 1 1 A 116 116 PHE C C 116 173.413 175.398 -1.985 1
1 1265 . 1 1 1 A 116 116 PHE CA C 116 57.708 56.163 1.545 1
1 1266 . 1 1 1 A 116 116 PHE CB C 116 44.557 42.165 2.392 1
1 1267 . 1 1 1 A 116 116 PHE N N 116 120.567 116.869 3.698 1
1 1268 . 1 1 1 A 117 117 PHE H H 117 9.439 8.813 0.626 1
1 1269 . 1 1 1 A 117 117 PHE HA H 117 5.091 5.630 -0.539 1
1 1277 . 1 1 1 A 117 117 PHE C C 117 171.614 172.808 -1.194 1
1 1278 . 1 1 1 A 117 117 PHE CA C 117 55.311 55.432 -0.121 1
1 1279 . 1 1 1 A 117 117 PHE CB C 117 41.887 42.119 -0.232 1
1 1283 . 1 1 1 A 117 117 PHE N N 117 118.040 119.366 -1.326 1
1 1284 . 1 1 1 A 118 118 HIS H H 118 8.779 9.087 -0.308 1
1 1285 . 1 1 1 A 118 118 HIS HA H 118 4.836 4.848 -0.012 1
1 1289 . 1 1 1 A 118 118 HIS C C 118 174.879 173.922 0.957 1
1 1290 . 1 1 1 A 118 118 HIS CA C 118 55.322 55.694 -0.372 1
1 1291 . 1 1 1 A 118 118 HIS CB C 118 30.950 31.115 -0.165 1
1 1293 . 1 1 1 A 118 118 HIS N N 118 121.208 120.717 0.491 1
1 1294 . 1 1 1 A 119 119 CYS H H 119 8.123 8.522 -0.399 1
1 1295 . 1 1 1 A 119 119 CYS HA H 119 4.529 4.641 -0.112 1
1 1298 . 1 1 1 A 119 119 CYS C C 119 176.567 174.081 2.486 1
1 1299 . 1 1 1 A 119 119 CYS CA C 119 58.957 59.227 -0.270 1
1 1300 . 1 1 1 A 119 119 CYS CB C 119 30.090 28.144 1.946 1
1 1301 . 1 1 1 A 119 119 CYS N N 119 131.659 127.202 4.457 1
1 1302 . 1 1 1 A 120 120 LEU H H 120 8.970 8.719 0.251 1
1 1303 . 1 1 1 A 120 120 LEU N N 120 130.361 130.119 0.242 1
1 1304 . 1 1 1 A 121 121 LYS HA H 121 4.299 3.943 0.356 1
1 1313 . 1 1 1 A 121 121 LYS CA C 121 58.727 57.200 1.527 1
1 1314 . 1 1 1 A 121 121 LYS CB C 121 33.210 31.102 2.108 1
1 1318 . 1 1 1 A 123 123 ASN HA H 123 4.438 4.760 -0.322 1
1 1323 . 1 1 1 A 123 123 ASN C C 123 172.444 173.742 -1.298 1
1 1324 . 1 1 1 A 123 123 ASN CA C 123 53.448 54.671 -1.223 1
1 1325 . 1 1 1 A 123 123 ASN CB C 123 37.130 37.041 0.089 1
1 1327 . 1 1 1 A 124 124 LEU H H 124 6.596 7.253 -0.657 1
1 1328 . 1 1 1 A 124 124 LEU HA H 124 4.576 4.817 -0.241 1
1 1338 . 1 1 1 A 124 124 LEU C C 124 175.903 175.157 0.746 1
1 1339 . 1 1 1 A 124 124 LEU CA C 124 54.043 53.125 0.918 1
1 1340 . 1 1 1 A 124 124 LEU CB C 124 45.837 45.447 0.390 1
1 1344 . 1 1 1 A 124 124 LEU N N 124 115.443 118.272 -2.829 1
1 1345 . 1 1 1 A 125 125 CYS H H 125 6.342 8.856 -2.514 1
1 1346 . 1 1 1 A 125 125 CYS HA H 125 5.033 5.418 -0.385 1
1 1349 . 1 1 1 A 125 125 CYS C C 125 175.101 173.754 1.347 1
1 1350 . 1 1 1 A 125 125 CYS CA C 125 62.046 57.420 4.626 1
1 1351 . 1 1 1 A 125 125 CYS CB C 125 30.840 29.616 1.224 1
1 1352 . 1 1 1 A 125 125 CYS N N 125 118.685 121.189 -2.504 1
1 1353 . 1 1 1 A 126 126 LEU H H 126 8.894 8.287 0.607 1
1 1354 . 1 1 1 A 126 126 LEU HA H 126 4.565 5.020 -0.455 1
1 1364 . 1 1 1 A 126 126 LEU C C 126 174.879 175.790 -0.911 1
1 1365 . 1 1 1 A 126 126 LEU CA C 126 52.751 53.269 -0.518 1
1 1366 . 1 1 1 A 126 126 LEU CB C 126 46.090 44.683 1.407 1
1 1370 . 1 1 1 A 126 126 LEU N N 126 124.501 125.691 -1.190 1
1 1371 . 1 1 1 A 127 127 ALA H H 127 8.378 8.712 -0.334 1
1 1372 . 1 1 1 A 127 127 ALA HA H 127 3.957 4.598 -0.641 1
1 1376 . 1 1 1 A 127 127 ALA C C 127 179.085 178.342 0.743 1
1 1377 . 1 1 1 A 127 127 ALA CA C 127 52.554 51.626 0.928 1
1 1378 . 1 1 1 A 127 127 ALA CB C 127 18.527 19.661 -1.134 1
1 1379 . 1 1 1 A 127 127 ALA N N 127 123.011 123.589 -0.578 1
1 1380 . 1 1 1 A 128 128 MET H H 128 8.237 8.556 -0.319 1
1 1385 . 1 1 1 A 128 128 MET N N 128 120.642 120.281 0.361 1
1 1386 . 1 1 1 A 129 129 ASN HA H 129 4.502 4.467 0.035 1
1 1389 . 1 1 1 A 129 129 ASN C C 129 175.931 177.506 -1.575 1
1 1390 . 1 1 1 A 129 129 ASN CA C 129 55.064 55.743 -0.679 1
1 1391 . 1 1 1 A 129 129 ASN CB C 129 36.920 38.779 -1.859 1
1 1392 . 1 1 1 A 130 130 LEU H H 130 8.211 7.587 0.624 1
1 1393 . 1 1 1 A 130 130 LEU HA H 130 4.489 4.067 0.422 1
1 1403 . 1 1 1 A 130 130 LEU C C 130 178.836 176.577 2.259 1
1 1404 . 1 1 1 A 130 130 LEU CA C 130 54.653 57.717 -3.064 1
1 1405 . 1 1 1 A 130 130 LEU CB C 130 41.887 41.469 0.418 1
1 1409 . 1 1 1 A 130 130 LEU N N 130 118.563 120.381 -1.818 1
1 1410 . 1 1 1 A 131 131 GLN H H 131 7.953 7.948 0.005 1
1 1411 . 1 1 1 A 131 131 GLN HA H 131 3.729 3.918 -0.189 1
1 1418 . 1 1 1 A 131 131 GLN CA C 131 59.310 57.103 2.207 1
1 1419 . 1 1 1 A 131 131 GLN CB C 131 28.340 26.891 1.449 1
1 1421 . 1 1 1 A 131 131 GLN N N 131 123.929 117.041 6.888 1
1 1423 . 1 1 1 A 132 132 GLY HA2 H 132 4.034 3.843 0.191 1
1 1424 . 1 1 1 A 132 132 GLY HA3 H 132 3.865 4.002 -0.137 1
1 1425 . 1 1 1 A 132 132 GLY C C 132 174.547 174.582 -0.035 1
1 1426 . 1 1 1 A 132 132 GLY CA C 132 45.902 45.990 -0.088 1
1 1427 . 1 1 1 A 133 133 ARG H H 133 7.735 7.627 0.108 1
1 1428 . 1 1 1 A 133 133 ARG HA H 133 4.611 4.218 0.393 1
1 1435 . 1 1 1 A 133 133 ARG C C 133 175.461 175.483 -0.022 1
1 1436 . 1 1 1 A 133 133 ARG CA C 133 54.987 55.561 -0.574 1
1 1437 . 1 1 1 A 133 133 ARG CB C 133 31.470 29.352 2.118 1
1 1440 . 1 1 1 A 133 133 ARG N N 133 118.194 120.044 -1.850 1
1 1441 . 1 1 1 A 134 134 HIS H H 134 7.803 8.282 -0.479 1
1 1444 . 1 1 1 A 134 134 HIS N N 134 118.700 121.625 -2.925 1
1 1445 . 1 1 1 A 135 135 LYS HA H 135 4.331 4.317 0.014 1
1 1454 . 1 1 1 A 135 135 LYS C C 135 174.852 176.601 -1.749 1
1 1455 . 1 1 1 A 135 135 LYS CA C 135 55.390 55.419 -0.029 1
1 1456 . 1 1 1 A 135 135 LYS CB C 135 32.970 32.223 0.747 1
1 1460 . 1 1 1 A 136 136 CYS H H 136 7.801 8.646 -0.845 1
1 1461 . 1 1 1 A 136 136 CYS HA H 136 4.113 4.605 -0.492 1
1 1464 . 1 1 1 A 136 136 CYS C C 136 174.879 174.066 0.813 1
1 1465 . 1 1 1 A 136 136 CYS CA C 136 60.028 58.816 1.212 1
1 1466 . 1 1 1 A 136 136 CYS CB C 136 30.350 27.740 2.610 1
1 1467 . 1 1 1 A 136 136 CYS N N 136 126.055 124.653 1.402 1
1 10 . 2 1 1 A 2 2 ALA H H 2 8.220 7.813 0.407 1
1 11 . 2 1 1 A 2 2 ALA HA H 2 4.321 4.476 -0.155 1
1 15 . 2 1 1 A 2 2 ALA C C 2 177.564 175.957 1.607 1
1 16 . 2 1 1 A 2 2 ALA CA C 2 52.383 51.473 0.910 1
1 17 . 2 1 1 A 2 2 ALA CB C 2 19.290 19.762 -0.472 1
1 18 . 2 1 1 A 2 2 ALA N N 2 125.223 122.668 2.555 1
1 19 . 2 1 1 A 3 3 ALA H H 3 8.246 8.971 -0.725 1
1 20 . 2 1 1 A 3 3 ALA N N 3 123.250 127.038 -3.788 1
1 21 . 2 1 1 A 5 5 ALA HA H 5 4.415 4.625 -0.210 1
1 25 . 2 1 1 A 5 5 ALA C C 5 177.481 177.041 0.440 1
1 26 . 2 1 1 A 5 5 ALA CA C 5 52.423 51.377 1.046 1
1 27 . 2 1 1 A 5 5 ALA CB C 5 19.420 20.692 -1.272 1
1 28 . 2 1 1 A 6 6 ARG H H 6 8.239 7.702 0.537 1
1 29 . 2 1 1 A 6 6 ARG HA H 6 4.371 4.406 -0.035 1
1 36 . 2 1 1 A 6 6 ARG C C 6 176.180 175.923 0.257 1
1 37 . 2 1 1 A 6 6 ARG CA C 6 56.353 56.127 0.226 1
1 38 . 2 1 1 A 6 6 ARG CB C 6 31.170 30.332 0.838 1
1 41 . 2 1 1 A 6 6 ARG N N 6 120.436 120.789 -0.353 1
1 42 . 2 1 1 A 7 7 GLU H H 7 8.535 8.945 -0.410 1
1 43 . 2 1 1 A 7 7 GLU HA H 7 4.335 4.580 -0.245 1
1 48 . 2 1 1 A 7 7 GLU C C 7 176.346 175.852 0.494 1
1 49 . 2 1 1 A 7 7 GLU CA C 7 56.740 56.708 0.032 1
1 50 . 2 1 1 A 7 7 GLU CB C 7 30.390 31.453 -1.063 1
1 52 . 2 1 1 A 7 7 GLU N N 7 122.189 124.069 -1.880 1
1 53 . 2 1 1 A 8 8 ASP H H 8 8.347 8.292 0.055 1
1 54 . 2 1 1 A 8 8 ASP N N 8 121.112 119.646 1.466 1
1 55 . 2 1 1 A 9 9 GLY HA2 H 9 3.975 4.214 -0.239 1
1 56 . 2 1 1 A 9 9 GLY HA3 H 9 3.975 4.214 -0.239 1
1 57 . 2 1 1 A 9 9 GLY C C 9 174.243 173.666 0.577 1
1 58 . 2 1 1 A 9 9 GLY CA C 9 45.933 45.709 0.224 1
1 59 . 2 1 1 A 10 10 ALA H H 10 8.111 8.042 0.069 1
1 60 . 2 1 1 A 10 10 ALA N N 10 123.721 123.754 -0.033 1
1 61 . 2 1 1 A 12 12 GLY HA2 H 12 3.992 4.210 -0.218 1
1 62 . 2 1 1 A 12 12 GLY HA3 H 12 3.992 4.210 -0.218 1
1 63 . 2 1 1 A 12 12 GLY C C 12 173.883 171.835 2.048 1
1 64 . 2 1 1 A 12 12 GLY CA C 12 45.381 44.965 0.416 1
1 65 . 2 1 1 A 13 13 GLU H H 13 8.224 9.061 -0.837 1
1 66 . 2 1 1 A 13 13 GLU HA H 13 4.367 5.139 -0.772 1
1 71 . 2 1 1 A 13 13 GLU C C 13 176.125 174.532 1.593 1
1 72 . 2 1 1 A 13 13 GLU CA C 13 56.349 55.050 1.299 1
1 73 . 2 1 1 A 13 13 GLU CB C 13 29.560 33.582 -4.022 1
1 75 . 2 1 1 A 13 13 GLU N N 13 120.148 125.706 -5.558 1
1 76 . 2 1 1 A 14 14 GLU H H 14 8.508 9.123 -0.615 1
1 77 . 2 1 1 A 14 14 GLU HA H 14 4.302 5.112 -0.810 1
1 82 . 2 1 1 A 14 14 GLU C C 14 176.623 174.199 2.424 1
1 83 . 2 1 1 A 14 14 GLU CA C 14 56.497 55.678 0.819 1
1 84 . 2 1 1 A 14 14 GLU CB C 14 30.110 30.442 -0.332 1
1 86 . 2 1 1 A 14 14 GLU N N 14 122.160 124.010 -1.850 1
1 87 . 2 1 1 A 15 15 ARG H H 15 8.356 9.022 -0.666 1
1 88 . 2 1 1 A 15 15 ARG HA H 15 4.366 4.998 -0.632 1
1 95 . 2 1 1 A 15 15 ARG C C 15 176.844 175.202 1.642 1
1 96 . 2 1 1 A 15 15 ARG CA C 15 56.010 54.910 1.100 1
1 97 . 2 1 1 A 15 15 ARG CB C 15 30.890 32.487 -1.597 1
1 100 . 2 1 1 A 15 15 ARG N N 15 121.945 126.535 -4.590 1
1 101 . 2 1 1 A 16 16 GLY H H 16 8.414 8.581 -0.167 1
1 102 . 2 1 1 A 16 16 GLY HA2 H 16 4.022 4.140 -0.118 1
1 103 . 2 1 1 A 16 16 GLY HA3 H 16 4.022 4.141 -0.119 1
1 104 . 2 1 1 A 16 16 GLY C C 16 174.326 173.676 0.650 1
1 105 . 2 1 1 A 16 16 GLY CA C 16 45.620 45.748 -0.128 1
1 106 . 2 1 1 A 16 16 GLY N N 16 109.734 113.922 -4.188 1
1 107 . 2 1 1 A 17 17 GLN H H 17 8.184 7.943 0.241 1
1 108 . 2 1 1 A 17 17 GLN HA H 17 4.366 4.715 -0.349 1
1 113 . 2 1 1 A 17 17 GLN C C 17 175.544 175.188 0.356 1
1 114 . 2 1 1 A 17 17 GLN CA C 17 55.749 55.198 0.551 1
1 115 . 2 1 1 A 17 17 GLN CB C 17 29.367 29.988 -0.621 1
1 117 . 2 1 1 A 17 17 GLN N N 17 119.546 121.707 -2.161 1
1 118 . 2 1 1 A 18 18 ARG H H 18 8.366 8.568 -0.202 1
1 119 . 2 1 1 A 18 18 ARG HA H 18 4.487 4.889 -0.402 1
1 126 . 2 1 1 A 18 18 ARG C C 18 176.042 175.856 0.186 1
1 127 . 2 1 1 A 18 18 ARG CA C 18 55.735 54.239 1.496 1
1 128 . 2 1 1 A 18 18 ARG CB C 18 31.170 33.653 -2.483 1
1 131 . 2 1 1 A 18 18 ARG N N 18 122.330 123.031 -0.701 1
1 132 . 2 1 1 A 19 19 GLY H H 19 8.192 8.529 -0.337 1
1 133 . 2 1 1 A 19 19 GLY HA2 H 19 4.852 4.106 0.746 1
1 134 . 2 1 1 A 19 19 GLY HA3 H 19 3.894 4.126 -0.232 1
1 135 . 2 1 1 A 19 19 GLY C C 19 172.361 171.996 0.365 1
1 136 . 2 1 1 A 19 19 GLY CA C 19 45.580 44.781 0.799 1
1 137 . 2 1 1 A 19 19 GLY N N 19 109.658 107.938 1.720 1
1 138 . 2 1 1 A 20 20 CYS H H 20 8.843 7.956 0.887 1
1 139 . 2 1 1 A 20 20 CYS HA H 20 5.147 5.006 0.141 1
1 142 . 2 1 1 A 20 20 CYS C C 20 175.211 174.508 0.703 1
1 143 . 2 1 1 A 20 20 CYS CA C 20 56.712 58.145 -1.433 1
1 144 . 2 1 1 A 20 20 CYS CB C 20 33.530 30.689 2.841 1
1 145 . 2 1 1 A 20 20 CYS N N 20 120.185 118.223 1.962 1
1 146 . 2 1 1 A 21 21 GLU H H 21 8.981 8.910 0.071 1
1 147 . 2 1 1 A 21 21 GLU HA H 21 4.100 4.005 0.095 1
1 152 . 2 1 1 A 21 21 GLU C C 21 176.014 177.235 -1.221 1
1 153 . 2 1 1 A 21 21 GLU CA C 21 57.134 58.557 -1.423 1
1 154 . 2 1 1 A 21 21 GLU CB C 21 28.890 28.909 -0.019 1
1 156 . 2 1 1 A 21 21 GLU N N 21 116.078 124.171 -8.093 1
1 157 . 2 1 1 A 22 22 HIS H H 22 9.342 7.602 1.740 1
1 158 . 2 1 1 A 22 22 HIS HA H 22 4.210 4.311 -0.101 1
1 161 . 2 1 1 A 22 22 HIS C C 22 175.128 174.583 0.545 1
1 162 . 2 1 1 A 22 22 HIS CA C 22 58.945 57.233 1.712 1
1 163 . 2 1 1 A 22 22 HIS CB C 22 33.160 31.643 1.517 1
1 164 . 2 1 1 A 22 22 HIS N N 22 122.296 117.134 5.162 1
1 165 . 2 1 1 A 23 23 TYR H H 23 7.931 7.850 0.081 1
1 166 . 2 1 1 A 23 23 TYR HA H 23 4.856 5.247 -0.391 1
1 171 . 2 1 1 A 23 23 TYR C C 23 173.108 174.218 -1.110 1
1 172 . 2 1 1 A 23 23 TYR CA C 23 57.852 56.079 1.773 1
1 173 . 2 1 1 A 23 23 TYR CB C 23 45.300 42.574 2.726 1
1 175 . 2 1 1 A 23 23 TYR N N 23 115.205 115.364 -0.159 1
1 176 . 2 1 1 A 24 24 ASP H H 24 8.384 8.899 -0.515 1
1 177 . 2 1 1 A 24 24 ASP HA H 24 5.160 5.144 0.016 1
1 180 . 2 1 1 A 24 24 ASP C C 24 174.437 174.837 -0.400 1
1 181 . 2 1 1 A 24 24 ASP CA C 24 53.343 53.567 -0.224 1
1 182 . 2 1 1 A 24 24 ASP CB C 24 41.470 41.326 0.144 1
1 183 . 2 1 1 A 24 24 ASP N N 24 122.016 123.694 -1.678 1
1 184 . 2 1 1 A 25 25 ARG H H 25 7.313 8.861 -1.548 1
1 185 . 2 1 1 A 25 25 ARG HA H 25 5.331 5.210 0.121 1
1 192 . 2 1 1 A 25 25 ARG C C 25 175.045 175.905 -0.860 1
1 193 . 2 1 1 A 25 25 ARG CA C 25 54.224 54.276 -0.052 1
1 194 . 2 1 1 A 25 25 ARG CB C 25 34.090 34.219 -0.129 1
1 197 . 2 1 1 A 25 25 ARG N N 25 115.898 121.812 -5.914 1
1 198 . 2 1 1 A 26 26 GLY H H 26 9.387 8.866 0.521 1
1 199 . 2 1 1 A 26 26 GLY HA2 H 26 4.622 4.014 0.608 1
1 200 . 2 1 1 A 26 26 GLY HA3 H 26 3.788 4.121 -0.333 1
1 201 . 2 1 1 A 26 26 GLY C C 26 170.978 172.804 -1.826 1
1 202 . 2 1 1 A 26 26 GLY CA C 26 44.794 45.791 -0.997 1
1 203 . 2 1 1 A 26 26 GLY N N 26 105.653 108.092 -2.439 1
1 204 . 2 1 1 A 27 27 CYS H H 27 6.864 7.573 -0.709 1
1 205 . 2 1 1 A 27 27 CYS HA H 27 5.195 5.331 -0.136 1
1 208 . 2 1 1 A 27 27 CYS C C 27 171.144 172.874 -1.730 1
1 209 . 2 1 1 A 27 27 CYS CA C 27 52.349 57.972 -5.623 1
1 210 . 2 1 1 A 27 27 CYS CB C 27 30.997 31.646 -0.649 1
1 211 . 2 1 1 A 27 27 CYS N N 27 110.921 117.032 -6.111 1
1 212 . 2 1 1 A 28 28 LEU H H 28 8.310 8.689 -0.379 1
1 213 . 2 1 1 A 28 28 LEU HA H 28 4.651 4.917 -0.266 1
1 223 . 2 1 1 A 28 28 LEU C C 28 176.827 176.590 0.237 1
1 224 . 2 1 1 A 28 28 LEU CA C 28 53.054 53.482 -0.428 1
1 225 . 2 1 1 A 28 28 LEU CB C 28 44.200 43.498 0.702 1
1 229 . 2 1 1 A 28 28 LEU N N 28 115.519 123.834 -8.315 1
1 230 . 2 1 1 A 29 29 LEU H H 29 8.800 8.833 -0.033 1
1 231 . 2 1 1 A 29 29 LEU HA H 29 4.313 4.469 -0.156 1
1 240 . 2 1 1 A 29 29 LEU C C 29 175.571 176.057 -0.486 1
1 241 . 2 1 1 A 29 29 LEU CA C 29 54.388 54.528 -0.140 1
1 242 . 2 1 1 A 29 29 LEU CB C 29 42.780 41.047 1.733 1
1 245 . 2 1 1 A 29 29 LEU N N 29 118.712 125.645 -6.933 1
1 246 . 2 1 1 A 30 30 LYS H H 30 8.009 8.465 -0.456 1
1 247 . 2 1 1 A 30 30 LYS HA H 30 4.592 4.649 -0.057 1
1 256 . 2 1 1 A 30 30 LYS C C 30 174.990 174.886 0.104 1
1 257 . 2 1 1 A 30 30 LYS CA C 30 54.999 56.395 -1.396 1
1 258 . 2 1 1 A 30 30 LYS CB C 30 32.330 32.725 -0.395 1
1 262 . 2 1 1 A 30 30 LYS N N 30 122.310 126.273 -3.963 1
1 263 . 2 1 1 A 31 31 ALA H H 31 9.238 8.412 0.826 1
1 264 . 2 1 1 A 31 31 ALA HA H 31 4.477 4.490 -0.013 1
1 268 . 2 1 1 A 31 31 ALA CA C 31 50.190 49.234 0.956 1
1 269 . 2 1 1 A 31 31 ALA CB C 31 21.637 19.931 1.706 1
1 270 . 2 1 1 A 31 31 ALA N N 31 133.864 130.207 3.657 1
1 271 . 2 1 1 A 32 32 PRO HA H 32 4.637 4.397 0.240 1
1 278 . 2 1 1 A 32 32 PRO C C 32 175.737 177.299 -1.562 1
1 279 . 2 1 1 A 32 32 PRO CA C 32 64.259 64.135 0.124 1
1 280 . 2 1 1 A 32 32 PRO CB C 32 31.740 31.782 -0.042 1
1 283 . 2 1 1 A 33 33 CYS H H 33 8.779 8.283 0.496 1
1 284 . 2 1 1 A 33 33 CYS HA H 33 4.321 4.200 0.121 1
1 287 . 2 1 1 A 33 33 CYS C C 33 176.733 175.330 1.403 1
1 288 . 2 1 1 A 33 33 CYS CA C 33 54.398 61.812 -7.414 1
1 289 . 2 1 1 A 33 33 CYS CB C 33 30.697 27.035 3.662 1
1 290 . 2 1 1 A 33 33 CYS N N 33 120.005 116.357 3.648 1
1 291 . 2 1 1 A 34 34 CYS H H 34 7.424 7.744 -0.320 1
1 292 . 2 1 1 A 34 34 CYS HA H 34 4.896 4.653 0.243 1
1 295 . 2 1 1 A 34 34 CYS C C 34 174.935 174.845 0.090 1
1 296 . 2 1 1 A 34 34 CYS CA C 34 56.962 58.592 -1.630 1
1 297 . 2 1 1 A 34 34 CYS CB C 34 31.067 29.702 1.365 1
1 298 . 2 1 1 A 34 34 CYS N N 34 115.034 117.002 -1.968 1
1 299 . 2 1 1 A 35 35 ASP H H 35 8.368 8.181 0.187 1
1 300 . 2 1 1 A 35 35 ASP HA H 35 4.454 4.238 0.216 1
1 303 . 2 1 1 A 35 35 ASP C C 35 174.354 174.990 -0.636 1
1 304 . 2 1 1 A 35 35 ASP CA C 35 56.222 55.490 0.732 1
1 305 . 2 1 1 A 35 35 ASP CB C 35 39.730 39.681 0.049 1
1 306 . 2 1 1 A 35 35 ASP N N 35 121.381 117.094 4.287 1
1 307 . 2 1 1 A 36 36 LYS H H 36 7.227 8.013 -0.786 1
1 308 . 2 1 1 A 36 36 LYS HA H 36 4.451 4.525 -0.074 1
1 317 . 2 1 1 A 36 36 LYS C C 36 175.433 175.623 -0.190 1
1 318 . 2 1 1 A 36 36 LYS CA C 36 56.270 55.487 0.783 1
1 319 . 2 1 1 A 36 36 LYS CB C 36 36.620 33.915 2.705 1
1 323 . 2 1 1 A 36 36 LYS N N 36 117.673 118.441 -0.768 1
1 324 . 2 1 1 A 37 37 LEU H H 37 8.053 8.200 -0.147 1
1 325 . 2 1 1 A 37 37 LEU HA H 37 5.292 4.866 0.426 1
1 335 . 2 1 1 A 37 37 LEU C C 37 176.484 175.111 1.373 1
1 336 . 2 1 1 A 37 37 LEU CA C 37 53.348 52.864 0.484 1
1 337 . 2 1 1 A 37 37 LEU CB C 37 42.400 42.916 -0.516 1
1 341 . 2 1 1 A 37 37 LEU N N 37 120.994 122.531 -1.537 1
1 342 . 2 1 1 A 38 38 TYR H H 38 8.741 8.472 0.269 1
1 343 . 2 1 1 A 38 38 TYR HA H 38 5.002 4.879 0.123 1
1 350 . 2 1 1 A 38 38 TYR C C 38 176.374 175.886 0.488 1
1 351 . 2 1 1 A 38 38 TYR CA C 38 57.081 56.830 0.251 1
1 352 . 2 1 1 A 38 38 TYR CB C 38 45.647 41.722 3.925 1
1 355 . 2 1 1 A 38 38 TYR N N 38 121.128 122.359 -1.231 1
1 356 . 2 1 1 A 39 39 THR H H 39 9.402 8.961 0.441 1
1 357 . 2 1 1 A 39 39 THR HA H 39 4.098 4.014 0.084 1
1 362 . 2 1 1 A 39 39 THR C C 39 173.496 175.218 -1.722 1
1 363 . 2 1 1 A 39 39 THR CA C 39 67.062 66.086 0.976 1
1 364 . 2 1 1 A 39 39 THR CB C 39 68.047 68.703 -0.656 1
1 366 . 2 1 1 A 39 39 THR N N 39 116.641 117.882 -1.241 1
1 367 . 2 1 1 A 40 40 CYS H H 40 7.317 8.020 -0.703 1
1 368 . 2 1 1 A 40 40 CYS HA H 40 4.771 4.751 0.020 1
1 371 . 2 1 1 A 40 40 CYS C C 40 175.128 175.796 -0.668 1
1 372 . 2 1 1 A 40 40 CYS CA C 40 56.577 57.816 -1.239 1
1 373 . 2 1 1 A 40 40 CYS CB C 40 35.087 29.158 5.929 1
1 374 . 2 1 1 A 40 40 CYS N N 40 109.059 119.244 -10.185 1
1 375 . 2 1 1 A 41 41 ARG H H 41 9.201 8.721 0.480 1
1 376 . 2 1 1 A 41 41 ARG HA H 41 3.982 3.962 0.020 1
1 383 . 2 1 1 A 41 41 ARG C C 41 175.101 177.343 -2.242 1
1 384 . 2 1 1 A 41 41 ARG CA C 41 58.591 58.790 -0.199 1
1 385 . 2 1 1 A 41 41 ARG CB C 41 29.640 29.738 -0.098 1
1 388 . 2 1 1 A 41 41 ARG N N 41 121.737 124.505 -2.768 1
1 389 . 2 1 1 A 42 42 LEU H H 42 9.116 7.694 1.422 1
1 390 . 2 1 1 A 42 42 LEU HA H 42 4.029 4.072 -0.043 1
1 400 . 2 1 1 A 42 42 LEU C C 42 179.943 179.407 0.536 1
1 401 . 2 1 1 A 42 42 LEU CA C 42 58.005 57.354 0.651 1
1 402 . 2 1 1 A 42 42 LEU CB C 42 38.960 41.243 -2.283 1
1 406 . 2 1 1 A 42 42 LEU N N 42 126.364 116.778 9.586 1
1 407 . 2 1 1 A 43 43 CYS H H 43 8.785 8.229 0.556 1
1 408 . 2 1 1 A 43 43 CYS HA H 43 4.187 4.152 0.035 1
1 411 . 2 1 1 A 43 43 CYS C C 43 177.785 177.173 0.612 1
1 412 . 2 1 1 A 43 43 CYS CA C 43 66.415 62.369 4.046 1
1 413 . 2 1 1 A 43 43 CYS CB C 43 28.870 27.049 1.821 1
1 414 . 2 1 1 A 43 43 CYS N N 43 124.519 117.241 7.278 1
1 415 . 2 1 1 A 44 44 HIS H H 44 7.604 7.435 0.169 1
1 416 . 2 1 1 A 44 44 HIS HA H 44 1.983 2.769 -0.786 1
1 420 . 2 1 1 A 44 44 HIS C C 44 176.429 175.986 0.443 1
1 421 . 2 1 1 A 44 44 HIS CA C 44 58.760 58.859 -0.099 1
1 422 . 2 1 1 A 44 44 HIS CB C 44 27.990 29.467 -1.477 1
1 423 . 2 1 1 A 44 44 HIS N N 44 117.024 121.202 -4.178 1
1 424 . 2 1 1 A 45 45 ASP H H 45 8.750 8.015 0.735 1
1 425 . 2 1 1 A 45 45 ASP HA H 45 4.116 3.971 0.145 1
1 428 . 2 1 1 A 45 45 ASP C C 45 177.453 178.630 -1.177 1
1 429 . 2 1 1 A 45 45 ASP CA C 45 56.840 57.194 -0.354 1
1 430 . 2 1 1 A 45 45 ASP CB C 45 38.960 40.268 -1.308 1
1 431 . 2 1 1 A 45 45 ASP N N 45 120.440 118.983 1.457 1
1 432 . 2 1 1 A 46 46 ASN H H 46 7.888 8.210 -0.322 1
1 433 . 2 1 1 A 46 46 ASN HA H 46 4.612 4.393 0.219 1
1 438 . 2 1 1 A 46 46 ASN C C 46 175.903 176.741 -0.838 1
1 439 . 2 1 1 A 46 46 ASN CA C 46 54.342 56.984 -2.642 1
1 440 . 2 1 1 A 46 46 ASN CB C 46 38.790 39.549 -0.759 1
1 441 . 2 1 1 A 46 46 ASN N N 46 115.758 116.789 -1.031 1
1 443 . 2 1 1 A 47 47 ASN H H 47 7.384 7.400 -0.016 1
1 444 . 2 1 1 A 47 47 ASN HA H 47 4.893 4.774 0.119 1
1 449 . 2 1 1 A 47 47 ASN C C 47 173.579 175.262 -1.683 1
1 450 . 2 1 1 A 47 47 ASN CA C 47 53.937 53.723 0.214 1
1 451 . 2 1 1 A 47 47 ASN CB C 47 43.130 39.319 3.811 1
1 452 . 2 1 1 A 47 47 ASN N N 47 116.576 114.539 2.037 1
1 454 . 2 1 1 A 48 48 GLU H H 48 7.143 7.428 -0.285 1
1 455 . 2 1 1 A 48 48 GLU HA H 48 4.572 4.476 0.096 1
1 460 . 2 1 1 A 48 48 GLU C C 48 175.627 176.559 -0.932 1
1 461 . 2 1 1 A 48 48 GLU CA C 48 53.727 54.515 -0.788 1
1 462 . 2 1 1 A 48 48 GLU CB C 48 32.480 30.770 1.710 1
1 464 . 2 1 1 A 48 48 GLU N N 48 116.967 117.707 -0.740 1
1 465 . 2 1 1 A 49 49 ASP H H 49 8.748 8.523 0.225 1
1 466 . 2 1 1 A 49 49 ASP HA H 49 4.576 4.541 0.035 1
1 469 . 2 1 1 A 49 49 ASP C C 49 174.796 175.999 -1.203 1
1 470 . 2 1 1 A 49 49 ASP CA C 49 53.027 56.352 -3.325 1
1 471 . 2 1 1 A 49 49 ASP CB C 49 40.340 42.320 -1.980 1
1 472 . 2 1 1 A 49 49 ASP N N 49 119.296 120.928 -1.632 1
1 473 . 2 1 1 A 50 50 HIS H H 50 6.919 7.222 -0.303 1
1 474 . 2 1 1 A 50 50 HIS HA H 50 4.880 5.352 -0.472 1
1 477 . 2 1 1 A 50 50 HIS C C 50 172.942 174.236 -1.294 1
1 478 . 2 1 1 A 50 50 HIS CA C 50 53.978 53.043 0.935 1
1 479 . 2 1 1 A 50 50 HIS CB C 50 30.330 33.058 -2.728 1
1 480 . 2 1 1 A 50 50 HIS N N 50 113.709 114.644 -0.935 1
1 481 . 2 1 1 A 51 51 GLN H H 51 8.646 8.438 0.208 1
1 482 . 2 1 1 A 51 51 GLN HA H 51 4.896 4.586 0.310 1
1 487 . 2 1 1 A 51 51 GLN C C 51 176.512 174.759 1.753 1
1 488 . 2 1 1 A 51 51 GLN CA C 51 54.872 55.409 -0.537 1
1 489 . 2 1 1 A 51 51 GLN CB C 51 30.950 29.982 0.968 1
1 491 . 2 1 1 A 51 51 GLN N N 51 119.379 118.499 0.880 1
1 492 . 2 1 1 A 52 52 LEU H H 52 9.646 8.697 0.949 1
1 493 . 2 1 1 A 52 52 LEU HA H 52 4.206 4.582 -0.376 1
1 503 . 2 1 1 A 52 52 LEU C C 52 175.793 174.598 1.195 1
1 504 . 2 1 1 A 52 52 LEU CA C 52 55.450 53.675 1.775 1
1 505 . 2 1 1 A 52 52 LEU CB C 52 41.407 43.373 -1.966 1
1 509 . 2 1 1 A 52 52 LEU N N 52 128.069 125.385 2.684 1
1 510 . 2 1 1 A 53 53 ASP H H 53 9.281 8.901 0.380 1
1 511 . 2 1 1 A 53 53 ASP HA H 53 4.725 4.590 0.135 1
1 514 . 2 1 1 A 53 53 ASP C C 53 176.401 177.416 -1.015 1
1 515 . 2 1 1 A 53 53 ASP CA C 53 52.590 54.432 -1.842 1
1 516 . 2 1 1 A 53 53 ASP CB C 53 39.990 40.577 -0.587 1
1 517 . 2 1 1 A 53 53 ASP N N 53 128.783 127.106 1.677 1
1 518 . 2 1 1 A 54 54 ARG H H 54 8.496 8.404 0.092 1
1 519 . 2 1 1 A 54 54 ARG HA H 54 3.859 3.818 0.041 1
1 526 . 2 1 1 A 54 54 ARG C C 54 176.346 177.042 -0.696 1
1 527 . 2 1 1 A 54 54 ARG CA C 54 57.357 58.034 -0.677 1
1 528 . 2 1 1 A 54 54 ARG CB C 54 28.890 29.329 -0.439 1
1 531 . 2 1 1 A 54 54 ARG N N 54 125.813 125.193 0.620 1
1 532 . 2 1 1 A 55 55 PHE H H 55 8.005 7.341 0.664 1
1 533 . 2 1 1 A 55 55 PHE HA H 55 4.712 4.361 0.351 1
1 540 . 2 1 1 A 55 55 PHE C C 55 177.481 177.941 -0.460 1
1 541 . 2 1 1 A 55 55 PHE CA C 55 59.080 60.968 -1.888 1
1 542 . 2 1 1 A 55 55 PHE CB C 55 37.447 39.301 -1.854 1
1 545 . 2 1 1 A 55 55 PHE N N 55 120.168 117.770 2.398 1
1 546 . 2 1 1 A 56 56 LYS H H 56 7.681 7.546 0.135 1
1 547 . 2 1 1 A 56 56 LYS HA H 56 4.411 4.320 0.091 1
1 556 . 2 1 1 A 56 56 LYS C C 56 175.959 176.475 -0.516 1
1 557 . 2 1 1 A 56 56 LYS CA C 56 55.459 57.549 -2.090 1
1 558 . 2 1 1 A 56 56 LYS CB C 56 33.590 33.209 0.381 1
1 562 . 2 1 1 A 56 56 LYS N N 56 116.937 117.298 -0.361 1
1 563 . 2 1 1 A 57 57 VAL H H 57 6.553 7.205 -0.652 1
1 564 . 2 1 1 A 57 57 VAL HA H 57 3.408 3.910 -0.502 1
1 572 . 2 1 1 A 57 57 VAL C C 57 173.911 175.327 -1.416 1
1 573 . 2 1 1 A 57 57 VAL CA C 57 65.025 62.130 2.895 1
1 574 . 2 1 1 A 57 57 VAL CB C 57 32.663 32.124 0.539 1
1 577 . 2 1 1 A 57 57 VAL N N 57 119.519 117.394 2.125 1
1 578 . 2 1 1 A 58 58 LYS H H 58 9.182 9.046 0.136 1
1 579 . 2 1 1 A 58 58 LYS HA H 58 4.489 4.633 -0.144 1
1 588 . 2 1 1 A 58 58 LYS C C 58 176.927 175.696 1.231 1
1 589 . 2 1 1 A 58 58 LYS CA C 58 55.913 57.343 -1.430 1
1 590 . 2 1 1 A 58 58 LYS CB C 58 36.340 35.940 0.400 1
1 594 . 2 1 1 A 58 58 LYS N N 58 124.985 125.433 -0.448 1
1 595 . 2 1 1 A 59 59 GLU H H 59 8.799 7.974 0.825 1
1 596 . 2 1 1 A 59 59 GLU HA H 59 5.209 4.762 0.447 1
1 601 . 2 1 1 A 59 59 GLU C C 59 173.911 175.529 -1.618 1
1 602 . 2 1 1 A 59 59 GLU CA C 59 54.670 54.806 -0.136 1
1 603 . 2 1 1 A 59 59 GLU CB C 59 35.180 32.448 2.732 1
1 605 . 2 1 1 A 59 59 GLU N N 59 121.493 117.682 3.811 1
1 606 . 2 1 1 A 60 60 VAL H H 60 8.917 8.921 -0.004 1
1 607 . 2 1 1 A 60 60 VAL HA H 60 4.983 5.100 -0.117 1
1 615 . 2 1 1 A 60 60 VAL C C 60 173.441 173.889 -0.448 1
1 616 . 2 1 1 A 60 60 VAL CA C 60 57.497 59.108 -1.611 1
1 617 . 2 1 1 A 60 60 VAL CB C 60 35.460 35.974 -0.514 1
1 620 . 2 1 1 A 60 60 VAL N N 60 109.266 117.035 -7.769 1
1 621 . 2 1 1 A 61 61 GLN H H 61 8.970 8.442 0.528 1
1 622 . 2 1 1 A 61 61 GLN HA H 61 5.024 4.829 0.195 1
1 629 . 2 1 1 A 61 61 GLN C C 61 175.045 174.608 0.437 1
1 630 . 2 1 1 A 61 61 GLN CA C 61 53.128 54.714 -1.586 1
1 631 . 2 1 1 A 61 61 GLN CB C 61 33.980 30.025 3.955 1
1 633 . 2 1 1 A 61 61 GLN N N 61 118.525 120.312 -1.787 1
1 635 . 2 1 1 A 62 62 CYS H H 62 7.688 8.598 -0.910 1
1 636 . 2 1 1 A 62 62 CYS HA H 62 4.210 4.517 -0.307 1
1 639 . 2 1 1 A 62 62 CYS C C 62 177.951 175.264 2.687 1
1 640 . 2 1 1 A 62 62 CYS CA C 62 59.845 59.757 0.088 1
1 641 . 2 1 1 A 62 62 CYS CB C 62 33.120 28.353 4.767 1
1 642 . 2 1 1 A 62 62 CYS N N 62 128.772 124.751 4.021 1
1 643 . 2 1 1 A 63 63 ILE H H 63 8.192 8.513 -0.321 1
1 644 . 2 1 1 A 63 63 ILE HA H 63 3.984 4.397 -0.413 1
1 654 . 2 1 1 A 63 63 ILE C C 63 175.433 176.519 -1.086 1
1 655 . 2 1 1 A 63 63 ILE CA C 63 63.657 61.722 1.935 1
1 656 . 2 1 1 A 63 63 ILE CB C 63 38.506 37.063 1.443 1
1 660 . 2 1 1 A 63 63 ILE N N 63 127.455 127.428 0.027 1
1 661 . 2 1 1 A 64 64 ASN H H 64 9.181 8.410 0.771 1
1 662 . 2 1 1 A 64 64 ASN HA H 64 4.810 4.917 -0.107 1
1 667 . 2 1 1 A 64 64 ASN C C 64 175.931 176.110 -0.179 1
1 668 . 2 1 1 A 64 64 ASN CA C 64 55.617 53.801 1.816 1
1 669 . 2 1 1 A 64 64 ASN CB C 64 40.640 39.921 0.719 1
1 670 . 2 1 1 A 64 64 ASN N N 64 122.104 119.747 2.357 1
1 672 . 2 1 1 A 65 65 CYS H H 65 9.065 7.632 1.433 1
1 673 . 2 1 1 A 65 65 CYS HA H 65 4.979 4.654 0.325 1
1 676 . 2 1 1 A 65 65 CYS C C 65 176.291 175.251 1.040 1
1 677 . 2 1 1 A 65 65 CYS CA C 65 59.027 58.411 0.616 1
1 678 . 2 1 1 A 65 65 CYS CB C 65 32.030 29.522 2.508 1
1 679 . 2 1 1 A 65 65 CYS N N 65 120.368 115.261 5.107 1
1 680 . 2 1 1 A 66 66 GLU H H 66 7.281 8.169 -0.888 1
1 681 . 2 1 1 A 66 66 GLU HA H 66 4.046 3.868 0.178 1
1 686 . 2 1 1 A 66 66 GLU C C 66 175.211 174.672 0.539 1
1 687 . 2 1 1 A 66 66 GLU CA C 66 58.591 57.530 1.061 1
1 688 . 2 1 1 A 66 66 GLU CB C 66 27.067 27.397 -0.330 1
1 690 . 2 1 1 A 66 66 GLU N N 66 115.012 116.141 -1.129 1
1 691 . 2 1 1 A 67 67 LYS H H 67 8.481 7.789 0.692 1
1 692 . 2 1 1 A 67 67 LYS HA H 67 4.326 4.486 -0.160 1
1 701 . 2 1 1 A 67 67 LYS C C 67 177.923 176.133 1.790 1
1 702 . 2 1 1 A 67 67 LYS CA C 67 57.628 55.907 1.721 1
1 703 . 2 1 1 A 67 67 LYS CB C 67 33.617 33.925 -0.308 1
1 707 . 2 1 1 A 67 67 LYS N N 67 123.514 119.962 3.552 1
1 708 . 2 1 1 A 68 68 ILE H H 68 8.867 8.313 0.554 1
1 709 . 2 1 1 A 68 68 ILE HA H 68 4.976 4.545 0.431 1
1 719 . 2 1 1 A 68 68 ILE C C 68 175.018 175.362 -0.344 1
1 720 . 2 1 1 A 68 68 ILE CA C 68 60.919 60.409 0.510 1
1 721 . 2 1 1 A 68 68 ILE CB C 68 37.090 37.696 -0.606 1
1 725 . 2 1 1 A 68 68 ILE N N 68 133.478 125.477 8.001 1
1 726 . 2 1 1 A 69 69 GLN H H 69 9.269 8.588 0.681 1
1 727 . 2 1 1 A 69 69 GLN HA H 69 5.036 4.875 0.161 1
1 732 . 2 1 1 A 69 69 GLN C C 69 173.607 174.609 -1.002 1
1 733 . 2 1 1 A 69 69 GLN CA C 69 53.419 53.789 -0.370 1
1 734 . 2 1 1 A 69 69 GLN CB C 69 34.997 32.540 2.457 1
1 736 . 2 1 1 A 69 69 GLN N N 69 125.104 123.873 1.231 1
1 737 . 2 1 1 A 70 70 HIS H H 70 8.829 8.725 0.104 1
1 738 . 2 1 1 A 70 70 HIS HA H 70 4.865 4.791 0.074 1
1 741 . 2 1 1 A 70 70 HIS C C 70 174.852 175.312 -0.460 1
1 742 . 2 1 1 A 70 70 HIS CA C 70 56.304 56.758 -0.454 1
1 743 . 2 1 1 A 70 70 HIS CB C 70 30.050 30.455 -0.405 1
1 744 . 2 1 1 A 70 70 HIS N N 70 118.576 120.134 -1.558 1
1 745 . 2 1 1 A 71 71 ALA H H 71 7.768 8.622 -0.854 1
1 746 . 2 1 1 A 71 71 ALA HA H 71 3.977 4.610 -0.633 1
1 750 . 2 1 1 A 71 71 ALA C C 71 175.433 176.968 -1.535 1
1 751 . 2 1 1 A 71 71 ALA CA C 71 54.393 52.291 2.102 1
1 752 . 2 1 1 A 71 71 ALA CB C 71 18.000 18.790 -0.790 1
1 753 . 2 1 1 A 71 71 ALA N N 71 121.438 124.730 -3.292 1
1 754 . 2 1 1 A 72 72 GLN H H 72 7.227 8.283 -1.056 1
1 755 . 2 1 1 A 72 72 GLN HA H 72 4.371 4.542 -0.171 1
1 762 . 2 1 1 A 72 72 GLN C C 72 173.053 175.780 -2.727 1
1 763 . 2 1 1 A 72 72 GLN CA C 72 54.290 54.647 -0.357 1
1 764 . 2 1 1 A 72 72 GLN CB C 72 28.623 29.897 -1.274 1
1 766 . 2 1 1 A 72 72 GLN N N 72 115.858 123.988 -8.130 1
1 768 . 2 1 1 A 73 73 GLN H H 73 8.481 8.628 -0.147 1
1 769 . 2 1 1 A 73 73 GLN HA H 73 3.570 4.154 -0.584 1
1 776 . 2 1 1 A 73 73 GLN C C 73 174.243 174.843 -0.600 1
1 777 . 2 1 1 A 73 73 GLN CA C 73 60.206 56.808 3.398 1
1 778 . 2 1 1 A 73 73 GLN CB C 73 28.850 29.857 -1.007 1
1 780 . 2 1 1 A 73 73 GLN N N 73 116.433 118.090 -1.657 1
1 782 . 2 1 1 A 74 74 THR H H 74 7.211 7.431 -0.220 1
1 783 . 2 1 1 A 74 74 THR HA H 74 4.160 4.639 -0.479 1
1 788 . 2 1 1 A 74 74 THR C C 74 171.836 172.374 -0.538 1
1 789 . 2 1 1 A 74 74 THR CA C 74 59.072 60.778 -1.706 1
1 790 . 2 1 1 A 74 74 THR CB C 74 71.560 71.420 0.140 1
1 792 . 2 1 1 A 74 74 THR N N 74 108.717 111.045 -2.328 1
1 793 . 2 1 1 A 75 75 CYS H H 75 7.676 7.861 -0.185 1
1 794 . 2 1 1 A 75 75 CYS HA H 75 4.158 4.818 -0.660 1
1 797 . 2 1 1 A 75 75 CYS C C 75 178.781 176.035 2.746 1
1 798 . 2 1 1 A 75 75 CYS CA C 75 58.661 57.636 1.025 1
1 799 . 2 1 1 A 75 75 CYS CB C 75 30.840 30.107 0.733 1
1 800 . 2 1 1 A 75 75 CYS N N 75 123.108 123.799 -0.691 1
1 801 . 2 1 1 A 76 76 GLU H H 76 9.203 8.904 0.299 1
1 802 . 2 1 1 A 76 76 GLU HA H 76 4.187 4.080 0.107 1
1 807 . 2 1 1 A 76 76 GLU C C 76 175.488 178.477 -2.989 1
1 808 . 2 1 1 A 76 76 GLU CA C 76 57.306 58.944 -1.638 1
1 809 . 2 1 1 A 76 76 GLU CB C 76 29.347 29.082 0.265 1
1 811 . 2 1 1 A 76 76 GLU N N 76 129.817 126.372 3.445 1
1 812 . 2 1 1 A 77 77 GLU H H 77 9.496 7.599 1.897 1
1 813 . 2 1 1 A 77 77 GLU HA H 77 4.599 4.198 0.401 1
1 818 . 2 1 1 A 77 77 GLU C C 77 177.148 177.202 -0.054 1
1 819 . 2 1 1 A 77 77 GLU CA C 77 57.554 58.479 -0.925 1
1 820 . 2 1 1 A 77 77 GLU CB C 77 31.980 30.333 1.647 1
1 822 . 2 1 1 A 77 77 GLU N N 77 124.795 120.268 4.527 1
1 823 . 2 1 1 A 78 78 CYS H H 78 8.967 7.748 1.219 1
1 824 . 2 1 1 A 78 78 CYS HA H 78 5.073 4.619 0.454 1
1 827 . 2 1 1 A 78 78 CYS C C 78 176.374 175.135 1.239 1
1 828 . 2 1 1 A 78 78 CYS CA C 78 58.537 58.209 0.328 1
1 829 . 2 1 1 A 78 78 CYS CB C 78 31.597 28.977 2.620 1
1 830 . 2 1 1 A 78 78 CYS N N 78 119.692 115.301 4.391 1
1 831 . 2 1 1 A 79 79 SER H H 79 7.474 8.037 -0.563 1
1 832 . 2 1 1 A 79 79 SER HA H 79 4.113 4.212 -0.099 1
1 835 . 2 1 1 A 79 79 SER C C 79 172.915 173.408 -0.493 1
1 836 . 2 1 1 A 79 79 SER CA C 79 60.440 59.560 0.880 1
1 837 . 2 1 1 A 79 79 SER CB C 79 61.421 61.265 0.156 1
1 838 . 2 1 1 A 79 79 SER N N 79 113.385 112.474 0.911 1
1 839 . 2 1 1 A 80 80 THR H H 80 7.907 7.763 0.144 1
1 840 . 2 1 1 A 80 80 THR HA H 80 3.913 4.168 -0.255 1
1 845 . 2 1 1 A 80 80 THR C C 80 172.306 173.887 -1.581 1
1 846 . 2 1 1 A 80 80 THR CA C 80 65.262 63.678 1.584 1
1 847 . 2 1 1 A 80 80 THR CB C 80 69.910 69.327 0.583 1
1 849 . 2 1 1 A 80 80 THR N N 80 120.005 115.646 4.359 1
1 850 . 2 1 1 A 81 81 LEU H H 81 8.556 8.372 0.184 1
1 851 . 2 1 1 A 81 81 LEU HA H 81 4.172 4.323 -0.151 1
1 861 . 2 1 1 A 81 81 LEU C C 81 177.121 176.792 0.329 1
1 862 . 2 1 1 A 81 81 LEU CA C 81 54.996 54.674 0.322 1
1 863 . 2 1 1 A 81 81 LEU CB C 81 42.147 42.395 -0.248 1
1 867 . 2 1 1 A 81 81 LEU N N 81 128.272 127.868 0.404 1
1 868 . 2 1 1 A 82 82 PHE H H 82 9.251 8.886 0.365 1
1 869 . 2 1 1 A 82 82 PHE HA H 82 4.576 4.492 0.084 1
1 874 . 2 1 1 A 82 82 PHE C C 82 177.785 175.769 2.016 1
1 875 . 2 1 1 A 82 82 PHE CA C 82 56.470 59.846 -3.376 1
1 876 . 2 1 1 A 82 82 PHE CB C 82 38.210 38.877 -0.667 1
1 878 . 2 1 1 A 82 82 PHE N N 82 129.268 126.276 2.992 1
1 879 . 2 1 1 A 83 83 GLY H H 83 7.047 7.369 -0.322 1
1 880 . 2 1 1 A 83 83 GLY HA2 H 83 4.783 4.159 0.624 1
1 881 . 2 1 1 A 83 83 GLY HA3 H 83 3.876 4.210 -0.334 1
1 882 . 2 1 1 A 83 83 GLY C C 83 171.642 174.666 -3.024 1
1 883 . 2 1 1 A 83 83 GLY CA C 83 45.826 46.139 -0.313 1
1 884 . 2 1 1 A 83 83 GLY N N 83 102.168 104.898 -2.730 1
1 885 . 2 1 1 A 84 84 GLU H H 84 8.444 8.887 -0.443 1
1 886 . 2 1 1 A 84 84 GLU HA H 84 4.111 4.152 -0.041 1
1 891 . 2 1 1 A 84 84 GLU C C 84 177.259 176.576 0.683 1
1 892 . 2 1 1 A 84 84 GLU CA C 84 59.438 59.287 0.151 1
1 893 . 2 1 1 A 84 84 GLU CB C 84 30.670 30.395 0.275 1
1 895 . 2 1 1 A 84 84 GLU N N 84 127.546 120.933 6.613 1
1 896 . 2 1 1 A 85 85 TYR H H 85 9.344 8.222 1.122 1
1 897 . 2 1 1 A 85 85 TYR HA H 85 4.599 4.796 -0.197 1
1 902 . 2 1 1 A 85 85 TYR C C 85 173.302 174.672 -1.370 1
1 903 . 2 1 1 A 85 85 TYR CA C 85 57.261 58.919 -1.658 1
1 904 . 2 1 1 A 85 85 TYR CB C 85 40.850 39.936 0.914 1
1 906 . 2 1 1 A 85 85 TYR N N 85 118.936 120.491 -1.555 1
1 907 . 2 1 1 A 86 86 TYR H H 86 7.323 8.355 -1.032 1
1 908 . 2 1 1 A 86 86 TYR HA H 86 5.298 5.463 -0.165 1
1 911 . 2 1 1 A 86 86 TYR C C 86 172.804 173.574 -0.770 1
1 912 . 2 1 1 A 86 86 TYR CA C 86 54.041 56.316 -2.275 1
1 913 . 2 1 1 A 86 86 TYR CB C 86 40.987 42.100 -1.113 1
1 914 . 2 1 1 A 86 86 TYR N N 86 124.965 127.492 -2.527 1
1 915 . 2 1 1 A 87 87 CYS H H 87 7.046 8.443 -1.397 1
1 916 . 2 1 1 A 87 87 CYS HA H 87 3.842 4.338 -0.496 1
1 919 . 2 1 1 A 87 87 CYS C C 87 174.243 173.933 0.310 1
1 920 . 2 1 1 A 87 87 CYS CA C 87 56.377 57.975 -1.598 1
1 921 . 2 1 1 A 87 87 CYS CB C 87 33.230 29.737 3.493 1
1 922 . 2 1 1 A 87 87 CYS N N 87 128.735 125.391 3.344 1
1 923 . 2 1 1 A 88 88 ASP H H 88 8.002 8.630 -0.628 1
1 924 . 2 1 1 A 88 88 ASP HA H 88 3.761 4.370 -0.609 1
1 927 . 2 1 1 A 88 88 ASP C C 88 173.579 177.965 -4.386 1
1 928 . 2 1 1 A 88 88 ASP CA C 88 53.958 56.317 -2.359 1
1 929 . 2 1 1 A 88 88 ASP CB C 88 41.240 39.722 1.518 1
1 930 . 2 1 1 A 88 88 ASP N N 88 127.013 126.637 0.376 1
1 931 . 2 1 1 A 89 89 ILE H H 89 7.972 7.775 0.197 1
1 932 . 2 1 1 A 89 89 ILE HA H 89 3.660 3.579 0.081 1
1 942 . 2 1 1 A 89 89 ILE C C 89 177.259 177.699 -0.440 1
1 943 . 2 1 1 A 89 89 ILE CA C 89 63.107 65.173 -2.066 1
1 944 . 2 1 1 A 89 89 ILE CB C 89 39.430 37.883 1.547 1
1 948 . 2 1 1 A 89 89 ILE N N 89 120.357 120.701 -0.344 1
1 949 . 2 1 1 A 90 90 CYS H H 90 8.554 7.643 0.911 1
1 950 . 2 1 1 A 90 90 CYS HA H 90 3.677 4.397 -0.720 1
1 953 . 2 1 1 A 90 90 CYS C C 90 175.128 174.289 0.839 1
1 954 . 2 1 1 A 90 90 CYS CA C 90 60.791 58.982 1.809 1
1 955 . 2 1 1 A 90 90 CYS CB C 90 30.427 27.957 2.470 1
1 956 . 2 1 1 A 90 90 CYS N N 90 119.564 117.523 2.041 1
1 957 . 2 1 1 A 91 91 HIS H H 91 7.364 7.495 -0.131 1
1 958 . 2 1 1 A 91 91 HIS HA H 91 3.512 3.798 -0.286 1
1 963 . 2 1 1 A 91 91 HIS C C 91 170.590 172.875 -2.285 1
1 964 . 2 1 1 A 91 91 HIS CA C 91 58.739 56.601 2.138 1
1 965 . 2 1 1 A 91 91 HIS CB C 91 24.810 26.498 -1.688 1
1 968 . 2 1 1 A 91 91 HIS N N 91 111.440 116.251 -4.811 1
1 969 . 2 1 1 A 92 92 LEU H H 92 6.214 7.511 -1.297 1
1 970 . 2 1 1 A 92 92 LEU HA H 92 4.191 4.053 0.138 1
1 980 . 2 1 1 A 92 92 LEU C C 92 173.911 175.307 -1.396 1
1 981 . 2 1 1 A 92 92 LEU CA C 92 53.717 53.315 0.402 1
1 982 . 2 1 1 A 92 92 LEU CB C 92 45.360 42.649 2.711 1
1 986 . 2 1 1 A 92 92 LEU N N 92 115.684 117.916 -2.232 1
1 987 . 2 1 1 A 93 93 PHE H H 93 6.669 8.775 -2.106 1
1 988 . 2 1 1 A 93 93 PHE HA H 93 5.622 5.068 0.554 1
1 995 . 2 1 1 A 93 93 PHE C C 93 175.765 174.232 1.533 1
1 996 . 2 1 1 A 93 93 PHE CA C 93 55.387 56.557 -1.170 1
1 997 . 2 1 1 A 93 93 PHE CB C 93 42.700 40.959 1.741 1
1 1000 . 2 1 1 A 93 93 PHE N N 93 121.535 121.776 -0.241 1
1 1001 . 2 1 1 A 94 94 ASP H H 94 9.209 8.448 0.761 1
1 1002 . 2 1 1 A 94 94 ASP HA H 94 5.819 5.317 0.502 1
1 1005 . 2 1 1 A 94 94 ASP C C 94 175.654 175.607 0.047 1
1 1006 . 2 1 1 A 94 94 ASP CA C 94 53.330 52.806 0.524 1
1 1007 . 2 1 1 A 94 94 ASP CB C 94 44.720 45.642 -0.922 1
1 1008 . 2 1 1 A 94 94 ASP N N 94 123.504 122.527 0.977 1
1 1009 . 2 1 1 A 95 95 LYS H H 95 9.043 8.377 0.666 1
1 1010 . 2 1 1 A 95 95 LYS HA H 95 4.527 4.326 0.201 1
1 1019 . 2 1 1 A 95 95 LYS C C 95 174.879 176.435 -1.556 1
1 1020 . 2 1 1 A 95 95 LYS CA C 95 56.620 57.252 -0.632 1
1 1021 . 2 1 1 A 95 95 LYS CB C 95 33.720 33.193 0.527 1
1 1025 . 2 1 1 A 95 95 LYS N N 95 120.380 120.412 -0.032 1
1 1026 . 2 1 1 A 96 96 ASP H H 96 8.999 8.648 0.351 1
1 1027 . 2 1 1 A 96 96 ASP HA H 96 4.724 4.756 -0.032 1
1 1030 . 2 1 1 A 96 96 ASP C C 96 176.401 176.298 0.103 1
1 1031 . 2 1 1 A 96 96 ASP CA C 96 56.147 53.473 2.674 1
1 1032 . 2 1 1 A 96 96 ASP CB C 96 40.790 40.761 0.029 1
1 1033 . 2 1 1 A 96 96 ASP N N 96 120.784 122.723 -1.939 1
1 1034 . 2 1 1 A 97 97 LYS H H 97 9.382 8.257 1.125 1
1 1035 . 2 1 1 A 97 97 LYS HA H 97 4.473 4.500 -0.027 1
1 1044 . 2 1 1 A 97 97 LYS C C 97 175.903 175.208 0.695 1
1 1045 . 2 1 1 A 97 97 LYS CA C 97 54.771 55.726 -0.955 1
1 1046 . 2 1 1 A 97 97 LYS CB C 97 33.270 32.065 1.205 1
1 1050 . 2 1 1 A 97 97 LYS N N 97 131.617 125.752 5.865 1
1 1051 . 2 1 1 A 98 98 LYS H H 98 8.940 8.007 0.933 1
1 1052 . 2 1 1 A 98 98 LYS HA H 98 4.118 3.887 0.231 1
1 1061 . 2 1 1 A 98 98 LYS C C 98 177.065 175.129 1.936 1
1 1062 . 2 1 1 A 98 98 LYS CA C 98 56.297 57.531 -1.234 1
1 1063 . 2 1 1 A 98 98 LYS CB C 98 28.467 29.284 -0.817 1
1 1067 . 2 1 1 A 98 98 LYS N N 98 115.034 114.965 0.069 1
1 1068 . 2 1 1 A 99 99 GLN H H 99 9.266 7.649 1.617 1
1 1069 . 2 1 1 A 99 99 GLN HA H 99 4.460 4.291 0.169 1
1 1074 . 2 1 1 A 99 99 GLN C C 99 174.990 175.102 -0.112 1
1 1075 . 2 1 1 A 99 99 GLN CA C 99 57.563 55.694 1.869 1
1 1076 . 2 1 1 A 99 99 GLN CB C 99 27.280 28.731 -1.451 1
1 1078 . 2 1 1 A 99 99 GLN N N 99 117.717 118.217 -0.500 1
1 1079 . 2 1 1 A 100 100 TYR H H 100 8.402 8.455 -0.053 1
1 1080 . 2 1 1 A 100 100 TYR HA H 100 4.935 5.317 -0.382 1
1 1087 . 2 1 1 A 100 100 TYR C C 100 171.504 173.559 -2.055 1
1 1088 . 2 1 1 A 100 100 TYR CA C 100 55.786 55.880 -0.094 1
1 1089 . 2 1 1 A 100 100 TYR CB C 100 41.090 40.101 0.989 1
1 1092 . 2 1 1 A 100 100 TYR N N 100 115.081 121.840 -6.759 1
1 1093 . 2 1 1 A 101 101 HIS H H 101 8.829 8.946 -0.117 1
1 1094 . 2 1 1 A 101 101 HIS HA H 101 4.525 4.934 -0.409 1
1 1099 . 2 1 1 A 101 101 HIS C C 101 174.935 173.903 1.032 1
1 1100 . 2 1 1 A 101 101 HIS CA C 101 56.327 55.030 1.297 1
1 1101 . 2 1 1 A 101 101 HIS CB C 101 31.020 30.611 0.409 1
1 1104 . 2 1 1 A 101 101 HIS N N 101 120.894 123.871 -2.977 1
1 1105 . 2 1 1 A 102 102 CYS H H 102 7.427 8.400 -0.973 1
1 1106 . 2 1 1 A 102 102 CYS HA H 102 4.561 4.439 0.122 1
1 1109 . 2 1 1 A 102 102 CYS C C 102 175.765 175.827 -0.062 1
1 1110 . 2 1 1 A 102 102 CYS CA C 102 57.707 58.535 -0.828 1
1 1111 . 2 1 1 A 102 102 CYS CB C 102 29.130 28.659 0.471 1
1 1112 . 2 1 1 A 102 102 CYS N N 102 131.256 126.902 4.354 1
1 1113 . 2 1 1 A 103 103 GLU H H 103 9.497 8.918 0.579 1
1 1114 . 2 1 1 A 103 103 GLU HA H 103 4.003 4.056 -0.053 1
1 1119 . 2 1 1 A 103 103 GLU C C 103 176.540 178.640 -2.100 1
1 1120 . 2 1 1 A 103 103 GLU CA C 103 58.796 59.630 -0.834 1
1 1121 . 2 1 1 A 103 103 GLU CB C 103 29.280 29.426 -0.146 1
1 1123 . 2 1 1 A 103 103 GLU N N 103 129.829 127.883 1.946 1
1 1124 . 2 1 1 A 104 104 ASN H H 104 7.832 7.946 -0.114 1
1 1125 . 2 1 1 A 104 104 ASN HA H 104 4.457 4.436 0.021 1
1 1130 . 2 1 1 A 104 104 ASN C C 104 176.401 177.378 -0.977 1
1 1131 . 2 1 1 A 104 104 ASN CA C 104 56.053 56.237 -0.184 1
1 1132 . 2 1 1 A 104 104 ASN CB C 104 38.400 37.779 0.621 1
1 1133 . 2 1 1 A 104 104 ASN N N 104 117.703 117.321 0.382 1
1 1135 . 2 1 1 A 105 105 CYS H H 105 9.415 7.397 2.018 1
1 1136 . 2 1 1 A 105 105 CYS HA H 105 4.137 4.500 -0.363 1
1 1139 . 2 1 1 A 105 105 CYS C C 105 176.844 175.399 1.445 1
1 1140 . 2 1 1 A 105 105 CYS CA C 105 64.328 59.419 4.909 1
1 1141 . 2 1 1 A 105 105 CYS CB C 105 30.350 28.228 2.122 1
1 1142 . 2 1 1 A 105 105 CYS N N 105 124.939 115.087 9.852 1
1 1143 . 2 1 1 A 106 106 GLY H H 106 8.145 8.677 -0.532 1
1 1144 . 2 1 1 A 106 106 GLY HA2 H 106 3.980 3.918 0.062 1
1 1145 . 2 1 1 A 106 106 GLY HA3 H 106 3.502 3.932 -0.430 1
1 1146 . 2 1 1 A 106 106 GLY C C 106 172.500 173.500 -1.000 1
1 1147 . 2 1 1 A 106 106 GLY CA C 106 44.968 46.037 -1.069 1
1 1148 . 2 1 1 A 106 106 GLY N N 106 106.090 109.710 -3.620 1
1 1149 . 2 1 1 A 107 107 ILE H H 107 6.465 6.800 -0.335 1
1 1150 . 2 1 1 A 107 107 ILE HA H 107 4.878 4.912 -0.034 1
1 1160 . 2 1 1 A 107 107 ILE C C 107 174.824 174.168 0.656 1
1 1161 . 2 1 1 A 107 107 ILE CA C 107 58.226 58.591 -0.365 1
1 1162 . 2 1 1 A 107 107 ILE CB C 107 44.460 42.360 2.100 1
1 1166 . 2 1 1 A 107 107 ILE N N 107 107.914 114.896 -6.982 1
1 1167 . 2 1 1 A 108 108 CYS H H 108 7.041 9.105 -2.064 1
1 1168 . 2 1 1 A 108 108 CYS HA H 108 5.018 5.424 -0.406 1
1 1171 . 2 1 1 A 108 108 CYS C C 108 175.461 173.266 2.195 1
1 1172 . 2 1 1 A 108 108 CYS CA C 108 62.097 57.181 4.916 1
1 1173 . 2 1 1 A 108 108 CYS CB C 108 31.353 29.987 1.366 1
1 1174 . 2 1 1 A 108 108 CYS N N 108 122.441 121.150 1.291 1
1 1175 . 2 1 1 A 109 109 ARG H H 109 8.561 8.427 0.134 1
1 1176 . 2 1 1 A 109 109 ARG HA H 109 4.239 4.651 -0.412 1
1 1183 . 2 1 1 A 109 109 ARG C C 109 174.271 176.017 -1.746 1
1 1184 . 2 1 1 A 109 109 ARG CA C 109 52.962 54.039 -1.077 1
1 1185 . 2 1 1 A 109 109 ARG CB C 109 33.903 31.767 2.136 1
1 1188 . 2 1 1 A 109 109 ARG N N 109 121.163 124.823 -3.660 1
1 1189 . 2 1 1 A 110 110 ILE H H 110 7.847 8.390 -0.543 1
1 1190 . 2 1 1 A 110 110 ILE HA H 110 3.531 4.183 -0.652 1
1 1200 . 2 1 1 A 110 110 ILE C C 110 175.405 175.635 -0.230 1
1 1201 . 2 1 1 A 110 110 ILE CA C 110 62.201 61.095 1.106 1
1 1202 . 2 1 1 A 110 110 ILE CB C 110 36.860 36.511 0.349 1
1 1206 . 2 1 1 A 110 110 ILE N N 110 118.955 122.300 -3.345 1
1 1207 . 2 1 1 A 111 111 GLY H H 111 6.928 8.304 -1.376 1
1 1208 . 2 1 1 A 111 111 GLY HA2 H 111 4.564 4.215 0.349 1
1 1209 . 2 1 1 A 111 111 GLY HA3 H 111 4.135 4.290 -0.155 1
1 1210 . 2 1 1 A 111 111 GLY CA C 111 43.068 45.472 -2.404 1
1 1211 . 2 1 1 A 111 111 GLY N N 111 113.782 113.830 -0.048 1
1 1212 . 2 1 1 A 112 112 PRO HA H 112 4.990 4.764 0.226 1
1 1219 . 2 1 1 A 112 112 PRO C C 112 177.342 177.618 -0.276 1
1 1220 . 2 1 1 A 112 112 PRO CA C 112 62.920 62.714 0.206 1
1 1221 . 2 1 1 A 112 112 PRO CB C 112 34.807 32.031 2.776 1
1 1224 . 2 1 1 A 113 113 LYS H H 113 8.989 8.607 0.382 1
1 1225 . 2 1 1 A 113 113 LYS HA H 113 3.144 3.922 -0.778 1
1 1234 . 2 1 1 A 113 113 LYS C C 113 177.536 177.996 -0.460 1
1 1235 . 2 1 1 A 113 113 LYS CA C 113 59.883 58.919 0.964 1
1 1236 . 2 1 1 A 113 113 LYS CB C 113 32.260 32.009 0.251 1
1 1240 . 2 1 1 A 113 113 LYS N N 113 123.545 121.958 1.587 1
1 1241 . 2 1 1 A 114 114 GLU H H 114 9.080 9.216 -0.136 1
1 1242 . 2 1 1 A 114 114 GLU HA H 114 4.199 4.164 0.035 1
1 1247 . 2 1 1 A 114 114 GLU C C 114 176.374 177.512 -1.138 1
1 1248 . 2 1 1 A 114 114 GLU CA C 114 58.733 58.361 0.372 1
1 1249 . 2 1 1 A 114 114 GLU CB C 114 28.077 27.424 0.653 1
1 1251 . 2 1 1 A 114 114 GLU N N 114 114.832 120.663 -5.831 1
1 1252 . 2 1 1 A 115 115 ASP H H 115 7.799 7.959 -0.160 1
1 1253 . 2 1 1 A 115 115 ASP HA H 115 4.642 4.743 -0.101 1
1 1256 . 2 1 1 A 115 115 ASP C C 115 176.374 175.844 0.530 1
1 1257 . 2 1 1 A 115 115 ASP CA C 115 54.470 54.862 -0.392 1
1 1258 . 2 1 1 A 115 115 ASP CB C 115 40.850 42.064 -1.214 1
1 1259 . 2 1 1 A 115 115 ASP N N 115 118.858 119.561 -0.703 1
1 1260 . 2 1 1 A 116 116 PHE H H 116 8.063 7.764 0.299 1
1 1261 . 2 1 1 A 116 116 PHE HA H 116 5.239 4.571 0.668 1
1 1264 . 2 1 1 A 116 116 PHE C C 116 173.413 174.818 -1.405 1
1 1265 . 2 1 1 A 116 116 PHE CA C 116 57.708 55.306 2.402 1
1 1266 . 2 1 1 A 116 116 PHE CB C 116 44.557 41.189 3.368 1
1 1267 . 2 1 1 A 116 116 PHE N N 116 120.567 115.605 4.962 1
1 1268 . 2 1 1 A 117 117 PHE H H 117 9.439 8.666 0.773 1
1 1269 . 2 1 1 A 117 117 PHE HA H 117 5.091 4.834 0.257 1
1 1277 . 2 1 1 A 117 117 PHE C C 117 171.614 172.639 -1.025 1
1 1278 . 2 1 1 A 117 117 PHE CA C 117 55.311 55.259 0.052 1
1 1279 . 2 1 1 A 117 117 PHE CB C 117 41.887 42.018 -0.131 1
1 1283 . 2 1 1 A 117 117 PHE N N 117 118.040 115.062 2.978 1
1 1284 . 2 1 1 A 118 118 HIS H H 118 8.779 8.964 -0.185 1
1 1285 . 2 1 1 A 118 118 HIS HA H 118 4.836 4.858 -0.022 1
1 1289 . 2 1 1 A 118 118 HIS C C 118 174.879 173.729 1.150 1
1 1290 . 2 1 1 A 118 118 HIS CA C 118 55.322 55.209 0.113 1
1 1291 . 2 1 1 A 118 118 HIS CB C 118 30.950 30.660 0.290 1
1 1293 . 2 1 1 A 118 118 HIS N N 118 121.208 122.095 -0.887 1
1 1294 . 2 1 1 A 119 119 CYS H H 119 8.123 8.326 -0.203 1
1 1295 . 2 1 1 A 119 119 CYS HA H 119 4.529 4.598 -0.069 1
1 1298 . 2 1 1 A 119 119 CYS C C 119 176.567 175.497 1.070 1
1 1299 . 2 1 1 A 119 119 CYS CA C 119 58.957 57.930 1.027 1
1 1300 . 2 1 1 A 119 119 CYS CB C 119 30.090 28.570 1.520 1
1 1301 . 2 1 1 A 119 119 CYS N N 119 131.659 127.338 4.321 1
1 1302 . 2 1 1 A 120 120 LEU H H 120 8.970 8.761 0.209 1
1 1303 . 2 1 1 A 120 120 LEU N N 120 130.361 129.517 0.844 1
1 1304 . 2 1 1 A 121 121 LYS HA H 121 4.299 4.317 -0.018 1
1 1313 . 2 1 1 A 121 121 LYS CA C 121 58.727 55.683 3.044 1
1 1314 . 2 1 1 A 121 121 LYS CB C 121 33.210 31.224 1.986 1
1 1318 . 2 1 1 A 123 123 ASN HA H 123 4.438 4.353 0.085 1
1 1323 . 2 1 1 A 123 123 ASN C C 123 172.444 173.755 -1.311 1
1 1324 . 2 1 1 A 123 123 ASN CA C 123 53.448 54.661 -1.213 1
1 1325 . 2 1 1 A 123 123 ASN CB C 123 37.130 36.596 0.534 1
1 1327 . 2 1 1 A 124 124 LEU H H 124 6.596 7.071 -0.475 1
1 1328 . 2 1 1 A 124 124 LEU HA H 124 4.576 4.723 -0.147 1
1 1338 . 2 1 1 A 124 124 LEU C C 124 175.903 174.306 1.597 1
1 1339 . 2 1 1 A 124 124 LEU CA C 124 54.043 54.233 -0.190 1
1 1340 . 2 1 1 A 124 124 LEU CB C 124 45.837 45.171 0.666 1
1 1344 . 2 1 1 A 124 124 LEU N N 124 115.443 118.213 -2.770 1
1 1345 . 2 1 1 A 125 125 CYS H H 125 6.342 8.563 -2.221 1
1 1346 . 2 1 1 A 125 125 CYS HA H 125 5.033 5.081 -0.048 1
1 1349 . 2 1 1 A 125 125 CYS C C 125 175.101 174.518 0.583 1
1 1350 . 2 1 1 A 125 125 CYS CA C 125 62.046 57.526 4.520 1
1 1351 . 2 1 1 A 125 125 CYS CB C 125 30.840 28.465 2.375 1
1 1352 . 2 1 1 A 125 125 CYS N N 125 118.685 124.663 -5.978 1
1 1353 . 2 1 1 A 126 126 LEU H H 126 8.894 8.369 0.525 1
1 1354 . 2 1 1 A 126 126 LEU HA H 126 4.565 4.794 -0.229 1
1 1364 . 2 1 1 A 126 126 LEU C C 126 174.879 176.142 -1.263 1
1 1365 . 2 1 1 A 126 126 LEU CA C 126 52.751 52.991 -0.240 1
1 1366 . 2 1 1 A 126 126 LEU CB C 126 46.090 43.950 2.140 1
1 1370 . 2 1 1 A 126 126 LEU N N 126 124.501 126.164 -1.663 1
1 1371 . 2 1 1 A 127 127 ALA H H 127 8.378 8.423 -0.045 1
1 1372 . 2 1 1 A 127 127 ALA HA H 127 3.957 4.707 -0.750 1
1 1376 . 2 1 1 A 127 127 ALA C C 127 179.085 178.439 0.646 1
1 1377 . 2 1 1 A 127 127 ALA CA C 127 52.554 50.619 1.935 1
1 1378 . 2 1 1 A 127 127 ALA CB C 127 18.527 21.242 -2.715 1
1 1379 . 2 1 1 A 127 127 ALA N N 127 123.011 123.129 -0.118 1
1 1380 . 2 1 1 A 128 128 MET H H 128 8.237 8.646 -0.409 1
1 1385 . 2 1 1 A 128 128 MET N N 128 120.642 120.755 -0.113 1
1 1386 . 2 1 1 A 129 129 ASN HA H 129 4.502 4.544 -0.042 1
1 1389 . 2 1 1 A 129 129 ASN C C 129 175.931 177.092 -1.161 1
1 1390 . 2 1 1 A 129 129 ASN CA C 129 55.064 55.715 -0.651 1
1 1391 . 2 1 1 A 129 129 ASN CB C 129 36.920 38.547 -1.627 1
1 1392 . 2 1 1 A 130 130 LEU H H 130 8.211 7.633 0.578 1
1 1393 . 2 1 1 A 130 130 LEU HA H 130 4.489 4.401 0.088 1
1 1403 . 2 1 1 A 130 130 LEU C C 130 178.836 176.656 2.180 1
1 1404 . 2 1 1 A 130 130 LEU CA C 130 54.653 54.765 -0.112 1
1 1405 . 2 1 1 A 130 130 LEU CB C 130 41.887 41.238 0.649 1
1 1409 . 2 1 1 A 130 130 LEU N N 130 118.563 117.766 0.797 1
1 1410 . 2 1 1 A 131 131 GLN H H 131 7.953 7.743 0.210 1
1 1411 . 2 1 1 A 131 131 GLN HA H 131 3.729 4.622 -0.893 1
1 1418 . 2 1 1 A 131 131 GLN CA C 131 59.310 57.106 2.204 1
1 1419 . 2 1 1 A 131 131 GLN CB C 131 28.340 28.621 -0.281 1
1 1421 . 2 1 1 A 131 131 GLN N N 131 123.929 118.839 5.090 1
1 1423 . 2 1 1 A 132 132 GLY HA2 H 132 4.034 3.903 0.131 1
1 1424 . 2 1 1 A 132 132 GLY HA3 H 132 3.865 3.988 -0.123 1
1 1425 . 2 1 1 A 132 132 GLY C C 132 174.547 175.140 -0.593 1
1 1426 . 2 1 1 A 132 132 GLY CA C 132 45.902 45.153 0.749 1
1 1427 . 2 1 1 A 133 133 ARG H H 133 7.735 7.688 0.047 1
1 1428 . 2 1 1 A 133 133 ARG HA H 133 4.611 4.076 0.535 1
1 1435 . 2 1 1 A 133 133 ARG C C 133 175.461 176.158 -0.697 1
1 1436 . 2 1 1 A 133 133 ARG CA C 133 54.987 58.843 -3.856 1
1 1437 . 2 1 1 A 133 133 ARG CB C 133 31.470 30.007 1.463 1
1 1440 . 2 1 1 A 133 133 ARG N N 133 118.194 122.030 -3.836 1
1 1441 . 2 1 1 A 134 134 HIS H H 134 7.803 7.999 -0.196 1
1 1444 . 2 1 1 A 134 134 HIS N N 134 118.700 114.433 4.267 1
1 1445 . 2 1 1 A 135 135 LYS HA H 135 4.331 4.562 -0.231 1
1 1454 . 2 1 1 A 135 135 LYS C C 135 174.852 176.687 -1.835 1
1 1455 . 2 1 1 A 135 135 LYS CA C 135 55.390 55.238 0.152 1
1 1456 . 2 1 1 A 135 135 LYS CB C 135 32.970 33.684 -0.714 1
1 1460 . 2 1 1 A 136 136 CYS H H 136 7.801 8.810 -1.009 1
1 1461 . 2 1 1 A 136 136 CYS HA H 136 4.113 4.782 -0.669 1
1 1464 . 2 1 1 A 136 136 CYS C C 136 174.879 174.313 0.566 1
1 1465 . 2 1 1 A 136 136 CYS CA C 136 60.028 58.406 1.622 1
1 1466 . 2 1 1 A 136 136 CYS CB C 136 30.350 28.018 2.332 1
1 1467 . 2 1 1 A 136 136 CYS N N 136 126.055 123.029 3.026 1
1 10 . 3 1 1 A 2 2 ALA H H 2 8.220 7.725 0.495 1
1 11 . 3 1 1 A 2 2 ALA HA H 2 4.321 4.550 -0.229 1
1 15 . 3 1 1 A 2 2 ALA C C 2 177.564 176.881 0.683 1
1 16 . 3 1 1 A 2 2 ALA CA C 2 52.383 51.646 0.737 1
1 17 . 3 1 1 A 2 2 ALA CB C 2 19.290 20.334 -1.044 1
1 18 . 3 1 1 A 2 2 ALA N N 2 125.223 121.045 4.178 1
1 19 . 3 1 1 A 3 3 ALA H H 3 8.246 7.475 0.771 1
1 20 . 3 1 1 A 3 3 ALA N N 3 123.250 121.470 1.780 1
1 21 . 3 1 1 A 5 5 ALA HA H 5 4.415 4.447 -0.032 1
1 25 . 3 1 1 A 5 5 ALA C C 5 177.481 177.511 -0.030 1
1 26 . 3 1 1 A 5 5 ALA CA C 5 52.423 52.683 -0.260 1
1 27 . 3 1 1 A 5 5 ALA CB C 5 19.420 19.548 -0.128 1
1 28 . 3 1 1 A 6 6 ARG H H 6 8.239 8.529 -0.290 1
1 29 . 3 1 1 A 6 6 ARG HA H 6 4.371 4.957 -0.586 1
1 36 . 3 1 1 A 6 6 ARG C C 6 176.180 175.242 0.938 1
1 37 . 3 1 1 A 6 6 ARG CA C 6 56.353 54.003 2.350 1
1 38 . 3 1 1 A 6 6 ARG CB C 6 31.170 33.729 -2.559 1
1 41 . 3 1 1 A 6 6 ARG N N 6 120.436 118.169 2.267 1
1 42 . 3 1 1 A 7 7 GLU H H 7 8.535 9.047 -0.512 1
1 43 . 3 1 1 A 7 7 GLU HA H 7 4.335 4.001 0.334 1
1 48 . 3 1 1 A 7 7 GLU C C 7 176.346 175.745 0.601 1
1 49 . 3 1 1 A 7 7 GLU CA C 7 56.740 57.174 -0.434 1
1 50 . 3 1 1 A 7 7 GLU CB C 7 30.390 28.295 2.095 1
1 52 . 3 1 1 A 7 7 GLU N N 7 122.189 119.492 2.697 1
1 53 . 3 1 1 A 8 8 ASP H H 8 8.347 8.673 -0.326 1
1 54 . 3 1 1 A 8 8 ASP N N 8 121.112 125.640 -4.528 1
1 55 . 3 1 1 A 9 9 GLY HA2 H 9 3.975 3.922 0.053 1
1 56 . 3 1 1 A 9 9 GLY HA3 H 9 3.975 3.922 0.053 1
1 57 . 3 1 1 A 9 9 GLY C C 9 174.243 173.445 0.798 1
1 58 . 3 1 1 A 9 9 GLY CA C 9 45.933 47.101 -1.168 1
1 59 . 3 1 1 A 10 10 ALA H H 10 8.111 8.210 -0.099 1
1 60 . 3 1 1 A 10 10 ALA N N 10 123.721 124.279 -0.558 1
1 61 . 3 1 1 A 12 12 GLY HA2 H 12 3.992 4.146 -0.154 1
1 62 . 3 1 1 A 12 12 GLY HA3 H 12 3.992 4.147 -0.155 1
1 63 . 3 1 1 A 12 12 GLY C C 12 173.883 173.193 0.690 1
1 64 . 3 1 1 A 12 12 GLY CA C 12 45.381 45.608 -0.227 1
1 65 . 3 1 1 A 13 13 GLU H H 13 8.224 8.915 -0.691 1
1 66 . 3 1 1 A 13 13 GLU HA H 13 4.367 3.933 0.434 1
1 71 . 3 1 1 A 13 13 GLU C C 13 176.125 175.664 0.461 1
1 72 . 3 1 1 A 13 13 GLU CA C 13 56.349 57.308 -0.959 1
1 73 . 3 1 1 A 13 13 GLU CB C 13 29.560 28.147 1.413 1
1 75 . 3 1 1 A 13 13 GLU N N 13 120.148 120.395 -0.247 1
1 76 . 3 1 1 A 14 14 GLU H H 14 8.508 7.874 0.634 1
1 77 . 3 1 1 A 14 14 GLU HA H 14 4.302 4.744 -0.442 1
1 82 . 3 1 1 A 14 14 GLU C C 14 176.623 174.440 2.183 1
1 83 . 3 1 1 A 14 14 GLU CA C 14 56.497 56.239 0.258 1
1 84 . 3 1 1 A 14 14 GLU CB C 14 30.110 32.414 -2.304 1
1 86 . 3 1 1 A 14 14 GLU N N 14 122.160 122.878 -0.718 1
1 87 . 3 1 1 A 15 15 ARG H H 15 8.356 8.995 -0.639 1
1 88 . 3 1 1 A 15 15 ARG HA H 15 4.366 4.909 -0.543 1
1 95 . 3 1 1 A 15 15 ARG C C 15 176.844 176.063 0.781 1
1 96 . 3 1 1 A 15 15 ARG CA C 15 56.010 54.726 1.284 1
1 97 . 3 1 1 A 15 15 ARG CB C 15 30.890 31.928 -1.038 1
1 100 . 3 1 1 A 15 15 ARG N N 15 121.945 126.475 -4.530 1
1 101 . 3 1 1 A 16 16 GLY H H 16 8.414 8.819 -0.405 1
1 102 . 3 1 1 A 16 16 GLY HA2 H 16 4.022 4.002 0.020 1
1 103 . 3 1 1 A 16 16 GLY HA3 H 16 4.022 4.010 0.012 1
1 104 . 3 1 1 A 16 16 GLY C C 16 174.326 172.160 2.166 1
1 105 . 3 1 1 A 16 16 GLY CA C 16 45.620 45.317 0.303 1
1 106 . 3 1 1 A 16 16 GLY N N 16 109.734 111.815 -2.081 1
1 107 . 3 1 1 A 17 17 GLN H H 17 8.184 8.570 -0.386 1
1 108 . 3 1 1 A 17 17 GLN HA H 17 4.366 4.446 -0.080 1
1 113 . 3 1 1 A 17 17 GLN C C 17 175.544 175.103 0.441 1
1 114 . 3 1 1 A 17 17 GLN CA C 17 55.749 55.791 -0.042 1
1 115 . 3 1 1 A 17 17 GLN CB C 17 29.367 29.106 0.261 1
1 117 . 3 1 1 A 17 17 GLN N N 17 119.546 121.985 -2.439 1
1 118 . 3 1 1 A 18 18 ARG H H 18 8.366 8.420 -0.054 1
1 119 . 3 1 1 A 18 18 ARG HA H 18 4.487 4.340 0.147 1
1 126 . 3 1 1 A 18 18 ARG C C 18 176.042 176.108 -0.066 1
1 127 . 3 1 1 A 18 18 ARG CA C 18 55.735 56.535 -0.800 1
1 128 . 3 1 1 A 18 18 ARG CB C 18 31.170 30.105 1.065 1
1 131 . 3 1 1 A 18 18 ARG N N 18 122.330 124.218 -1.888 1
1 132 . 3 1 1 A 19 19 GLY H H 19 8.192 8.317 -0.125 1
1 133 . 3 1 1 A 19 19 GLY HA2 H 19 4.852 4.155 0.697 1
1 134 . 3 1 1 A 19 19 GLY HA3 H 19 3.894 4.179 -0.285 1
1 135 . 3 1 1 A 19 19 GLY C C 19 172.361 171.560 0.801 1
1 136 . 3 1 1 A 19 19 GLY CA C 19 45.580 44.382 1.198 1
1 137 . 3 1 1 A 19 19 GLY N N 19 109.658 109.083 0.575 1
1 138 . 3 1 1 A 20 20 CYS H H 20 8.843 8.322 0.521 1
1 139 . 3 1 1 A 20 20 CYS HA H 20 5.147 5.036 0.111 1
1 142 . 3 1 1 A 20 20 CYS C C 20 175.211 174.692 0.519 1
1 143 . 3 1 1 A 20 20 CYS CA C 20 56.712 58.205 -1.493 1
1 144 . 3 1 1 A 20 20 CYS CB C 20 33.530 30.631 2.899 1
1 145 . 3 1 1 A 20 20 CYS N N 20 120.185 118.462 1.723 1
1 146 . 3 1 1 A 21 21 GLU H H 21 8.981 8.903 0.078 1
1 147 . 3 1 1 A 21 21 GLU HA H 21 4.100 3.994 0.106 1
1 152 . 3 1 1 A 21 21 GLU C C 21 176.014 178.037 -2.023 1
1 153 . 3 1 1 A 21 21 GLU CA C 21 57.134 58.950 -1.816 1
1 154 . 3 1 1 A 21 21 GLU CB C 21 28.890 28.872 0.018 1
1 156 . 3 1 1 A 21 21 GLU N N 21 116.078 124.166 -8.088 1
1 157 . 3 1 1 A 22 22 HIS H H 22 9.342 7.653 1.689 1
1 158 . 3 1 1 A 22 22 HIS HA H 22 4.210 4.199 0.011 1
1 161 . 3 1 1 A 22 22 HIS C C 22 175.128 174.672 0.456 1
1 162 . 3 1 1 A 22 22 HIS CA C 22 58.945 58.426 0.519 1
1 163 . 3 1 1 A 22 22 HIS CB C 22 33.160 30.493 2.667 1
1 164 . 3 1 1 A 22 22 HIS N N 22 122.296 117.804 4.492 1
1 165 . 3 1 1 A 23 23 TYR H H 23 7.931 7.813 0.118 1
1 166 . 3 1 1 A 23 23 TYR HA H 23 4.856 5.169 -0.313 1
1 171 . 3 1 1 A 23 23 TYR C C 23 173.108 174.434 -1.326 1
1 172 . 3 1 1 A 23 23 TYR CA C 23 57.852 56.275 1.577 1
1 173 . 3 1 1 A 23 23 TYR CB C 23 45.300 41.311 3.989 1
1 175 . 3 1 1 A 23 23 TYR N N 23 115.205 115.159 0.046 1
1 176 . 3 1 1 A 24 24 ASP H H 24 8.384 8.566 -0.182 1
1 177 . 3 1 1 A 24 24 ASP HA H 24 5.160 5.011 0.149 1
1 180 . 3 1 1 A 24 24 ASP C C 24 174.437 175.284 -0.847 1
1 181 . 3 1 1 A 24 24 ASP CA C 24 53.343 53.516 -0.173 1
1 182 . 3 1 1 A 24 24 ASP CB C 24 41.470 39.646 1.824 1
1 183 . 3 1 1 A 24 24 ASP N N 24 122.016 124.910 -2.894 1
1 184 . 3 1 1 A 25 25 ARG H H 25 7.313 7.950 -0.637 1
1 185 . 3 1 1 A 25 25 ARG HA H 25 5.331 5.577 -0.246 1
1 192 . 3 1 1 A 25 25 ARG C C 25 175.045 176.466 -1.421 1
1 193 . 3 1 1 A 25 25 ARG CA C 25 54.224 54.741 -0.517 1
1 194 . 3 1 1 A 25 25 ARG CB C 25 34.090 33.604 0.486 1
1 197 . 3 1 1 A 25 25 ARG N N 25 115.898 120.870 -4.972 1
1 198 . 3 1 1 A 26 26 GLY H H 26 9.387 8.677 0.710 1
1 199 . 3 1 1 A 26 26 GLY HA2 H 26 4.622 3.743 0.879 1
1 200 . 3 1 1 A 26 26 GLY HA3 H 26 3.788 3.762 0.026 1
1 201 . 3 1 1 A 26 26 GLY C C 26 170.978 172.969 -1.991 1
1 202 . 3 1 1 A 26 26 GLY CA C 26 44.794 45.871 -1.077 1
1 203 . 3 1 1 A 26 26 GLY N N 26 105.653 108.087 -2.434 1
1 204 . 3 1 1 A 27 27 CYS H H 27 6.864 7.533 -0.669 1
1 205 . 3 1 1 A 27 27 CYS HA H 27 5.195 4.875 0.320 1
1 208 . 3 1 1 A 27 27 CYS C C 27 171.144 172.890 -1.746 1
1 209 . 3 1 1 A 27 27 CYS CA C 27 52.349 58.011 -5.662 1
1 210 . 3 1 1 A 27 27 CYS CB C 27 30.997 32.058 -1.061 1
1 211 . 3 1 1 A 27 27 CYS N N 27 110.921 117.271 -6.350 1
1 212 . 3 1 1 A 28 28 LEU H H 28 8.310 8.705 -0.395 1
1 213 . 3 1 1 A 28 28 LEU HA H 28 4.651 4.934 -0.283 1
1 223 . 3 1 1 A 28 28 LEU C C 28 176.827 177.118 -0.291 1
1 224 . 3 1 1 A 28 28 LEU CA C 28 53.054 53.536 -0.482 1
1 225 . 3 1 1 A 28 28 LEU CB C 28 44.200 43.761 0.439 1
1 229 . 3 1 1 A 28 28 LEU N N 28 115.519 122.999 -7.480 1
1 230 . 3 1 1 A 29 29 LEU H H 29 8.800 8.732 0.068 1
1 231 . 3 1 1 A 29 29 LEU HA H 29 4.313 4.394 -0.081 1
1 240 . 3 1 1 A 29 29 LEU C C 29 175.571 176.345 -0.774 1
1 241 . 3 1 1 A 29 29 LEU CA C 29 54.388 54.779 -0.391 1
1 242 . 3 1 1 A 29 29 LEU CB C 29 42.780 41.301 1.479 1
1 245 . 3 1 1 A 29 29 LEU N N 29 118.712 125.519 -6.807 1
1 246 . 3 1 1 A 30 30 LYS H H 30 8.009 8.686 -0.677 1
1 247 . 3 1 1 A 30 30 LYS HA H 30 4.592 4.775 -0.183 1
1 256 . 3 1 1 A 30 30 LYS C C 30 174.990 174.965 0.025 1
1 257 . 3 1 1 A 30 30 LYS CA C 30 54.999 56.142 -1.143 1
1 258 . 3 1 1 A 30 30 LYS CB C 30 32.330 33.029 -0.699 1
1 262 . 3 1 1 A 30 30 LYS N N 30 122.310 125.841 -3.531 1
1 263 . 3 1 1 A 31 31 ALA H H 31 9.238 8.517 0.721 1
1 264 . 3 1 1 A 31 31 ALA HA H 31 4.477 4.453 0.024 1
1 268 . 3 1 1 A 31 31 ALA CA C 31 50.190 49.715 0.475 1
1 269 . 3 1 1 A 31 31 ALA CB C 31 21.637 20.018 1.619 1
1 270 . 3 1 1 A 31 31 ALA N N 31 133.864 130.420 3.444 1
1 271 . 3 1 1 A 32 32 PRO HA H 32 4.637 4.432 0.205 1
1 278 . 3 1 1 A 32 32 PRO C C 32 175.737 177.395 -1.658 1
1 279 . 3 1 1 A 32 32 PRO CA C 32 64.259 64.287 -0.028 1
1 280 . 3 1 1 A 32 32 PRO CB C 32 31.740 31.828 -0.088 1
1 283 . 3 1 1 A 33 33 CYS H H 33 8.779 8.307 0.472 1
1 284 . 3 1 1 A 33 33 CYS HA H 33 4.321 4.272 0.049 1
1 287 . 3 1 1 A 33 33 CYS C C 33 176.733 175.252 1.481 1
1 288 . 3 1 1 A 33 33 CYS CA C 33 54.398 61.194 -6.796 1
1 289 . 3 1 1 A 33 33 CYS CB C 33 30.697 27.123 3.574 1
1 290 . 3 1 1 A 33 33 CYS N N 33 120.005 116.436 3.569 1
1 291 . 3 1 1 A 34 34 CYS H H 34 7.424 7.633 -0.209 1
1 292 . 3 1 1 A 34 34 CYS HA H 34 4.896 4.750 0.146 1
1 295 . 3 1 1 A 34 34 CYS C C 34 174.935 175.015 -0.080 1
1 296 . 3 1 1 A 34 34 CYS CA C 34 56.962 58.625 -1.663 1
1 297 . 3 1 1 A 34 34 CYS CB C 34 31.067 29.754 1.313 1
1 298 . 3 1 1 A 34 34 CYS N N 34 115.034 117.838 -2.804 1
1 299 . 3 1 1 A 35 35 ASP H H 35 8.368 8.131 0.237 1
1 300 . 3 1 1 A 35 35 ASP HA H 35 4.454 4.245 0.209 1
1 303 . 3 1 1 A 35 35 ASP C C 35 174.354 175.009 -0.655 1
1 304 . 3 1 1 A 35 35 ASP CA C 35 56.222 55.608 0.614 1
1 305 . 3 1 1 A 35 35 ASP CB C 35 39.730 39.814 -0.084 1
1 306 . 3 1 1 A 35 35 ASP N N 35 121.381 117.152 4.229 1
1 307 . 3 1 1 A 36 36 LYS H H 36 7.227 7.974 -0.747 1
1 308 . 3 1 1 A 36 36 LYS HA H 36 4.451 4.578 -0.127 1
1 317 . 3 1 1 A 36 36 LYS C C 36 175.433 175.572 -0.139 1
1 318 . 3 1 1 A 36 36 LYS CA C 36 56.270 55.338 0.932 1
1 319 . 3 1 1 A 36 36 LYS CB C 36 36.620 34.149 2.471 1
1 323 . 3 1 1 A 36 36 LYS N N 36 117.673 118.491 -0.818 1
1 324 . 3 1 1 A 37 37 LEU H H 37 8.053 8.347 -0.294 1
1 325 . 3 1 1 A 37 37 LEU HA H 37 5.292 4.967 0.325 1
1 335 . 3 1 1 A 37 37 LEU C C 37 176.484 175.199 1.285 1
1 336 . 3 1 1 A 37 37 LEU CA C 37 53.348 53.039 0.309 1
1 337 . 3 1 1 A 37 37 LEU CB C 37 42.400 42.609 -0.209 1
1 341 . 3 1 1 A 37 37 LEU N N 37 120.994 122.788 -1.794 1
1 342 . 3 1 1 A 38 38 TYR H H 38 8.741 8.726 0.015 1
1 343 . 3 1 1 A 38 38 TYR HA H 38 5.002 4.911 0.091 1
1 350 . 3 1 1 A 38 38 TYR C C 38 176.374 175.919 0.455 1
1 351 . 3 1 1 A 38 38 TYR CA C 38 57.081 56.985 0.096 1
1 352 . 3 1 1 A 38 38 TYR CB C 38 45.647 42.246 3.401 1
1 355 . 3 1 1 A 38 38 TYR N N 38 121.128 122.180 -1.052 1
1 356 . 3 1 1 A 39 39 THR H H 39 9.402 8.676 0.726 1
1 357 . 3 1 1 A 39 39 THR HA H 39 4.098 4.129 -0.031 1
1 362 . 3 1 1 A 39 39 THR C C 39 173.496 174.969 -1.473 1
1 363 . 3 1 1 A 39 39 THR CA C 39 67.062 65.804 1.258 1
1 364 . 3 1 1 A 39 39 THR CB C 39 68.047 68.559 -0.512 1
1 366 . 3 1 1 A 39 39 THR N N 39 116.641 117.619 -0.978 1
1 367 . 3 1 1 A 40 40 CYS H H 40 7.317 7.908 -0.591 1
1 368 . 3 1 1 A 40 40 CYS HA H 40 4.771 4.894 -0.123 1
1 371 . 3 1 1 A 40 40 CYS C C 40 175.128 175.173 -0.045 1
1 372 . 3 1 1 A 40 40 CYS CA C 40 56.577 57.964 -1.387 1
1 373 . 3 1 1 A 40 40 CYS CB C 40 35.087 31.898 3.189 1
1 374 . 3 1 1 A 40 40 CYS N N 40 109.059 118.054 -8.995 1
1 375 . 3 1 1 A 41 41 ARG H H 41 9.201 8.982 0.219 1
1 376 . 3 1 1 A 41 41 ARG HA H 41 3.982 4.025 -0.043 1
1 383 . 3 1 1 A 41 41 ARG C C 41 175.101 178.152 -3.051 1
1 384 . 3 1 1 A 41 41 ARG CA C 41 58.591 58.886 -0.295 1
1 385 . 3 1 1 A 41 41 ARG CB C 41 29.640 29.830 -0.190 1
1 388 . 3 1 1 A 41 41 ARG N N 41 121.737 123.584 -1.847 1
1 389 . 3 1 1 A 42 42 LEU H H 42 9.116 7.747 1.369 1
1 390 . 3 1 1 A 42 42 LEU HA H 42 4.029 4.027 0.002 1
1 400 . 3 1 1 A 42 42 LEU C C 42 179.943 179.276 0.667 1
1 401 . 3 1 1 A 42 42 LEU CA C 42 58.005 57.754 0.251 1
1 402 . 3 1 1 A 42 42 LEU CB C 42 38.960 41.092 -2.132 1
1 406 . 3 1 1 A 42 42 LEU N N 42 126.364 116.826 9.538 1
1 407 . 3 1 1 A 43 43 CYS H H 43 8.785 8.276 0.509 1
1 408 . 3 1 1 A 43 43 CYS HA H 43 4.187 4.113 0.074 1
1 411 . 3 1 1 A 43 43 CYS C C 43 177.785 176.954 0.831 1
1 412 . 3 1 1 A 43 43 CYS CA C 43 66.415 63.406 3.009 1
1 413 . 3 1 1 A 43 43 CYS CB C 43 28.870 27.433 1.437 1
1 414 . 3 1 1 A 43 43 CYS N N 43 124.519 118.221 6.298 1
1 415 . 3 1 1 A 44 44 HIS H H 44 7.604 7.686 -0.082 1
1 416 . 3 1 1 A 44 44 HIS HA H 44 1.983 2.745 -0.762 1
1 420 . 3 1 1 A 44 44 HIS C C 44 176.429 176.538 -0.109 1
1 421 . 3 1 1 A 44 44 HIS CA C 44 58.760 58.934 -0.174 1
1 422 . 3 1 1 A 44 44 HIS CB C 44 27.990 29.487 -1.497 1
1 423 . 3 1 1 A 44 44 HIS N N 44 117.024 120.503 -3.479 1
1 424 . 3 1 1 A 45 45 ASP H H 45 8.750 8.251 0.499 1
1 425 . 3 1 1 A 45 45 ASP HA H 45 4.116 4.280 -0.164 1
1 428 . 3 1 1 A 45 45 ASP C C 45 177.453 178.376 -0.923 1
1 429 . 3 1 1 A 45 45 ASP CA C 45 56.840 57.054 -0.214 1
1 430 . 3 1 1 A 45 45 ASP CB C 45 38.960 41.594 -2.634 1
1 431 . 3 1 1 A 45 45 ASP N N 45 120.440 118.973 1.467 1
1 432 . 3 1 1 A 46 46 ASN H H 46 7.888 7.915 -0.027 1
1 433 . 3 1 1 A 46 46 ASN HA H 46 4.612 4.476 0.136 1
1 438 . 3 1 1 A 46 46 ASN C C 46 175.903 177.553 -1.650 1
1 439 . 3 1 1 A 46 46 ASN CA C 46 54.342 55.777 -1.435 1
1 440 . 3 1 1 A 46 46 ASN CB C 46 38.790 38.490 0.300 1
1 441 . 3 1 1 A 46 46 ASN N N 46 115.758 116.689 -0.931 1
1 443 . 3 1 1 A 47 47 ASN H H 47 7.384 7.490 -0.106 1
1 444 . 3 1 1 A 47 47 ASN HA H 47 4.893 4.642 0.251 1
1 449 . 3 1 1 A 47 47 ASN C C 47 173.579 175.632 -2.053 1
1 450 . 3 1 1 A 47 47 ASN CA C 47 53.937 54.837 -0.900 1
1 451 . 3 1 1 A 47 47 ASN CB C 47 43.130 39.253 3.877 1
1 452 . 3 1 1 A 47 47 ASN N N 47 116.576 115.620 0.956 1
1 454 . 3 1 1 A 48 48 GLU H H 48 7.143 7.447 -0.304 1
1 455 . 3 1 1 A 48 48 GLU HA H 48 4.572 4.323 0.249 1
1 460 . 3 1 1 A 48 48 GLU C C 48 175.627 176.502 -0.875 1
1 461 . 3 1 1 A 48 48 GLU CA C 48 53.727 54.908 -1.181 1
1 462 . 3 1 1 A 48 48 GLU CB C 48 32.480 30.192 2.288 1
1 464 . 3 1 1 A 48 48 GLU N N 48 116.967 117.874 -0.907 1
1 465 . 3 1 1 A 49 49 ASP H H 49 8.748 8.682 0.066 1
1 466 . 3 1 1 A 49 49 ASP HA H 49 4.576 4.454 0.122 1
1 469 . 3 1 1 A 49 49 ASP C C 49 174.796 176.072 -1.276 1
1 470 . 3 1 1 A 49 49 ASP CA C 49 53.027 56.341 -3.314 1
1 471 . 3 1 1 A 49 49 ASP CB C 49 40.340 41.296 -0.956 1
1 472 . 3 1 1 A 49 49 ASP N N 49 119.296 122.692 -3.396 1
1 473 . 3 1 1 A 50 50 HIS H H 50 6.919 7.399 -0.480 1
1 474 . 3 1 1 A 50 50 HIS HA H 50 4.880 5.131 -0.251 1
1 477 . 3 1 1 A 50 50 HIS C C 50 172.942 174.456 -1.514 1
1 478 . 3 1 1 A 50 50 HIS CA C 50 53.978 53.235 0.743 1
1 479 . 3 1 1 A 50 50 HIS CB C 50 30.330 32.877 -2.547 1
1 480 . 3 1 1 A 50 50 HIS N N 50 113.709 113.744 -0.035 1
1 481 . 3 1 1 A 51 51 GLN H H 51 8.646 8.642 0.004 1
1 482 . 3 1 1 A 51 51 GLN HA H 51 4.896 5.099 -0.203 1
1 487 . 3 1 1 A 51 51 GLN C C 51 176.512 174.288 2.224 1
1 488 . 3 1 1 A 51 51 GLN CA C 51 54.872 54.825 0.047 1
1 489 . 3 1 1 A 51 51 GLN CB C 51 30.950 30.518 0.432 1
1 491 . 3 1 1 A 51 51 GLN N N 51 119.379 117.976 1.403 1
1 492 . 3 1 1 A 52 52 LEU H H 52 9.646 8.747 0.899 1
1 493 . 3 1 1 A 52 52 LEU HA H 52 4.206 4.798 -0.592 1
1 503 . 3 1 1 A 52 52 LEU C C 52 175.793 174.175 1.618 1
1 504 . 3 1 1 A 52 52 LEU CA C 52 55.450 53.549 1.901 1
1 505 . 3 1 1 A 52 52 LEU CB C 52 41.407 44.171 -2.764 1
1 509 . 3 1 1 A 52 52 LEU N N 52 128.069 124.988 3.081 1
1 510 . 3 1 1 A 53 53 ASP H H 53 9.281 8.617 0.664 1
1 511 . 3 1 1 A 53 53 ASP HA H 53 4.725 4.920 -0.195 1
1 514 . 3 1 1 A 53 53 ASP C C 53 176.401 177.395 -0.994 1
1 515 . 3 1 1 A 53 53 ASP CA C 53 52.590 53.328 -0.738 1
1 516 . 3 1 1 A 53 53 ASP CB C 53 39.990 42.804 -2.814 1
1 517 . 3 1 1 A 53 53 ASP N N 53 128.783 127.120 1.663 1
1 518 . 3 1 1 A 54 54 ARG H H 54 8.496 8.745 -0.249 1
1 519 . 3 1 1 A 54 54 ARG HA H 54 3.859 3.883 -0.024 1
1 526 . 3 1 1 A 54 54 ARG C C 54 176.346 176.742 -0.396 1
1 527 . 3 1 1 A 54 54 ARG CA C 54 57.357 57.997 -0.640 1
1 528 . 3 1 1 A 54 54 ARG CB C 54 28.890 29.375 -0.485 1
1 531 . 3 1 1 A 54 54 ARG N N 54 125.813 125.091 0.722 1
1 532 . 3 1 1 A 55 55 PHE H H 55 8.005 7.641 0.364 1
1 533 . 3 1 1 A 55 55 PHE HA H 55 4.712 4.459 0.253 1
1 540 . 3 1 1 A 55 55 PHE C C 55 177.481 177.812 -0.331 1
1 541 . 3 1 1 A 55 55 PHE CA C 55 59.080 60.877 -1.797 1
1 542 . 3 1 1 A 55 55 PHE CB C 55 37.447 39.282 -1.835 1
1 545 . 3 1 1 A 55 55 PHE N N 55 120.168 117.633 2.535 1
1 546 . 3 1 1 A 56 56 LYS H H 56 7.681 7.455 0.226 1
1 547 . 3 1 1 A 56 56 LYS HA H 56 4.411 4.301 0.110 1
1 556 . 3 1 1 A 56 56 LYS C C 56 175.959 176.447 -0.488 1
1 557 . 3 1 1 A 56 56 LYS CA C 56 55.459 57.736 -2.277 1
1 558 . 3 1 1 A 56 56 LYS CB C 56 33.590 32.833 0.757 1
1 562 . 3 1 1 A 56 56 LYS N N 56 116.937 118.112 -1.175 1
1 563 . 3 1 1 A 57 57 VAL H H 57 6.553 7.130 -0.577 1
1 564 . 3 1 1 A 57 57 VAL HA H 57 3.408 3.906 -0.498 1
1 572 . 3 1 1 A 57 57 VAL C C 57 173.911 175.946 -2.035 1
1 573 . 3 1 1 A 57 57 VAL CA C 57 65.025 61.923 3.102 1
1 574 . 3 1 1 A 57 57 VAL CB C 57 32.663 31.691 0.972 1
1 577 . 3 1 1 A 57 57 VAL N N 57 119.519 117.739 1.780 1
1 578 . 3 1 1 A 58 58 LYS H H 58 9.182 8.804 0.378 1
1 579 . 3 1 1 A 58 58 LYS HA H 58 4.489 4.289 0.200 1
1 588 . 3 1 1 A 58 58 LYS C C 58 176.927 175.947 0.980 1
1 589 . 3 1 1 A 58 58 LYS CA C 58 55.913 57.961 -2.048 1
1 590 . 3 1 1 A 58 58 LYS CB C 58 36.340 33.546 2.794 1
1 594 . 3 1 1 A 58 58 LYS N N 58 124.985 126.741 -1.756 1
1 595 . 3 1 1 A 59 59 GLU H H 59 8.799 7.791 1.008 1
1 596 . 3 1 1 A 59 59 GLU HA H 59 5.209 4.954 0.255 1
1 601 . 3 1 1 A 59 59 GLU C C 59 173.911 175.099 -1.188 1
1 602 . 3 1 1 A 59 59 GLU CA C 59 54.670 54.462 0.208 1
1 603 . 3 1 1 A 59 59 GLU CB C 59 35.180 33.493 1.687 1
1 605 . 3 1 1 A 59 59 GLU N N 59 121.493 116.166 5.327 1
1 606 . 3 1 1 A 60 60 VAL H H 60 8.917 8.843 0.074 1
1 607 . 3 1 1 A 60 60 VAL HA H 60 4.983 5.061 -0.078 1
1 615 . 3 1 1 A 60 60 VAL C C 60 173.441 173.898 -0.457 1
1 616 . 3 1 1 A 60 60 VAL CA C 60 57.497 59.035 -1.538 1
1 617 . 3 1 1 A 60 60 VAL CB C 60 35.460 36.492 -1.032 1
1 620 . 3 1 1 A 60 60 VAL N N 60 109.266 117.845 -8.579 1
1 621 . 3 1 1 A 61 61 GLN H H 61 8.970 8.765 0.205 1
1 622 . 3 1 1 A 61 61 GLN HA H 61 5.024 5.521 -0.497 1
1 629 . 3 1 1 A 61 61 GLN C C 61 175.045 173.731 1.314 1
1 630 . 3 1 1 A 61 61 GLN CA C 61 53.128 53.679 -0.551 1
1 631 . 3 1 1 A 61 61 GLN CB C 61 33.980 32.487 1.493 1
1 633 . 3 1 1 A 61 61 GLN N N 61 118.525 119.739 -1.214 1
1 635 . 3 1 1 A 62 62 CYS H H 62 7.688 8.371 -0.683 1
1 636 . 3 1 1 A 62 62 CYS HA H 62 4.210 4.791 -0.581 1
1 639 . 3 1 1 A 62 62 CYS C C 62 177.951 173.653 4.298 1
1 640 . 3 1 1 A 62 62 CYS CA C 62 59.845 57.091 2.754 1
1 641 . 3 1 1 A 62 62 CYS CB C 62 33.120 29.987 3.133 1
1 642 . 3 1 1 A 62 62 CYS N N 62 128.772 120.106 8.666 1
1 643 . 3 1 1 A 63 63 ILE H H 63 8.192 8.603 -0.411 1
1 644 . 3 1 1 A 63 63 ILE HA H 63 3.984 4.292 -0.308 1
1 654 . 3 1 1 A 63 63 ILE C C 63 175.433 175.529 -0.096 1
1 655 . 3 1 1 A 63 63 ILE CA C 63 63.657 61.131 2.526 1
1 656 . 3 1 1 A 63 63 ILE CB C 63 38.506 35.532 2.974 1
1 660 . 3 1 1 A 63 63 ILE N N 63 127.455 128.686 -1.231 1
1 661 . 3 1 1 A 64 64 ASN H H 64 9.181 8.447 0.734 1
1 662 . 3 1 1 A 64 64 ASN HA H 64 4.810 4.964 -0.154 1
1 667 . 3 1 1 A 64 64 ASN C C 64 175.931 176.045 -0.114 1
1 668 . 3 1 1 A 64 64 ASN CA C 64 55.617 54.712 0.905 1
1 669 . 3 1 1 A 64 64 ASN CB C 64 40.640 40.634 0.006 1
1 670 . 3 1 1 A 64 64 ASN N N 64 122.104 124.329 -2.225 1
1 672 . 3 1 1 A 65 65 CYS H H 65 9.065 7.995 1.070 1
1 673 . 3 1 1 A 65 65 CYS HA H 65 4.979 4.521 0.458 1
1 676 . 3 1 1 A 65 65 CYS C C 65 176.291 174.836 1.455 1
1 677 . 3 1 1 A 65 65 CYS CA C 65 59.027 58.115 0.912 1
1 678 . 3 1 1 A 65 65 CYS CB C 65 32.030 29.547 2.483 1
1 679 . 3 1 1 A 65 65 CYS N N 65 120.368 115.925 4.443 1
1 680 . 3 1 1 A 66 66 GLU H H 66 7.281 7.999 -0.718 1
1 681 . 3 1 1 A 66 66 GLU HA H 66 4.046 4.099 -0.053 1
1 686 . 3 1 1 A 66 66 GLU C C 66 175.211 175.288 -0.077 1
1 687 . 3 1 1 A 66 66 GLU CA C 66 58.591 57.395 1.196 1
1 688 . 3 1 1 A 66 66 GLU CB C 66 27.067 27.026 0.041 1
1 690 . 3 1 1 A 66 66 GLU N N 66 115.012 116.280 -1.268 1
1 691 . 3 1 1 A 67 67 LYS H H 67 8.481 7.374 1.107 1
1 692 . 3 1 1 A 67 67 LYS HA H 67 4.326 4.218 0.108 1
1 701 . 3 1 1 A 67 67 LYS C C 67 177.923 175.892 2.031 1
1 702 . 3 1 1 A 67 67 LYS CA C 67 57.628 56.936 0.692 1
1 703 . 3 1 1 A 67 67 LYS CB C 67 33.617 32.915 0.702 1
1 707 . 3 1 1 A 67 67 LYS N N 67 123.514 120.607 2.907 1
1 708 . 3 1 1 A 68 68 ILE H H 68 8.867 8.660 0.207 1
1 709 . 3 1 1 A 68 68 ILE HA H 68 4.976 4.639 0.337 1
1 719 . 3 1 1 A 68 68 ILE C C 68 175.018 175.350 -0.332 1
1 720 . 3 1 1 A 68 68 ILE CA C 68 60.919 60.989 -0.070 1
1 721 . 3 1 1 A 68 68 ILE CB C 68 37.090 36.715 0.375 1
1 725 . 3 1 1 A 68 68 ILE N N 68 133.478 129.357 4.121 1
1 726 . 3 1 1 A 69 69 GLN H H 69 9.269 8.553 0.716 1
1 727 . 3 1 1 A 69 69 GLN HA H 69 5.036 4.947 0.089 1
1 732 . 3 1 1 A 69 69 GLN C C 69 173.607 174.626 -1.019 1
1 733 . 3 1 1 A 69 69 GLN CA C 69 53.419 53.731 -0.312 1
1 734 . 3 1 1 A 69 69 GLN CB C 69 34.997 32.452 2.545 1
1 736 . 3 1 1 A 69 69 GLN N N 69 125.104 123.518 1.586 1
1 737 . 3 1 1 A 70 70 HIS H H 70 8.829 8.794 0.035 1
1 738 . 3 1 1 A 70 70 HIS HA H 70 4.865 4.825 0.040 1
1 741 . 3 1 1 A 70 70 HIS C C 70 174.852 175.082 -0.230 1
1 742 . 3 1 1 A 70 70 HIS CA C 70 56.304 56.637 -0.333 1
1 743 . 3 1 1 A 70 70 HIS CB C 70 30.050 30.334 -0.284 1
1 744 . 3 1 1 A 70 70 HIS N N 70 118.576 119.802 -1.226 1
1 745 . 3 1 1 A 71 71 ALA H H 71 7.768 8.524 -0.756 1
1 746 . 3 1 1 A 71 71 ALA HA H 71 3.977 4.499 -0.522 1
1 750 . 3 1 1 A 71 71 ALA C C 71 175.433 177.033 -1.600 1
1 751 . 3 1 1 A 71 71 ALA CA C 71 54.393 52.733 1.660 1
1 752 . 3 1 1 A 71 71 ALA CB C 71 18.000 18.950 -0.950 1
1 753 . 3 1 1 A 71 71 ALA N N 71 121.438 124.777 -3.339 1
1 754 . 3 1 1 A 72 72 GLN H H 72 7.227 8.168 -0.941 1
1 755 . 3 1 1 A 72 72 GLN HA H 72 4.371 4.572 -0.201 1
1 762 . 3 1 1 A 72 72 GLN C C 72 173.053 174.887 -1.834 1
1 763 . 3 1 1 A 72 72 GLN CA C 72 54.290 53.584 0.706 1
1 764 . 3 1 1 A 72 72 GLN CB C 72 28.623 31.762 -3.139 1
1 766 . 3 1 1 A 72 72 GLN N N 72 115.858 123.408 -7.550 1
1 768 . 3 1 1 A 73 73 GLN H H 73 8.481 8.426 0.055 1
1 769 . 3 1 1 A 73 73 GLN HA H 73 3.570 3.263 0.307 1
1 776 . 3 1 1 A 73 73 GLN C C 73 174.243 174.826 -0.583 1
1 777 . 3 1 1 A 73 73 GLN CA C 73 60.206 57.447 2.759 1
1 778 . 3 1 1 A 73 73 GLN CB C 73 28.850 28.845 0.005 1
1 780 . 3 1 1 A 73 73 GLN N N 73 116.433 122.382 -5.949 1
1 782 . 3 1 1 A 74 74 THR H H 74 7.211 7.478 -0.267 1
1 783 . 3 1 1 A 74 74 THR HA H 74 4.160 5.019 -0.859 1
1 788 . 3 1 1 A 74 74 THR C C 74 171.836 173.256 -1.420 1
1 789 . 3 1 1 A 74 74 THR CA C 74 59.072 60.829 -1.757 1
1 790 . 3 1 1 A 74 74 THR CB C 74 71.560 72.250 -0.690 1
1 792 . 3 1 1 A 74 74 THR N N 74 108.717 110.243 -1.526 1
1 793 . 3 1 1 A 75 75 CYS H H 75 7.676 8.950 -1.274 1
1 794 . 3 1 1 A 75 75 CYS HA H 75 4.158 4.870 -0.712 1
1 797 . 3 1 1 A 75 75 CYS C C 75 178.781 175.657 3.124 1
1 798 . 3 1 1 A 75 75 CYS CA C 75 58.661 59.228 -0.567 1
1 799 . 3 1 1 A 75 75 CYS CB C 75 30.840 27.482 3.358 1
1 800 . 3 1 1 A 75 75 CYS N N 75 123.108 125.164 -2.056 1
1 801 . 3 1 1 A 76 76 GLU H H 76 9.203 8.853 0.350 1
1 802 . 3 1 1 A 76 76 GLU HA H 76 4.187 4.068 0.119 1
1 807 . 3 1 1 A 76 76 GLU C C 76 175.488 177.729 -2.241 1
1 808 . 3 1 1 A 76 76 GLU CA C 76 57.306 59.316 -2.010 1
1 809 . 3 1 1 A 76 76 GLU CB C 76 29.347 29.068 0.279 1
1 811 . 3 1 1 A 76 76 GLU N N 76 129.817 127.254 2.563 1
1 812 . 3 1 1 A 77 77 GLU H H 77 9.496 8.301 1.195 1
1 813 . 3 1 1 A 77 77 GLU HA H 77 4.599 4.192 0.407 1
1 818 . 3 1 1 A 77 77 GLU C C 77 177.148 177.060 0.088 1
1 819 . 3 1 1 A 77 77 GLU CA C 77 57.554 58.297 -0.743 1
1 820 . 3 1 1 A 77 77 GLU CB C 77 31.980 29.484 2.496 1
1 822 . 3 1 1 A 77 77 GLU N N 77 124.795 117.729 7.066 1
1 823 . 3 1 1 A 78 78 CYS H H 78 8.967 7.405 1.562 1
1 824 . 3 1 1 A 78 78 CYS HA H 78 5.073 4.601 0.472 1
1 827 . 3 1 1 A 78 78 CYS C C 78 176.374 174.722 1.652 1
1 828 . 3 1 1 A 78 78 CYS CA C 78 58.537 58.240 0.297 1
1 829 . 3 1 1 A 78 78 CYS CB C 78 31.597 29.081 2.516 1
1 830 . 3 1 1 A 78 78 CYS N N 78 119.692 118.295 1.397 1
1 831 . 3 1 1 A 79 79 SER H H 79 7.474 8.278 -0.804 1
1 832 . 3 1 1 A 79 79 SER HA H 79 4.113 4.138 -0.025 1
1 835 . 3 1 1 A 79 79 SER C C 79 172.915 173.440 -0.525 1
1 836 . 3 1 1 A 79 79 SER CA C 79 60.440 59.358 1.082 1
1 837 . 3 1 1 A 79 79 SER CB C 79 61.421 61.008 0.413 1
1 838 . 3 1 1 A 79 79 SER N N 79 113.385 112.779 0.606 1
1 839 . 3 1 1 A 80 80 THR H H 80 7.907 7.894 0.013 1
1 840 . 3 1 1 A 80 80 THR HA H 80 3.913 4.199 -0.286 1
1 845 . 3 1 1 A 80 80 THR C C 80 172.306 174.022 -1.716 1
1 846 . 3 1 1 A 80 80 THR CA C 80 65.262 63.137 2.125 1
1 847 . 3 1 1 A 80 80 THR CB C 80 69.910 68.523 1.387 1
1 849 . 3 1 1 A 80 80 THR N N 80 120.005 116.172 3.833 1
1 850 . 3 1 1 A 81 81 LEU H H 81 8.556 8.623 -0.067 1
1 851 . 3 1 1 A 81 81 LEU HA H 81 4.172 4.405 -0.233 1
1 861 . 3 1 1 A 81 81 LEU C C 81 177.121 177.420 -0.299 1
1 862 . 3 1 1 A 81 81 LEU CA C 81 54.996 56.381 -1.385 1
1 863 . 3 1 1 A 81 81 LEU CB C 81 42.147 42.772 -0.625 1
1 867 . 3 1 1 A 81 81 LEU N N 81 128.272 128.897 -0.625 1
1 868 . 3 1 1 A 82 82 PHE H H 82 9.251 9.294 -0.043 1
1 869 . 3 1 1 A 82 82 PHE HA H 82 4.576 4.329 0.247 1
1 874 . 3 1 1 A 82 82 PHE C C 82 177.785 176.440 1.345 1
1 875 . 3 1 1 A 82 82 PHE CA C 82 56.470 60.780 -4.310 1
1 876 . 3 1 1 A 82 82 PHE CB C 82 38.210 39.363 -1.153 1
1 878 . 3 1 1 A 82 82 PHE N N 82 129.268 125.981 3.287 1
1 879 . 3 1 1 A 83 83 GLY H H 83 7.047 7.528 -0.481 1
1 880 . 3 1 1 A 83 83 GLY HA2 H 83 4.783 4.151 0.632 1
1 881 . 3 1 1 A 83 83 GLY HA3 H 83 3.876 4.217 -0.341 1
1 882 . 3 1 1 A 83 83 GLY C C 83 171.642 174.822 -3.180 1
1 883 . 3 1 1 A 83 83 GLY CA C 83 45.826 45.646 0.180 1
1 884 . 3 1 1 A 83 83 GLY N N 83 102.168 103.782 -1.614 1
1 885 . 3 1 1 A 84 84 GLU H H 84 8.444 8.949 -0.505 1
1 886 . 3 1 1 A 84 84 GLU HA H 84 4.111 4.134 -0.023 1
1 891 . 3 1 1 A 84 84 GLU C C 84 177.259 176.898 0.361 1
1 892 . 3 1 1 A 84 84 GLU CA C 84 59.438 59.291 0.147 1
1 893 . 3 1 1 A 84 84 GLU CB C 84 30.670 30.010 0.660 1
1 895 . 3 1 1 A 84 84 GLU N N 84 127.546 120.613 6.933 1
1 896 . 3 1 1 A 85 85 TYR H H 85 9.344 8.228 1.116 1
1 897 . 3 1 1 A 85 85 TYR HA H 85 4.599 4.750 -0.151 1
1 902 . 3 1 1 A 85 85 TYR C C 85 173.302 174.325 -1.023 1
1 903 . 3 1 1 A 85 85 TYR CA C 85 57.261 59.005 -1.744 1
1 904 . 3 1 1 A 85 85 TYR CB C 85 40.850 39.837 1.013 1
1 906 . 3 1 1 A 85 85 TYR N N 85 118.936 121.116 -2.180 1
1 907 . 3 1 1 A 86 86 TYR H H 86 7.323 8.117 -0.794 1
1 908 . 3 1 1 A 86 86 TYR HA H 86 5.298 5.830 -0.532 1
1 911 . 3 1 1 A 86 86 TYR C C 86 172.804 173.032 -0.228 1
1 912 . 3 1 1 A 86 86 TYR CA C 86 54.041 55.249 -1.208 1
1 913 . 3 1 1 A 86 86 TYR CB C 86 40.987 42.318 -1.331 1
1 914 . 3 1 1 A 86 86 TYR N N 86 124.965 120.544 4.421 1
1 915 . 3 1 1 A 87 87 CYS H H 87 7.046 8.865 -1.819 1
1 916 . 3 1 1 A 87 87 CYS HA H 87 3.842 4.704 -0.862 1
1 919 . 3 1 1 A 87 87 CYS C C 87 174.243 174.269 -0.026 1
1 920 . 3 1 1 A 87 87 CYS CA C 87 56.377 58.669 -2.292 1
1 921 . 3 1 1 A 87 87 CYS CB C 87 33.230 29.754 3.476 1
1 922 . 3 1 1 A 87 87 CYS N N 87 128.735 118.479 10.256 1
1 923 . 3 1 1 A 88 88 ASP H H 88 8.002 9.131 -1.129 1
1 924 . 3 1 1 A 88 88 ASP HA H 88 3.761 4.548 -0.787 1
1 927 . 3 1 1 A 88 88 ASP C C 88 173.579 178.116 -4.537 1
1 928 . 3 1 1 A 88 88 ASP CA C 88 53.958 56.713 -2.755 1
1 929 . 3 1 1 A 88 88 ASP CB C 88 41.240 39.643 1.597 1
1 930 . 3 1 1 A 88 88 ASP N N 88 127.013 127.045 -0.032 1
1 931 . 3 1 1 A 89 89 ILE H H 89 7.972 7.847 0.125 1
1 932 . 3 1 1 A 89 89 ILE HA H 89 3.660 3.523 0.137 1
1 942 . 3 1 1 A 89 89 ILE C C 89 177.259 177.380 -0.121 1
1 943 . 3 1 1 A 89 89 ILE CA C 89 63.107 65.019 -1.912 1
1 944 . 3 1 1 A 89 89 ILE CB C 89 39.430 37.825 1.605 1
1 948 . 3 1 1 A 89 89 ILE N N 89 120.357 120.530 -0.173 1
1 949 . 3 1 1 A 90 90 CYS H H 90 8.554 7.702 0.852 1
1 950 . 3 1 1 A 90 90 CYS HA H 90 3.677 3.672 0.005 1
1 953 . 3 1 1 A 90 90 CYS C C 90 175.128 174.454 0.674 1
1 954 . 3 1 1 A 90 90 CYS CA C 90 60.791 59.207 1.584 1
1 955 . 3 1 1 A 90 90 CYS CB C 90 30.427 27.877 2.550 1
1 956 . 3 1 1 A 90 90 CYS N N 90 119.564 117.331 2.233 1
1 957 . 3 1 1 A 91 91 HIS H H 91 7.364 7.440 -0.076 1
1 958 . 3 1 1 A 91 91 HIS HA H 91 3.512 3.711 -0.199 1
1 963 . 3 1 1 A 91 91 HIS C C 91 170.590 173.145 -2.555 1
1 964 . 3 1 1 A 91 91 HIS CA C 91 58.739 56.792 1.947 1
1 965 . 3 1 1 A 91 91 HIS CB C 91 24.810 26.631 -1.821 1
1 968 . 3 1 1 A 91 91 HIS N N 91 111.440 115.870 -4.430 1
1 969 . 3 1 1 A 92 92 LEU H H 92 6.214 7.464 -1.250 1
1 970 . 3 1 1 A 92 92 LEU HA H 92 4.191 4.036 0.155 1
1 980 . 3 1 1 A 92 92 LEU C C 92 173.911 175.632 -1.721 1
1 981 . 3 1 1 A 92 92 LEU CA C 92 53.717 53.453 0.264 1
1 982 . 3 1 1 A 92 92 LEU CB C 92 45.360 42.290 3.070 1
1 986 . 3 1 1 A 92 92 LEU N N 92 115.684 118.966 -3.282 1
1 987 . 3 1 1 A 93 93 PHE H H 93 6.669 8.893 -2.224 1
1 988 . 3 1 1 A 93 93 PHE HA H 93 5.622 5.323 0.299 1
1 995 . 3 1 1 A 93 93 PHE C C 93 175.765 174.294 1.471 1
1 996 . 3 1 1 A 93 93 PHE CA C 93 55.387 56.500 -1.113 1
1 997 . 3 1 1 A 93 93 PHE CB C 93 42.700 42.519 0.181 1
1 1000 . 3 1 1 A 93 93 PHE N N 93 121.535 120.773 0.762 1
1 1001 . 3 1 1 A 94 94 ASP H H 94 9.209 8.600 0.609 1
1 1002 . 3 1 1 A 94 94 ASP HA H 94 5.819 5.212 0.607 1
1 1005 . 3 1 1 A 94 94 ASP C C 94 175.654 175.282 0.372 1
1 1006 . 3 1 1 A 94 94 ASP CA C 94 53.330 53.204 0.126 1
1 1007 . 3 1 1 A 94 94 ASP CB C 94 44.720 45.012 -0.292 1
1 1008 . 3 1 1 A 94 94 ASP N N 94 123.504 121.196 2.308 1
1 1009 . 3 1 1 A 95 95 LYS H H 95 9.043 8.698 0.345 1
1 1010 . 3 1 1 A 95 95 LYS HA H 95 4.527 4.397 0.130 1
1 1019 . 3 1 1 A 95 95 LYS C C 95 174.879 176.501 -1.622 1
1 1020 . 3 1 1 A 95 95 LYS CA C 95 56.620 56.855 -0.235 1
1 1021 . 3 1 1 A 95 95 LYS CB C 95 33.720 33.321 0.399 1
1 1025 . 3 1 1 A 95 95 LYS N N 95 120.380 121.806 -1.426 1
1 1026 . 3 1 1 A 96 96 ASP H H 96 8.999 8.553 0.446 1
1 1027 . 3 1 1 A 96 96 ASP HA H 96 4.724 4.692 0.032 1
1 1030 . 3 1 1 A 96 96 ASP C C 96 176.401 176.151 0.250 1
1 1031 . 3 1 1 A 96 96 ASP CA C 96 56.147 54.046 2.101 1
1 1032 . 3 1 1 A 96 96 ASP CB C 96 40.790 41.003 -0.213 1
1 1033 . 3 1 1 A 96 96 ASP N N 96 120.784 121.520 -0.736 1
1 1034 . 3 1 1 A 97 97 LYS H H 97 9.382 8.535 0.847 1
1 1035 . 3 1 1 A 97 97 LYS HA H 97 4.473 4.588 -0.115 1
1 1044 . 3 1 1 A 97 97 LYS C C 97 175.903 175.732 0.171 1
1 1045 . 3 1 1 A 97 97 LYS CA C 97 54.771 55.009 -0.238 1
1 1046 . 3 1 1 A 97 97 LYS CB C 97 33.270 33.207 0.063 1
1 1050 . 3 1 1 A 97 97 LYS N N 97 131.617 126.128 5.489 1
1 1051 . 3 1 1 A 98 98 LYS H H 98 8.940 8.002 0.938 1
1 1052 . 3 1 1 A 98 98 LYS HA H 98 4.118 3.894 0.224 1
1 1061 . 3 1 1 A 98 98 LYS C C 98 177.065 175.193 1.872 1
1 1062 . 3 1 1 A 98 98 LYS CA C 98 56.297 57.591 -1.294 1
1 1063 . 3 1 1 A 98 98 LYS CB C 98 28.467 29.409 -0.942 1
1 1067 . 3 1 1 A 98 98 LYS N N 98 115.034 116.034 -1.000 1
1 1068 . 3 1 1 A 99 99 GLN H H 99 9.266 7.578 1.688 1
1 1069 . 3 1 1 A 99 99 GLN HA H 99 4.460 4.183 0.277 1
1 1074 . 3 1 1 A 99 99 GLN C C 99 174.990 175.143 -0.153 1
1 1075 . 3 1 1 A 99 99 GLN CA C 99 57.563 55.919 1.644 1
1 1076 . 3 1 1 A 99 99 GLN CB C 99 27.280 28.653 -1.373 1
1 1078 . 3 1 1 A 99 99 GLN N N 99 117.717 117.880 -0.163 1
1 1079 . 3 1 1 A 100 100 TYR H H 100 8.402 8.301 0.101 1
1 1080 . 3 1 1 A 100 100 TYR HA H 100 4.935 5.447 -0.512 1
1 1087 . 3 1 1 A 100 100 TYR C C 100 171.504 173.443 -1.939 1
1 1088 . 3 1 1 A 100 100 TYR CA C 100 55.786 55.752 0.034 1
1 1089 . 3 1 1 A 100 100 TYR CB C 100 41.090 40.619 0.471 1
1 1092 . 3 1 1 A 100 100 TYR N N 100 115.081 119.182 -4.101 1
1 1093 . 3 1 1 A 101 101 HIS H H 101 8.829 9.044 -0.215 1
1 1094 . 3 1 1 A 101 101 HIS HA H 101 4.525 5.002 -0.477 1
1 1099 . 3 1 1 A 101 101 HIS C C 101 174.935 174.005 0.930 1
1 1100 . 3 1 1 A 101 101 HIS CA C 101 56.327 55.051 1.276 1
1 1101 . 3 1 1 A 101 101 HIS CB C 101 31.020 30.298 0.722 1
1 1104 . 3 1 1 A 101 101 HIS N N 101 120.894 123.149 -2.255 1
1 1105 . 3 1 1 A 102 102 CYS H H 102 7.427 8.296 -0.869 1
1 1106 . 3 1 1 A 102 102 CYS HA H 102 4.561 4.396 0.165 1
1 1109 . 3 1 1 A 102 102 CYS C C 102 175.765 175.469 0.296 1
1 1110 . 3 1 1 A 102 102 CYS CA C 102 57.707 59.180 -1.473 1
1 1111 . 3 1 1 A 102 102 CYS CB C 102 29.130 27.928 1.202 1
1 1112 . 3 1 1 A 102 102 CYS N N 102 131.256 126.706 4.550 1
1 1113 . 3 1 1 A 103 103 GLU H H 103 9.497 8.756 0.741 1
1 1114 . 3 1 1 A 103 103 GLU HA H 103 4.003 4.179 -0.176 1
1 1119 . 3 1 1 A 103 103 GLU C C 103 176.540 178.935 -2.395 1
1 1120 . 3 1 1 A 103 103 GLU CA C 103 58.796 59.477 -0.681 1
1 1121 . 3 1 1 A 103 103 GLU CB C 103 29.280 29.483 -0.203 1
1 1123 . 3 1 1 A 103 103 GLU N N 103 129.829 127.463 2.366 1
1 1124 . 3 1 1 A 104 104 ASN H H 104 7.832 8.330 -0.498 1
1 1125 . 3 1 1 A 104 104 ASN HA H 104 4.457 4.379 0.078 1
1 1130 . 3 1 1 A 104 104 ASN C C 104 176.401 176.969 -0.568 1
1 1131 . 3 1 1 A 104 104 ASN CA C 104 56.053 56.679 -0.626 1
1 1132 . 3 1 1 A 104 104 ASN CB C 104 38.400 38.988 -0.588 1
1 1133 . 3 1 1 A 104 104 ASN N N 104 117.703 117.576 0.127 1
1 1135 . 3 1 1 A 105 105 CYS H H 105 9.415 7.608 1.807 1
1 1136 . 3 1 1 A 105 105 CYS HA H 105 4.137 4.415 -0.278 1
1 1139 . 3 1 1 A 105 105 CYS C C 105 176.844 175.312 1.532 1
1 1140 . 3 1 1 A 105 105 CYS CA C 105 64.328 59.366 4.962 1
1 1141 . 3 1 1 A 105 105 CYS CB C 105 30.350 28.204 2.146 1
1 1142 . 3 1 1 A 105 105 CYS N N 105 124.939 115.172 9.767 1
1 1143 . 3 1 1 A 106 106 GLY H H 106 8.145 8.730 -0.585 1
1 1144 . 3 1 1 A 106 106 GLY HA2 H 106 3.980 3.992 -0.012 1
1 1145 . 3 1 1 A 106 106 GLY HA3 H 106 3.502 4.048 -0.546 1
1 1146 . 3 1 1 A 106 106 GLY C C 106 172.500 173.717 -1.217 1
1 1147 . 3 1 1 A 106 106 GLY CA C 106 44.968 46.368 -1.400 1
1 1148 . 3 1 1 A 106 106 GLY N N 106 106.090 109.703 -3.613 1
1 1149 . 3 1 1 A 107 107 ILE H H 107 6.465 6.766 -0.301 1
1 1150 . 3 1 1 A 107 107 ILE HA H 107 4.878 5.046 -0.168 1
1 1160 . 3 1 1 A 107 107 ILE C C 107 174.824 174.151 0.673 1
1 1161 . 3 1 1 A 107 107 ILE CA C 107 58.226 58.702 -0.476 1
1 1162 . 3 1 1 A 107 107 ILE CB C 107 44.460 42.651 1.809 1
1 1166 . 3 1 1 A 107 107 ILE N N 107 107.914 114.348 -6.434 1
1 1167 . 3 1 1 A 108 108 CYS H H 108 7.041 9.046 -2.005 1
1 1168 . 3 1 1 A 108 108 CYS HA H 108 5.018 5.443 -0.425 1
1 1171 . 3 1 1 A 108 108 CYS C C 108 175.461 173.188 2.273 1
1 1172 . 3 1 1 A 108 108 CYS CA C 108 62.097 58.060 4.037 1
1 1173 . 3 1 1 A 108 108 CYS CB C 108 31.353 30.701 0.652 1
1 1174 . 3 1 1 A 108 108 CYS N N 108 122.441 121.103 1.338 1
1 1175 . 3 1 1 A 109 109 ARG H H 109 8.561 8.202 0.359 1
1 1176 . 3 1 1 A 109 109 ARG HA H 109 4.239 4.743 -0.504 1
1 1183 . 3 1 1 A 109 109 ARG C C 109 174.271 175.456 -1.185 1
1 1184 . 3 1 1 A 109 109 ARG CA C 109 52.962 53.816 -0.854 1
1 1185 . 3 1 1 A 109 109 ARG CB C 109 33.903 34.340 -0.437 1
1 1188 . 3 1 1 A 109 109 ARG N N 109 121.163 123.830 -2.667 1
1 1189 . 3 1 1 A 110 110 ILE H H 110 7.847 8.306 -0.459 1
1 1190 . 3 1 1 A 110 110 ILE HA H 110 3.531 3.979 -0.448 1
1 1200 . 3 1 1 A 110 110 ILE C C 110 175.405 176.269 -0.864 1
1 1201 . 3 1 1 A 110 110 ILE CA C 110 62.201 62.494 -0.293 1
1 1202 . 3 1 1 A 110 110 ILE CB C 110 36.860 37.581 -0.721 1
1 1206 . 3 1 1 A 110 110 ILE N N 110 118.955 120.680 -1.725 1
1 1207 . 3 1 1 A 111 111 GLY H H 111 6.928 8.177 -1.249 1
1 1208 . 3 1 1 A 111 111 GLY HA2 H 111 4.564 3.674 0.890 1
1 1209 . 3 1 1 A 111 111 GLY HA3 H 111 4.135 4.123 0.012 1
1 1210 . 3 1 1 A 111 111 GLY CA C 111 43.068 45.470 -2.402 1
1 1211 . 3 1 1 A 111 111 GLY N N 111 113.782 112.571 1.211 1
1 1212 . 3 1 1 A 112 112 PRO HA H 112 4.990 4.720 0.270 1
1 1219 . 3 1 1 A 112 112 PRO C C 112 177.342 177.776 -0.434 1
1 1220 . 3 1 1 A 112 112 PRO CA C 112 62.920 62.952 -0.032 1
1 1221 . 3 1 1 A 112 112 PRO CB C 112 34.807 31.788 3.019 1
1 1224 . 3 1 1 A 113 113 LYS H H 113 8.989 8.254 0.735 1
1 1225 . 3 1 1 A 113 113 LYS HA H 113 3.144 4.018 -0.874 1
1 1234 . 3 1 1 A 113 113 LYS C C 113 177.536 178.087 -0.551 1
1 1235 . 3 1 1 A 113 113 LYS CA C 113 59.883 58.965 0.918 1
1 1236 . 3 1 1 A 113 113 LYS CB C 113 32.260 31.992 0.268 1
1 1240 . 3 1 1 A 113 113 LYS N N 113 123.545 124.001 -0.456 1
1 1241 . 3 1 1 A 114 114 GLU H H 114 9.080 9.187 -0.107 1
1 1242 . 3 1 1 A 114 114 GLU HA H 114 4.199 4.091 0.108 1
1 1247 . 3 1 1 A 114 114 GLU C C 114 176.374 176.960 -0.586 1
1 1248 . 3 1 1 A 114 114 GLU CA C 114 58.733 59.414 -0.681 1
1 1249 . 3 1 1 A 114 114 GLU CB C 114 28.077 29.049 -0.972 1
1 1251 . 3 1 1 A 114 114 GLU N N 114 114.832 120.550 -5.718 1
1 1252 . 3 1 1 A 115 115 ASP H H 115 7.799 7.877 -0.078 1
1 1253 . 3 1 1 A 115 115 ASP HA H 115 4.642 4.741 -0.099 1
1 1256 . 3 1 1 A 115 115 ASP C C 115 176.374 175.336 1.038 1
1 1257 . 3 1 1 A 115 115 ASP CA C 115 54.470 53.434 1.036 1
1 1258 . 3 1 1 A 115 115 ASP CB C 115 40.850 41.353 -0.503 1
1 1259 . 3 1 1 A 115 115 ASP N N 115 118.858 118.818 0.040 1
1 1260 . 3 1 1 A 116 116 PHE H H 116 8.063 7.700 0.363 1
1 1261 . 3 1 1 A 116 116 PHE HA H 116 5.239 5.116 0.123 1
1 1264 . 3 1 1 A 116 116 PHE C C 116 173.413 174.546 -1.133 1
1 1265 . 3 1 1 A 116 116 PHE CA C 116 57.708 55.873 1.835 1
1 1266 . 3 1 1 A 116 116 PHE CB C 116 44.557 43.663 0.894 1
1 1267 . 3 1 1 A 116 116 PHE N N 116 120.567 118.245 2.322 1
1 1268 . 3 1 1 A 117 117 PHE H H 117 9.439 8.675 0.764 1
1 1269 . 3 1 1 A 117 117 PHE HA H 117 5.091 4.968 0.123 1
1 1277 . 3 1 1 A 117 117 PHE C C 117 171.614 171.951 -0.337 1
1 1278 . 3 1 1 A 117 117 PHE CA C 117 55.311 56.072 -0.761 1
1 1279 . 3 1 1 A 117 117 PHE CB C 117 41.887 40.888 0.999 1
1 1283 . 3 1 1 A 117 117 PHE N N 117 118.040 117.220 0.820 1
1 1284 . 3 1 1 A 118 118 HIS H H 118 8.779 8.921 -0.142 1
1 1285 . 3 1 1 A 118 118 HIS HA H 118 4.836 5.043 -0.207 1
1 1289 . 3 1 1 A 118 118 HIS C C 118 174.879 173.724 1.155 1
1 1290 . 3 1 1 A 118 118 HIS CA C 118 55.322 54.751 0.571 1
1 1291 . 3 1 1 A 118 118 HIS CB C 118 30.950 32.298 -1.348 1
1 1293 . 3 1 1 A 118 118 HIS N N 118 121.208 119.885 1.323 1
1 1294 . 3 1 1 A 119 119 CYS H H 119 8.123 8.027 0.096 1
1 1295 . 3 1 1 A 119 119 CYS HA H 119 4.529 4.503 0.026 1
1 1298 . 3 1 1 A 119 119 CYS C C 119 176.567 174.676 1.891 1
1 1299 . 3 1 1 A 119 119 CYS CA C 119 58.957 57.575 1.382 1
1 1300 . 3 1 1 A 119 119 CYS CB C 119 30.090 27.107 2.983 1
1 1301 . 3 1 1 A 119 119 CYS N N 119 131.659 125.685 5.974 1
1 1302 . 3 1 1 A 120 120 LEU H H 120 8.970 8.425 0.545 1
1 1303 . 3 1 1 A 120 120 LEU N N 120 130.361 128.028 2.333 1
1 1304 . 3 1 1 A 121 121 LYS HA H 121 4.299 4.411 -0.112 1
1 1313 . 3 1 1 A 121 121 LYS CA C 121 58.727 55.360 3.367 1
1 1314 . 3 1 1 A 121 121 LYS CB C 121 33.210 32.027 1.183 1
1 1318 . 3 1 1 A 123 123 ASN HA H 123 4.438 4.509 -0.071 1
1 1323 . 3 1 1 A 123 123 ASN C C 123 172.444 173.802 -1.358 1
1 1324 . 3 1 1 A 123 123 ASN CA C 123 53.448 55.090 -1.642 1
1 1325 . 3 1 1 A 123 123 ASN CB C 123 37.130 36.722 0.408 1
1 1327 . 3 1 1 A 124 124 LEU H H 124 6.596 7.818 -1.222 1
1 1328 . 3 1 1 A 124 124 LEU HA H 124 4.576 4.816 -0.240 1
1 1338 . 3 1 1 A 124 124 LEU C C 124 175.903 176.018 -0.115 1
1 1339 . 3 1 1 A 124 124 LEU CA C 124 54.043 53.469 0.574 1
1 1340 . 3 1 1 A 124 124 LEU CB C 124 45.837 44.507 1.330 1
1 1344 . 3 1 1 A 124 124 LEU N N 124 115.443 122.371 -6.928 1
1 1345 . 3 1 1 A 125 125 CYS H H 125 6.342 8.479 -2.137 1
1 1346 . 3 1 1 A 125 125 CYS HA H 125 5.033 4.435 0.598 1
1 1349 . 3 1 1 A 125 125 CYS C C 125 175.101 174.232 0.869 1
1 1350 . 3 1 1 A 125 125 CYS CA C 125 62.046 58.909 3.137 1
1 1351 . 3 1 1 A 125 125 CYS CB C 125 30.840 28.773 2.067 1
1 1352 . 3 1 1 A 125 125 CYS N N 125 118.685 123.216 -4.531 1
1 1353 . 3 1 1 A 126 126 LEU H H 126 8.894 8.131 0.763 1
1 1354 . 3 1 1 A 126 126 LEU HA H 126 4.565 4.647 -0.082 1
1 1364 . 3 1 1 A 126 126 LEU C C 126 174.879 173.694 1.185 1
1 1365 . 3 1 1 A 126 126 LEU CA C 126 52.751 53.182 -0.431 1
1 1366 . 3 1 1 A 126 126 LEU CB C 126 46.090 45.023 1.067 1
1 1370 . 3 1 1 A 126 126 LEU N N 126 124.501 122.745 1.756 1
1 1371 . 3 1 1 A 127 127 ALA H H 127 8.378 8.548 -0.170 1
1 1372 . 3 1 1 A 127 127 ALA HA H 127 3.957 3.647 0.310 1
1 1376 . 3 1 1 A 127 127 ALA C C 127 179.085 177.976 1.109 1
1 1377 . 3 1 1 A 127 127 ALA CA C 127 52.554 51.544 1.010 1
1 1378 . 3 1 1 A 127 127 ALA CB C 127 18.527 19.082 -0.555 1
1 1379 . 3 1 1 A 127 127 ALA N N 127 123.011 125.787 -2.776 1
1 1380 . 3 1 1 A 128 128 MET H H 128 8.237 8.448 -0.211 1
1 1385 . 3 1 1 A 128 128 MET N N 128 120.642 121.419 -0.777 1
1 1386 . 3 1 1 A 129 129 ASN HA H 129 4.502 4.567 -0.065 1
1 1389 . 3 1 1 A 129 129 ASN C C 129 175.931 177.489 -1.558 1
1 1390 . 3 1 1 A 129 129 ASN CA C 129 55.064 55.867 -0.803 1
1 1391 . 3 1 1 A 129 129 ASN CB C 129 36.920 38.267 -1.347 1
1 1392 . 3 1 1 A 130 130 LEU H H 130 8.211 7.513 0.698 1
1 1393 . 3 1 1 A 130 130 LEU HA H 130 4.489 4.070 0.419 1
1 1403 . 3 1 1 A 130 130 LEU C C 130 178.836 176.455 2.381 1
1 1404 . 3 1 1 A 130 130 LEU CA C 130 54.653 56.792 -2.139 1
1 1405 . 3 1 1 A 130 130 LEU CB C 130 41.887 42.085 -0.198 1
1 1409 . 3 1 1 A 130 130 LEU N N 130 118.563 120.339 -1.776 1
1 1410 . 3 1 1 A 131 131 GLN H H 131 7.953 7.262 0.691 1
1 1411 . 3 1 1 A 131 131 GLN HA H 131 3.729 4.199 -0.470 1
1 1418 . 3 1 1 A 131 131 GLN CA C 131 59.310 56.844 2.466 1
1 1419 . 3 1 1 A 131 131 GLN CB C 131 28.340 28.555 -0.215 1
1 1421 . 3 1 1 A 131 131 GLN N N 131 123.929 114.983 8.946 1
1 1423 . 3 1 1 A 132 132 GLY HA2 H 132 4.034 3.959 0.075 1
1 1424 . 3 1 1 A 132 132 GLY HA3 H 132 3.865 3.968 -0.103 1
1 1425 . 3 1 1 A 132 132 GLY C C 132 174.547 174.255 0.292 1
1 1426 . 3 1 1 A 132 132 GLY CA C 132 45.902 45.148 0.754 1
1 1427 . 3 1 1 A 133 133 ARG H H 133 7.735 7.646 0.089 1
1 1428 . 3 1 1 A 133 133 ARG HA H 133 4.611 4.321 0.290 1
1 1435 . 3 1 1 A 133 133 ARG C C 133 175.461 176.476 -1.015 1
1 1436 . 3 1 1 A 133 133 ARG CA C 133 54.987 56.913 -1.926 1
1 1437 . 3 1 1 A 133 133 ARG CB C 133 31.470 30.857 0.613 1
1 1440 . 3 1 1 A 133 133 ARG N N 133 118.194 121.898 -3.704 1
1 1441 . 3 1 1 A 134 134 HIS H H 134 7.803 7.713 0.090 1
1 1444 . 3 1 1 A 134 134 HIS N N 134 118.700 118.651 0.049 1
1 1445 . 3 1 1 A 135 135 LYS HA H 135 4.331 4.452 -0.121 1
1 1454 . 3 1 1 A 135 135 LYS C C 135 174.852 176.440 -1.588 1
1 1455 . 3 1 1 A 135 135 LYS CA C 135 55.390 56.274 -0.884 1
1 1456 . 3 1 1 A 135 135 LYS CB C 135 32.970 32.783 0.187 1
1 1460 . 3 1 1 A 136 136 CYS H H 136 7.801 8.743 -0.942 1
1 1461 . 3 1 1 A 136 136 CYS HA H 136 4.113 4.863 -0.750 1
1 1464 . 3 1 1 A 136 136 CYS C C 136 174.879 173.762 1.117 1
1 1465 . 3 1 1 A 136 136 CYS CA C 136 60.028 58.579 1.449 1
1 1466 . 3 1 1 A 136 136 CYS CB C 136 30.350 29.203 1.147 1
1 1467 . 3 1 1 A 136 136 CYS N N 136 126.055 119.812 6.243 1
1 10 . 4 1 1 A 2 2 ALA H H 2 8.220 8.706 -0.486 1
1 11 . 4 1 1 A 2 2 ALA HA H 2 4.321 4.727 -0.406 1
1 15 . 4 1 1 A 2 2 ALA C C 2 177.564 176.948 0.616 1
1 16 . 4 1 1 A 2 2 ALA CA C 2 52.383 51.447 0.936 1
1 17 . 4 1 1 A 2 2 ALA CB C 2 19.290 20.160 -0.870 1
1 18 . 4 1 1 A 2 2 ALA N N 2 125.223 126.340 -1.117 1
1 19 . 4 1 1 A 3 3 ALA H H 3 8.246 8.834 -0.588 1
1 20 . 4 1 1 A 3 3 ALA N N 3 123.250 126.405 -3.155 1
1 21 . 4 1 1 A 5 5 ALA HA H 5 4.415 4.920 -0.505 1
1 25 . 4 1 1 A 5 5 ALA C C 5 177.481 175.335 2.146 1
1 26 . 4 1 1 A 5 5 ALA CA C 5 52.423 51.445 0.978 1
1 27 . 4 1 1 A 5 5 ALA CB C 5 19.420 23.562 -4.142 1
1 28 . 4 1 1 A 6 6 ARG H H 6 8.239 8.910 -0.671 1
1 29 . 4 1 1 A 6 6 ARG HA H 6 4.371 5.065 -0.694 1
1 36 . 4 1 1 A 6 6 ARG C C 6 176.180 175.084 1.096 1
1 37 . 4 1 1 A 6 6 ARG CA C 6 56.353 54.734 1.619 1
1 38 . 4 1 1 A 6 6 ARG CB C 6 31.170 32.138 -0.968 1
1 41 . 4 1 1 A 6 6 ARG N N 6 120.436 116.799 3.637 1
1 42 . 4 1 1 A 7 7 GLU H H 7 8.535 8.914 -0.379 1
1 43 . 4 1 1 A 7 7 GLU HA H 7 4.335 4.672 -0.337 1
1 48 . 4 1 1 A 7 7 GLU C C 7 176.346 176.339 0.007 1
1 49 . 4 1 1 A 7 7 GLU CA C 7 56.740 55.701 1.039 1
1 50 . 4 1 1 A 7 7 GLU CB C 7 30.390 30.731 -0.341 1
1 52 . 4 1 1 A 7 7 GLU N N 7 122.189 120.078 2.111 1
1 53 . 4 1 1 A 8 8 ASP H H 8 8.347 7.568 0.779 1
1 54 . 4 1 1 A 8 8 ASP N N 8 121.112 120.422 0.690 1
1 55 . 4 1 1 A 9 9 GLY HA2 H 9 3.975 4.019 -0.044 1
1 56 . 4 1 1 A 9 9 GLY HA3 H 9 3.975 4.019 -0.044 1
1 57 . 4 1 1 A 9 9 GLY C C 9 174.243 174.879 -0.636 1
1 58 . 4 1 1 A 9 9 GLY CA C 9 45.933 45.950 -0.017 1
1 59 . 4 1 1 A 10 10 ALA H H 10 8.111 8.649 -0.538 1
1 60 . 4 1 1 A 10 10 ALA N N 10 123.721 127.007 -3.286 1
1 61 . 4 1 1 A 12 12 GLY HA2 H 12 3.992 4.199 -0.207 1
1 62 . 4 1 1 A 12 12 GLY HA3 H 12 3.992 4.199 -0.207 1
1 63 . 4 1 1 A 12 12 GLY C C 12 173.883 172.392 1.491 1
1 64 . 4 1 1 A 12 12 GLY CA C 12 45.381 44.916 0.465 1
1 65 . 4 1 1 A 13 13 GLU H H 13 8.224 9.040 -0.816 1
1 66 . 4 1 1 A 13 13 GLU HA H 13 4.367 5.309 -0.942 1
1 71 . 4 1 1 A 13 13 GLU C C 13 176.125 174.574 1.551 1
1 72 . 4 1 1 A 13 13 GLU CA C 13 56.349 54.626 1.723 1
1 73 . 4 1 1 A 13 13 GLU CB C 13 29.560 33.727 -4.167 1
1 75 . 4 1 1 A 13 13 GLU N N 13 120.148 122.151 -2.003 1
1 76 . 4 1 1 A 14 14 GLU H H 14 8.508 8.870 -0.362 1
1 77 . 4 1 1 A 14 14 GLU HA H 14 4.302 5.236 -0.934 1
1 82 . 4 1 1 A 14 14 GLU C C 14 176.623 175.556 1.067 1
1 83 . 4 1 1 A 14 14 GLU CA C 14 56.497 55.171 1.326 1
1 84 . 4 1 1 A 14 14 GLU CB C 14 30.110 33.638 -3.528 1
1 86 . 4 1 1 A 14 14 GLU N N 14 122.160 118.731 3.429 1
1 87 . 4 1 1 A 15 15 ARG H H 15 8.356 8.912 -0.556 1
1 88 . 4 1 1 A 15 15 ARG HA H 15 4.366 4.739 -0.373 1
1 95 . 4 1 1 A 15 15 ARG C C 15 176.844 176.996 -0.152 1
1 96 . 4 1 1 A 15 15 ARG CA C 15 56.010 55.905 0.105 1
1 97 . 4 1 1 A 15 15 ARG CB C 15 30.890 31.188 -0.298 1
1 100 . 4 1 1 A 15 15 ARG N N 15 121.945 120.732 1.213 1
1 101 . 4 1 1 A 16 16 GLY H H 16 8.414 8.053 0.361 1
1 102 . 4 1 1 A 16 16 GLY HA2 H 16 4.022 3.952 0.070 1
1 103 . 4 1 1 A 16 16 GLY HA3 H 16 4.022 3.955 0.067 1
1 104 . 4 1 1 A 16 16 GLY C C 16 174.326 173.692 0.634 1
1 105 . 4 1 1 A 16 16 GLY CA C 16 45.620 45.265 0.355 1
1 106 . 4 1 1 A 16 16 GLY N N 16 109.734 108.213 1.521 1
1 107 . 4 1 1 A 17 17 GLN H H 17 8.184 7.767 0.417 1
1 108 . 4 1 1 A 17 17 GLN HA H 17 4.366 4.622 -0.256 1
1 113 . 4 1 1 A 17 17 GLN C C 17 175.544 175.222 0.322 1
1 114 . 4 1 1 A 17 17 GLN CA C 17 55.749 55.359 0.390 1
1 115 . 4 1 1 A 17 17 GLN CB C 17 29.367 29.750 -0.383 1
1 117 . 4 1 1 A 17 17 GLN N N 17 119.546 121.752 -2.206 1
1 118 . 4 1 1 A 18 18 ARG H H 18 8.366 8.628 -0.262 1
1 119 . 4 1 1 A 18 18 ARG HA H 18 4.487 4.872 -0.385 1
1 126 . 4 1 1 A 18 18 ARG C C 18 176.042 175.521 0.521 1
1 127 . 4 1 1 A 18 18 ARG CA C 18 55.735 54.324 1.411 1
1 128 . 4 1 1 A 18 18 ARG CB C 18 31.170 33.538 -2.368 1
1 131 . 4 1 1 A 18 18 ARG N N 18 122.330 123.138 -0.808 1
1 132 . 4 1 1 A 19 19 GLY H H 19 8.192 8.485 -0.293 1
1 133 . 4 1 1 A 19 19 GLY HA2 H 19 4.852 4.108 0.744 1
1 134 . 4 1 1 A 19 19 GLY HA3 H 19 3.894 4.117 -0.223 1
1 135 . 4 1 1 A 19 19 GLY C C 19 172.361 172.060 0.301 1
1 136 . 4 1 1 A 19 19 GLY CA C 19 45.580 44.658 0.922 1
1 137 . 4 1 1 A 19 19 GLY N N 19 109.658 107.920 1.738 1
1 138 . 4 1 1 A 20 20 CYS H H 20 8.843 8.287 0.556 1
1 139 . 4 1 1 A 20 20 CYS HA H 20 5.147 5.070 0.077 1
1 142 . 4 1 1 A 20 20 CYS C C 20 175.211 174.882 0.329 1
1 143 . 4 1 1 A 20 20 CYS CA C 20 56.712 58.344 -1.632 1
1 144 . 4 1 1 A 20 20 CYS CB C 20 33.530 31.170 2.360 1
1 145 . 4 1 1 A 20 20 CYS N N 20 120.185 118.430 1.755 1
1 146 . 4 1 1 A 21 21 GLU H H 21 8.981 8.898 0.083 1
1 147 . 4 1 1 A 21 21 GLU HA H 21 4.100 4.046 0.054 1
1 152 . 4 1 1 A 21 21 GLU C C 21 176.014 178.150 -2.136 1
1 153 . 4 1 1 A 21 21 GLU CA C 21 57.134 58.880 -1.746 1
1 154 . 4 1 1 A 21 21 GLU CB C 21 28.890 28.923 -0.033 1
1 156 . 4 1 1 A 21 21 GLU N N 21 116.078 126.016 -9.938 1
1 157 . 4 1 1 A 22 22 HIS H H 22 9.342 7.722 1.620 1
1 158 . 4 1 1 A 22 22 HIS HA H 22 4.210 4.218 -0.008 1
1 161 . 4 1 1 A 22 22 HIS C C 22 175.128 174.772 0.356 1
1 162 . 4 1 1 A 22 22 HIS CA C 22 58.945 58.627 0.318 1
1 163 . 4 1 1 A 22 22 HIS CB C 22 33.160 29.895 3.265 1
1 164 . 4 1 1 A 22 22 HIS N N 22 122.296 117.949 4.347 1
1 165 . 4 1 1 A 23 23 TYR H H 23 7.931 7.463 0.468 1
1 166 . 4 1 1 A 23 23 TYR HA H 23 4.856 5.140 -0.284 1
1 171 . 4 1 1 A 23 23 TYR C C 23 173.108 174.328 -1.220 1
1 172 . 4 1 1 A 23 23 TYR CA C 23 57.852 56.331 1.521 1
1 173 . 4 1 1 A 23 23 TYR CB C 23 45.300 41.319 3.981 1
1 175 . 4 1 1 A 23 23 TYR N N 23 115.205 115.205 0.000 1
1 176 . 4 1 1 A 24 24 ASP H H 24 8.384 8.811 -0.427 1
1 177 . 4 1 1 A 24 24 ASP HA H 24 5.160 5.120 0.040 1
1 180 . 4 1 1 A 24 24 ASP C C 24 174.437 175.255 -0.818 1
1 181 . 4 1 1 A 24 24 ASP CA C 24 53.343 53.815 -0.472 1
1 182 . 4 1 1 A 24 24 ASP CB C 24 41.470 40.810 0.660 1
1 183 . 4 1 1 A 24 24 ASP N N 24 122.016 124.801 -2.785 1
1 184 . 4 1 1 A 25 25 ARG H H 25 7.313 8.121 -0.808 1
1 185 . 4 1 1 A 25 25 ARG HA H 25 5.331 5.256 0.075 1
1 192 . 4 1 1 A 25 25 ARG C C 25 175.045 175.744 -0.699 1
1 193 . 4 1 1 A 25 25 ARG CA C 25 54.224 54.651 -0.427 1
1 194 . 4 1 1 A 25 25 ARG CB C 25 34.090 33.914 0.176 1
1 197 . 4 1 1 A 25 25 ARG N N 25 115.898 121.972 -6.074 1
1 198 . 4 1 1 A 26 26 GLY H H 26 9.387 8.768 0.619 1
1 199 . 4 1 1 A 26 26 GLY HA2 H 26 4.622 3.851 0.771 1
1 200 . 4 1 1 A 26 26 GLY HA3 H 26 3.788 3.943 -0.155 1
1 201 . 4 1 1 A 26 26 GLY C C 26 170.978 174.454 -3.476 1
1 202 . 4 1 1 A 26 26 GLY CA C 26 44.794 46.142 -1.348 1
1 203 . 4 1 1 A 26 26 GLY N N 26 105.653 107.847 -2.194 1
1 204 . 4 1 1 A 27 27 CYS H H 27 6.864 7.584 -0.720 1
1 205 . 4 1 1 A 27 27 CYS HA H 27 5.195 5.112 0.083 1
1 208 . 4 1 1 A 27 27 CYS C C 27 171.144 172.172 -1.028 1
1 209 . 4 1 1 A 27 27 CYS CA C 27 52.349 56.722 -4.373 1
1 210 . 4 1 1 A 27 27 CYS CB C 27 30.997 31.123 -0.126 1
1 211 . 4 1 1 A 27 27 CYS N N 27 110.921 117.316 -6.395 1
1 212 . 4 1 1 A 28 28 LEU H H 28 8.310 8.719 -0.409 1
1 213 . 4 1 1 A 28 28 LEU HA H 28 4.651 4.934 -0.283 1
1 223 . 4 1 1 A 28 28 LEU C C 28 176.827 176.158 0.669 1
1 224 . 4 1 1 A 28 28 LEU CA C 28 53.054 53.125 -0.071 1
1 225 . 4 1 1 A 28 28 LEU CB C 28 44.200 45.152 -0.952 1
1 229 . 4 1 1 A 28 28 LEU N N 28 115.519 120.714 -5.195 1
1 230 . 4 1 1 A 29 29 LEU H H 29 8.800 8.798 0.002 1
1 231 . 4 1 1 A 29 29 LEU HA H 29 4.313 4.406 -0.093 1
1 240 . 4 1 1 A 29 29 LEU C C 29 175.571 176.288 -0.717 1
1 241 . 4 1 1 A 29 29 LEU CA C 29 54.388 54.669 -0.281 1
1 242 . 4 1 1 A 29 29 LEU CB C 29 42.780 41.658 1.122 1
1 245 . 4 1 1 A 29 29 LEU N N 29 118.712 125.782 -7.070 1
1 246 . 4 1 1 A 30 30 LYS H H 30 8.009 8.342 -0.333 1
1 247 . 4 1 1 A 30 30 LYS HA H 30 4.592 4.598 -0.006 1
1 256 . 4 1 1 A 30 30 LYS C C 30 174.990 174.795 0.195 1
1 257 . 4 1 1 A 30 30 LYS CA C 30 54.999 55.849 -0.850 1
1 258 . 4 1 1 A 30 30 LYS CB C 30 32.330 32.243 0.087 1
1 262 . 4 1 1 A 30 30 LYS N N 30 122.310 126.012 -3.702 1
1 263 . 4 1 1 A 31 31 ALA H H 31 9.238 8.567 0.671 1
1 264 . 4 1 1 A 31 31 ALA HA H 31 4.477 4.372 0.105 1
1 268 . 4 1 1 A 31 31 ALA CA C 31 50.190 50.039 0.151 1
1 269 . 4 1 1 A 31 31 ALA CB C 31 21.637 19.770 1.867 1
1 270 . 4 1 1 A 31 31 ALA N N 31 133.864 130.024 3.840 1
1 271 . 4 1 1 A 32 32 PRO HA H 32 4.637 4.476 0.161 1
1 278 . 4 1 1 A 32 32 PRO C C 32 175.737 177.190 -1.453 1
1 279 . 4 1 1 A 32 32 PRO CA C 32 64.259 64.105 0.154 1
1 280 . 4 1 1 A 32 32 PRO CB C 32 31.740 32.440 -0.700 1
1 283 . 4 1 1 A 33 33 CYS H H 33 8.779 8.289 0.490 1
1 284 . 4 1 1 A 33 33 CYS HA H 33 4.321 4.315 0.006 1
1 287 . 4 1 1 A 33 33 CYS C C 33 176.733 175.058 1.675 1
1 288 . 4 1 1 A 33 33 CYS CA C 33 54.398 60.962 -6.564 1
1 289 . 4 1 1 A 33 33 CYS CB C 33 30.697 27.637 3.060 1
1 290 . 4 1 1 A 33 33 CYS N N 33 120.005 116.860 3.145 1
1 291 . 4 1 1 A 34 34 CYS H H 34 7.424 7.478 -0.054 1
1 292 . 4 1 1 A 34 34 CYS HA H 34 4.896 4.694 0.202 1
1 295 . 4 1 1 A 34 34 CYS C C 34 174.935 174.583 0.352 1
1 296 . 4 1 1 A 34 34 CYS CA C 34 56.962 58.516 -1.554 1
1 297 . 4 1 1 A 34 34 CYS CB C 34 31.067 29.315 1.752 1
1 298 . 4 1 1 A 34 34 CYS N N 34 115.034 117.984 -2.950 1
1 299 . 4 1 1 A 35 35 ASP H H 35 8.368 8.060 0.308 1
1 300 . 4 1 1 A 35 35 ASP HA H 35 4.454 4.224 0.230 1
1 303 . 4 1 1 A 35 35 ASP C C 35 174.354 174.739 -0.385 1
1 304 . 4 1 1 A 35 35 ASP CA C 35 56.222 55.505 0.717 1
1 305 . 4 1 1 A 35 35 ASP CB C 35 39.730 40.500 -0.770 1
1 306 . 4 1 1 A 35 35 ASP N N 35 121.381 119.751 1.630 1
1 307 . 4 1 1 A 36 36 LYS H H 36 7.227 7.455 -0.228 1
1 308 . 4 1 1 A 36 36 LYS HA H 36 4.451 4.598 -0.147 1
1 317 . 4 1 1 A 36 36 LYS C C 36 175.433 175.837 -0.404 1
1 318 . 4 1 1 A 36 36 LYS CA C 36 56.270 54.819 1.451 1
1 319 . 4 1 1 A 36 36 LYS CB C 36 36.620 34.128 2.492 1
1 323 . 4 1 1 A 36 36 LYS N N 36 117.673 119.149 -1.476 1
1 324 . 4 1 1 A 37 37 LEU H H 37 8.053 8.271 -0.218 1
1 325 . 4 1 1 A 37 37 LEU HA H 37 5.292 5.269 0.023 1
1 335 . 4 1 1 A 37 37 LEU C C 37 176.484 174.946 1.538 1
1 336 . 4 1 1 A 37 37 LEU CA C 37 53.348 52.854 0.494 1
1 337 . 4 1 1 A 37 37 LEU CB C 37 42.400 43.928 -1.528 1
1 341 . 4 1 1 A 37 37 LEU N N 37 120.994 121.385 -0.391 1
1 342 . 4 1 1 A 38 38 TYR H H 38 8.741 8.673 0.068 1
1 343 . 4 1 1 A 38 38 TYR HA H 38 5.002 4.917 0.085 1
1 350 . 4 1 1 A 38 38 TYR C C 38 176.374 175.981 0.393 1
1 351 . 4 1 1 A 38 38 TYR CA C 38 57.081 56.758 0.323 1
1 352 . 4 1 1 A 38 38 TYR CB C 38 45.647 41.853 3.794 1
1 355 . 4 1 1 A 38 38 TYR N N 38 121.128 122.150 -1.022 1
1 356 . 4 1 1 A 39 39 THR H H 39 9.402 8.781 0.621 1
1 357 . 4 1 1 A 39 39 THR HA H 39 4.098 4.012 0.086 1
1 362 . 4 1 1 A 39 39 THR C C 39 173.496 175.017 -1.521 1
1 363 . 4 1 1 A 39 39 THR CA C 39 67.062 65.987 1.075 1
1 364 . 4 1 1 A 39 39 THR CB C 39 68.047 68.639 -0.592 1
1 366 . 4 1 1 A 39 39 THR N N 39 116.641 118.340 -1.699 1
1 367 . 4 1 1 A 40 40 CYS H H 40 7.317 7.996 -0.679 1
1 368 . 4 1 1 A 40 40 CYS HA H 40 4.771 4.710 0.061 1
1 371 . 4 1 1 A 40 40 CYS C C 40 175.128 175.693 -0.565 1
1 372 . 4 1 1 A 40 40 CYS CA C 40 56.577 57.763 -1.186 1
1 373 . 4 1 1 A 40 40 CYS CB C 40 35.087 29.606 5.481 1
1 374 . 4 1 1 A 40 40 CYS N N 40 109.059 118.700 -9.641 1
1 375 . 4 1 1 A 41 41 ARG H H 41 9.201 8.754 0.447 1
1 376 . 4 1 1 A 41 41 ARG HA H 41 3.982 4.003 -0.021 1
1 383 . 4 1 1 A 41 41 ARG C C 41 175.101 178.065 -2.964 1
1 384 . 4 1 1 A 41 41 ARG CA C 41 58.591 58.875 -0.284 1
1 385 . 4 1 1 A 41 41 ARG CB C 41 29.640 29.812 -0.172 1
1 388 . 4 1 1 A 41 41 ARG N N 41 121.737 124.286 -2.549 1
1 389 . 4 1 1 A 42 42 LEU H H 42 9.116 7.784 1.332 1
1 390 . 4 1 1 A 42 42 LEU HA H 42 4.029 4.013 0.016 1
1 400 . 4 1 1 A 42 42 LEU C C 42 179.943 179.176 0.767 1
1 401 . 4 1 1 A 42 42 LEU CA C 42 58.005 57.731 0.274 1
1 402 . 4 1 1 A 42 42 LEU CB C 42 38.960 41.082 -2.122 1
1 406 . 4 1 1 A 42 42 LEU N N 42 126.364 116.574 9.790 1
1 407 . 4 1 1 A 43 43 CYS H H 43 8.785 8.261 0.524 1
1 408 . 4 1 1 A 43 43 CYS HA H 43 4.187 4.148 0.039 1
1 411 . 4 1 1 A 43 43 CYS C C 43 177.785 177.071 0.714 1
1 412 . 4 1 1 A 43 43 CYS CA C 43 66.415 63.038 3.377 1
1 413 . 4 1 1 A 43 43 CYS CB C 43 28.870 27.358 1.512 1
1 414 . 4 1 1 A 43 43 CYS N N 43 124.519 117.543 6.976 1
1 415 . 4 1 1 A 44 44 HIS H H 44 7.604 7.433 0.171 1
1 416 . 4 1 1 A 44 44 HIS HA H 44 1.983 2.909 -0.926 1
1 420 . 4 1 1 A 44 44 HIS C C 44 176.429 176.173 0.256 1
1 421 . 4 1 1 A 44 44 HIS CA C 44 58.760 58.817 -0.057 1
1 422 . 4 1 1 A 44 44 HIS CB C 44 27.990 29.489 -1.499 1
1 423 . 4 1 1 A 44 44 HIS N N 44 117.024 120.729 -3.705 1
1 424 . 4 1 1 A 45 45 ASP H H 45 8.750 8.189 0.561 1
1 425 . 4 1 1 A 45 45 ASP HA H 45 4.116 4.078 0.038 1
1 428 . 4 1 1 A 45 45 ASP C C 45 177.453 177.838 -0.385 1
1 429 . 4 1 1 A 45 45 ASP CA C 45 56.840 57.583 -0.743 1
1 430 . 4 1 1 A 45 45 ASP CB C 45 38.960 42.200 -3.240 1
1 431 . 4 1 1 A 45 45 ASP N N 45 120.440 118.659 1.781 1
1 432 . 4 1 1 A 46 46 ASN H H 46 7.888 8.231 -0.343 1
1 433 . 4 1 1 A 46 46 ASN HA H 46 4.612 4.375 0.237 1
1 438 . 4 1 1 A 46 46 ASN C C 46 175.903 176.793 -0.890 1
1 439 . 4 1 1 A 46 46 ASN CA C 46 54.342 57.135 -2.793 1
1 440 . 4 1 1 A 46 46 ASN CB C 46 38.790 39.690 -0.900 1
1 441 . 4 1 1 A 46 46 ASN N N 46 115.758 117.194 -1.436 1
1 443 . 4 1 1 A 47 47 ASN H H 47 7.384 7.140 0.244 1
1 444 . 4 1 1 A 47 47 ASN HA H 47 4.893 4.659 0.234 1
1 449 . 4 1 1 A 47 47 ASN C C 47 173.579 175.670 -2.091 1
1 450 . 4 1 1 A 47 47 ASN CA C 47 53.937 54.469 -0.532 1
1 451 . 4 1 1 A 47 47 ASN CB C 47 43.130 39.404 3.726 1
1 452 . 4 1 1 A 47 47 ASN N N 47 116.576 114.876 1.700 1
1 454 . 4 1 1 A 48 48 GLU H H 48 7.143 7.425 -0.282 1
1 455 . 4 1 1 A 48 48 GLU HA H 48 4.572 4.388 0.184 1
1 460 . 4 1 1 A 48 48 GLU C C 48 175.627 176.420 -0.793 1
1 461 . 4 1 1 A 48 48 GLU CA C 48 53.727 54.617 -0.890 1
1 462 . 4 1 1 A 48 48 GLU CB C 48 32.480 29.945 2.535 1
1 464 . 4 1 1 A 48 48 GLU N N 48 116.967 117.477 -0.510 1
1 465 . 4 1 1 A 49 49 ASP H H 49 8.748 8.836 -0.088 1
1 466 . 4 1 1 A 49 49 ASP HA H 49 4.576 4.512 0.064 1
1 469 . 4 1 1 A 49 49 ASP C C 49 174.796 175.286 -0.490 1
1 470 . 4 1 1 A 49 49 ASP CA C 49 53.027 54.739 -1.712 1
1 471 . 4 1 1 A 49 49 ASP CB C 49 40.340 40.347 -0.007 1
1 472 . 4 1 1 A 49 49 ASP N N 49 119.296 120.053 -0.757 1
1 473 . 4 1 1 A 50 50 HIS H H 50 6.919 7.196 -0.277 1
1 474 . 4 1 1 A 50 50 HIS HA H 50 4.880 5.345 -0.465 1
1 477 . 4 1 1 A 50 50 HIS C C 50 172.942 172.771 0.171 1
1 478 . 4 1 1 A 50 50 HIS CA C 50 53.978 53.686 0.292 1
1 479 . 4 1 1 A 50 50 HIS CB C 50 30.330 32.837 -2.507 1
1 480 . 4 1 1 A 50 50 HIS N N 50 113.709 114.159 -0.450 1
1 481 . 4 1 1 A 51 51 GLN H H 51 8.646 8.644 0.002 1
1 482 . 4 1 1 A 51 51 GLN HA H 51 4.896 4.992 -0.096 1
1 487 . 4 1 1 A 51 51 GLN C C 51 176.512 174.772 1.740 1
1 488 . 4 1 1 A 51 51 GLN CA C 51 54.872 54.647 0.225 1
1 489 . 4 1 1 A 51 51 GLN CB C 51 30.950 31.003 -0.053 1
1 491 . 4 1 1 A 51 51 GLN N N 51 119.379 119.046 0.333 1
1 492 . 4 1 1 A 52 52 LEU H H 52 9.646 8.514 1.132 1
1 493 . 4 1 1 A 52 52 LEU HA H 52 4.206 4.569 -0.363 1
1 503 . 4 1 1 A 52 52 LEU C C 52 175.793 174.437 1.356 1
1 504 . 4 1 1 A 52 52 LEU CA C 52 55.450 54.004 1.446 1
1 505 . 4 1 1 A 52 52 LEU CB C 52 41.407 42.819 -1.412 1
1 509 . 4 1 1 A 52 52 LEU N N 52 128.069 124.788 3.281 1
1 510 . 4 1 1 A 53 53 ASP H H 53 9.281 8.944 0.337 1
1 511 . 4 1 1 A 53 53 ASP HA H 53 4.725 4.719 0.006 1
1 514 . 4 1 1 A 53 53 ASP C C 53 176.401 177.527 -1.126 1
1 515 . 4 1 1 A 53 53 ASP CA C 53 52.590 54.369 -1.779 1
1 516 . 4 1 1 A 53 53 ASP CB C 53 39.990 40.772 -0.782 1
1 517 . 4 1 1 A 53 53 ASP N N 53 128.783 127.476 1.307 1
1 518 . 4 1 1 A 54 54 ARG H H 54 8.496 8.592 -0.096 1
1 519 . 4 1 1 A 54 54 ARG HA H 54 3.859 3.915 -0.056 1
1 526 . 4 1 1 A 54 54 ARG C C 54 176.346 177.976 -1.630 1
1 527 . 4 1 1 A 54 54 ARG CA C 54 57.357 58.647 -1.290 1
1 528 . 4 1 1 A 54 54 ARG CB C 54 28.890 29.886 -0.996 1
1 531 . 4 1 1 A 54 54 ARG N N 54 125.813 125.638 0.175 1
1 532 . 4 1 1 A 55 55 PHE H H 55 8.005 8.045 -0.040 1
1 533 . 4 1 1 A 55 55 PHE HA H 55 4.712 4.321 0.391 1
1 540 . 4 1 1 A 55 55 PHE C C 55 177.481 178.567 -1.086 1
1 541 . 4 1 1 A 55 55 PHE CA C 55 59.080 60.434 -1.354 1
1 542 . 4 1 1 A 55 55 PHE CB C 55 37.447 38.096 -0.649 1
1 545 . 4 1 1 A 55 55 PHE N N 55 120.168 119.129 1.039 1
1 546 . 4 1 1 A 56 56 LYS H H 56 7.681 7.652 0.029 1
1 547 . 4 1 1 A 56 56 LYS HA H 56 4.411 4.257 0.154 1
1 556 . 4 1 1 A 56 56 LYS C C 56 175.959 177.572 -1.613 1
1 557 . 4 1 1 A 56 56 LYS CA C 56 55.459 58.453 -2.994 1
1 558 . 4 1 1 A 56 56 LYS CB C 56 33.590 32.744 0.846 1
1 562 . 4 1 1 A 56 56 LYS N N 56 116.937 118.346 -1.409 1
1 563 . 4 1 1 A 57 57 VAL H H 57 6.553 6.939 -0.386 1
1 564 . 4 1 1 A 57 57 VAL HA H 57 3.408 3.894 -0.486 1
1 572 . 4 1 1 A 57 57 VAL C C 57 173.911 175.519 -1.608 1
1 573 . 4 1 1 A 57 57 VAL CA C 57 65.025 63.261 1.764 1
1 574 . 4 1 1 A 57 57 VAL CB C 57 32.663 31.332 1.331 1
1 577 . 4 1 1 A 57 57 VAL N N 57 119.519 119.091 0.428 1
1 578 . 4 1 1 A 58 58 LYS H H 58 9.182 9.017 0.165 1
1 579 . 4 1 1 A 58 58 LYS HA H 58 4.489 4.480 0.009 1
1 588 . 4 1 1 A 58 58 LYS C C 58 176.927 176.388 0.539 1
1 589 . 4 1 1 A 58 58 LYS CA C 58 55.913 57.146 -1.233 1
1 590 . 4 1 1 A 58 58 LYS CB C 58 36.340 34.314 2.026 1
1 594 . 4 1 1 A 58 58 LYS N N 58 124.985 129.316 -4.331 1
1 595 . 4 1 1 A 59 59 GLU H H 59 8.799 7.874 0.925 1
1 596 . 4 1 1 A 59 59 GLU HA H 59 5.209 4.906 0.303 1
1 601 . 4 1 1 A 59 59 GLU C C 59 173.911 175.239 -1.328 1
1 602 . 4 1 1 A 59 59 GLU CA C 59 54.670 54.921 -0.251 1
1 603 . 4 1 1 A 59 59 GLU CB C 59 35.180 32.257 2.923 1
1 605 . 4 1 1 A 59 59 GLU N N 59 121.493 118.076 3.417 1
1 606 . 4 1 1 A 60 60 VAL H H 60 8.917 8.760 0.157 1
1 607 . 4 1 1 A 60 60 VAL HA H 60 4.983 4.994 -0.011 1
1 615 . 4 1 1 A 60 60 VAL C C 60 173.441 173.979 -0.538 1
1 616 . 4 1 1 A 60 60 VAL CA C 60 57.497 58.976 -1.479 1
1 617 . 4 1 1 A 60 60 VAL CB C 60 35.460 35.981 -0.521 1
1 620 . 4 1 1 A 60 60 VAL N N 60 109.266 117.194 -7.928 1
1 621 . 4 1 1 A 61 61 GLN H H 61 8.970 8.687 0.283 1
1 622 . 4 1 1 A 61 61 GLN HA H 61 5.024 5.091 -0.067 1
1 629 . 4 1 1 A 61 61 GLN C C 61 175.045 173.462 1.583 1
1 630 . 4 1 1 A 61 61 GLN CA C 61 53.128 53.491 -0.363 1
1 631 . 4 1 1 A 61 61 GLN CB C 61 33.980 32.591 1.389 1
1 633 . 4 1 1 A 61 61 GLN N N 61 118.525 117.999 0.526 1
1 635 . 4 1 1 A 62 62 CYS H H 62 7.688 8.599 -0.911 1
1 636 . 4 1 1 A 62 62 CYS HA H 62 4.210 4.590 -0.380 1
1 639 . 4 1 1 A 62 62 CYS C C 62 177.951 176.079 1.872 1
1 640 . 4 1 1 A 62 62 CYS CA C 62 59.845 57.714 2.131 1
1 641 . 4 1 1 A 62 62 CYS CB C 62 33.120 29.603 3.517 1
1 642 . 4 1 1 A 62 62 CYS N N 62 128.772 120.434 8.338 1
1 643 . 4 1 1 A 63 63 ILE H H 63 8.192 8.471 -0.279 1
1 644 . 4 1 1 A 63 63 ILE HA H 63 3.984 3.934 0.050 1
1 654 . 4 1 1 A 63 63 ILE C C 63 175.433 177.442 -2.009 1
1 655 . 4 1 1 A 63 63 ILE CA C 63 63.657 64.240 -0.583 1
1 656 . 4 1 1 A 63 63 ILE CB C 63 38.506 37.574 0.932 1
1 660 . 4 1 1 A 63 63 ILE N N 63 127.455 128.657 -1.202 1
1 661 . 4 1 1 A 64 64 ASN H H 64 9.181 8.061 1.120 1
1 662 . 4 1 1 A 64 64 ASN HA H 64 4.810 4.750 0.060 1
1 667 . 4 1 1 A 64 64 ASN C C 64 175.931 175.112 0.819 1
1 668 . 4 1 1 A 64 64 ASN CA C 64 55.617 52.188 3.429 1
1 669 . 4 1 1 A 64 64 ASN CB C 64 40.640 37.009 3.631 1
1 670 . 4 1 1 A 64 64 ASN N N 64 122.104 118.331 3.773 1
1 672 . 4 1 1 A 65 65 CYS H H 65 9.065 7.816 1.249 1
1 673 . 4 1 1 A 65 65 CYS HA H 65 4.979 4.540 0.439 1
1 676 . 4 1 1 A 65 65 CYS C C 65 176.291 174.890 1.401 1
1 677 . 4 1 1 A 65 65 CYS CA C 65 59.027 59.602 -0.575 1
1 678 . 4 1 1 A 65 65 CYS CB C 65 32.030 28.279 3.751 1
1 679 . 4 1 1 A 65 65 CYS N N 65 120.368 120.023 0.345 1
1 680 . 4 1 1 A 66 66 GLU H H 66 7.281 8.348 -1.067 1
1 681 . 4 1 1 A 66 66 GLU HA H 66 4.046 4.146 -0.100 1
1 686 . 4 1 1 A 66 66 GLU C C 66 175.211 175.308 -0.097 1
1 687 . 4 1 1 A 66 66 GLU CA C 66 58.591 58.014 0.577 1
1 688 . 4 1 1 A 66 66 GLU CB C 66 27.067 27.117 -0.050 1
1 690 . 4 1 1 A 66 66 GLU N N 66 115.012 116.270 -1.258 1
1 691 . 4 1 1 A 67 67 LYS H H 67 8.481 7.837 0.644 1
1 692 . 4 1 1 A 67 67 LYS HA H 67 4.326 4.288 0.038 1
1 701 . 4 1 1 A 67 67 LYS C C 67 177.923 176.176 1.747 1
1 702 . 4 1 1 A 67 67 LYS CA C 67 57.628 56.822 0.806 1
1 703 . 4 1 1 A 67 67 LYS CB C 67 33.617 32.809 0.808 1
1 707 . 4 1 1 A 67 67 LYS N N 67 123.514 120.999 2.515 1
1 708 . 4 1 1 A 68 68 ILE H H 68 8.867 8.604 0.263 1
1 709 . 4 1 1 A 68 68 ILE HA H 68 4.976 4.458 0.518 1
1 719 . 4 1 1 A 68 68 ILE C C 68 175.018 175.473 -0.455 1
1 720 . 4 1 1 A 68 68 ILE CA C 68 60.919 61.053 -0.134 1
1 721 . 4 1 1 A 68 68 ILE CB C 68 37.090 37.411 -0.321 1
1 725 . 4 1 1 A 68 68 ILE N N 68 133.478 128.633 4.845 1
1 726 . 4 1 1 A 69 69 GLN H H 69 9.269 8.758 0.511 1
1 727 . 4 1 1 A 69 69 GLN HA H 69 5.036 5.082 -0.046 1
1 732 . 4 1 1 A 69 69 GLN C C 69 173.607 174.747 -1.140 1
1 733 . 4 1 1 A 69 69 GLN CA C 69 53.419 54.012 -0.593 1
1 734 . 4 1 1 A 69 69 GLN CB C 69 34.997 32.359 2.638 1
1 736 . 4 1 1 A 69 69 GLN N N 69 125.104 123.962 1.142 1
1 737 . 4 1 1 A 70 70 HIS H H 70 8.829 9.050 -0.221 1
1 738 . 4 1 1 A 70 70 HIS HA H 70 4.865 4.629 0.236 1
1 741 . 4 1 1 A 70 70 HIS C C 70 174.852 174.755 0.097 1
1 742 . 4 1 1 A 70 70 HIS CA C 70 56.304 55.713 0.591 1
1 743 . 4 1 1 A 70 70 HIS CB C 70 30.050 30.867 -0.817 1
1 744 . 4 1 1 A 70 70 HIS N N 70 118.576 117.830 0.746 1
1 745 . 4 1 1 A 71 71 ALA H H 71 7.768 8.091 -0.323 1
1 746 . 4 1 1 A 71 71 ALA HA H 71 3.977 4.403 -0.426 1
1 750 . 4 1 1 A 71 71 ALA C C 71 175.433 176.446 -1.013 1
1 751 . 4 1 1 A 71 71 ALA CA C 71 54.393 52.007 2.386 1
1 752 . 4 1 1 A 71 71 ALA CB C 71 18.000 18.420 -0.420 1
1 753 . 4 1 1 A 71 71 ALA N N 71 121.438 123.734 -2.296 1
1 754 . 4 1 1 A 72 72 GLN H H 72 7.227 8.004 -0.777 1
1 755 . 4 1 1 A 72 72 GLN HA H 72 4.371 4.470 -0.099 1
1 762 . 4 1 1 A 72 72 GLN C C 72 173.053 175.890 -2.837 1
1 763 . 4 1 1 A 72 72 GLN CA C 72 54.290 53.604 0.686 1
1 764 . 4 1 1 A 72 72 GLN CB C 72 28.623 31.511 -2.888 1
1 766 . 4 1 1 A 72 72 GLN N N 72 115.858 123.479 -7.621 1
1 768 . 4 1 1 A 73 73 GLN H H 73 8.481 8.564 -0.083 1
1 769 . 4 1 1 A 73 73 GLN HA H 73 3.570 3.825 -0.255 1
1 776 . 4 1 1 A 73 73 GLN C C 73 174.243 175.044 -0.801 1
1 777 . 4 1 1 A 73 73 GLN CA C 73 60.206 57.601 2.605 1
1 778 . 4 1 1 A 73 73 GLN CB C 73 28.850 28.652 0.198 1
1 780 . 4 1 1 A 73 73 GLN N N 73 116.433 124.158 -7.725 1
1 782 . 4 1 1 A 74 74 THR H H 74 7.211 7.427 -0.216 1
1 783 . 4 1 1 A 74 74 THR HA H 74 4.160 4.489 -0.329 1
1 788 . 4 1 1 A 74 74 THR C C 74 171.836 172.342 -0.506 1
1 789 . 4 1 1 A 74 74 THR CA C 74 59.072 60.814 -1.742 1
1 790 . 4 1 1 A 74 74 THR CB C 74 71.560 71.969 -0.409 1
1 792 . 4 1 1 A 74 74 THR N N 74 108.717 110.259 -1.542 1
1 793 . 4 1 1 A 75 75 CYS H H 75 7.676 8.023 -0.347 1
1 794 . 4 1 1 A 75 75 CYS HA H 75 4.158 4.444 -0.286 1
1 797 . 4 1 1 A 75 75 CYS C C 75 178.781 175.618 3.163 1
1 798 . 4 1 1 A 75 75 CYS CA C 75 58.661 58.104 0.557 1
1 799 . 4 1 1 A 75 75 CYS CB C 75 30.840 27.393 3.447 1
1 800 . 4 1 1 A 75 75 CYS N N 75 123.108 123.688 -0.580 1
1 801 . 4 1 1 A 76 76 GLU H H 76 9.203 8.752 0.451 1
1 802 . 4 1 1 A 76 76 GLU HA H 76 4.187 4.027 0.160 1
1 807 . 4 1 1 A 76 76 GLU C C 76 175.488 178.805 -3.317 1
1 808 . 4 1 1 A 76 76 GLU CA C 76 57.306 59.010 -1.704 1
1 809 . 4 1 1 A 76 76 GLU CB C 76 29.347 29.067 0.280 1
1 811 . 4 1 1 A 76 76 GLU N N 76 129.817 127.301 2.516 1
1 812 . 4 1 1 A 77 77 GLU H H 77 9.496 7.686 1.810 1
1 813 . 4 1 1 A 77 77 GLU HA H 77 4.599 4.075 0.524 1
1 818 . 4 1 1 A 77 77 GLU C C 77 177.148 177.258 -0.110 1
1 819 . 4 1 1 A 77 77 GLU CA C 77 57.554 59.038 -1.484 1
1 820 . 4 1 1 A 77 77 GLU CB C 77 31.980 30.254 1.726 1
1 822 . 4 1 1 A 77 77 GLU N N 77 124.795 120.362 4.433 1
1 823 . 4 1 1 A 78 78 CYS H H 78 8.967 7.265 1.702 1
1 824 . 4 1 1 A 78 78 CYS HA H 78 5.073 4.636 0.437 1
1 827 . 4 1 1 A 78 78 CYS C C 78 176.374 174.716 1.658 1
1 828 . 4 1 1 A 78 78 CYS CA C 78 58.537 58.075 0.462 1
1 829 . 4 1 1 A 78 78 CYS CB C 78 31.597 28.800 2.797 1
1 830 . 4 1 1 A 78 78 CYS N N 78 119.692 115.280 4.412 1
1 831 . 4 1 1 A 79 79 SER H H 79 7.474 8.232 -0.758 1
1 832 . 4 1 1 A 79 79 SER HA H 79 4.113 4.040 0.073 1
1 835 . 4 1 1 A 79 79 SER C C 79 172.915 173.361 -0.446 1
1 836 . 4 1 1 A 79 79 SER CA C 79 60.440 59.313 1.127 1
1 837 . 4 1 1 A 79 79 SER CB C 79 61.421 61.107 0.314 1
1 838 . 4 1 1 A 79 79 SER N N 79 113.385 112.591 0.794 1
1 839 . 4 1 1 A 80 80 THR H H 80 7.907 7.764 0.143 1
1 840 . 4 1 1 A 80 80 THR HA H 80 3.913 4.165 -0.252 1
1 845 . 4 1 1 A 80 80 THR C C 80 172.306 173.736 -1.430 1
1 846 . 4 1 1 A 80 80 THR CA C 80 65.262 62.824 2.438 1
1 847 . 4 1 1 A 80 80 THR CB C 80 69.910 68.079 1.831 1
1 849 . 4 1 1 A 80 80 THR N N 80 120.005 115.724 4.281 1
1 850 . 4 1 1 A 81 81 LEU H H 81 8.556 8.043 0.513 1
1 851 . 4 1 1 A 81 81 LEU HA H 81 4.172 4.183 -0.011 1
1 861 . 4 1 1 A 81 81 LEU C C 81 177.121 176.606 0.515 1
1 862 . 4 1 1 A 81 81 LEU CA C 81 54.996 54.826 0.170 1
1 863 . 4 1 1 A 81 81 LEU CB C 81 42.147 42.764 -0.617 1
1 867 . 4 1 1 A 81 81 LEU N N 81 128.272 129.069 -0.797 1
1 868 . 4 1 1 A 82 82 PHE H H 82 9.251 8.552 0.699 1
1 869 . 4 1 1 A 82 82 PHE HA H 82 4.576 4.342 0.234 1
1 874 . 4 1 1 A 82 82 PHE C C 82 177.785 176.202 1.583 1
1 875 . 4 1 1 A 82 82 PHE CA C 82 56.470 60.002 -3.532 1
1 876 . 4 1 1 A 82 82 PHE CB C 82 38.210 38.921 -0.711 1
1 878 . 4 1 1 A 82 82 PHE N N 82 129.268 125.853 3.415 1
1 879 . 4 1 1 A 83 83 GLY H H 83 7.047 7.695 -0.648 1
1 880 . 4 1 1 A 83 83 GLY HA2 H 83 4.783 4.182 0.601 1
1 881 . 4 1 1 A 83 83 GLY HA3 H 83 3.876 4.224 -0.348 1
1 882 . 4 1 1 A 83 83 GLY C C 83 171.642 174.612 -2.970 1
1 883 . 4 1 1 A 83 83 GLY CA C 83 45.826 45.370 0.456 1
1 884 . 4 1 1 A 83 83 GLY N N 83 102.168 103.767 -1.599 1
1 885 . 4 1 1 A 84 84 GLU H H 84 8.444 8.746 -0.302 1
1 886 . 4 1 1 A 84 84 GLU HA H 84 4.111 4.206 -0.095 1
1 891 . 4 1 1 A 84 84 GLU C C 84 177.259 176.455 0.804 1
1 892 . 4 1 1 A 84 84 GLU CA C 84 59.438 58.943 0.495 1
1 893 . 4 1 1 A 84 84 GLU CB C 84 30.670 30.609 0.061 1
1 895 . 4 1 1 A 84 84 GLU N N 84 127.546 120.913 6.633 1
1 896 . 4 1 1 A 85 85 TYR H H 85 9.344 8.164 1.180 1
1 897 . 4 1 1 A 85 85 TYR HA H 85 4.599 4.835 -0.236 1
1 902 . 4 1 1 A 85 85 TYR C C 85 173.302 174.330 -1.028 1
1 903 . 4 1 1 A 85 85 TYR CA C 85 57.261 58.609 -1.348 1
1 904 . 4 1 1 A 85 85 TYR CB C 85 40.850 39.999 0.851 1
1 906 . 4 1 1 A 85 85 TYR N N 85 118.936 120.782 -1.846 1
1 907 . 4 1 1 A 86 86 TYR H H 86 7.323 8.562 -1.239 1
1 908 . 4 1 1 A 86 86 TYR HA H 86 5.298 5.694 -0.396 1
1 911 . 4 1 1 A 86 86 TYR C C 86 172.804 172.725 0.079 1
1 912 . 4 1 1 A 86 86 TYR CA C 86 54.041 55.093 -1.052 1
1 913 . 4 1 1 A 86 86 TYR CB C 86 40.987 42.337 -1.350 1
1 914 . 4 1 1 A 86 86 TYR N N 86 124.965 120.756 4.209 1
1 915 . 4 1 1 A 87 87 CYS H H 87 7.046 8.691 -1.645 1
1 916 . 4 1 1 A 87 87 CYS HA H 87 3.842 4.506 -0.664 1
1 919 . 4 1 1 A 87 87 CYS C C 87 174.243 174.520 -0.277 1
1 920 . 4 1 1 A 87 87 CYS CA C 87 56.377 57.496 -1.119 1
1 921 . 4 1 1 A 87 87 CYS CB C 87 33.230 29.204 4.026 1
1 922 . 4 1 1 A 87 87 CYS N N 87 128.735 118.975 9.760 1
1 923 . 4 1 1 A 88 88 ASP H H 88 8.002 9.088 -1.086 1
1 924 . 4 1 1 A 88 88 ASP HA H 88 3.761 4.646 -0.885 1
1 927 . 4 1 1 A 88 88 ASP C C 88 173.579 178.388 -4.809 1
1 928 . 4 1 1 A 88 88 ASP CA C 88 53.958 56.491 -2.533 1
1 929 . 4 1 1 A 88 88 ASP CB C 88 41.240 40.380 0.860 1
1 930 . 4 1 1 A 88 88 ASP N N 88 127.013 127.480 -0.467 1
1 931 . 4 1 1 A 89 89 ILE H H 89 7.972 7.779 0.193 1
1 932 . 4 1 1 A 89 89 ILE HA H 89 3.660 3.672 -0.012 1
1 942 . 4 1 1 A 89 89 ILE C C 89 177.259 176.964 0.295 1
1 943 . 4 1 1 A 89 89 ILE CA C 89 63.107 65.142 -2.035 1
1 944 . 4 1 1 A 89 89 ILE CB C 89 39.430 38.209 1.221 1
1 948 . 4 1 1 A 89 89 ILE N N 89 120.357 120.582 -0.225 1
1 949 . 4 1 1 A 90 90 CYS H H 90 8.554 7.651 0.903 1
1 950 . 4 1 1 A 90 90 CYS HA H 90 3.677 4.241 -0.564 1
1 953 . 4 1 1 A 90 90 CYS C C 90 175.128 174.329 0.799 1
1 954 . 4 1 1 A 90 90 CYS CA C 90 60.791 58.559 2.232 1
1 955 . 4 1 1 A 90 90 CYS CB C 90 30.427 28.429 1.998 1
1 956 . 4 1 1 A 90 90 CYS N N 90 119.564 116.406 3.158 1
1 957 . 4 1 1 A 91 91 HIS H H 91 7.364 7.876 -0.512 1
1 958 . 4 1 1 A 91 91 HIS HA H 91 3.512 3.878 -0.366 1
1 963 . 4 1 1 A 91 91 HIS C C 91 170.590 173.909 -3.319 1
1 964 . 4 1 1 A 91 91 HIS CA C 91 58.739 56.670 2.069 1
1 965 . 4 1 1 A 91 91 HIS CB C 91 24.810 28.791 -3.981 1
1 968 . 4 1 1 A 91 91 HIS N N 91 111.440 117.751 -6.311 1
1 969 . 4 1 1 A 92 92 LEU H H 92 6.214 7.612 -1.398 1
1 970 . 4 1 1 A 92 92 LEU HA H 92 4.191 4.057 0.134 1
1 980 . 4 1 1 A 92 92 LEU C C 92 173.911 175.356 -1.445 1
1 981 . 4 1 1 A 92 92 LEU CA C 92 53.717 53.184 0.533 1
1 982 . 4 1 1 A 92 92 LEU CB C 92 45.360 42.668 2.692 1
1 986 . 4 1 1 A 92 92 LEU N N 92 115.684 117.656 -1.972 1
1 987 . 4 1 1 A 93 93 PHE H H 93 6.669 8.704 -2.035 1
1 988 . 4 1 1 A 93 93 PHE HA H 93 5.622 5.066 0.556 1
1 995 . 4 1 1 A 93 93 PHE C C 93 175.765 174.504 1.261 1
1 996 . 4 1 1 A 93 93 PHE CA C 93 55.387 56.460 -1.073 1
1 997 . 4 1 1 A 93 93 PHE CB C 93 42.700 41.250 1.450 1
1 1000 . 4 1 1 A 93 93 PHE N N 93 121.535 120.215 1.320 1
1 1001 . 4 1 1 A 94 94 ASP H H 94 9.209 8.957 0.252 1
1 1002 . 4 1 1 A 94 94 ASP HA H 94 5.819 5.362 0.457 1
1 1005 . 4 1 1 A 94 94 ASP C C 94 175.654 175.393 0.261 1
1 1006 . 4 1 1 A 94 94 ASP CA C 94 53.330 52.863 0.467 1
1 1007 . 4 1 1 A 94 94 ASP CB C 94 44.720 44.133 0.587 1
1 1008 . 4 1 1 A 94 94 ASP N N 94 123.504 120.661 2.843 1
1 1009 . 4 1 1 A 95 95 LYS H H 95 9.043 8.327 0.716 1
1 1010 . 4 1 1 A 95 95 LYS HA H 95 4.527 4.393 0.134 1
1 1019 . 4 1 1 A 95 95 LYS C C 95 174.879 176.546 -1.667 1
1 1020 . 4 1 1 A 95 95 LYS CA C 95 56.620 56.834 -0.214 1
1 1021 . 4 1 1 A 95 95 LYS CB C 95 33.720 33.318 0.402 1
1 1025 . 4 1 1 A 95 95 LYS N N 95 120.380 119.799 0.581 1
1 1026 . 4 1 1 A 96 96 ASP H H 96 8.999 8.331 0.668 1
1 1027 . 4 1 1 A 96 96 ASP HA H 96 4.724 4.725 -0.001 1
1 1030 . 4 1 1 A 96 96 ASP C C 96 176.401 176.163 0.238 1
1 1031 . 4 1 1 A 96 96 ASP CA C 96 56.147 54.222 1.925 1
1 1032 . 4 1 1 A 96 96 ASP CB C 96 40.790 41.024 -0.234 1
1 1033 . 4 1 1 A 96 96 ASP N N 96 120.784 121.736 -0.952 1
1 1034 . 4 1 1 A 97 97 LYS H H 97 9.382 8.400 0.982 1
1 1035 . 4 1 1 A 97 97 LYS HA H 97 4.473 4.574 -0.101 1
1 1044 . 4 1 1 A 97 97 LYS C C 97 175.903 175.876 0.027 1
1 1045 . 4 1 1 A 97 97 LYS CA C 97 54.771 55.043 -0.272 1
1 1046 . 4 1 1 A 97 97 LYS CB C 97 33.270 33.304 -0.034 1
1 1050 . 4 1 1 A 97 97 LYS N N 97 131.617 126.657 4.960 1
1 1051 . 4 1 1 A 98 98 LYS H H 98 8.940 8.044 0.896 1
1 1052 . 4 1 1 A 98 98 LYS HA H 98 4.118 3.860 0.258 1
1 1061 . 4 1 1 A 98 98 LYS C C 98 177.065 175.328 1.737 1
1 1062 . 4 1 1 A 98 98 LYS CA C 98 56.297 57.867 -1.570 1
1 1063 . 4 1 1 A 98 98 LYS CB C 98 28.467 29.927 -1.460 1
1 1067 . 4 1 1 A 98 98 LYS N N 98 115.034 115.236 -0.202 1
1 1068 . 4 1 1 A 99 99 GLN H H 99 9.266 7.893 1.373 1
1 1069 . 4 1 1 A 99 99 GLN HA H 99 4.460 4.392 0.068 1
1 1074 . 4 1 1 A 99 99 GLN C C 99 174.990 175.039 -0.049 1
1 1075 . 4 1 1 A 99 99 GLN CA C 99 57.563 55.708 1.855 1
1 1076 . 4 1 1 A 99 99 GLN CB C 99 27.280 29.461 -2.181 1
1 1078 . 4 1 1 A 99 99 GLN N N 99 117.717 118.436 -0.719 1
1 1079 . 4 1 1 A 100 100 TYR H H 100 8.402 8.616 -0.214 1
1 1080 . 4 1 1 A 100 100 TYR HA H 100 4.935 5.667 -0.732 1
1 1087 . 4 1 1 A 100 100 TYR C C 100 171.504 173.133 -1.629 1
1 1088 . 4 1 1 A 100 100 TYR CA C 100 55.786 55.461 0.325 1
1 1089 . 4 1 1 A 100 100 TYR CB C 100 41.090 41.785 -0.695 1
1 1092 . 4 1 1 A 100 100 TYR N N 100 115.081 117.221 -2.140 1
1 1093 . 4 1 1 A 101 101 HIS H H 101 8.829 9.092 -0.263 1
1 1094 . 4 1 1 A 101 101 HIS HA H 101 4.525 4.753 -0.228 1
1 1099 . 4 1 1 A 101 101 HIS C C 101 174.935 173.833 1.102 1
1 1100 . 4 1 1 A 101 101 HIS CA C 101 56.327 55.065 1.262 1
1 1101 . 4 1 1 A 101 101 HIS CB C 101 31.020 30.570 0.450 1
1 1104 . 4 1 1 A 101 101 HIS N N 101 120.894 123.308 -2.414 1
1 1105 . 4 1 1 A 102 102 CYS H H 102 7.427 8.391 -0.964 1
1 1106 . 4 1 1 A 102 102 CYS HA H 102 4.561 4.446 0.115 1
1 1109 . 4 1 1 A 102 102 CYS C C 102 175.765 175.848 -0.083 1
1 1110 . 4 1 1 A 102 102 CYS CA C 102 57.707 58.190 -0.483 1
1 1111 . 4 1 1 A 102 102 CYS CB C 102 29.130 28.695 0.435 1
1 1112 . 4 1 1 A 102 102 CYS N N 102 131.256 127.080 4.176 1
1 1113 . 4 1 1 A 103 103 GLU H H 103 9.497 8.958 0.539 1
1 1114 . 4 1 1 A 103 103 GLU HA H 103 4.003 4.034 -0.031 1
1 1119 . 4 1 1 A 103 103 GLU C C 103 176.540 178.678 -2.138 1
1 1120 . 4 1 1 A 103 103 GLU CA C 103 58.796 59.465 -0.669 1
1 1121 . 4 1 1 A 103 103 GLU CB C 103 29.280 29.523 -0.243 1
1 1123 . 4 1 1 A 103 103 GLU N N 103 129.829 127.522 2.307 1
1 1124 . 4 1 1 A 104 104 ASN H H 104 7.832 8.079 -0.247 1
1 1125 . 4 1 1 A 104 104 ASN HA H 104 4.457 4.443 0.014 1
1 1130 . 4 1 1 A 104 104 ASN C C 104 176.401 177.993 -1.592 1
1 1131 . 4 1 1 A 104 104 ASN CA C 104 56.053 56.293 -0.240 1
1 1132 . 4 1 1 A 104 104 ASN CB C 104 38.400 38.114 0.286 1
1 1133 . 4 1 1 A 104 104 ASN N N 104 117.703 117.993 -0.290 1
1 1135 . 4 1 1 A 105 105 CYS H H 105 9.415 7.702 1.713 1
1 1136 . 4 1 1 A 105 105 CYS HA H 105 4.137 4.515 -0.378 1
1 1139 . 4 1 1 A 105 105 CYS C C 105 176.844 175.227 1.617 1
1 1140 . 4 1 1 A 105 105 CYS CA C 105 64.328 59.403 4.925 1
1 1141 . 4 1 1 A 105 105 CYS CB C 105 30.350 28.054 2.296 1
1 1142 . 4 1 1 A 105 105 CYS N N 105 124.939 115.233 9.706 1
1 1143 . 4 1 1 A 106 106 GLY H H 106 8.145 8.964 -0.819 1
1 1144 . 4 1 1 A 106 106 GLY HA2 H 106 3.980 3.934 0.046 1
1 1145 . 4 1 1 A 106 106 GLY HA3 H 106 3.502 3.945 -0.443 1
1 1146 . 4 1 1 A 106 106 GLY C C 106 172.500 173.580 -1.080 1
1 1147 . 4 1 1 A 106 106 GLY CA C 106 44.968 45.501 -0.533 1
1 1148 . 4 1 1 A 106 106 GLY N N 106 106.090 109.218 -3.128 1
1 1149 . 4 1 1 A 107 107 ILE H H 107 6.465 7.253 -0.788 1
1 1150 . 4 1 1 A 107 107 ILE HA H 107 4.878 4.917 -0.039 1
1 1160 . 4 1 1 A 107 107 ILE C C 107 174.824 174.297 0.527 1
1 1161 . 4 1 1 A 107 107 ILE CA C 107 58.226 58.314 -0.088 1
1 1162 . 4 1 1 A 107 107 ILE CB C 107 44.460 41.828 2.632 1
1 1166 . 4 1 1 A 107 107 ILE N N 107 107.914 114.455 -6.541 1
1 1167 . 4 1 1 A 108 108 CYS H H 108 7.041 9.126 -2.085 1
1 1168 . 4 1 1 A 108 108 CYS HA H 108 5.018 5.350 -0.332 1
1 1171 . 4 1 1 A 108 108 CYS C C 108 175.461 173.449 2.012 1
1 1172 . 4 1 1 A 108 108 CYS CA C 108 62.097 57.246 4.851 1
1 1173 . 4 1 1 A 108 108 CYS CB C 108 31.353 30.329 1.024 1
1 1174 . 4 1 1 A 108 108 CYS N N 108 122.441 121.198 1.243 1
1 1175 . 4 1 1 A 109 109 ARG H H 109 8.561 8.404 0.157 1
1 1176 . 4 1 1 A 109 109 ARG HA H 109 4.239 4.900 -0.661 1
1 1183 . 4 1 1 A 109 109 ARG C C 109 174.271 175.567 -1.296 1
1 1184 . 4 1 1 A 109 109 ARG CA C 109 52.962 54.419 -1.457 1
1 1185 . 4 1 1 A 109 109 ARG CB C 109 33.903 33.027 0.876 1
1 1188 . 4 1 1 A 109 109 ARG N N 109 121.163 123.324 -2.161 1
1 1189 . 4 1 1 A 110 110 ILE H H 110 7.847 8.466 -0.619 1
1 1190 . 4 1 1 A 110 110 ILE HA H 110 3.531 4.134 -0.603 1
1 1200 . 4 1 1 A 110 110 ILE C C 110 175.405 175.627 -0.222 1
1 1201 . 4 1 1 A 110 110 ILE CA C 110 62.201 61.452 0.749 1
1 1202 . 4 1 1 A 110 110 ILE CB C 110 36.860 36.539 0.321 1
1 1206 . 4 1 1 A 110 110 ILE N N 110 118.955 122.752 -3.797 1
1 1207 . 4 1 1 A 111 111 GLY H H 111 6.928 8.170 -1.242 1
1 1208 . 4 1 1 A 111 111 GLY HA2 H 111 4.564 3.822 0.742 1
1 1209 . 4 1 1 A 111 111 GLY HA3 H 111 4.135 3.999 0.136 1
1 1210 . 4 1 1 A 111 111 GLY CA C 111 43.068 45.252 -2.184 1
1 1211 . 4 1 1 A 111 111 GLY N N 111 113.782 113.986 -0.204 1
1 1212 . 4 1 1 A 112 112 PRO HA H 112 4.990 4.683 0.307 1
1 1219 . 4 1 1 A 112 112 PRO C C 112 177.342 177.770 -0.428 1
1 1220 . 4 1 1 A 112 112 PRO CA C 112 62.920 63.068 -0.148 1
1 1221 . 4 1 1 A 112 112 PRO CB C 112 34.807 31.766 3.041 1
1 1224 . 4 1 1 A 113 113 LYS H H 113 8.989 8.258 0.731 1
1 1225 . 4 1 1 A 113 113 LYS HA H 113 3.144 3.695 -0.551 1
1 1234 . 4 1 1 A 113 113 LYS C C 113 177.536 178.038 -0.502 1
1 1235 . 4 1 1 A 113 113 LYS CA C 113 59.883 58.785 1.098 1
1 1236 . 4 1 1 A 113 113 LYS CB C 113 32.260 31.872 0.388 1
1 1240 . 4 1 1 A 113 113 LYS N N 113 123.545 123.444 0.101 1
1 1241 . 4 1 1 A 114 114 GLU H H 114 9.080 8.979 0.101 1
1 1242 . 4 1 1 A 114 114 GLU HA H 114 4.199 4.047 0.152 1
1 1247 . 4 1 1 A 114 114 GLU C C 114 176.374 178.265 -1.891 1
1 1248 . 4 1 1 A 114 114 GLU CA C 114 58.733 59.297 -0.564 1
1 1249 . 4 1 1 A 114 114 GLU CB C 114 28.077 29.023 -0.946 1
1 1251 . 4 1 1 A 114 114 GLU N N 114 114.832 120.731 -5.899 1
1 1252 . 4 1 1 A 115 115 ASP H H 115 7.799 7.850 -0.051 1
1 1253 . 4 1 1 A 115 115 ASP HA H 115 4.642 4.537 0.105 1
1 1256 . 4 1 1 A 115 115 ASP C C 115 176.374 176.095 0.279 1
1 1257 . 4 1 1 A 115 115 ASP CA C 115 54.470 56.278 -1.808 1
1 1258 . 4 1 1 A 115 115 ASP CB C 115 40.850 41.831 -0.981 1
1 1259 . 4 1 1 A 115 115 ASP N N 115 118.858 120.283 -1.425 1
1 1260 . 4 1 1 A 116 116 PHE H H 116 8.063 8.275 -0.212 1
1 1261 . 4 1 1 A 116 116 PHE HA H 116 5.239 4.987 0.252 1
1 1264 . 4 1 1 A 116 116 PHE C C 116 173.413 175.306 -1.893 1
1 1265 . 4 1 1 A 116 116 PHE CA C 116 57.708 57.443 0.265 1
1 1266 . 4 1 1 A 116 116 PHE CB C 116 44.557 39.972 4.585 1
1 1267 . 4 1 1 A 116 116 PHE N N 116 120.567 116.785 3.782 1
1 1268 . 4 1 1 A 117 117 PHE H H 117 9.439 8.977 0.462 1
1 1269 . 4 1 1 A 117 117 PHE HA H 117 5.091 5.480 -0.389 1
1 1277 . 4 1 1 A 117 117 PHE C C 117 171.614 172.715 -1.101 1
1 1278 . 4 1 1 A 117 117 PHE CA C 117 55.311 55.233 0.078 1
1 1279 . 4 1 1 A 117 117 PHE CB C 117 41.887 41.985 -0.098 1
1 1283 . 4 1 1 A 117 117 PHE N N 117 118.040 119.986 -1.946 1
1 1284 . 4 1 1 A 118 118 HIS H H 118 8.779 8.914 -0.135 1
1 1285 . 4 1 1 A 118 118 HIS HA H 118 4.836 4.939 -0.103 1
1 1289 . 4 1 1 A 118 118 HIS C C 118 174.879 174.908 -0.029 1
1 1290 . 4 1 1 A 118 118 HIS CA C 118 55.322 55.046 0.276 1
1 1291 . 4 1 1 A 118 118 HIS CB C 118 30.950 31.544 -0.594 1
1 1293 . 4 1 1 A 118 118 HIS N N 118 121.208 120.556 0.652 1
1 1294 . 4 1 1 A 119 119 CYS H H 119 8.123 8.010 0.113 1
1 1295 . 4 1 1 A 119 119 CYS HA H 119 4.529 4.537 -0.008 1
1 1298 . 4 1 1 A 119 119 CYS C C 119 176.567 174.641 1.926 1
1 1299 . 4 1 1 A 119 119 CYS CA C 119 58.957 59.159 -0.202 1
1 1300 . 4 1 1 A 119 119 CYS CB C 119 30.090 27.458 2.632 1
1 1301 . 4 1 1 A 119 119 CYS N N 119 131.659 125.497 6.162 1
1 1302 . 4 1 1 A 120 120 LEU H H 120 8.970 8.802 0.168 1
1 1303 . 4 1 1 A 120 120 LEU N N 120 130.361 128.281 2.080 1
1 1304 . 4 1 1 A 121 121 LYS HA H 121 4.299 4.098 0.201 1
1 1313 . 4 1 1 A 121 121 LYS CA C 121 58.727 59.139 -0.412 1
1 1314 . 4 1 1 A 121 121 LYS CB C 121 33.210 32.533 0.677 1
1 1318 . 4 1 1 A 123 123 ASN HA H 123 4.438 4.788 -0.350 1
1 1323 . 4 1 1 A 123 123 ASN C C 123 172.444 175.154 -2.710 1
1 1324 . 4 1 1 A 123 123 ASN CA C 123 53.448 53.833 -0.385 1
1 1325 . 4 1 1 A 123 123 ASN CB C 123 37.130 37.281 -0.151 1
1 1327 . 4 1 1 A 124 124 LEU H H 124 6.596 7.399 -0.803 1
1 1328 . 4 1 1 A 124 124 LEU HA H 124 4.576 4.295 0.281 1
1 1338 . 4 1 1 A 124 124 LEU C C 124 175.903 176.617 -0.714 1
1 1339 . 4 1 1 A 124 124 LEU CA C 124 54.043 54.997 -0.954 1
1 1340 . 4 1 1 A 124 124 LEU CB C 124 45.837 43.294 2.543 1
1 1344 . 4 1 1 A 124 124 LEU N N 124 115.443 122.513 -7.070 1
1 1345 . 4 1 1 A 125 125 CYS H H 125 6.342 8.622 -2.280 1
1 1346 . 4 1 1 A 125 125 CYS HA H 125 5.033 4.971 0.062 1
1 1349 . 4 1 1 A 125 125 CYS C C 125 175.101 174.270 0.831 1
1 1350 . 4 1 1 A 125 125 CYS CA C 125 62.046 57.818 4.228 1
1 1351 . 4 1 1 A 125 125 CYS CB C 125 30.840 28.131 2.709 1
1 1352 . 4 1 1 A 125 125 CYS N N 125 118.685 123.740 -5.055 1
1 1353 . 4 1 1 A 126 126 LEU H H 126 8.894 7.799 1.095 1
1 1354 . 4 1 1 A 126 126 LEU HA H 126 4.565 4.946 -0.381 1
1 1364 . 4 1 1 A 126 126 LEU C C 126 174.879 175.737 -0.858 1
1 1365 . 4 1 1 A 126 126 LEU CA C 126 52.751 53.130 -0.379 1
1 1366 . 4 1 1 A 126 126 LEU CB C 126 46.090 45.036 1.054 1
1 1370 . 4 1 1 A 126 126 LEU N N 126 124.501 124.657 -0.156 1
1 1371 . 4 1 1 A 127 127 ALA H H 127 8.378 8.465 -0.087 1
1 1372 . 4 1 1 A 127 127 ALA HA H 127 3.957 4.039 -0.082 1
1 1376 . 4 1 1 A 127 127 ALA C C 127 179.085 178.422 0.663 1
1 1377 . 4 1 1 A 127 127 ALA CA C 127 52.554 50.355 2.199 1
1 1378 . 4 1 1 A 127 127 ALA CB C 127 18.527 20.826 -2.299 1
1 1379 . 4 1 1 A 127 127 ALA N N 127 123.011 121.997 1.014 1
1 1380 . 4 1 1 A 128 128 MET H H 128 8.237 8.354 -0.117 1
1 1385 . 4 1 1 A 128 128 MET N N 128 120.642 120.440 0.202 1
1 1386 . 4 1 1 A 129 129 ASN HA H 129 4.502 4.446 0.056 1
1 1389 . 4 1 1 A 129 129 ASN C C 129 175.931 175.693 0.238 1
1 1390 . 4 1 1 A 129 129 ASN CA C 129 55.064 54.949 0.115 1
1 1391 . 4 1 1 A 129 129 ASN CB C 129 36.920 37.177 -0.257 1
1 1392 . 4 1 1 A 130 130 LEU H H 130 8.211 7.467 0.744 1
1 1393 . 4 1 1 A 130 130 LEU HA H 130 4.489 4.326 0.163 1
1 1403 . 4 1 1 A 130 130 LEU C C 130 178.836 177.531 1.305 1
1 1404 . 4 1 1 A 130 130 LEU CA C 130 54.653 54.656 -0.003 1
1 1405 . 4 1 1 A 130 130 LEU CB C 130 41.887 42.436 -0.549 1
1 1409 . 4 1 1 A 130 130 LEU N N 130 118.563 118.534 0.029 1
1 1410 . 4 1 1 A 131 131 GLN H H 131 7.953 7.660 0.293 1
1 1411 . 4 1 1 A 131 131 GLN HA H 131 3.729 3.795 -0.066 1
1 1418 . 4 1 1 A 131 131 GLN CA C 131 59.310 58.725 0.585 1
1 1419 . 4 1 1 A 131 131 GLN CB C 131 28.340 27.898 0.442 1
1 1421 . 4 1 1 A 131 131 GLN N N 131 123.929 119.418 4.511 1
1 1423 . 4 1 1 A 132 132 GLY HA2 H 132 4.034 3.727 0.307 1
1 1424 . 4 1 1 A 132 132 GLY HA3 H 132 3.865 3.733 0.132 1
1 1425 . 4 1 1 A 132 132 GLY C C 132 174.547 176.265 -1.718 1
1 1426 . 4 1 1 A 132 132 GLY CA C 132 45.902 46.616 -0.714 1
1 1427 . 4 1 1 A 133 133 ARG H H 133 7.735 7.509 0.226 1
1 1428 . 4 1 1 A 133 133 ARG HA H 133 4.611 4.252 0.359 1
1 1435 . 4 1 1 A 133 133 ARG C C 133 175.461 176.200 -0.739 1
1 1436 . 4 1 1 A 133 133 ARG CA C 133 54.987 58.801 -3.814 1
1 1437 . 4 1 1 A 133 133 ARG CB C 133 31.470 30.861 0.609 1
1 1440 . 4 1 1 A 133 133 ARG N N 133 118.194 120.004 -1.810 1
1 1441 . 4 1 1 A 134 134 HIS H H 134 7.803 7.751 0.052 1
1 1444 . 4 1 1 A 134 134 HIS N N 134 118.700 114.827 3.873 1
1 1445 . 4 1 1 A 135 135 LYS HA H 135 4.331 4.307 0.024 1
1 1454 . 4 1 1 A 135 135 LYS C C 135 174.852 176.472 -1.620 1
1 1455 . 4 1 1 A 135 135 LYS CA C 135 55.390 55.669 -0.279 1
1 1456 . 4 1 1 A 135 135 LYS CB C 135 32.970 31.180 1.790 1
1 1460 . 4 1 1 A 136 136 CYS H H 136 7.801 8.204 -0.403 1
1 1461 . 4 1 1 A 136 136 CYS HA H 136 4.113 4.904 -0.791 1
1 1464 . 4 1 1 A 136 136 CYS C C 136 174.879 174.515 0.364 1
1 1465 . 4 1 1 A 136 136 CYS CA C 136 60.028 58.201 1.827 1
1 1466 . 4 1 1 A 136 136 CYS CB C 136 30.350 28.642 1.708 1
1 1467 . 4 1 1 A 136 136 CYS N N 136 126.055 125.189 0.866 1
1 10 . 5 1 1 A 2 2 ALA H H 2 8.220 8.874 -0.654 1
1 11 . 5 1 1 A 2 2 ALA HA H 2 4.321 4.868 -0.547 1
1 15 . 5 1 1 A 2 2 ALA C C 2 177.564 175.122 2.442 1
1 16 . 5 1 1 A 2 2 ALA CA C 2 52.383 51.374 1.009 1
1 17 . 5 1 1 A 2 2 ALA CB C 2 19.290 23.381 -4.091 1
1 18 . 5 1 1 A 2 2 ALA N N 2 125.223 125.747 -0.524 1
1 19 . 5 1 1 A 3 3 ALA H H 3 8.246 8.750 -0.504 1
1 20 . 5 1 1 A 3 3 ALA N N 3 123.250 120.536 2.714 1
1 21 . 5 1 1 A 5 5 ALA HA H 5 4.415 4.530 -0.115 1
1 25 . 5 1 1 A 5 5 ALA C C 5 177.481 177.028 0.453 1
1 26 . 5 1 1 A 5 5 ALA CA C 5 52.423 52.222 0.201 1
1 27 . 5 1 1 A 5 5 ALA CB C 5 19.420 19.095 0.325 1
1 28 . 5 1 1 A 6 6 ARG H H 6 8.239 8.298 -0.059 1
1 29 . 5 1 1 A 6 6 ARG HA H 6 4.371 4.821 -0.450 1
1 36 . 5 1 1 A 6 6 ARG C C 6 176.180 175.853 0.327 1
1 37 . 5 1 1 A 6 6 ARG CA C 6 56.353 54.605 1.748 1
1 38 . 5 1 1 A 6 6 ARG CB C 6 31.170 32.151 -0.981 1
1 41 . 5 1 1 A 6 6 ARG N N 6 120.436 122.749 -2.313 1
1 42 . 5 1 1 A 7 7 GLU H H 7 8.535 9.038 -0.503 1
1 43 . 5 1 1 A 7 7 GLU HA H 7 4.335 4.250 0.085 1
1 48 . 5 1 1 A 7 7 GLU C C 7 176.346 176.127 0.219 1
1 49 . 5 1 1 A 7 7 GLU CA C 7 56.740 57.011 -0.271 1
1 50 . 5 1 1 A 7 7 GLU CB C 7 30.390 30.527 -0.137 1
1 52 . 5 1 1 A 7 7 GLU N N 7 122.189 118.841 3.348 1
1 53 . 5 1 1 A 8 8 ASP H H 8 8.347 8.320 0.027 1
1 54 . 5 1 1 A 8 8 ASP N N 8 121.112 119.473 1.639 1
1 55 . 5 1 1 A 9 9 GLY HA2 H 9 3.975 4.159 -0.184 1
1 56 . 5 1 1 A 9 9 GLY HA3 H 9 3.975 4.160 -0.185 1
1 57 . 5 1 1 A 9 9 GLY C C 9 174.243 171.701 2.542 1
1 58 . 5 1 1 A 9 9 GLY CA C 9 45.933 46.109 -0.176 1
1 59 . 5 1 1 A 10 10 ALA H H 10 8.111 8.474 -0.363 1
1 60 . 5 1 1 A 10 10 ALA N N 10 123.721 124.792 -1.071 1
1 61 . 5 1 1 A 12 12 GLY HA2 H 12 3.992 4.050 -0.058 1
1 62 . 5 1 1 A 12 12 GLY HA3 H 12 3.992 4.050 -0.058 1
1 63 . 5 1 1 A 12 12 GLY C C 12 173.883 173.155 0.728 1
1 64 . 5 1 1 A 12 12 GLY CA C 12 45.381 44.288 1.093 1
1 65 . 5 1 1 A 13 13 GLU H H 13 8.224 8.412 -0.188 1
1 66 . 5 1 1 A 13 13 GLU HA H 13 4.367 4.557 -0.190 1
1 71 . 5 1 1 A 13 13 GLU C C 13 176.125 176.217 -0.092 1
1 72 . 5 1 1 A 13 13 GLU CA C 13 56.349 55.834 0.515 1
1 73 . 5 1 1 A 13 13 GLU CB C 13 29.560 31.108 -1.548 1
1 75 . 5 1 1 A 13 13 GLU N N 13 120.148 120.581 -0.433 1
1 76 . 5 1 1 A 14 14 GLU H H 14 8.508 8.637 -0.129 1
1 77 . 5 1 1 A 14 14 GLU HA H 14 4.302 4.283 0.019 1
1 82 . 5 1 1 A 14 14 GLU C C 14 176.623 175.338 1.285 1
1 83 . 5 1 1 A 14 14 GLU CA C 14 56.497 55.975 0.522 1
1 84 . 5 1 1 A 14 14 GLU CB C 14 30.110 28.956 1.154 1
1 86 . 5 1 1 A 14 14 GLU N N 14 122.160 126.261 -4.101 1
1 87 . 5 1 1 A 15 15 ARG H H 15 8.356 8.324 0.032 1
1 88 . 5 1 1 A 15 15 ARG HA H 15 4.366 4.699 -0.333 1
1 95 . 5 1 1 A 15 15 ARG C C 15 176.844 175.544 1.300 1
1 96 . 5 1 1 A 15 15 ARG CA C 15 56.010 54.918 1.092 1
1 97 . 5 1 1 A 15 15 ARG CB C 15 30.890 30.440 0.450 1
1 100 . 5 1 1 A 15 15 ARG N N 15 121.945 128.572 -6.627 1
1 101 . 5 1 1 A 16 16 GLY H H 16 8.414 8.306 0.108 1
1 102 . 5 1 1 A 16 16 GLY HA2 H 16 4.022 4.245 -0.223 1
1 103 . 5 1 1 A 16 16 GLY HA3 H 16 4.022 4.247 -0.225 1
1 104 . 5 1 1 A 16 16 GLY C C 16 174.326 174.605 -0.279 1
1 105 . 5 1 1 A 16 16 GLY CA C 16 45.620 45.540 0.080 1
1 106 . 5 1 1 A 16 16 GLY N N 16 109.734 114.415 -4.681 1
1 107 . 5 1 1 A 17 17 GLN H H 17 8.184 8.345 -0.161 1
1 108 . 5 1 1 A 17 17 GLN HA H 17 4.366 4.235 0.131 1
1 113 . 5 1 1 A 17 17 GLN C C 17 175.544 176.042 -0.498 1
1 114 . 5 1 1 A 17 17 GLN CA C 17 55.749 58.432 -2.683 1
1 115 . 5 1 1 A 17 17 GLN CB C 17 29.367 28.789 0.578 1
1 117 . 5 1 1 A 17 17 GLN N N 17 119.546 122.223 -2.677 1
1 118 . 5 1 1 A 18 18 ARG H H 18 8.366 7.796 0.570 1
1 119 . 5 1 1 A 18 18 ARG HA H 18 4.487 4.717 -0.230 1
1 126 . 5 1 1 A 18 18 ARG C C 18 176.042 175.865 0.177 1
1 127 . 5 1 1 A 18 18 ARG CA C 18 55.735 55.245 0.490 1
1 128 . 5 1 1 A 18 18 ARG CB C 18 31.170 32.209 -1.039 1
1 131 . 5 1 1 A 18 18 ARG N N 18 122.330 116.009 6.321 1
1 132 . 5 1 1 A 19 19 GLY H H 19 8.192 8.652 -0.460 1
1 133 . 5 1 1 A 19 19 GLY HA2 H 19 4.852 3.999 0.853 1
1 134 . 5 1 1 A 19 19 GLY HA3 H 19 3.894 4.006 -0.112 1
1 135 . 5 1 1 A 19 19 GLY C C 19 172.361 172.607 -0.246 1
1 136 . 5 1 1 A 19 19 GLY CA C 19 45.580 45.940 -0.360 1
1 137 . 5 1 1 A 19 19 GLY N N 19 109.658 108.601 1.057 1
1 138 . 5 1 1 A 20 20 CYS H H 20 8.843 8.312 0.531 1
1 139 . 5 1 1 A 20 20 CYS HA H 20 5.147 5.064 0.083 1
1 142 . 5 1 1 A 20 20 CYS C C 20 175.211 174.500 0.711 1
1 143 . 5 1 1 A 20 20 CYS CA C 20 56.712 57.999 -1.287 1
1 144 . 5 1 1 A 20 20 CYS CB C 20 33.530 30.881 2.649 1
1 145 . 5 1 1 A 20 20 CYS N N 20 120.185 119.383 0.802 1
1 146 . 5 1 1 A 21 21 GLU H H 21 8.981 9.009 -0.028 1
1 147 . 5 1 1 A 21 21 GLU HA H 21 4.100 4.000 0.100 1
1 152 . 5 1 1 A 21 21 GLU C C 21 176.014 178.035 -2.021 1
1 153 . 5 1 1 A 21 21 GLU CA C 21 57.134 58.941 -1.807 1
1 154 . 5 1 1 A 21 21 GLU CB C 21 28.890 28.901 -0.011 1
1 156 . 5 1 1 A 21 21 GLU N N 21 116.078 124.128 -8.050 1
1 157 . 5 1 1 A 22 22 HIS H H 22 9.342 7.627 1.715 1
1 158 . 5 1 1 A 22 22 HIS HA H 22 4.210 4.233 -0.023 1
1 161 . 5 1 1 A 22 22 HIS C C 22 175.128 174.684 0.444 1
1 162 . 5 1 1 A 22 22 HIS CA C 22 58.945 58.203 0.742 1
1 163 . 5 1 1 A 22 22 HIS CB C 22 33.160 30.876 2.284 1
1 164 . 5 1 1 A 22 22 HIS N N 22 122.296 117.739 4.557 1
1 165 . 5 1 1 A 23 23 TYR H H 23 7.931 7.872 0.059 1
1 166 . 5 1 1 A 23 23 TYR HA H 23 4.856 5.216 -0.360 1
1 171 . 5 1 1 A 23 23 TYR C C 23 173.108 174.529 -1.421 1
1 172 . 5 1 1 A 23 23 TYR CA C 23 57.852 56.312 1.540 1
1 173 . 5 1 1 A 23 23 TYR CB C 23 45.300 41.748 3.552 1
1 175 . 5 1 1 A 23 23 TYR N N 23 115.205 115.583 -0.378 1
1 176 . 5 1 1 A 24 24 ASP H H 24 8.384 8.847 -0.463 1
1 177 . 5 1 1 A 24 24 ASP HA H 24 5.160 5.089 0.071 1
1 180 . 5 1 1 A 24 24 ASP C C 24 174.437 175.486 -1.049 1
1 181 . 5 1 1 A 24 24 ASP CA C 24 53.343 53.935 -0.592 1
1 182 . 5 1 1 A 24 24 ASP CB C 24 41.470 41.074 0.396 1
1 183 . 5 1 1 A 24 24 ASP N N 24 122.016 124.678 -2.662 1
1 184 . 5 1 1 A 25 25 ARG H H 25 7.313 8.678 -1.365 1
1 185 . 5 1 1 A 25 25 ARG HA H 25 5.331 5.041 0.290 1
1 192 . 5 1 1 A 25 25 ARG C C 25 175.045 175.822 -0.777 1
1 193 . 5 1 1 A 25 25 ARG CA C 25 54.224 54.257 -0.033 1
1 194 . 5 1 1 A 25 25 ARG CB C 25 34.090 34.185 -0.095 1
1 197 . 5 1 1 A 25 25 ARG N N 25 115.898 122.170 -6.272 1
1 198 . 5 1 1 A 26 26 GLY H H 26 9.387 8.765 0.622 1
1 199 . 5 1 1 A 26 26 GLY HA2 H 26 4.622 3.941 0.681 1
1 200 . 5 1 1 A 26 26 GLY HA3 H 26 3.788 4.004 -0.216 1
1 201 . 5 1 1 A 26 26 GLY C C 26 170.978 174.226 -3.248 1
1 202 . 5 1 1 A 26 26 GLY CA C 26 44.794 45.371 -0.577 1
1 203 . 5 1 1 A 26 26 GLY N N 26 105.653 108.002 -2.349 1
1 204 . 5 1 1 A 27 27 CYS H H 27 6.864 7.620 -0.756 1
1 205 . 5 1 1 A 27 27 CYS HA H 27 5.195 5.172 0.023 1
1 208 . 5 1 1 A 27 27 CYS C C 27 171.144 172.466 -1.322 1
1 209 . 5 1 1 A 27 27 CYS CA C 27 52.349 56.830 -4.481 1
1 210 . 5 1 1 A 27 27 CYS CB C 27 30.997 31.451 -0.454 1
1 211 . 5 1 1 A 27 27 CYS N N 27 110.921 117.328 -6.407 1
1 212 . 5 1 1 A 28 28 LEU H H 28 8.310 8.766 -0.456 1
1 213 . 5 1 1 A 28 28 LEU HA H 28 4.651 5.008 -0.357 1
1 223 . 5 1 1 A 28 28 LEU C C 28 176.827 175.905 0.922 1
1 224 . 5 1 1 A 28 28 LEU CA C 28 53.054 53.421 -0.367 1
1 225 . 5 1 1 A 28 28 LEU CB C 28 44.200 45.254 -1.054 1
1 229 . 5 1 1 A 28 28 LEU N N 28 115.519 120.420 -4.901 1
1 230 . 5 1 1 A 29 29 LEU H H 29 8.800 8.807 -0.007 1
1 231 . 5 1 1 A 29 29 LEU HA H 29 4.313 4.841 -0.528 1
1 240 . 5 1 1 A 29 29 LEU C C 29 175.571 175.409 0.162 1
1 241 . 5 1 1 A 29 29 LEU CA C 29 54.388 53.522 0.866 1
1 242 . 5 1 1 A 29 29 LEU CB C 29 42.780 43.791 -1.011 1
1 245 . 5 1 1 A 29 29 LEU N N 29 118.712 121.172 -2.460 1
1 246 . 5 1 1 A 30 30 LYS H H 30 8.009 8.739 -0.730 1
1 247 . 5 1 1 A 30 30 LYS HA H 30 4.592 4.637 -0.045 1
1 256 . 5 1 1 A 30 30 LYS C C 30 174.990 175.018 -0.028 1
1 257 . 5 1 1 A 30 30 LYS CA C 30 54.999 56.147 -1.148 1
1 258 . 5 1 1 A 30 30 LYS CB C 30 32.330 33.062 -0.732 1
1 262 . 5 1 1 A 30 30 LYS N N 30 122.310 126.033 -3.723 1
1 263 . 5 1 1 A 31 31 ALA H H 31 9.238 8.398 0.840 1
1 264 . 5 1 1 A 31 31 ALA HA H 31 4.477 4.380 0.097 1
1 268 . 5 1 1 A 31 31 ALA CA C 31 50.190 49.960 0.230 1
1 269 . 5 1 1 A 31 31 ALA CB C 31 21.637 19.900 1.737 1
1 270 . 5 1 1 A 31 31 ALA N N 31 133.864 129.952 3.912 1
1 271 . 5 1 1 A 32 32 PRO HA H 32 4.637 4.412 0.225 1
1 278 . 5 1 1 A 32 32 PRO C C 32 175.737 177.524 -1.787 1
1 279 . 5 1 1 A 32 32 PRO CA C 32 64.259 64.413 -0.154 1
1 280 . 5 1 1 A 32 32 PRO CB C 32 31.740 31.792 -0.052 1
1 283 . 5 1 1 A 33 33 CYS H H 33 8.779 8.288 0.491 1
1 284 . 5 1 1 A 33 33 CYS HA H 33 4.321 4.289 0.032 1
1 287 . 5 1 1 A 33 33 CYS C C 33 176.733 175.727 1.006 1
1 288 . 5 1 1 A 33 33 CYS CA C 33 54.398 61.455 -7.057 1
1 289 . 5 1 1 A 33 33 CYS CB C 33 30.697 27.055 3.642 1
1 290 . 5 1 1 A 33 33 CYS N N 33 120.005 115.866 4.139 1
1 291 . 5 1 1 A 34 34 CYS H H 34 7.424 7.694 -0.270 1
1 292 . 5 1 1 A 34 34 CYS HA H 34 4.896 4.681 0.215 1
1 295 . 5 1 1 A 34 34 CYS C C 34 174.935 173.847 1.088 1
1 296 . 5 1 1 A 34 34 CYS CA C 34 56.962 59.026 -2.064 1
1 297 . 5 1 1 A 34 34 CYS CB C 34 31.067 30.154 0.913 1
1 298 . 5 1 1 A 34 34 CYS N N 34 115.034 119.256 -4.222 1
1 299 . 5 1 1 A 35 35 ASP H H 35 8.368 8.138 0.230 1
1 300 . 5 1 1 A 35 35 ASP HA H 35 4.454 4.242 0.212 1
1 303 . 5 1 1 A 35 35 ASP C C 35 174.354 174.903 -0.549 1
1 304 . 5 1 1 A 35 35 ASP CA C 35 56.222 55.540 0.682 1
1 305 . 5 1 1 A 35 35 ASP CB C 35 39.730 39.817 -0.087 1
1 306 . 5 1 1 A 35 35 ASP N N 35 121.381 118.768 2.613 1
1 307 . 5 1 1 A 36 36 LYS H H 36 7.227 7.880 -0.653 1
1 308 . 5 1 1 A 36 36 LYS HA H 36 4.451 4.547 -0.096 1
1 317 . 5 1 1 A 36 36 LYS C C 36 175.433 175.639 -0.206 1
1 318 . 5 1 1 A 36 36 LYS CA C 36 56.270 55.186 1.084 1
1 319 . 5 1 1 A 36 36 LYS CB C 36 36.620 34.110 2.510 1
1 323 . 5 1 1 A 36 36 LYS N N 36 117.673 118.430 -0.757 1
1 324 . 5 1 1 A 37 37 LEU H H 37 8.053 8.308 -0.255 1
1 325 . 5 1 1 A 37 37 LEU HA H 37 5.292 4.834 0.458 1
1 335 . 5 1 1 A 37 37 LEU C C 37 176.484 175.005 1.479 1
1 336 . 5 1 1 A 37 37 LEU CA C 37 53.348 52.985 0.363 1
1 337 . 5 1 1 A 37 37 LEU CB C 37 42.400 42.728 -0.328 1
1 341 . 5 1 1 A 37 37 LEU N N 37 120.994 122.797 -1.803 1
1 342 . 5 1 1 A 38 38 TYR H H 38 8.741 8.711 0.030 1
1 343 . 5 1 1 A 38 38 TYR HA H 38 5.002 4.857 0.145 1
1 350 . 5 1 1 A 38 38 TYR C C 38 176.374 176.056 0.318 1
1 351 . 5 1 1 A 38 38 TYR CA C 38 57.081 56.779 0.302 1
1 352 . 5 1 1 A 38 38 TYR CB C 38 45.647 41.448 4.199 1
1 355 . 5 1 1 A 38 38 TYR N N 38 121.128 122.230 -1.102 1
1 356 . 5 1 1 A 39 39 THR H H 39 9.402 8.767 0.635 1
1 357 . 5 1 1 A 39 39 THR HA H 39 4.098 4.144 -0.046 1
1 362 . 5 1 1 A 39 39 THR C C 39 173.496 174.965 -1.469 1
1 363 . 5 1 1 A 39 39 THR CA C 39 67.062 65.527 1.535 1
1 364 . 5 1 1 A 39 39 THR CB C 39 68.047 68.514 -0.467 1
1 366 . 5 1 1 A 39 39 THR N N 39 116.641 117.995 -1.354 1
1 367 . 5 1 1 A 40 40 CYS H H 40 7.317 7.912 -0.595 1
1 368 . 5 1 1 A 40 40 CYS HA H 40 4.771 4.955 -0.184 1
1 371 . 5 1 1 A 40 40 CYS C C 40 175.128 175.183 -0.055 1
1 372 . 5 1 1 A 40 40 CYS CA C 40 56.577 57.859 -1.282 1
1 373 . 5 1 1 A 40 40 CYS CB C 40 35.087 31.264 3.823 1
1 374 . 5 1 1 A 40 40 CYS N N 40 109.059 118.548 -9.489 1
1 375 . 5 1 1 A 41 41 ARG H H 41 9.201 8.923 0.278 1
1 376 . 5 1 1 A 41 41 ARG HA H 41 3.982 4.028 -0.046 1
1 383 . 5 1 1 A 41 41 ARG C C 41 175.101 177.898 -2.797 1
1 384 . 5 1 1 A 41 41 ARG CA C 41 58.591 58.808 -0.217 1
1 385 . 5 1 1 A 41 41 ARG CB C 41 29.640 29.838 -0.198 1
1 388 . 5 1 1 A 41 41 ARG N N 41 121.737 124.478 -2.741 1
1 389 . 5 1 1 A 42 42 LEU H H 42 9.116 7.747 1.369 1
1 390 . 5 1 1 A 42 42 LEU HA H 42 4.029 4.056 -0.027 1
1 400 . 5 1 1 A 42 42 LEU C C 42 179.943 179.387 0.556 1
1 401 . 5 1 1 A 42 42 LEU CA C 42 58.005 57.696 0.309 1
1 402 . 5 1 1 A 42 42 LEU CB C 42 38.960 41.061 -2.101 1
1 406 . 5 1 1 A 42 42 LEU N N 42 126.364 116.537 9.827 1
1 407 . 5 1 1 A 43 43 CYS H H 43 8.785 8.241 0.544 1
1 408 . 5 1 1 A 43 43 CYS HA H 43 4.187 4.263 -0.076 1
1 411 . 5 1 1 A 43 43 CYS C C 43 177.785 177.293 0.492 1
1 412 . 5 1 1 A 43 43 CYS CA C 43 66.415 62.302 4.113 1
1 413 . 5 1 1 A 43 43 CYS CB C 43 28.870 27.011 1.859 1
1 414 . 5 1 1 A 43 43 CYS N N 43 124.519 117.404 7.115 1
1 415 . 5 1 1 A 44 44 HIS H H 44 7.604 7.297 0.307 1
1 416 . 5 1 1 A 44 44 HIS HA H 44 1.983 2.764 -0.781 1
1 420 . 5 1 1 A 44 44 HIS C C 44 176.429 176.195 0.234 1
1 421 . 5 1 1 A 44 44 HIS CA C 44 58.760 58.817 -0.057 1
1 422 . 5 1 1 A 44 44 HIS CB C 44 27.990 29.223 -1.233 1
1 423 . 5 1 1 A 44 44 HIS N N 44 117.024 121.350 -4.326 1
1 424 . 5 1 1 A 45 45 ASP H H 45 8.750 8.327 0.423 1
1 425 . 5 1 1 A 45 45 ASP HA H 45 4.116 4.160 -0.044 1
1 428 . 5 1 1 A 45 45 ASP C C 45 177.453 177.906 -0.453 1
1 429 . 5 1 1 A 45 45 ASP CA C 45 56.840 57.622 -0.782 1
1 430 . 5 1 1 A 45 45 ASP CB C 45 38.960 41.997 -3.037 1
1 431 . 5 1 1 A 45 45 ASP N N 45 120.440 118.611 1.829 1
1 432 . 5 1 1 A 46 46 ASN H H 46 7.888 8.047 -0.159 1
1 433 . 5 1 1 A 46 46 ASN HA H 46 4.612 4.447 0.165 1
1 438 . 5 1 1 A 46 46 ASN C C 46 175.903 176.931 -1.028 1
1 439 . 5 1 1 A 46 46 ASN CA C 46 54.342 57.181 -2.839 1
1 440 . 5 1 1 A 46 46 ASN CB C 46 38.790 40.290 -1.500 1
1 441 . 5 1 1 A 46 46 ASN N N 46 115.758 117.256 -1.498 1
1 443 . 5 1 1 A 47 47 ASN H H 47 7.384 7.445 -0.061 1
1 444 . 5 1 1 A 47 47 ASN HA H 47 4.893 4.635 0.258 1
1 449 . 5 1 1 A 47 47 ASN C C 47 173.579 175.291 -1.712 1
1 450 . 5 1 1 A 47 47 ASN CA C 47 53.937 54.779 -0.842 1
1 451 . 5 1 1 A 47 47 ASN CB C 47 43.130 39.231 3.899 1
1 452 . 5 1 1 A 47 47 ASN N N 47 116.576 115.238 1.338 1
1 454 . 5 1 1 A 48 48 GLU H H 48 7.143 7.377 -0.234 1
1 455 . 5 1 1 A 48 48 GLU HA H 48 4.572 4.543 0.029 1
1 460 . 5 1 1 A 48 48 GLU C C 48 175.627 175.937 -0.310 1
1 461 . 5 1 1 A 48 48 GLU CA C 48 53.727 54.616 -0.889 1
1 462 . 5 1 1 A 48 48 GLU CB C 48 32.480 31.584 0.896 1
1 464 . 5 1 1 A 48 48 GLU N N 48 116.967 117.158 -0.191 1
1 465 . 5 1 1 A 49 49 ASP H H 49 8.748 8.548 0.200 1
1 466 . 5 1 1 A 49 49 ASP HA H 49 4.576 4.589 -0.013 1
1 469 . 5 1 1 A 49 49 ASP C C 49 174.796 176.086 -1.290 1
1 470 . 5 1 1 A 49 49 ASP CA C 49 53.027 56.468 -3.441 1
1 471 . 5 1 1 A 49 49 ASP CB C 49 40.340 42.449 -2.109 1
1 472 . 5 1 1 A 49 49 ASP N N 49 119.296 120.394 -1.098 1
1 473 . 5 1 1 A 50 50 HIS H H 50 6.919 7.376 -0.457 1
1 474 . 5 1 1 A 50 50 HIS HA H 50 4.880 5.088 -0.208 1
1 477 . 5 1 1 A 50 50 HIS C C 50 172.942 174.728 -1.786 1
1 478 . 5 1 1 A 50 50 HIS CA C 50 53.978 53.343 0.635 1
1 479 . 5 1 1 A 50 50 HIS CB C 50 30.330 32.582 -2.252 1
1 480 . 5 1 1 A 50 50 HIS N N 50 113.709 115.503 -1.794 1
1 481 . 5 1 1 A 51 51 GLN H H 51 8.646 8.727 -0.081 1
1 482 . 5 1 1 A 51 51 GLN HA H 51 4.896 4.793 0.103 1
1 487 . 5 1 1 A 51 51 GLN C C 51 176.512 174.830 1.682 1
1 488 . 5 1 1 A 51 51 GLN CA C 51 54.872 55.261 -0.389 1
1 489 . 5 1 1 A 51 51 GLN CB C 51 30.950 30.051 0.899 1
1 491 . 5 1 1 A 51 51 GLN N N 51 119.379 118.973 0.406 1
1 492 . 5 1 1 A 52 52 LEU H H 52 9.646 8.496 1.150 1
1 493 . 5 1 1 A 52 52 LEU HA H 52 4.206 4.581 -0.375 1
1 503 . 5 1 1 A 52 52 LEU C C 52 175.793 175.124 0.669 1
1 504 . 5 1 1 A 52 52 LEU CA C 52 55.450 54.069 1.381 1
1 505 . 5 1 1 A 52 52 LEU CB C 52 41.407 43.272 -1.865 1
1 509 . 5 1 1 A 52 52 LEU N N 52 128.069 125.114 2.955 1
1 510 . 5 1 1 A 53 53 ASP H H 53 9.281 8.646 0.635 1
1 511 . 5 1 1 A 53 53 ASP HA H 53 4.725 4.883 -0.158 1
1 514 . 5 1 1 A 53 53 ASP C C 53 176.401 177.604 -1.203 1
1 515 . 5 1 1 A 53 53 ASP CA C 53 52.590 54.050 -1.460 1
1 516 . 5 1 1 A 53 53 ASP CB C 53 39.990 42.621 -2.631 1
1 517 . 5 1 1 A 53 53 ASP N N 53 128.783 127.500 1.283 1
1 518 . 5 1 1 A 54 54 ARG H H 54 8.496 8.862 -0.366 1
1 519 . 5 1 1 A 54 54 ARG HA H 54 3.859 4.003 -0.144 1
1 526 . 5 1 1 A 54 54 ARG C C 54 176.346 176.040 0.306 1
1 527 . 5 1 1 A 54 54 ARG CA C 54 57.357 57.873 -0.516 1
1 528 . 5 1 1 A 54 54 ARG CB C 54 28.890 29.192 -0.302 1
1 531 . 5 1 1 A 54 54 ARG N N 54 125.813 124.950 0.863 1
1 532 . 5 1 1 A 55 55 PHE H H 55 8.005 7.665 0.340 1
1 533 . 5 1 1 A 55 55 PHE HA H 55 4.712 4.493 0.219 1
1 540 . 5 1 1 A 55 55 PHE C C 55 177.481 177.426 0.055 1
1 541 . 5 1 1 A 55 55 PHE CA C 55 59.080 59.729 -0.649 1
1 542 . 5 1 1 A 55 55 PHE CB C 55 37.447 40.078 -2.631 1
1 545 . 5 1 1 A 55 55 PHE N N 55 120.168 117.331 2.837 1
1 546 . 5 1 1 A 56 56 LYS H H 56 7.681 7.634 0.047 1
1 547 . 5 1 1 A 56 56 LYS HA H 56 4.411 4.301 0.110 1
1 556 . 5 1 1 A 56 56 LYS C C 56 175.959 176.576 -0.617 1
1 557 . 5 1 1 A 56 56 LYS CA C 56 55.459 57.955 -2.496 1
1 558 . 5 1 1 A 56 56 LYS CB C 56 33.590 32.998 0.592 1
1 562 . 5 1 1 A 56 56 LYS N N 56 116.937 117.851 -0.914 1
1 563 . 5 1 1 A 57 57 VAL H H 57 6.553 7.364 -0.811 1
1 564 . 5 1 1 A 57 57 VAL HA H 57 3.408 3.929 -0.521 1
1 572 . 5 1 1 A 57 57 VAL C C 57 173.911 175.158 -1.247 1
1 573 . 5 1 1 A 57 57 VAL CA C 57 65.025 61.793 3.232 1
1 574 . 5 1 1 A 57 57 VAL CB C 57 32.663 32.288 0.375 1
1 577 . 5 1 1 A 57 57 VAL N N 57 119.519 117.428 2.091 1
1 578 . 5 1 1 A 58 58 LYS H H 58 9.182 8.887 0.295 1
1 579 . 5 1 1 A 58 58 LYS HA H 58 4.489 4.375 0.114 1
1 588 . 5 1 1 A 58 58 LYS C C 58 176.927 175.896 1.031 1
1 589 . 5 1 1 A 58 58 LYS CA C 58 55.913 56.977 -1.064 1
1 590 . 5 1 1 A 58 58 LYS CB C 58 36.340 35.210 1.130 1
1 594 . 5 1 1 A 58 58 LYS N N 58 124.985 125.546 -0.561 1
1 595 . 5 1 1 A 59 59 GLU H H 59 8.799 7.732 1.067 1
1 596 . 5 1 1 A 59 59 GLU HA H 59 5.209 4.749 0.460 1
1 601 . 5 1 1 A 59 59 GLU C C 59 173.911 175.759 -1.848 1
1 602 . 5 1 1 A 59 59 GLU CA C 59 54.670 54.819 -0.149 1
1 603 . 5 1 1 A 59 59 GLU CB C 59 35.180 31.603 3.577 1
1 605 . 5 1 1 A 59 59 GLU N N 59 121.493 117.901 3.592 1
1 606 . 5 1 1 A 60 60 VAL H H 60 8.917 8.975 -0.058 1
1 607 . 5 1 1 A 60 60 VAL HA H 60 4.983 4.984 -0.001 1
1 615 . 5 1 1 A 60 60 VAL C C 60 173.441 173.833 -0.392 1
1 616 . 5 1 1 A 60 60 VAL CA C 60 57.497 58.944 -1.447 1
1 617 . 5 1 1 A 60 60 VAL CB C 60 35.460 36.644 -1.184 1
1 620 . 5 1 1 A 60 60 VAL N N 60 109.266 117.834 -8.568 1
1 621 . 5 1 1 A 61 61 GLN H H 61 8.970 8.269 0.701 1
1 622 . 5 1 1 A 61 61 GLN HA H 61 5.024 5.065 -0.041 1
1 629 . 5 1 1 A 61 61 GLN C C 61 175.045 174.198 0.847 1
1 630 . 5 1 1 A 61 61 GLN CA C 61 53.128 54.218 -1.090 1
1 631 . 5 1 1 A 61 61 GLN CB C 61 33.980 32.653 1.327 1
1 633 . 5 1 1 A 61 61 GLN N N 61 118.525 120.122 -1.597 1
1 635 . 5 1 1 A 62 62 CYS H H 62 7.688 8.827 -1.139 1
1 636 . 5 1 1 A 62 62 CYS HA H 62 4.210 4.156 0.054 1
1 639 . 5 1 1 A 62 62 CYS C C 62 177.951 175.890 2.061 1
1 640 . 5 1 1 A 62 62 CYS CA C 62 59.845 59.099 0.746 1
1 641 . 5 1 1 A 62 62 CYS CB C 62 33.120 28.130 4.990 1
1 642 . 5 1 1 A 62 62 CYS N N 62 128.772 124.635 4.137 1
1 643 . 5 1 1 A 63 63 ILE H H 63 8.192 8.333 -0.141 1
1 644 . 5 1 1 A 63 63 ILE HA H 63 3.984 3.872 0.112 1
1 654 . 5 1 1 A 63 63 ILE C C 63 175.433 177.289 -1.856 1
1 655 . 5 1 1 A 63 63 ILE CA C 63 63.657 64.399 -0.742 1
1 656 . 5 1 1 A 63 63 ILE CB C 63 38.506 37.921 0.585 1
1 660 . 5 1 1 A 63 63 ILE N N 63 127.455 128.557 -1.102 1
1 661 . 5 1 1 A 64 64 ASN H H 64 9.181 7.991 1.190 1
1 662 . 5 1 1 A 64 64 ASN HA H 64 4.810 4.701 0.109 1
1 667 . 5 1 1 A 64 64 ASN C C 64 175.931 175.349 0.582 1
1 668 . 5 1 1 A 64 64 ASN CA C 64 55.617 52.233 3.384 1
1 669 . 5 1 1 A 64 64 ASN CB C 64 40.640 37.129 3.511 1
1 670 . 5 1 1 A 64 64 ASN N N 64 122.104 117.910 4.194 1
1 672 . 5 1 1 A 65 65 CYS H H 65 9.065 7.968 1.097 1
1 673 . 5 1 1 A 65 65 CYS HA H 65 4.979 4.532 0.447 1
1 676 . 5 1 1 A 65 65 CYS C C 65 176.291 174.826 1.465 1
1 677 . 5 1 1 A 65 65 CYS CA C 65 59.027 59.719 -0.692 1
1 678 . 5 1 1 A 65 65 CYS CB C 65 32.030 27.757 4.273 1
1 679 . 5 1 1 A 65 65 CYS N N 65 120.368 120.984 -0.616 1
1 680 . 5 1 1 A 66 66 GLU H H 66 7.281 8.304 -1.023 1
1 681 . 5 1 1 A 66 66 GLU HA H 66 4.046 4.199 -0.153 1
1 686 . 5 1 1 A 66 66 GLU C C 66 175.211 175.180 0.031 1
1 687 . 5 1 1 A 66 66 GLU CA C 66 58.591 57.760 0.831 1
1 688 . 5 1 1 A 66 66 GLU CB C 66 27.067 27.351 -0.284 1
1 690 . 5 1 1 A 66 66 GLU N N 66 115.012 116.545 -1.533 1
1 691 . 5 1 1 A 67 67 LYS H H 67 8.481 7.845 0.636 1
1 692 . 5 1 1 A 67 67 LYS HA H 67 4.326 4.340 -0.014 1
1 701 . 5 1 1 A 67 67 LYS C C 67 177.923 176.134 1.789 1
1 702 . 5 1 1 A 67 67 LYS CA C 67 57.628 56.468 1.160 1
1 703 . 5 1 1 A 67 67 LYS CB C 67 33.617 33.241 0.376 1
1 707 . 5 1 1 A 67 67 LYS N N 67 123.514 120.638 2.876 1
1 708 . 5 1 1 A 68 68 ILE H H 68 8.867 8.485 0.382 1
1 709 . 5 1 1 A 68 68 ILE HA H 68 4.976 4.530 0.446 1
1 719 . 5 1 1 A 68 68 ILE C C 68 175.018 175.140 -0.122 1
1 720 . 5 1 1 A 68 68 ILE CA C 68 60.919 60.692 0.227 1
1 721 . 5 1 1 A 68 68 ILE CB C 68 37.090 37.568 -0.478 1
1 725 . 5 1 1 A 68 68 ILE N N 68 133.478 127.031 6.447 1
1 726 . 5 1 1 A 69 69 GLN H H 69 9.269 8.561 0.708 1
1 727 . 5 1 1 A 69 69 GLN HA H 69 5.036 5.097 -0.061 1
1 732 . 5 1 1 A 69 69 GLN C C 69 173.607 174.800 -1.193 1
1 733 . 5 1 1 A 69 69 GLN CA C 69 53.419 54.204 -0.785 1
1 734 . 5 1 1 A 69 69 GLN CB C 69 34.997 32.130 2.867 1
1 736 . 5 1 1 A 69 69 GLN N N 69 125.104 123.953 1.151 1
1 737 . 5 1 1 A 70 70 HIS H H 70 8.829 9.011 -0.182 1
1 738 . 5 1 1 A 70 70 HIS HA H 70 4.865 4.765 0.100 1
1 741 . 5 1 1 A 70 70 HIS C C 70 174.852 175.342 -0.490 1
1 742 . 5 1 1 A 70 70 HIS CA C 70 56.304 56.730 -0.426 1
1 743 . 5 1 1 A 70 70 HIS CB C 70 30.050 30.561 -0.511 1
1 744 . 5 1 1 A 70 70 HIS N N 70 118.576 119.537 -0.961 1
1 745 . 5 1 1 A 71 71 ALA H H 71 7.768 8.459 -0.691 1
1 746 . 5 1 1 A 71 71 ALA HA H 71 3.977 4.576 -0.599 1
1 750 . 5 1 1 A 71 71 ALA C C 71 175.433 177.575 -2.142 1
1 751 . 5 1 1 A 71 71 ALA CA C 71 54.393 53.467 0.926 1
1 752 . 5 1 1 A 71 71 ALA CB C 71 18.000 19.446 -1.446 1
1 753 . 5 1 1 A 71 71 ALA N N 71 121.438 124.344 -2.906 1
1 754 . 5 1 1 A 72 72 GLN H H 72 7.227 8.779 -1.552 1
1 755 . 5 1 1 A 72 72 GLN HA H 72 4.371 4.474 -0.103 1
1 762 . 5 1 1 A 72 72 GLN C C 72 173.053 174.958 -1.905 1
1 763 . 5 1 1 A 72 72 GLN CA C 72 54.290 54.948 -0.658 1
1 764 . 5 1 1 A 72 72 GLN CB C 72 28.623 32.462 -3.839 1
1 766 . 5 1 1 A 72 72 GLN N N 72 115.858 122.285 -6.427 1
1 768 . 5 1 1 A 73 73 GLN H H 73 8.481 8.525 -0.044 1
1 769 . 5 1 1 A 73 73 GLN HA H 73 3.570 3.666 -0.096 1
1 776 . 5 1 1 A 73 73 GLN C C 73 174.243 174.810 -0.567 1
1 777 . 5 1 1 A 73 73 GLN CA C 73 60.206 57.280 2.926 1
1 778 . 5 1 1 A 73 73 GLN CB C 73 28.850 29.418 -0.568 1
1 780 . 5 1 1 A 73 73 GLN N N 73 116.433 122.274 -5.841 1
1 782 . 5 1 1 A 74 74 THR H H 74 7.211 7.364 -0.153 1
1 783 . 5 1 1 A 74 74 THR HA H 74 4.160 4.717 -0.557 1
1 788 . 5 1 1 A 74 74 THR C C 74 171.836 172.685 -0.849 1
1 789 . 5 1 1 A 74 74 THR CA C 74 59.072 60.291 -1.219 1
1 790 . 5 1 1 A 74 74 THR CB C 74 71.560 72.434 -0.874 1
1 792 . 5 1 1 A 74 74 THR N N 74 108.717 110.074 -1.357 1
1 793 . 5 1 1 A 75 75 CYS H H 75 7.676 8.332 -0.656 1
1 794 . 5 1 1 A 75 75 CYS HA H 75 4.158 4.353 -0.195 1
1 797 . 5 1 1 A 75 75 CYS C C 75 178.781 175.697 3.084 1
1 798 . 5 1 1 A 75 75 CYS CA C 75 58.661 58.738 -0.077 1
1 799 . 5 1 1 A 75 75 CYS CB C 75 30.840 28.230 2.610 1
1 800 . 5 1 1 A 75 75 CYS N N 75 123.108 124.516 -1.408 1
1 801 . 5 1 1 A 76 76 GLU H H 76 9.203 8.745 0.458 1
1 802 . 5 1 1 A 76 76 GLU HA H 76 4.187 4.018 0.169 1
1 807 . 5 1 1 A 76 76 GLU C C 76 175.488 178.760 -3.272 1
1 808 . 5 1 1 A 76 76 GLU CA C 76 57.306 58.865 -1.559 1
1 809 . 5 1 1 A 76 76 GLU CB C 76 29.347 29.120 0.227 1
1 811 . 5 1 1 A 76 76 GLU N N 76 129.817 127.365 2.452 1
1 812 . 5 1 1 A 77 77 GLU H H 77 9.496 7.741 1.755 1
1 813 . 5 1 1 A 77 77 GLU HA H 77 4.599 4.080 0.519 1
1 818 . 5 1 1 A 77 77 GLU C C 77 177.148 177.276 -0.128 1
1 819 . 5 1 1 A 77 77 GLU CA C 77 57.554 58.935 -1.381 1
1 820 . 5 1 1 A 77 77 GLU CB C 77 31.980 30.140 1.840 1
1 822 . 5 1 1 A 77 77 GLU N N 77 124.795 120.705 4.090 1
1 823 . 5 1 1 A 78 78 CYS H H 78 8.967 7.338 1.629 1
1 824 . 5 1 1 A 78 78 CYS HA H 78 5.073 4.613 0.460 1
1 827 . 5 1 1 A 78 78 CYS C C 78 176.374 175.191 1.183 1
1 828 . 5 1 1 A 78 78 CYS CA C 78 58.537 58.384 0.153 1
1 829 . 5 1 1 A 78 78 CYS CB C 78 31.597 29.234 2.363 1
1 830 . 5 1 1 A 78 78 CYS N N 78 119.692 115.223 4.469 1
1 831 . 5 1 1 A 79 79 SER H H 79 7.474 8.291 -0.817 1
1 832 . 5 1 1 A 79 79 SER HA H 79 4.113 4.089 0.024 1
1 835 . 5 1 1 A 79 79 SER C C 79 172.915 173.411 -0.496 1
1 836 . 5 1 1 A 79 79 SER CA C 79 60.440 59.318 1.122 1
1 837 . 5 1 1 A 79 79 SER CB C 79 61.421 61.031 0.390 1
1 838 . 5 1 1 A 79 79 SER N N 79 113.385 112.624 0.761 1
1 839 . 5 1 1 A 80 80 THR H H 80 7.907 7.887 0.020 1
1 840 . 5 1 1 A 80 80 THR HA H 80 3.913 4.249 -0.336 1
1 845 . 5 1 1 A 80 80 THR C C 80 172.306 173.851 -1.545 1
1 846 . 5 1 1 A 80 80 THR CA C 80 65.262 63.365 1.897 1
1 847 . 5 1 1 A 80 80 THR CB C 80 69.910 69.149 0.761 1
1 849 . 5 1 1 A 80 80 THR N N 80 120.005 115.853 4.152 1
1 850 . 5 1 1 A 81 81 LEU H H 81 8.556 8.594 -0.038 1
1 851 . 5 1 1 A 81 81 LEU HA H 81 4.172 4.555 -0.383 1
1 861 . 5 1 1 A 81 81 LEU C C 81 177.121 176.834 0.287 1
1 862 . 5 1 1 A 81 81 LEU CA C 81 54.996 54.824 0.172 1
1 863 . 5 1 1 A 81 81 LEU CB C 81 42.147 42.240 -0.093 1
1 867 . 5 1 1 A 81 81 LEU N N 81 128.272 128.856 -0.584 1
1 868 . 5 1 1 A 82 82 PHE H H 82 9.251 9.081 0.170 1
1 869 . 5 1 1 A 82 82 PHE HA H 82 4.576 4.398 0.178 1
1 874 . 5 1 1 A 82 82 PHE C C 82 177.785 176.078 1.707 1
1 875 . 5 1 1 A 82 82 PHE CA C 82 56.470 60.263 -3.793 1
1 876 . 5 1 1 A 82 82 PHE CB C 82 38.210 38.867 -0.657 1
1 878 . 5 1 1 A 82 82 PHE N N 82 129.268 126.310 2.958 1
1 879 . 5 1 1 A 83 83 GLY H H 83 7.047 7.373 -0.326 1
1 880 . 5 1 1 A 83 83 GLY HA2 H 83 4.783 4.180 0.603 1
1 881 . 5 1 1 A 83 83 GLY HA3 H 83 3.876 4.242 -0.366 1
1 882 . 5 1 1 A 83 83 GLY C C 83 171.642 174.621 -2.979 1
1 883 . 5 1 1 A 83 83 GLY CA C 83 45.826 46.180 -0.354 1
1 884 . 5 1 1 A 83 83 GLY N N 83 102.168 104.233 -2.065 1
1 885 . 5 1 1 A 84 84 GLU H H 84 8.444 8.849 -0.405 1
1 886 . 5 1 1 A 84 84 GLU HA H 84 4.111 4.182 -0.071 1
1 891 . 5 1 1 A 84 84 GLU C C 84 177.259 176.493 0.766 1
1 892 . 5 1 1 A 84 84 GLU CA C 84 59.438 59.027 0.411 1
1 893 . 5 1 1 A 84 84 GLU CB C 84 30.670 30.569 0.101 1
1 895 . 5 1 1 A 84 84 GLU N N 84 127.546 120.729 6.817 1
1 896 . 5 1 1 A 85 85 TYR H H 85 9.344 8.053 1.291 1
1 897 . 5 1 1 A 85 85 TYR HA H 85 4.599 4.897 -0.298 1
1 902 . 5 1 1 A 85 85 TYR C C 85 173.302 174.242 -0.940 1
1 903 . 5 1 1 A 85 85 TYR CA C 85 57.261 58.266 -1.005 1
1 904 . 5 1 1 A 85 85 TYR CB C 85 40.850 40.110 0.740 1
1 906 . 5 1 1 A 85 85 TYR N N 85 118.936 120.601 -1.665 1
1 907 . 5 1 1 A 86 86 TYR H H 86 7.323 8.508 -1.185 1
1 908 . 5 1 1 A 86 86 TYR HA H 86 5.298 6.016 -0.718 1
1 911 . 5 1 1 A 86 86 TYR C C 86 172.804 173.458 -0.654 1
1 912 . 5 1 1 A 86 86 TYR CA C 86 54.041 55.611 -1.570 1
1 913 . 5 1 1 A 86 86 TYR CB C 86 40.987 42.156 -1.169 1
1 914 . 5 1 1 A 86 86 TYR N N 86 124.965 121.971 2.994 1
1 915 . 5 1 1 A 87 87 CYS H H 87 7.046 8.659 -1.613 1
1 916 . 5 1 1 A 87 87 CYS HA H 87 3.842 4.730 -0.888 1
1 919 . 5 1 1 A 87 87 CYS C C 87 174.243 174.220 0.023 1
1 920 . 5 1 1 A 87 87 CYS CA C 87 56.377 58.774 -2.397 1
1 921 . 5 1 1 A 87 87 CYS CB C 87 33.230 30.097 3.133 1
1 922 . 5 1 1 A 87 87 CYS N N 87 128.735 118.508 10.227 1
1 923 . 5 1 1 A 88 88 ASP H H 88 8.002 8.950 -0.948 1
1 924 . 5 1 1 A 88 88 ASP HA H 88 3.761 4.185 -0.424 1
1 927 . 5 1 1 A 88 88 ASP C C 88 173.579 177.524 -3.945 1
1 928 . 5 1 1 A 88 88 ASP CA C 88 53.958 56.238 -2.280 1
1 929 . 5 1 1 A 88 88 ASP CB C 88 41.240 40.635 0.605 1
1 930 . 5 1 1 A 88 88 ASP N N 88 127.013 127.100 -0.087 1
1 931 . 5 1 1 A 89 89 ILE H H 89 7.972 7.805 0.167 1
1 932 . 5 1 1 A 89 89 ILE HA H 89 3.660 3.500 0.160 1
1 942 . 5 1 1 A 89 89 ILE C C 89 177.259 176.670 0.589 1
1 943 . 5 1 1 A 89 89 ILE CA C 89 63.107 64.966 -1.859 1
1 944 . 5 1 1 A 89 89 ILE CB C 89 39.430 38.013 1.417 1
1 948 . 5 1 1 A 89 89 ILE N N 89 120.357 119.555 0.802 1
1 949 . 5 1 1 A 90 90 CYS H H 90 8.554 7.635 0.919 1
1 950 . 5 1 1 A 90 90 CYS HA H 90 3.677 4.180 -0.503 1
1 953 . 5 1 1 A 90 90 CYS C C 90 175.128 173.631 1.497 1
1 954 . 5 1 1 A 90 90 CYS CA C 90 60.791 58.504 2.287 1
1 955 . 5 1 1 A 90 90 CYS CB C 90 30.427 27.792 2.635 1
1 956 . 5 1 1 A 90 90 CYS N N 90 119.564 116.426 3.138 1
1 957 . 5 1 1 A 91 91 HIS H H 91 7.364 7.631 -0.267 1
1 958 . 5 1 1 A 91 91 HIS HA H 91 3.512 3.763 -0.251 1
1 963 . 5 1 1 A 91 91 HIS C C 91 170.590 173.078 -2.488 1
1 964 . 5 1 1 A 91 91 HIS CA C 91 58.739 56.008 2.731 1
1 965 . 5 1 1 A 91 91 HIS CB C 91 24.810 26.476 -1.666 1
1 968 . 5 1 1 A 91 91 HIS N N 91 111.440 116.015 -4.575 1
1 969 . 5 1 1 A 92 92 LEU H H 92 6.214 7.212 -0.998 1
1 970 . 5 1 1 A 92 92 LEU HA H 92 4.191 4.682 -0.491 1
1 980 . 5 1 1 A 92 92 LEU C C 92 173.911 175.172 -1.261 1
1 981 . 5 1 1 A 92 92 LEU CA C 92 53.717 52.867 0.850 1
1 982 . 5 1 1 A 92 92 LEU CB C 92 45.360 44.537 0.823 1
1 986 . 5 1 1 A 92 92 LEU N N 92 115.684 115.069 0.615 1
1 987 . 5 1 1 A 93 93 PHE H H 93 6.669 8.583 -1.914 1
1 988 . 5 1 1 A 93 93 PHE HA H 93 5.622 5.237 0.385 1
1 995 . 5 1 1 A 93 93 PHE C C 93 175.765 174.632 1.133 1
1 996 . 5 1 1 A 93 93 PHE CA C 93 55.387 56.564 -1.177 1
1 997 . 5 1 1 A 93 93 PHE CB C 93 42.700 41.067 1.633 1
1 1000 . 5 1 1 A 93 93 PHE N N 93 121.535 120.713 0.822 1
1 1001 . 5 1 1 A 94 94 ASP H H 94 9.209 9.026 0.183 1
1 1002 . 5 1 1 A 94 94 ASP HA H 94 5.819 5.345 0.474 1
1 1005 . 5 1 1 A 94 94 ASP C C 94 175.654 175.340 0.314 1
1 1006 . 5 1 1 A 94 94 ASP CA C 94 53.330 52.952 0.378 1
1 1007 . 5 1 1 A 94 94 ASP CB C 94 44.720 44.514 0.206 1
1 1008 . 5 1 1 A 94 94 ASP N N 94 123.504 121.049 2.455 1
1 1009 . 5 1 1 A 95 95 LYS H H 95 9.043 8.536 0.507 1
1 1010 . 5 1 1 A 95 95 LYS HA H 95 4.527 4.434 0.093 1
1 1019 . 5 1 1 A 95 95 LYS C C 95 174.879 176.482 -1.603 1
1 1020 . 5 1 1 A 95 95 LYS CA C 95 56.620 57.289 -0.669 1
1 1021 . 5 1 1 A 95 95 LYS CB C 95 33.720 33.207 0.513 1
1 1025 . 5 1 1 A 95 95 LYS N N 95 120.380 120.682 -0.302 1
1 1026 . 5 1 1 A 96 96 ASP H H 96 8.999 8.722 0.277 1
1 1027 . 5 1 1 A 96 96 ASP HA H 96 4.724 4.799 -0.075 1
1 1030 . 5 1 1 A 96 96 ASP C C 96 176.401 175.455 0.946 1
1 1031 . 5 1 1 A 96 96 ASP CA C 96 56.147 53.648 2.499 1
1 1032 . 5 1 1 A 96 96 ASP CB C 96 40.790 41.030 -0.240 1
1 1033 . 5 1 1 A 96 96 ASP N N 96 120.784 123.303 -2.519 1
1 1034 . 5 1 1 A 97 97 LYS H H 97 9.382 8.704 0.678 1
1 1035 . 5 1 1 A 97 97 LYS HA H 97 4.473 4.658 -0.185 1
1 1044 . 5 1 1 A 97 97 LYS C C 97 175.903 175.733 0.170 1
1 1045 . 5 1 1 A 97 97 LYS CA C 97 54.771 55.341 -0.570 1
1 1046 . 5 1 1 A 97 97 LYS CB C 97 33.270 32.006 1.264 1
1 1050 . 5 1 1 A 97 97 LYS N N 97 131.617 126.612 5.005 1
1 1051 . 5 1 1 A 98 98 LYS H H 98 8.940 7.738 1.202 1
1 1052 . 5 1 1 A 98 98 LYS HA H 98 4.118 3.915 0.203 1
1 1061 . 5 1 1 A 98 98 LYS C C 98 177.065 175.212 1.853 1
1 1062 . 5 1 1 A 98 98 LYS CA C 98 56.297 57.486 -1.189 1
1 1063 . 5 1 1 A 98 98 LYS CB C 98 28.467 29.186 -0.719 1
1 1067 . 5 1 1 A 98 98 LYS N N 98 115.034 113.636 1.398 1
1 1068 . 5 1 1 A 99 99 GLN H H 99 9.266 7.457 1.809 1
1 1069 . 5 1 1 A 99 99 GLN HA H 99 4.460 4.294 0.166 1
1 1074 . 5 1 1 A 99 99 GLN C C 99 174.990 175.055 -0.065 1
1 1075 . 5 1 1 A 99 99 GLN CA C 99 57.563 55.802 1.761 1
1 1076 . 5 1 1 A 99 99 GLN CB C 99 27.280 29.805 -2.525 1
1 1078 . 5 1 1 A 99 99 GLN N N 99 117.717 118.903 -1.186 1
1 1079 . 5 1 1 A 100 100 TYR H H 100 8.402 8.722 -0.320 1
1 1080 . 5 1 1 A 100 100 TYR HA H 100 4.935 5.350 -0.415 1
1 1087 . 5 1 1 A 100 100 TYR C C 100 171.504 172.782 -1.278 1
1 1088 . 5 1 1 A 100 100 TYR CA C 100 55.786 55.779 0.007 1
1 1089 . 5 1 1 A 100 100 TYR CB C 100 41.090 41.600 -0.510 1
1 1092 . 5 1 1 A 100 100 TYR N N 100 115.081 120.938 -5.857 1
1 1093 . 5 1 1 A 101 101 HIS H H 101 8.829 9.109 -0.280 1
1 1094 . 5 1 1 A 101 101 HIS HA H 101 4.525 4.878 -0.353 1
1 1099 . 5 1 1 A 101 101 HIS C C 101 174.935 173.884 1.051 1
1 1100 . 5 1 1 A 101 101 HIS CA C 101 56.327 54.937 1.390 1
1 1101 . 5 1 1 A 101 101 HIS CB C 101 31.020 30.074 0.946 1
1 1104 . 5 1 1 A 101 101 HIS N N 101 120.894 122.920 -2.026 1
1 1105 . 5 1 1 A 102 102 CYS H H 102 7.427 7.955 -0.528 1
1 1106 . 5 1 1 A 102 102 CYS HA H 102 4.561 4.387 0.174 1
1 1109 . 5 1 1 A 102 102 CYS C C 102 175.765 175.433 0.332 1
1 1110 . 5 1 1 A 102 102 CYS CA C 102 57.707 58.785 -1.078 1
1 1111 . 5 1 1 A 102 102 CYS CB C 102 29.130 27.990 1.140 1
1 1112 . 5 1 1 A 102 102 CYS N N 102 131.256 126.581 4.675 1
1 1113 . 5 1 1 A 103 103 GLU H H 103 9.497 8.724 0.773 1
1 1114 . 5 1 1 A 103 103 GLU HA H 103 4.003 4.055 -0.052 1
1 1119 . 5 1 1 A 103 103 GLU C C 103 176.540 178.530 -1.990 1
1 1120 . 5 1 1 A 103 103 GLU CA C 103 58.796 59.384 -0.588 1
1 1121 . 5 1 1 A 103 103 GLU CB C 103 29.280 29.429 -0.149 1
1 1123 . 5 1 1 A 103 103 GLU N N 103 129.829 127.362 2.467 1
1 1124 . 5 1 1 A 104 104 ASN H H 104 7.832 7.884 -0.052 1
1 1125 . 5 1 1 A 104 104 ASN HA H 104 4.457 4.409 0.048 1
1 1130 . 5 1 1 A 104 104 ASN C C 104 176.401 177.805 -1.404 1
1 1131 . 5 1 1 A 104 104 ASN CA C 104 56.053 56.073 -0.020 1
1 1132 . 5 1 1 A 104 104 ASN CB C 104 38.400 38.113 0.287 1
1 1133 . 5 1 1 A 104 104 ASN N N 104 117.703 117.506 0.197 1
1 1135 . 5 1 1 A 105 105 CYS H H 105 9.415 7.237 2.178 1
1 1136 . 5 1 1 A 105 105 CYS HA H 105 4.137 4.440 -0.303 1
1 1139 . 5 1 1 A 105 105 CYS C C 105 176.844 175.263 1.581 1
1 1140 . 5 1 1 A 105 105 CYS CA C 105 64.328 59.181 5.147 1
1 1141 . 5 1 1 A 105 105 CYS CB C 105 30.350 27.832 2.518 1
1 1142 . 5 1 1 A 105 105 CYS N N 105 124.939 115.006 9.933 1
1 1143 . 5 1 1 A 106 106 GLY H H 106 8.145 8.889 -0.744 1
1 1144 . 5 1 1 A 106 106 GLY HA2 H 106 3.980 3.872 0.108 1
1 1145 . 5 1 1 A 106 106 GLY HA3 H 106 3.502 3.892 -0.390 1
1 1146 . 5 1 1 A 106 106 GLY C C 106 172.500 173.460 -0.960 1
1 1147 . 5 1 1 A 106 106 GLY CA C 106 44.968 45.850 -0.882 1
1 1148 . 5 1 1 A 106 106 GLY N N 106 106.090 109.590 -3.500 1
1 1149 . 5 1 1 A 107 107 ILE H H 107 6.465 6.783 -0.318 1
1 1150 . 5 1 1 A 107 107 ILE HA H 107 4.878 4.893 -0.015 1
1 1160 . 5 1 1 A 107 107 ILE C C 107 174.824 174.031 0.793 1
1 1161 . 5 1 1 A 107 107 ILE CA C 107 58.226 58.546 -0.320 1
1 1162 . 5 1 1 A 107 107 ILE CB C 107 44.460 42.360 2.100 1
1 1166 . 5 1 1 A 107 107 ILE N N 107 107.914 114.888 -6.974 1
1 1167 . 5 1 1 A 108 108 CYS H H 108 7.041 9.166 -2.125 1
1 1168 . 5 1 1 A 108 108 CYS HA H 108 5.018 5.278 -0.260 1
1 1171 . 5 1 1 A 108 108 CYS C C 108 175.461 173.140 2.321 1
1 1172 . 5 1 1 A 108 108 CYS CA C 108 62.097 56.962 5.135 1
1 1173 . 5 1 1 A 108 108 CYS CB C 108 31.353 30.795 0.558 1
1 1174 . 5 1 1 A 108 108 CYS N N 108 122.441 121.035 1.406 1
1 1175 . 5 1 1 A 109 109 ARG H H 109 8.561 8.480 0.081 1
1 1176 . 5 1 1 A 109 109 ARG HA H 109 4.239 4.870 -0.631 1
1 1183 . 5 1 1 A 109 109 ARG C C 109 174.271 175.717 -1.446 1
1 1184 . 5 1 1 A 109 109 ARG CA C 109 52.962 54.027 -1.065 1
1 1185 . 5 1 1 A 109 109 ARG CB C 109 33.903 34.363 -0.460 1
1 1188 . 5 1 1 A 109 109 ARG N N 109 121.163 121.804 -0.641 1
1 1189 . 5 1 1 A 110 110 ILE H H 110 7.847 8.532 -0.685 1
1 1190 . 5 1 1 A 110 110 ILE HA H 110 3.531 4.180 -0.649 1
1 1200 . 5 1 1 A 110 110 ILE C C 110 175.405 175.555 -0.150 1
1 1201 . 5 1 1 A 110 110 ILE CA C 110 62.201 61.341 0.860 1
1 1202 . 5 1 1 A 110 110 ILE CB C 110 36.860 36.760 0.100 1
1 1206 . 5 1 1 A 110 110 ILE N N 110 118.955 121.377 -2.422 1
1 1207 . 5 1 1 A 111 111 GLY H H 111 6.928 8.372 -1.444 1
1 1208 . 5 1 1 A 111 111 GLY HA2 H 111 4.564 4.223 0.341 1
1 1209 . 5 1 1 A 111 111 GLY HA3 H 111 4.135 4.396 -0.261 1
1 1210 . 5 1 1 A 111 111 GLY CA C 111 43.068 45.377 -2.309 1
1 1211 . 5 1 1 A 111 111 GLY N N 111 113.782 114.620 -0.838 1
1 1212 . 5 1 1 A 112 112 PRO HA H 112 4.990 4.799 0.191 1
1 1219 . 5 1 1 A 112 112 PRO C C 112 177.342 177.717 -0.375 1
1 1220 . 5 1 1 A 112 112 PRO CA C 112 62.920 63.129 -0.209 1
1 1221 . 5 1 1 A 112 112 PRO CB C 112 34.807 31.798 3.009 1
1 1224 . 5 1 1 A 113 113 LYS H H 113 8.989 8.530 0.459 1
1 1225 . 5 1 1 A 113 113 LYS HA H 113 3.144 3.541 -0.397 1
1 1234 . 5 1 1 A 113 113 LYS C C 113 177.536 177.909 -0.373 1
1 1235 . 5 1 1 A 113 113 LYS CA C 113 59.883 58.599 1.284 1
1 1236 . 5 1 1 A 113 113 LYS CB C 113 32.260 31.596 0.664 1
1 1240 . 5 1 1 A 113 113 LYS N N 113 123.545 123.157 0.388 1
1 1241 . 5 1 1 A 114 114 GLU H H 114 9.080 8.918 0.162 1
1 1242 . 5 1 1 A 114 114 GLU HA H 114 4.199 4.036 0.163 1
1 1247 . 5 1 1 A 114 114 GLU C C 114 176.374 177.425 -1.051 1
1 1248 . 5 1 1 A 114 114 GLU CA C 114 58.733 59.524 -0.791 1
1 1249 . 5 1 1 A 114 114 GLU CB C 114 28.077 29.036 -0.959 1
1 1251 . 5 1 1 A 114 114 GLU N N 114 114.832 120.480 -5.648 1
1 1252 . 5 1 1 A 115 115 ASP H H 115 7.799 7.706 0.093 1
1 1253 . 5 1 1 A 115 115 ASP HA H 115 4.642 4.603 0.039 1
1 1256 . 5 1 1 A 115 115 ASP C C 115 176.374 175.150 1.224 1
1 1257 . 5 1 1 A 115 115 ASP CA C 115 54.470 54.710 -0.240 1
1 1258 . 5 1 1 A 115 115 ASP CB C 115 40.850 41.516 -0.666 1
1 1259 . 5 1 1 A 115 115 ASP N N 115 118.858 117.798 1.060 1
1 1260 . 5 1 1 A 116 116 PHE H H 116 8.063 7.260 0.803 1
1 1261 . 5 1 1 A 116 116 PHE HA H 116 5.239 5.489 -0.250 1
1 1264 . 5 1 1 A 116 116 PHE C C 116 173.413 175.203 -1.790 1
1 1265 . 5 1 1 A 116 116 PHE CA C 116 57.708 56.565 1.143 1
1 1266 . 5 1 1 A 116 116 PHE CB C 116 44.557 43.195 1.362 1
1 1267 . 5 1 1 A 116 116 PHE N N 116 120.567 117.620 2.947 1
1 1268 . 5 1 1 A 117 117 PHE H H 117 9.439 8.950 0.489 1
1 1269 . 5 1 1 A 117 117 PHE HA H 117 5.091 5.676 -0.585 1
1 1277 . 5 1 1 A 117 117 PHE C C 117 171.614 172.637 -1.023 1
1 1278 . 5 1 1 A 117 117 PHE CA C 117 55.311 55.527 -0.216 1
1 1279 . 5 1 1 A 117 117 PHE CB C 117 41.887 42.618 -0.731 1
1 1283 . 5 1 1 A 117 117 PHE N N 117 118.040 118.693 -0.653 1
1 1284 . 5 1 1 A 118 118 HIS H H 118 8.779 9.014 -0.235 1
1 1285 . 5 1 1 A 118 118 HIS HA H 118 4.836 4.926 -0.090 1
1 1289 . 5 1 1 A 118 118 HIS C C 118 174.879 173.986 0.893 1
1 1290 . 5 1 1 A 118 118 HIS CA C 118 55.322 56.242 -0.920 1
1 1291 . 5 1 1 A 118 118 HIS CB C 118 30.950 31.277 -0.327 1
1 1293 . 5 1 1 A 118 118 HIS N N 118 121.208 121.884 -0.676 1
1 1294 . 5 1 1 A 119 119 CYS H H 119 8.123 7.617 0.506 1
1 1295 . 5 1 1 A 119 119 CYS HA H 119 4.529 4.889 -0.360 1
1 1298 . 5 1 1 A 119 119 CYS C C 119 176.567 175.552 1.015 1
1 1299 . 5 1 1 A 119 119 CYS CA C 119 58.957 57.318 1.639 1
1 1300 . 5 1 1 A 119 119 CYS CB C 119 30.090 29.836 0.254 1
1 1301 . 5 1 1 A 119 119 CYS N N 119 131.659 126.504 5.155 1
1 1302 . 5 1 1 A 120 120 LEU H H 120 8.970 8.393 0.577 1
1 1303 . 5 1 1 A 120 120 LEU N N 120 130.361 127.799 2.562 1
1 1304 . 5 1 1 A 121 121 LYS HA H 121 4.299 4.766 -0.467 1
1 1313 . 5 1 1 A 121 121 LYS CA C 121 58.727 54.922 3.805 1
1 1314 . 5 1 1 A 121 121 LYS CB C 121 33.210 35.336 -2.126 1
1 1318 . 5 1 1 A 123 123 ASN HA H 123 4.438 4.922 -0.484 1
1 1323 . 5 1 1 A 123 123 ASN C C 123 172.444 174.893 -2.449 1
1 1324 . 5 1 1 A 123 123 ASN CA C 123 53.448 53.541 -0.093 1
1 1325 . 5 1 1 A 123 123 ASN CB C 123 37.130 38.660 -1.530 1
1 1327 . 5 1 1 A 124 124 LEU H H 124 6.596 7.378 -0.782 1
1 1328 . 5 1 1 A 124 124 LEU HA H 124 4.576 4.342 0.234 1
1 1338 . 5 1 1 A 124 124 LEU C C 124 175.903 175.734 0.169 1
1 1339 . 5 1 1 A 124 124 LEU CA C 124 54.043 54.879 -0.836 1
1 1340 . 5 1 1 A 124 124 LEU CB C 124 45.837 43.246 2.591 1
1 1344 . 5 1 1 A 124 124 LEU N N 124 115.443 121.112 -5.669 1
1 1345 . 5 1 1 A 125 125 CYS H H 125 6.342 8.726 -2.384 1
1 1346 . 5 1 1 A 125 125 CYS HA H 125 5.033 4.802 0.231 1
1 1349 . 5 1 1 A 125 125 CYS C C 125 175.101 174.773 0.328 1
1 1350 . 5 1 1 A 125 125 CYS CA C 125 62.046 57.286 4.760 1
1 1351 . 5 1 1 A 125 125 CYS CB C 125 30.840 27.758 3.082 1
1 1352 . 5 1 1 A 125 125 CYS N N 125 118.685 125.809 -7.124 1
1 1353 . 5 1 1 A 126 126 LEU H H 126 8.894 8.139 0.755 1
1 1354 . 5 1 1 A 126 126 LEU HA H 126 4.565 4.232 0.333 1
1 1364 . 5 1 1 A 126 126 LEU C C 126 174.879 177.522 -2.643 1
1 1365 . 5 1 1 A 126 126 LEU CA C 126 52.751 54.241 -1.490 1
1 1366 . 5 1 1 A 126 126 LEU CB C 126 46.090 41.864 4.226 1
1 1370 . 5 1 1 A 126 126 LEU N N 126 124.501 125.923 -1.422 1
1 1371 . 5 1 1 A 127 127 ALA H H 127 8.378 8.802 -0.424 1
1 1372 . 5 1 1 A 127 127 ALA HA H 127 3.957 4.253 -0.296 1
1 1376 . 5 1 1 A 127 127 ALA C C 127 179.085 178.390 0.695 1
1 1377 . 5 1 1 A 127 127 ALA CA C 127 52.554 52.016 0.538 1
1 1378 . 5 1 1 A 127 127 ALA CB C 127 18.527 19.453 -0.926 1
1 1379 . 5 1 1 A 127 127 ALA N N 127 123.011 124.703 -1.692 1
1 1380 . 5 1 1 A 128 128 MET H H 128 8.237 8.614 -0.377 1
1 1385 . 5 1 1 A 128 128 MET N N 128 120.642 121.257 -0.615 1
1 1386 . 5 1 1 A 129 129 ASN HA H 129 4.502 4.614 -0.112 1
1 1389 . 5 1 1 A 129 129 ASN C C 129 175.931 177.939 -2.008 1
1 1390 . 5 1 1 A 129 129 ASN CA C 129 55.064 56.193 -1.129 1
1 1391 . 5 1 1 A 129 129 ASN CB C 129 36.920 38.556 -1.636 1
1 1392 . 5 1 1 A 130 130 LEU H H 130 8.211 7.880 0.331 1
1 1393 . 5 1 1 A 130 130 LEU HA H 130 4.489 4.066 0.423 1
1 1403 . 5 1 1 A 130 130 LEU C C 130 178.836 176.787 2.049 1
1 1404 . 5 1 1 A 130 130 LEU CA C 130 54.653 57.553 -2.900 1
1 1405 . 5 1 1 A 130 130 LEU CB C 130 41.887 41.886 0.001 1
1 1409 . 5 1 1 A 130 130 LEU N N 130 118.563 121.275 -2.712 1
1 1410 . 5 1 1 A 131 131 GLN H H 131 7.953 7.955 -0.002 1
1 1411 . 5 1 1 A 131 131 GLN HA H 131 3.729 4.344 -0.615 1
1 1418 . 5 1 1 A 131 131 GLN CA C 131 59.310 58.125 1.185 1
1 1419 . 5 1 1 A 131 131 GLN CB C 131 28.340 28.311 0.029 1
1 1421 . 5 1 1 A 131 131 GLN N N 131 123.929 117.947 5.982 1
1 1423 . 5 1 1 A 132 132 GLY HA2 H 132 4.034 4.176 -0.142 1
1 1424 . 5 1 1 A 132 132 GLY HA3 H 132 3.865 4.294 -0.429 1
1 1425 . 5 1 1 A 132 132 GLY C C 132 174.547 173.840 0.707 1
1 1426 . 5 1 1 A 132 132 GLY CA C 132 45.902 45.619 0.283 1
1 1427 . 5 1 1 A 133 133 ARG H H 133 7.735 7.436 0.299 1
1 1428 . 5 1 1 A 133 133 ARG HA H 133 4.611 4.503 0.108 1
1 1435 . 5 1 1 A 133 133 ARG C C 133 175.461 174.716 0.745 1
1 1436 . 5 1 1 A 133 133 ARG CA C 133 54.987 55.344 -0.357 1
1 1437 . 5 1 1 A 133 133 ARG CB C 133 31.470 28.711 2.759 1
1 1440 . 5 1 1 A 133 133 ARG N N 133 118.194 120.398 -2.204 1
1 1441 . 5 1 1 A 134 134 HIS H H 134 7.803 8.076 -0.273 1
1 1444 . 5 1 1 A 134 134 HIS N N 134 118.700 116.982 1.718 1
1 1445 . 5 1 1 A 135 135 LYS HA H 135 4.331 4.345 -0.014 1
1 1454 . 5 1 1 A 135 135 LYS C C 135 174.852 176.167 -1.315 1
1 1455 . 5 1 1 A 135 135 LYS CA C 135 55.390 55.626 -0.236 1
1 1456 . 5 1 1 A 135 135 LYS CB C 135 32.970 30.931 2.039 1
1 1460 . 5 1 1 A 136 136 CYS H H 136 7.801 8.111 -0.310 1
1 1461 . 5 1 1 A 136 136 CYS HA H 136 4.113 4.780 -0.667 1
1 1464 . 5 1 1 A 136 136 CYS C C 136 174.879 174.149 0.730 1
1 1465 . 5 1 1 A 136 136 CYS CA C 136 60.028 58.499 1.529 1
1 1466 . 5 1 1 A 136 136 CYS CB C 136 30.350 29.124 1.226 1
1 1467 . 5 1 1 A 136 136 CYS N N 136 126.055 124.329 1.726 1
1 10 . 6 1 1 A 2 2 ALA H H 2 8.220 7.466 0.754 1
1 11 . 6 1 1 A 2 2 ALA HA H 2 4.321 4.505 -0.184 1
1 15 . 6 1 1 A 2 2 ALA C C 2 177.564 176.115 1.449 1
1 16 . 6 1 1 A 2 2 ALA CA C 2 52.383 51.006 1.377 1
1 17 . 6 1 1 A 2 2 ALA CB C 2 19.290 19.194 0.096 1
1 18 . 6 1 1 A 2 2 ALA N N 2 125.223 123.806 1.417 1
1 19 . 6 1 1 A 3 3 ALA H H 3 8.246 8.392 -0.146 1
1 20 . 6 1 1 A 3 3 ALA N N 3 123.250 127.101 -3.851 1
1 21 . 6 1 1 A 5 5 ALA HA H 5 4.415 5.130 -0.715 1
1 25 . 6 1 1 A 5 5 ALA C C 5 177.481 176.004 1.477 1
1 26 . 6 1 1 A 5 5 ALA CA C 5 52.423 51.372 1.051 1
1 27 . 6 1 1 A 5 5 ALA CB C 5 19.420 22.710 -3.290 1
1 28 . 6 1 1 A 6 6 ARG H H 6 8.239 8.890 -0.651 1
1 29 . 6 1 1 A 6 6 ARG HA H 6 4.371 4.931 -0.560 1
1 36 . 6 1 1 A 6 6 ARG C C 6 176.180 175.130 1.050 1
1 37 . 6 1 1 A 6 6 ARG CA C 6 56.353 54.409 1.944 1
1 38 . 6 1 1 A 6 6 ARG CB C 6 31.170 31.896 -0.726 1
1 41 . 6 1 1 A 6 6 ARG N N 6 120.436 123.295 -2.859 1
1 42 . 6 1 1 A 7 7 GLU H H 7 8.535 8.983 -0.448 1
1 43 . 6 1 1 A 7 7 GLU HA H 7 4.335 5.015 -0.680 1
1 48 . 6 1 1 A 7 7 GLU C C 7 176.346 175.283 1.063 1
1 49 . 6 1 1 A 7 7 GLU CA C 7 56.740 55.113 1.627 1
1 50 . 6 1 1 A 7 7 GLU CB C 7 30.390 31.311 -0.921 1
1 52 . 6 1 1 A 7 7 GLU N N 7 122.189 123.864 -1.675 1
1 53 . 6 1 1 A 8 8 ASP H H 8 8.347 8.825 -0.478 1
1 54 . 6 1 1 A 8 8 ASP N N 8 121.112 123.995 -2.883 1
1 55 . 6 1 1 A 9 9 GLY HA2 H 9 3.975 4.193 -0.218 1
1 56 . 6 1 1 A 9 9 GLY HA3 H 9 3.975 4.193 -0.218 1
1 57 . 6 1 1 A 9 9 GLY C C 9 174.243 172.621 1.622 1
1 58 . 6 1 1 A 9 9 GLY CA C 9 45.933 45.760 0.173 1
1 59 . 6 1 1 A 10 10 ALA H H 10 8.111 8.808 -0.697 1
1 60 . 6 1 1 A 10 10 ALA N N 10 123.721 122.966 0.755 1
1 61 . 6 1 1 A 12 12 GLY HA2 H 12 3.992 4.096 -0.104 1
1 62 . 6 1 1 A 12 12 GLY HA3 H 12 3.992 4.096 -0.104 1
1 63 . 6 1 1 A 12 12 GLY C C 12 173.883 172.809 1.074 1
1 64 . 6 1 1 A 12 12 GLY CA C 12 45.381 45.070 0.311 1
1 65 . 6 1 1 A 13 13 GLU H H 13 8.224 8.867 -0.643 1
1 66 . 6 1 1 A 13 13 GLU HA H 13 4.367 5.040 -0.673 1
1 71 . 6 1 1 A 13 13 GLU C C 13 176.125 175.771 0.354 1
1 72 . 6 1 1 A 13 13 GLU CA C 13 56.349 55.086 1.263 1
1 73 . 6 1 1 A 13 13 GLU CB C 13 29.560 32.952 -3.392 1
1 75 . 6 1 1 A 13 13 GLU N N 13 120.148 125.316 -5.168 1
1 76 . 6 1 1 A 14 14 GLU H H 14 8.508 8.752 -0.244 1
1 77 . 6 1 1 A 14 14 GLU HA H 14 4.302 5.006 -0.704 1
1 82 . 6 1 1 A 14 14 GLU C C 14 176.623 174.827 1.796 1
1 83 . 6 1 1 A 14 14 GLU CA C 14 56.497 55.683 0.814 1
1 84 . 6 1 1 A 14 14 GLU CB C 14 30.110 33.032 -2.922 1
1 86 . 6 1 1 A 14 14 GLU N N 14 122.160 123.414 -1.254 1
1 87 . 6 1 1 A 15 15 ARG H H 15 8.356 8.928 -0.572 1
1 88 . 6 1 1 A 15 15 ARG HA H 15 4.366 5.096 -0.730 1
1 95 . 6 1 1 A 15 15 ARG C C 15 176.844 174.686 2.158 1
1 96 . 6 1 1 A 15 15 ARG CA C 15 56.010 54.350 1.660 1
1 97 . 6 1 1 A 15 15 ARG CB C 15 30.890 33.074 -2.184 1
1 100 . 6 1 1 A 15 15 ARG N N 15 121.945 124.415 -2.470 1
1 101 . 6 1 1 A 16 16 GLY H H 16 8.414 8.400 0.014 1
1 102 . 6 1 1 A 16 16 GLY HA2 H 16 4.022 4.367 -0.345 1
1 103 . 6 1 1 A 16 16 GLY HA3 H 16 4.022 4.368 -0.346 1
1 104 . 6 1 1 A 16 16 GLY C C 16 174.326 172.519 1.807 1
1 105 . 6 1 1 A 16 16 GLY CA C 16 45.620 45.189 0.431 1
1 106 . 6 1 1 A 16 16 GLY N N 16 109.734 106.384 3.350 1
1 107 . 6 1 1 A 17 17 GLN H H 17 8.184 8.391 -0.207 1
1 108 . 6 1 1 A 17 17 GLN HA H 17 4.366 4.467 -0.101 1
1 113 . 6 1 1 A 17 17 GLN C C 17 175.544 175.481 0.063 1
1 114 . 6 1 1 A 17 17 GLN CA C 17 55.749 54.869 0.880 1
1 115 . 6 1 1 A 17 17 GLN CB C 17 29.367 29.559 -0.192 1
1 117 . 6 1 1 A 17 17 GLN N N 17 119.546 117.227 2.319 1
1 118 . 6 1 1 A 18 18 ARG H H 18 8.366 8.525 -0.159 1
1 119 . 6 1 1 A 18 18 ARG HA H 18 4.487 4.877 -0.390 1
1 126 . 6 1 1 A 18 18 ARG C C 18 176.042 175.557 0.485 1
1 127 . 6 1 1 A 18 18 ARG CA C 18 55.735 54.430 1.305 1
1 128 . 6 1 1 A 18 18 ARG CB C 18 31.170 33.549 -2.379 1
1 131 . 6 1 1 A 18 18 ARG N N 18 122.330 117.424 4.906 1
1 132 . 6 1 1 A 19 19 GLY H H 19 8.192 8.229 -0.037 1
1 133 . 6 1 1 A 19 19 GLY HA2 H 19 4.852 4.115 0.737 1
1 134 . 6 1 1 A 19 19 GLY HA3 H 19 3.894 4.132 -0.238 1
1 135 . 6 1 1 A 19 19 GLY C C 19 172.361 171.913 0.448 1
1 136 . 6 1 1 A 19 19 GLY CA C 19 45.580 44.682 0.898 1
1 137 . 6 1 1 A 19 19 GLY N N 19 109.658 108.148 1.510 1
1 138 . 6 1 1 A 20 20 CYS H H 20 8.843 8.159 0.684 1
1 139 . 6 1 1 A 20 20 CYS HA H 20 5.147 5.059 0.088 1
1 142 . 6 1 1 A 20 20 CYS C C 20 175.211 174.857 0.354 1
1 143 . 6 1 1 A 20 20 CYS CA C 20 56.712 58.185 -1.473 1
1 144 . 6 1 1 A 20 20 CYS CB C 20 33.530 30.687 2.843 1
1 145 . 6 1 1 A 20 20 CYS N N 20 120.185 118.435 1.750 1
1 146 . 6 1 1 A 21 21 GLU H H 21 8.981 8.959 0.022 1
1 147 . 6 1 1 A 21 21 GLU HA H 21 4.100 4.012 0.088 1
1 152 . 6 1 1 A 21 21 GLU C C 21 176.014 178.077 -2.063 1
1 153 . 6 1 1 A 21 21 GLU CA C 21 57.134 58.931 -1.797 1
1 154 . 6 1 1 A 21 21 GLU CB C 21 28.890 28.906 -0.016 1
1 156 . 6 1 1 A 21 21 GLU N N 21 116.078 124.172 -8.094 1
1 157 . 6 1 1 A 22 22 HIS H H 22 9.342 7.668 1.674 1
1 158 . 6 1 1 A 22 22 HIS HA H 22 4.210 4.197 0.013 1
1 161 . 6 1 1 A 22 22 HIS C C 22 175.128 174.704 0.424 1
1 162 . 6 1 1 A 22 22 HIS CA C 22 58.945 58.262 0.683 1
1 163 . 6 1 1 A 22 22 HIS CB C 22 33.160 30.707 2.453 1
1 164 . 6 1 1 A 22 22 HIS N N 22 122.296 117.947 4.349 1
1 165 . 6 1 1 A 23 23 TYR H H 23 7.931 7.833 0.098 1
1 166 . 6 1 1 A 23 23 TYR HA H 23 4.856 5.175 -0.319 1
1 171 . 6 1 1 A 23 23 TYR C C 23 173.108 174.431 -1.323 1
1 172 . 6 1 1 A 23 23 TYR CA C 23 57.852 56.196 1.656 1
1 173 . 6 1 1 A 23 23 TYR CB C 23 45.300 42.022 3.278 1
1 175 . 6 1 1 A 23 23 TYR N N 23 115.205 115.177 0.028 1
1 176 . 6 1 1 A 24 24 ASP H H 24 8.384 8.895 -0.511 1
1 177 . 6 1 1 A 24 24 ASP HA H 24 5.160 4.980 0.180 1
1 180 . 6 1 1 A 24 24 ASP C C 24 174.437 175.239 -0.802 1
1 181 . 6 1 1 A 24 24 ASP CA C 24 53.343 53.831 -0.488 1
1 182 . 6 1 1 A 24 24 ASP CB C 24 41.470 39.789 1.681 1
1 183 . 6 1 1 A 24 24 ASP N N 24 122.016 124.719 -2.703 1
1 184 . 6 1 1 A 25 25 ARG H H 25 7.313 8.408 -1.095 1
1 185 . 6 1 1 A 25 25 ARG HA H 25 5.331 5.390 -0.059 1
1 192 . 6 1 1 A 25 25 ARG C C 25 175.045 175.659 -0.614 1
1 193 . 6 1 1 A 25 25 ARG CA C 25 54.224 54.706 -0.482 1
1 194 . 6 1 1 A 25 25 ARG CB C 25 34.090 33.916 0.174 1
1 197 . 6 1 1 A 25 25 ARG N N 25 115.898 122.016 -6.118 1
1 198 . 6 1 1 A 26 26 GLY H H 26 9.387 8.782 0.605 1
1 199 . 6 1 1 A 26 26 GLY HA2 H 26 4.622 3.884 0.738 1
1 200 . 6 1 1 A 26 26 GLY HA3 H 26 3.788 4.017 -0.229 1
1 201 . 6 1 1 A 26 26 GLY C C 26 170.978 174.318 -3.340 1
1 202 . 6 1 1 A 26 26 GLY CA C 26 44.794 45.648 -0.854 1
1 203 . 6 1 1 A 26 26 GLY N N 26 105.653 108.149 -2.496 1
1 204 . 6 1 1 A 27 27 CYS H H 27 6.864 7.534 -0.670 1
1 205 . 6 1 1 A 27 27 CYS HA H 27 5.195 5.295 -0.100 1
1 208 . 6 1 1 A 27 27 CYS C C 27 171.144 173.238 -2.094 1
1 209 . 6 1 1 A 27 27 CYS CA C 27 52.349 57.151 -4.802 1
1 210 . 6 1 1 A 27 27 CYS CB C 27 30.997 30.932 0.065 1
1 211 . 6 1 1 A 27 27 CYS N N 27 110.921 117.645 -6.724 1
1 212 . 6 1 1 A 28 28 LEU H H 28 8.310 8.783 -0.473 1
1 213 . 6 1 1 A 28 28 LEU HA H 28 4.651 4.963 -0.312 1
1 223 . 6 1 1 A 28 28 LEU C C 28 176.827 176.567 0.260 1
1 224 . 6 1 1 A 28 28 LEU CA C 28 53.054 53.281 -0.227 1
1 225 . 6 1 1 A 28 28 LEU CB C 28 44.200 43.134 1.066 1
1 229 . 6 1 1 A 28 28 LEU N N 28 115.519 124.124 -8.605 1
1 230 . 6 1 1 A 29 29 LEU H H 29 8.800 8.907 -0.107 1
1 231 . 6 1 1 A 29 29 LEU HA H 29 4.313 4.370 -0.057 1
1 240 . 6 1 1 A 29 29 LEU C C 29 175.571 176.379 -0.808 1
1 241 . 6 1 1 A 29 29 LEU CA C 29 54.388 54.573 -0.185 1
1 242 . 6 1 1 A 29 29 LEU CB C 29 42.780 41.162 1.618 1
1 245 . 6 1 1 A 29 29 LEU N N 29 118.712 125.819 -7.107 1
1 246 . 6 1 1 A 30 30 LYS H H 30 8.009 8.433 -0.424 1
1 247 . 6 1 1 A 30 30 LYS HA H 30 4.592 4.749 -0.157 1
1 256 . 6 1 1 A 30 30 LYS C C 30 174.990 175.897 -0.907 1
1 257 . 6 1 1 A 30 30 LYS CA C 30 54.999 56.471 -1.472 1
1 258 . 6 1 1 A 30 30 LYS CB C 30 32.330 32.798 -0.468 1
1 262 . 6 1 1 A 30 30 LYS N N 30 122.310 126.092 -3.782 1
1 263 . 6 1 1 A 31 31 ALA H H 31 9.238 8.579 0.659 1
1 264 . 6 1 1 A 31 31 ALA HA H 31 4.477 4.370 0.107 1
1 268 . 6 1 1 A 31 31 ALA CA C 31 50.190 50.319 -0.129 1
1 269 . 6 1 1 A 31 31 ALA CB C 31 21.637 19.552 2.085 1
1 270 . 6 1 1 A 31 31 ALA N N 31 133.864 129.982 3.882 1
1 271 . 6 1 1 A 32 32 PRO HA H 32 4.637 4.446 0.191 1
1 278 . 6 1 1 A 32 32 PRO C C 32 175.737 177.249 -1.512 1
1 279 . 6 1 1 A 32 32 PRO CA C 32 64.259 64.503 -0.244 1
1 280 . 6 1 1 A 32 32 PRO CB C 32 31.740 31.806 -0.066 1
1 283 . 6 1 1 A 33 33 CYS H H 33 8.779 8.285 0.494 1
1 284 . 6 1 1 A 33 33 CYS HA H 33 4.321 4.293 0.028 1
1 287 . 6 1 1 A 33 33 CYS C C 33 176.733 175.498 1.235 1
1 288 . 6 1 1 A 33 33 CYS CA C 33 54.398 61.084 -6.686 1
1 289 . 6 1 1 A 33 33 CYS CB C 33 30.697 27.191 3.506 1
1 290 . 6 1 1 A 33 33 CYS N N 33 120.005 115.739 4.266 1
1 291 . 6 1 1 A 34 34 CYS H H 34 7.424 7.546 -0.122 1
1 292 . 6 1 1 A 34 34 CYS HA H 34 4.896 4.692 0.204 1
1 295 . 6 1 1 A 34 34 CYS C C 34 174.935 174.138 0.797 1
1 296 . 6 1 1 A 34 34 CYS CA C 34 56.962 58.917 -1.955 1
1 297 . 6 1 1 A 34 34 CYS CB C 34 31.067 30.156 0.911 1
1 298 . 6 1 1 A 34 34 CYS N N 34 115.034 119.333 -4.299 1
1 299 . 6 1 1 A 35 35 ASP H H 35 8.368 8.122 0.246 1
1 300 . 6 1 1 A 35 35 ASP HA H 35 4.454 4.229 0.225 1
1 303 . 6 1 1 A 35 35 ASP C C 35 174.354 174.793 -0.439 1
1 304 . 6 1 1 A 35 35 ASP CA C 35 56.222 55.508 0.714 1
1 305 . 6 1 1 A 35 35 ASP CB C 35 39.730 39.613 0.117 1
1 306 . 6 1 1 A 35 35 ASP N N 35 121.381 118.766 2.615 1
1 307 . 6 1 1 A 36 36 LYS H H 36 7.227 7.828 -0.601 1
1 308 . 6 1 1 A 36 36 LYS HA H 36 4.451 4.686 -0.235 1
1 317 . 6 1 1 A 36 36 LYS C C 36 175.433 175.786 -0.353 1
1 318 . 6 1 1 A 36 36 LYS CA C 36 56.270 54.724 1.546 1
1 319 . 6 1 1 A 36 36 LYS CB C 36 36.620 34.506 2.114 1
1 323 . 6 1 1 A 36 36 LYS N N 36 117.673 118.335 -0.662 1
1 324 . 6 1 1 A 37 37 LEU H H 37 8.053 8.401 -0.348 1
1 325 . 6 1 1 A 37 37 LEU HA H 37 5.292 4.874 0.418 1
1 335 . 6 1 1 A 37 37 LEU C C 37 176.484 175.162 1.322 1
1 336 . 6 1 1 A 37 37 LEU CA C 37 53.348 53.047 0.301 1
1 337 . 6 1 1 A 37 37 LEU CB C 37 42.400 42.721 -0.321 1
1 341 . 6 1 1 A 37 37 LEU N N 37 120.994 122.596 -1.602 1
1 342 . 6 1 1 A 38 38 TYR H H 38 8.741 8.821 -0.080 1
1 343 . 6 1 1 A 38 38 TYR HA H 38 5.002 4.881 0.121 1
1 350 . 6 1 1 A 38 38 TYR C C 38 176.374 176.046 0.328 1
1 351 . 6 1 1 A 38 38 TYR CA C 38 57.081 56.754 0.327 1
1 352 . 6 1 1 A 38 38 TYR CB C 38 45.647 41.404 4.243 1
1 355 . 6 1 1 A 38 38 TYR N N 38 121.128 121.984 -0.856 1
1 356 . 6 1 1 A 39 39 THR H H 39 9.402 8.747 0.655 1
1 357 . 6 1 1 A 39 39 THR HA H 39 4.098 4.149 -0.051 1
1 362 . 6 1 1 A 39 39 THR C C 39 173.496 174.962 -1.466 1
1 363 . 6 1 1 A 39 39 THR CA C 39 67.062 65.442 1.620 1
1 364 . 6 1 1 A 39 39 THR CB C 39 68.047 68.564 -0.517 1
1 366 . 6 1 1 A 39 39 THR N N 39 116.641 118.451 -1.810 1
1 367 . 6 1 1 A 40 40 CYS H H 40 7.317 7.899 -0.582 1
1 368 . 6 1 1 A 40 40 CYS HA H 40 4.771 4.984 -0.213 1
1 371 . 6 1 1 A 40 40 CYS C C 40 175.128 175.033 0.095 1
1 372 . 6 1 1 A 40 40 CYS CA C 40 56.577 58.104 -1.527 1
1 373 . 6 1 1 A 40 40 CYS CB C 40 35.087 31.323 3.764 1
1 374 . 6 1 1 A 40 40 CYS N N 40 109.059 118.549 -9.490 1
1 375 . 6 1 1 A 41 41 ARG H H 41 9.201 8.929 0.272 1
1 376 . 6 1 1 A 41 41 ARG HA H 41 3.982 4.005 -0.023 1
1 383 . 6 1 1 A 41 41 ARG C C 41 175.101 177.955 -2.854 1
1 384 . 6 1 1 A 41 41 ARG CA C 41 58.591 58.975 -0.384 1
1 385 . 6 1 1 A 41 41 ARG CB C 41 29.640 29.758 -0.118 1
1 388 . 6 1 1 A 41 41 ARG N N 41 121.737 124.548 -2.811 1
1 389 . 6 1 1 A 42 42 LEU H H 42 9.116 7.757 1.359 1
1 390 . 6 1 1 A 42 42 LEU HA H 42 4.029 4.031 -0.002 1
1 400 . 6 1 1 A 42 42 LEU C C 42 179.943 179.014 0.929 1
1 401 . 6 1 1 A 42 42 LEU CA C 42 58.005 57.650 0.355 1
1 402 . 6 1 1 A 42 42 LEU CB C 42 38.960 41.019 -2.059 1
1 406 . 6 1 1 A 42 42 LEU N N 42 126.364 116.495 9.869 1
1 407 . 6 1 1 A 43 43 CYS H H 43 8.785 8.219 0.566 1
1 408 . 6 1 1 A 43 43 CYS HA H 43 4.187 4.265 -0.078 1
1 411 . 6 1 1 A 43 43 CYS C C 43 177.785 177.154 0.631 1
1 412 . 6 1 1 A 43 43 CYS CA C 43 66.415 62.305 4.110 1
1 413 . 6 1 1 A 43 43 CYS CB C 43 28.870 26.782 2.088 1
1 414 . 6 1 1 A 43 43 CYS N N 43 124.519 117.536 6.983 1
1 415 . 6 1 1 A 44 44 HIS H H 44 7.604 7.099 0.505 1
1 416 . 6 1 1 A 44 44 HIS HA H 44 1.983 3.044 -1.061 1
1 420 . 6 1 1 A 44 44 HIS C C 44 176.429 176.334 0.095 1
1 421 . 6 1 1 A 44 44 HIS CA C 44 58.760 58.813 -0.053 1
1 422 . 6 1 1 A 44 44 HIS CB C 44 27.990 29.260 -1.270 1
1 423 . 6 1 1 A 44 44 HIS N N 44 117.024 121.104 -4.080 1
1 424 . 6 1 1 A 45 45 ASP H H 45 8.750 7.973 0.777 1
1 425 . 6 1 1 A 45 45 ASP HA H 45 4.116 4.313 -0.197 1
1 428 . 6 1 1 A 45 45 ASP C C 45 177.453 178.083 -0.630 1
1 429 . 6 1 1 A 45 45 ASP CA C 45 56.840 57.372 -0.532 1
1 430 . 6 1 1 A 45 45 ASP CB C 45 38.960 41.541 -2.581 1
1 431 . 6 1 1 A 45 45 ASP N N 45 120.440 118.952 1.488 1
1 432 . 6 1 1 A 46 46 ASN H H 46 7.888 8.085 -0.197 1
1 433 . 6 1 1 A 46 46 ASN HA H 46 4.612 4.426 0.186 1
1 438 . 6 1 1 A 46 46 ASN C C 46 175.903 176.512 -0.609 1
1 439 . 6 1 1 A 46 46 ASN CA C 46 54.342 55.959 -1.617 1
1 440 . 6 1 1 A 46 46 ASN CB C 46 38.790 38.430 0.360 1
1 441 . 6 1 1 A 46 46 ASN N N 46 115.758 117.555 -1.797 1
1 443 . 6 1 1 A 47 47 ASN H H 47 7.384 7.641 -0.257 1
1 444 . 6 1 1 A 47 47 ASN HA H 47 4.893 4.689 0.204 1
1 449 . 6 1 1 A 47 47 ASN C C 47 173.579 175.238 -1.659 1
1 450 . 6 1 1 A 47 47 ASN CA C 47 53.937 54.581 -0.644 1
1 451 . 6 1 1 A 47 47 ASN CB C 47 43.130 39.665 3.465 1
1 452 . 6 1 1 A 47 47 ASN N N 47 116.576 114.823 1.753 1
1 454 . 6 1 1 A 48 48 GLU H H 48 7.143 7.524 -0.381 1
1 455 . 6 1 1 A 48 48 GLU HA H 48 4.572 4.545 0.027 1
1 460 . 6 1 1 A 48 48 GLU C C 48 175.627 176.703 -1.076 1
1 461 . 6 1 1 A 48 48 GLU CA C 48 53.727 54.628 -0.901 1
1 462 . 6 1 1 A 48 48 GLU CB C 48 32.480 31.086 1.394 1
1 464 . 6 1 1 A 48 48 GLU N N 48 116.967 117.717 -0.750 1
1 465 . 6 1 1 A 49 49 ASP H H 49 8.748 8.838 -0.090 1
1 466 . 6 1 1 A 49 49 ASP HA H 49 4.576 4.447 0.129 1
1 469 . 6 1 1 A 49 49 ASP C C 49 174.796 176.191 -1.395 1
1 470 . 6 1 1 A 49 49 ASP CA C 49 53.027 55.715 -2.688 1
1 471 . 6 1 1 A 49 49 ASP CB C 49 40.340 40.988 -0.648 1
1 472 . 6 1 1 A 49 49 ASP N N 49 119.296 120.790 -1.494 1
1 473 . 6 1 1 A 50 50 HIS H H 50 6.919 7.324 -0.405 1
1 474 . 6 1 1 A 50 50 HIS HA H 50 4.880 5.156 -0.276 1
1 477 . 6 1 1 A 50 50 HIS C C 50 172.942 174.672 -1.730 1
1 478 . 6 1 1 A 50 50 HIS CA C 50 53.978 53.265 0.713 1
1 479 . 6 1 1 A 50 50 HIS CB C 50 30.330 32.920 -2.590 1
1 480 . 6 1 1 A 50 50 HIS N N 50 113.709 113.973 -0.264 1
1 481 . 6 1 1 A 51 51 GLN H H 51 8.646 8.476 0.170 1
1 482 . 6 1 1 A 51 51 GLN HA H 51 4.896 4.672 0.224 1
1 487 . 6 1 1 A 51 51 GLN C C 51 176.512 174.705 1.807 1
1 488 . 6 1 1 A 51 51 GLN CA C 51 54.872 55.369 -0.497 1
1 489 . 6 1 1 A 51 51 GLN CB C 51 30.950 29.750 1.200 1
1 491 . 6 1 1 A 51 51 GLN N N 51 119.379 118.276 1.103 1
1 492 . 6 1 1 A 52 52 LEU H H 52 9.646 8.694 0.952 1
1 493 . 6 1 1 A 52 52 LEU HA H 52 4.206 4.741 -0.535 1
1 503 . 6 1 1 A 52 52 LEU C C 52 175.793 174.175 1.618 1
1 504 . 6 1 1 A 52 52 LEU CA C 52 55.450 53.550 1.900 1
1 505 . 6 1 1 A 52 52 LEU CB C 52 41.407 43.865 -2.458 1
1 509 . 6 1 1 A 52 52 LEU N N 52 128.069 125.170 2.899 1
1 510 . 6 1 1 A 53 53 ASP H H 53 9.281 8.693 0.588 1
1 511 . 6 1 1 A 53 53 ASP HA H 53 4.725 4.851 -0.126 1
1 514 . 6 1 1 A 53 53 ASP C C 53 176.401 177.475 -1.074 1
1 515 . 6 1 1 A 53 53 ASP CA C 53 52.590 53.266 -0.676 1
1 516 . 6 1 1 A 53 53 ASP CB C 53 39.990 42.700 -2.710 1
1 517 . 6 1 1 A 53 53 ASP N N 53 128.783 127.479 1.304 1
1 518 . 6 1 1 A 54 54 ARG H H 54 8.496 8.835 -0.339 1
1 519 . 6 1 1 A 54 54 ARG HA H 54 3.859 3.974 -0.115 1
1 526 . 6 1 1 A 54 54 ARG C C 54 176.346 176.247 0.099 1
1 527 . 6 1 1 A 54 54 ARG CA C 54 57.357 57.898 -0.541 1
1 528 . 6 1 1 A 54 54 ARG CB C 54 28.890 29.291 -0.401 1
1 531 . 6 1 1 A 54 54 ARG N N 54 125.813 125.265 0.548 1
1 532 . 6 1 1 A 55 55 PHE H H 55 8.005 7.463 0.542 1
1 533 . 6 1 1 A 55 55 PHE HA H 55 4.712 4.543 0.169 1
1 540 . 6 1 1 A 55 55 PHE C C 55 177.481 177.713 -0.232 1
1 541 . 6 1 1 A 55 55 PHE CA C 55 59.080 60.170 -1.090 1
1 542 . 6 1 1 A 55 55 PHE CB C 55 37.447 40.088 -2.641 1
1 545 . 6 1 1 A 55 55 PHE N N 55 120.168 117.909 2.259 1
1 546 . 6 1 1 A 56 56 LYS H H 56 7.681 7.490 0.191 1
1 547 . 6 1 1 A 56 56 LYS HA H 56 4.411 4.325 0.086 1
1 556 . 6 1 1 A 56 56 LYS C C 56 175.959 176.465 -0.506 1
1 557 . 6 1 1 A 56 56 LYS CA C 56 55.459 57.737 -2.278 1
1 558 . 6 1 1 A 56 56 LYS CB C 56 33.590 33.042 0.548 1
1 562 . 6 1 1 A 56 56 LYS N N 56 116.937 117.768 -0.831 1
1 563 . 6 1 1 A 57 57 VAL H H 57 6.553 7.156 -0.603 1
1 564 . 6 1 1 A 57 57 VAL HA H 57 3.408 3.874 -0.466 1
1 572 . 6 1 1 A 57 57 VAL C C 57 173.911 174.972 -1.061 1
1 573 . 6 1 1 A 57 57 VAL CA C 57 65.025 61.868 3.157 1
1 574 . 6 1 1 A 57 57 VAL CB C 57 32.663 32.569 0.094 1
1 577 . 6 1 1 A 57 57 VAL N N 57 119.519 117.424 2.095 1
1 578 . 6 1 1 A 58 58 LYS H H 58 9.182 8.806 0.376 1
1 579 . 6 1 1 A 58 58 LYS HA H 58 4.489 4.527 -0.038 1
1 588 . 6 1 1 A 58 58 LYS C C 58 176.927 176.035 0.892 1
1 589 . 6 1 1 A 58 58 LYS CA C 58 55.913 57.593 -1.680 1
1 590 . 6 1 1 A 58 58 LYS CB C 58 36.340 35.606 0.734 1
1 594 . 6 1 1 A 58 58 LYS N N 58 124.985 124.489 0.496 1
1 595 . 6 1 1 A 59 59 GLU H H 59 8.799 8.042 0.757 1
1 596 . 6 1 1 A 59 59 GLU HA H 59 5.209 4.750 0.459 1
1 601 . 6 1 1 A 59 59 GLU C C 59 173.911 175.639 -1.728 1
1 602 . 6 1 1 A 59 59 GLU CA C 59 54.670 55.001 -0.331 1
1 603 . 6 1 1 A 59 59 GLU CB C 59 35.180 31.554 3.626 1
1 605 . 6 1 1 A 59 59 GLU N N 59 121.493 118.407 3.086 1
1 606 . 6 1 1 A 60 60 VAL H H 60 8.917 8.950 -0.033 1
1 607 . 6 1 1 A 60 60 VAL HA H 60 4.983 5.252 -0.269 1
1 615 . 6 1 1 A 60 60 VAL C C 60 173.441 173.826 -0.385 1
1 616 . 6 1 1 A 60 60 VAL CA C 60 57.497 58.935 -1.438 1
1 617 . 6 1 1 A 60 60 VAL CB C 60 35.460 36.406 -0.946 1
1 620 . 6 1 1 A 60 60 VAL N N 60 109.266 117.507 -8.241 1
1 621 . 6 1 1 A 61 61 GLN H H 61 8.970 8.543 0.427 1
1 622 . 6 1 1 A 61 61 GLN HA H 61 5.024 5.270 -0.246 1
1 629 . 6 1 1 A 61 61 GLN C C 61 175.045 173.377 1.668 1
1 630 . 6 1 1 A 61 61 GLN CA C 61 53.128 53.705 -0.577 1
1 631 . 6 1 1 A 61 61 GLN CB C 61 33.980 32.653 1.327 1
1 633 . 6 1 1 A 61 61 GLN N N 61 118.525 118.304 0.221 1
1 635 . 6 1 1 A 62 62 CYS H H 62 7.688 8.500 -0.812 1
1 636 . 6 1 1 A 62 62 CYS HA H 62 4.210 4.914 -0.704 1
1 639 . 6 1 1 A 62 62 CYS C C 62 177.951 174.014 3.937 1
1 640 . 6 1 1 A 62 62 CYS CA C 62 59.845 57.301 2.544 1
1 641 . 6 1 1 A 62 62 CYS CB C 62 33.120 29.924 3.196 1
1 642 . 6 1 1 A 62 62 CYS N N 62 128.772 119.550 9.222 1
1 643 . 6 1 1 A 63 63 ILE H H 63 8.192 8.645 -0.453 1
1 644 . 6 1 1 A 63 63 ILE HA H 63 3.984 4.234 -0.250 1
1 654 . 6 1 1 A 63 63 ILE C C 63 175.433 175.824 -0.391 1
1 655 . 6 1 1 A 63 63 ILE CA C 63 63.657 61.122 2.535 1
1 656 . 6 1 1 A 63 63 ILE CB C 63 38.506 36.019 2.487 1
1 660 . 6 1 1 A 63 63 ILE N N 63 127.455 128.207 -0.752 1
1 661 . 6 1 1 A 64 64 ASN H H 64 9.181 8.097 1.084 1
1 662 . 6 1 1 A 64 64 ASN HA H 64 4.810 4.953 -0.143 1
1 667 . 6 1 1 A 64 64 ASN C C 64 175.931 175.867 0.064 1
1 668 . 6 1 1 A 64 64 ASN CA C 64 55.617 54.428 1.189 1
1 669 . 6 1 1 A 64 64 ASN CB C 64 40.640 40.803 -0.163 1
1 670 . 6 1 1 A 64 64 ASN N N 64 122.104 120.418 1.686 1
1 672 . 6 1 1 A 65 65 CYS H H 65 9.065 8.097 0.968 1
1 673 . 6 1 1 A 65 65 CYS HA H 65 4.979 4.596 0.383 1
1 676 . 6 1 1 A 65 65 CYS C C 65 176.291 174.860 1.431 1
1 677 . 6 1 1 A 65 65 CYS CA C 65 59.027 58.261 0.766 1
1 678 . 6 1 1 A 65 65 CYS CB C 65 32.030 29.634 2.396 1
1 679 . 6 1 1 A 65 65 CYS N N 65 120.368 115.696 4.672 1
1 680 . 6 1 1 A 66 66 GLU H H 66 7.281 7.976 -0.695 1
1 681 . 6 1 1 A 66 66 GLU HA H 66 4.046 4.093 -0.047 1
1 686 . 6 1 1 A 66 66 GLU C C 66 175.211 175.267 -0.056 1
1 687 . 6 1 1 A 66 66 GLU CA C 66 58.591 57.432 1.159 1
1 688 . 6 1 1 A 66 66 GLU CB C 66 27.067 27.440 -0.373 1
1 690 . 6 1 1 A 66 66 GLU N N 66 115.012 116.061 -1.049 1
1 691 . 6 1 1 A 67 67 LYS H H 67 8.481 7.903 0.578 1
1 692 . 6 1 1 A 67 67 LYS HA H 67 4.326 4.248 0.078 1
1 701 . 6 1 1 A 67 67 LYS C C 67 177.923 176.036 1.887 1
1 702 . 6 1 1 A 67 67 LYS CA C 67 57.628 56.873 0.755 1
1 703 . 6 1 1 A 67 67 LYS CB C 67 33.617 32.997 0.620 1
1 707 . 6 1 1 A 67 67 LYS N N 67 123.514 120.724 2.790 1
1 708 . 6 1 1 A 68 68 ILE H H 68 8.867 8.668 0.199 1
1 709 . 6 1 1 A 68 68 ILE HA H 68 4.976 4.488 0.488 1
1 719 . 6 1 1 A 68 68 ILE C C 68 175.018 175.602 -0.584 1
1 720 . 6 1 1 A 68 68 ILE CA C 68 60.919 61.151 -0.232 1
1 721 . 6 1 1 A 68 68 ILE CB C 68 37.090 36.722 0.368 1
1 725 . 6 1 1 A 68 68 ILE N N 68 133.478 129.247 4.231 1
1 726 . 6 1 1 A 69 69 GLN H H 69 9.269 8.390 0.879 1
1 727 . 6 1 1 A 69 69 GLN HA H 69 5.036 5.122 -0.086 1
1 732 . 6 1 1 A 69 69 GLN C C 69 173.607 174.915 -1.308 1
1 733 . 6 1 1 A 69 69 GLN CA C 69 53.419 53.703 -0.284 1
1 734 . 6 1 1 A 69 69 GLN CB C 69 34.997 32.266 2.731 1
1 736 . 6 1 1 A 69 69 GLN N N 69 125.104 124.619 0.485 1
1 737 . 6 1 1 A 70 70 HIS H H 70 8.829 8.944 -0.115 1
1 738 . 6 1 1 A 70 70 HIS HA H 70 4.865 4.799 0.066 1
1 741 . 6 1 1 A 70 70 HIS C C 70 174.852 175.215 -0.363 1
1 742 . 6 1 1 A 70 70 HIS CA C 70 56.304 56.557 -0.253 1
1 743 . 6 1 1 A 70 70 HIS CB C 70 30.050 30.756 -0.706 1
1 744 . 6 1 1 A 70 70 HIS N N 70 118.576 119.075 -0.499 1
1 745 . 6 1 1 A 71 71 ALA H H 71 7.768 8.427 -0.659 1
1 746 . 6 1 1 A 71 71 ALA HA H 71 3.977 4.586 -0.609 1
1 750 . 6 1 1 A 71 71 ALA C C 71 175.433 177.196 -1.763 1
1 751 . 6 1 1 A 71 71 ALA CA C 71 54.393 52.575 1.818 1
1 752 . 6 1 1 A 71 71 ALA CB C 71 18.000 18.842 -0.842 1
1 753 . 6 1 1 A 71 71 ALA N N 71 121.438 124.343 -2.905 1
1 754 . 6 1 1 A 72 72 GLN H H 72 7.227 8.491 -1.264 1
1 755 . 6 1 1 A 72 72 GLN HA H 72 4.371 4.718 -0.347 1
1 762 . 6 1 1 A 72 72 GLN C C 72 173.053 175.266 -2.213 1
1 763 . 6 1 1 A 72 72 GLN CA C 72 54.290 53.977 0.313 1
1 764 . 6 1 1 A 72 72 GLN CB C 72 28.623 32.187 -3.564 1
1 766 . 6 1 1 A 72 72 GLN N N 72 115.858 123.097 -7.239 1
1 768 . 6 1 1 A 73 73 GLN H H 73 8.481 8.549 -0.068 1
1 769 . 6 1 1 A 73 73 GLN HA H 73 3.570 3.775 -0.205 1
1 776 . 6 1 1 A 73 73 GLN C C 73 174.243 174.950 -0.707 1
1 777 . 6 1 1 A 73 73 GLN CA C 73 60.206 57.412 2.794 1
1 778 . 6 1 1 A 73 73 GLN CB C 73 28.850 29.285 -0.435 1
1 780 . 6 1 1 A 73 73 GLN N N 73 116.433 122.139 -5.706 1
1 782 . 6 1 1 A 74 74 THR H H 74 7.211 7.368 -0.157 1
1 783 . 6 1 1 A 74 74 THR HA H 74 4.160 4.414 -0.254 1
1 788 . 6 1 1 A 74 74 THR C C 74 171.836 171.914 -0.078 1
1 789 . 6 1 1 A 74 74 THR CA C 74 59.072 60.775 -1.703 1
1 790 . 6 1 1 A 74 74 THR CB C 74 71.560 71.607 -0.047 1
1 792 . 6 1 1 A 74 74 THR N N 74 108.717 110.618 -1.901 1
1 793 . 6 1 1 A 75 75 CYS H H 75 7.676 7.965 -0.289 1
1 794 . 6 1 1 A 75 75 CYS HA H 75 4.158 4.568 -0.410 1
1 797 . 6 1 1 A 75 75 CYS C C 75 178.781 175.833 2.948 1
1 798 . 6 1 1 A 75 75 CYS CA C 75 58.661 57.549 1.112 1
1 799 . 6 1 1 A 75 75 CYS CB C 75 30.840 28.891 1.949 1
1 800 . 6 1 1 A 75 75 CYS N N 75 123.108 122.617 0.491 1
1 801 . 6 1 1 A 76 76 GLU H H 76 9.203 8.771 0.432 1
1 802 . 6 1 1 A 76 76 GLU HA H 76 4.187 4.009 0.178 1
1 807 . 6 1 1 A 76 76 GLU C C 76 175.488 178.945 -3.457 1
1 808 . 6 1 1 A 76 76 GLU CA C 76 57.306 58.952 -1.646 1
1 809 . 6 1 1 A 76 76 GLU CB C 76 29.347 29.023 0.324 1
1 811 . 6 1 1 A 76 76 GLU N N 76 129.817 127.423 2.394 1
1 812 . 6 1 1 A 77 77 GLU H H 77 9.496 7.782 1.714 1
1 813 . 6 1 1 A 77 77 GLU HA H 77 4.599 4.068 0.531 1
1 818 . 6 1 1 A 77 77 GLU C C 77 177.148 177.273 -0.125 1
1 819 . 6 1 1 A 77 77 GLU CA C 77 57.554 58.961 -1.407 1
1 820 . 6 1 1 A 77 77 GLU CB C 77 31.980 30.098 1.882 1
1 822 . 6 1 1 A 77 77 GLU N N 77 124.795 120.353 4.442 1
1 823 . 6 1 1 A 78 78 CYS H H 78 8.967 7.679 1.288 1
1 824 . 6 1 1 A 78 78 CYS HA H 78 5.073 4.613 0.460 1
1 827 . 6 1 1 A 78 78 CYS C C 78 176.374 175.192 1.182 1
1 828 . 6 1 1 A 78 78 CYS CA C 78 58.537 58.208 0.329 1
1 829 . 6 1 1 A 78 78 CYS CB C 78 31.597 29.041 2.556 1
1 830 . 6 1 1 A 78 78 CYS N N 78 119.692 114.908 4.784 1
1 831 . 6 1 1 A 79 79 SER H H 79 7.474 8.197 -0.723 1
1 832 . 6 1 1 A 79 79 SER HA H 79 4.113 4.085 0.028 1
1 835 . 6 1 1 A 79 79 SER C C 79 172.915 173.399 -0.484 1
1 836 . 6 1 1 A 79 79 SER CA C 79 60.440 59.639 0.801 1
1 837 . 6 1 1 A 79 79 SER CB C 79 61.421 61.301 0.120 1
1 838 . 6 1 1 A 79 79 SER N N 79 113.385 112.588 0.797 1
1 839 . 6 1 1 A 80 80 THR H H 80 7.907 7.794 0.113 1
1 840 . 6 1 1 A 80 80 THR HA H 80 3.913 4.162 -0.249 1
1 845 . 6 1 1 A 80 80 THR C C 80 172.306 173.638 -1.332 1
1 846 . 6 1 1 A 80 80 THR CA C 80 65.262 63.130 2.132 1
1 847 . 6 1 1 A 80 80 THR CB C 80 69.910 68.978 0.932 1
1 849 . 6 1 1 A 80 80 THR N N 80 120.005 115.832 4.173 1
1 850 . 6 1 1 A 81 81 LEU H H 81 8.556 8.530 0.026 1
1 851 . 6 1 1 A 81 81 LEU HA H 81 4.172 4.307 -0.135 1
1 861 . 6 1 1 A 81 81 LEU C C 81 177.121 176.374 0.747 1
1 862 . 6 1 1 A 81 81 LEU CA C 81 54.996 54.753 0.243 1
1 863 . 6 1 1 A 81 81 LEU CB C 81 42.147 42.331 -0.184 1
1 867 . 6 1 1 A 81 81 LEU N N 81 128.272 128.859 -0.587 1
1 868 . 6 1 1 A 82 82 PHE H H 82 9.251 8.680 0.571 1
1 869 . 6 1 1 A 82 82 PHE HA H 82 4.576 4.411 0.165 1
1 874 . 6 1 1 A 82 82 PHE C C 82 177.785 176.130 1.655 1
1 875 . 6 1 1 A 82 82 PHE CA C 82 56.470 60.438 -3.968 1
1 876 . 6 1 1 A 82 82 PHE CB C 82 38.210 38.996 -0.786 1
1 878 . 6 1 1 A 82 82 PHE N N 82 129.268 125.746 3.522 1
1 879 . 6 1 1 A 83 83 GLY H H 83 7.047 7.510 -0.463 1
1 880 . 6 1 1 A 83 83 GLY HA2 H 83 4.783 4.175 0.608 1
1 881 . 6 1 1 A 83 83 GLY HA3 H 83 3.876 4.234 -0.358 1
1 882 . 6 1 1 A 83 83 GLY C C 83 171.642 174.667 -3.025 1
1 883 . 6 1 1 A 83 83 GLY CA C 83 45.826 45.623 0.203 1
1 884 . 6 1 1 A 83 83 GLY N N 83 102.168 103.980 -1.812 1
1 885 . 6 1 1 A 84 84 GLU H H 84 8.444 8.960 -0.516 1
1 886 . 6 1 1 A 84 84 GLU HA H 84 4.111 4.330 -0.219 1
1 891 . 6 1 1 A 84 84 GLU C C 84 177.259 176.395 0.864 1
1 892 . 6 1 1 A 84 84 GLU CA C 84 59.438 58.279 1.159 1
1 893 . 6 1 1 A 84 84 GLU CB C 84 30.670 30.881 -0.211 1
1 895 . 6 1 1 A 84 84 GLU N N 84 127.546 118.975 8.571 1
1 896 . 6 1 1 A 85 85 TYR H H 85 9.344 8.196 1.148 1
1 897 . 6 1 1 A 85 85 TYR HA H 85 4.599 4.865 -0.266 1
1 902 . 6 1 1 A 85 85 TYR C C 85 173.302 174.267 -0.965 1
1 903 . 6 1 1 A 85 85 TYR CA C 85 57.261 58.270 -1.009 1
1 904 . 6 1 1 A 85 85 TYR CB C 85 40.850 40.019 0.831 1
1 906 . 6 1 1 A 85 85 TYR N N 85 118.936 120.824 -1.888 1
1 907 . 6 1 1 A 86 86 TYR H H 86 7.323 8.708 -1.385 1
1 908 . 6 1 1 A 86 86 TYR HA H 86 5.298 6.155 -0.857 1
1 911 . 6 1 1 A 86 86 TYR C C 86 172.804 173.456 -0.652 1
1 912 . 6 1 1 A 86 86 TYR CA C 86 54.041 55.619 -1.578 1
1 913 . 6 1 1 A 86 86 TYR CB C 86 40.987 41.958 -0.971 1
1 914 . 6 1 1 A 86 86 TYR N N 86 124.965 122.148 2.817 1
1 915 . 6 1 1 A 87 87 CYS H H 87 7.046 8.685 -1.639 1
1 916 . 6 1 1 A 87 87 CYS HA H 87 3.842 4.747 -0.905 1
1 919 . 6 1 1 A 87 87 CYS C C 87 174.243 174.327 -0.084 1
1 920 . 6 1 1 A 87 87 CYS CA C 87 56.377 58.462 -2.085 1
1 921 . 6 1 1 A 87 87 CYS CB C 87 33.230 30.080 3.150 1
1 922 . 6 1 1 A 87 87 CYS N N 87 128.735 118.597 10.138 1
1 923 . 6 1 1 A 88 88 ASP H H 88 8.002 9.213 -1.211 1
1 924 . 6 1 1 A 88 88 ASP HA H 88 3.761 4.433 -0.672 1
1 927 . 6 1 1 A 88 88 ASP C C 88 173.579 177.944 -4.365 1
1 928 . 6 1 1 A 88 88 ASP CA C 88 53.958 56.741 -2.783 1
1 929 . 6 1 1 A 88 88 ASP CB C 88 41.240 39.597 1.643 1
1 930 . 6 1 1 A 88 88 ASP N N 88 127.013 127.240 -0.227 1
1 931 . 6 1 1 A 89 89 ILE H H 89 7.972 7.894 0.078 1
1 932 . 6 1 1 A 89 89 ILE HA H 89 3.660 3.507 0.153 1
1 942 . 6 1 1 A 89 89 ILE C C 89 177.259 177.312 -0.053 1
1 943 . 6 1 1 A 89 89 ILE CA C 89 63.107 65.200 -2.093 1
1 944 . 6 1 1 A 89 89 ILE CB C 89 39.430 38.493 0.937 1
1 948 . 6 1 1 A 89 89 ILE N N 89 120.357 120.546 -0.189 1
1 949 . 6 1 1 A 90 90 CYS H H 90 8.554 7.634 0.920 1
1 950 . 6 1 1 A 90 90 CYS HA H 90 3.677 3.557 0.120 1
1 953 . 6 1 1 A 90 90 CYS C C 90 175.128 174.345 0.783 1
1 954 . 6 1 1 A 90 90 CYS CA C 90 60.791 58.980 1.811 1
1 955 . 6 1 1 A 90 90 CYS CB C 90 30.427 27.730 2.697 1
1 956 . 6 1 1 A 90 90 CYS N N 90 119.564 117.509 2.055 1
1 957 . 6 1 1 A 91 91 HIS H H 91 7.364 7.423 -0.059 1
1 958 . 6 1 1 A 91 91 HIS HA H 91 3.512 3.818 -0.306 1
1 963 . 6 1 1 A 91 91 HIS C C 91 170.590 172.905 -2.315 1
1 964 . 6 1 1 A 91 91 HIS CA C 91 58.739 56.637 2.102 1
1 965 . 6 1 1 A 91 91 HIS CB C 91 24.810 26.552 -1.742 1
1 968 . 6 1 1 A 91 91 HIS N N 91 111.440 115.912 -4.472 1
1 969 . 6 1 1 A 92 92 LEU H H 92 6.214 6.950 -0.736 1
1 970 . 6 1 1 A 92 92 LEU HA H 92 4.191 4.212 -0.021 1
1 980 . 6 1 1 A 92 92 LEU C C 92 173.911 175.190 -1.279 1
1 981 . 6 1 1 A 92 92 LEU CA C 92 53.717 53.276 0.441 1
1 982 . 6 1 1 A 92 92 LEU CB C 92 45.360 42.815 2.545 1
1 986 . 6 1 1 A 92 92 LEU N N 92 115.684 117.077 -1.393 1
1 987 . 6 1 1 A 93 93 PHE H H 93 6.669 8.700 -2.031 1
1 988 . 6 1 1 A 93 93 PHE HA H 93 5.622 5.310 0.312 1
1 995 . 6 1 1 A 93 93 PHE C C 93 175.765 174.527 1.238 1
1 996 . 6 1 1 A 93 93 PHE CA C 93 55.387 56.582 -1.195 1
1 997 . 6 1 1 A 93 93 PHE CB C 93 42.700 41.168 1.532 1
1 1000 . 6 1 1 A 93 93 PHE N N 93 121.535 120.286 1.249 1
1 1001 . 6 1 1 A 94 94 ASP H H 94 9.209 8.995 0.214 1
1 1002 . 6 1 1 A 94 94 ASP HA H 94 5.819 5.273 0.546 1
1 1005 . 6 1 1 A 94 94 ASP C C 94 175.654 175.351 0.303 1
1 1006 . 6 1 1 A 94 94 ASP CA C 94 53.330 53.312 0.018 1
1 1007 . 6 1 1 A 94 94 ASP CB C 94 44.720 43.989 0.731 1
1 1008 . 6 1 1 A 94 94 ASP N N 94 123.504 120.990 2.514 1
1 1009 . 6 1 1 A 95 95 LYS H H 95 9.043 8.581 0.462 1
1 1010 . 6 1 1 A 95 95 LYS HA H 95 4.527 4.406 0.121 1
1 1019 . 6 1 1 A 95 95 LYS C C 95 174.879 176.101 -1.222 1
1 1020 . 6 1 1 A 95 95 LYS CA C 95 56.620 57.547 -0.927 1
1 1021 . 6 1 1 A 95 95 LYS CB C 95 33.720 33.175 0.545 1
1 1025 . 6 1 1 A 95 95 LYS N N 95 120.380 119.653 0.727 1
1 1026 . 6 1 1 A 96 96 ASP H H 96 8.999 8.810 0.189 1
1 1027 . 6 1 1 A 96 96 ASP HA H 96 4.724 4.968 -0.244 1
1 1030 . 6 1 1 A 96 96 ASP C C 96 176.401 175.134 1.267 1
1 1031 . 6 1 1 A 96 96 ASP CA C 96 56.147 53.236 2.911 1
1 1032 . 6 1 1 A 96 96 ASP CB C 96 40.790 41.932 -1.142 1
1 1033 . 6 1 1 A 96 96 ASP N N 96 120.784 124.681 -3.897 1
1 1034 . 6 1 1 A 97 97 LYS H H 97 9.382 8.718 0.664 1
1 1035 . 6 1 1 A 97 97 LYS HA H 97 4.473 4.678 -0.205 1
1 1044 . 6 1 1 A 97 97 LYS C C 97 175.903 176.333 -0.430 1
1 1045 . 6 1 1 A 97 97 LYS CA C 97 54.771 54.986 -0.215 1
1 1046 . 6 1 1 A 97 97 LYS CB C 97 33.270 33.553 -0.283 1
1 1050 . 6 1 1 A 97 97 LYS N N 97 131.617 126.253 5.364 1
1 1051 . 6 1 1 A 98 98 LYS H H 98 8.940 8.209 0.731 1
1 1052 . 6 1 1 A 98 98 LYS HA H 98 4.118 3.897 0.221 1
1 1061 . 6 1 1 A 98 98 LYS C C 98 177.065 175.090 1.975 1
1 1062 . 6 1 1 A 98 98 LYS CA C 98 56.297 57.548 -1.251 1
1 1063 . 6 1 1 A 98 98 LYS CB C 98 28.467 29.148 -0.681 1
1 1067 . 6 1 1 A 98 98 LYS N N 98 115.034 117.560 -2.526 1
1 1068 . 6 1 1 A 99 99 GLN H H 99 9.266 7.374 1.892 1
1 1069 . 6 1 1 A 99 99 GLN HA H 99 4.460 4.450 0.010 1
1 1074 . 6 1 1 A 99 99 GLN C C 99 174.990 175.006 -0.016 1
1 1075 . 6 1 1 A 99 99 GLN CA C 99 57.563 55.774 1.789 1
1 1076 . 6 1 1 A 99 99 GLN CB C 99 27.280 29.841 -2.561 1
1 1078 . 6 1 1 A 99 99 GLN N N 99 117.717 118.886 -1.169 1
1 1079 . 6 1 1 A 100 100 TYR H H 100 8.402 8.823 -0.421 1
1 1080 . 6 1 1 A 100 100 TYR HA H 100 4.935 5.394 -0.459 1
1 1087 . 6 1 1 A 100 100 TYR C C 100 171.504 172.967 -1.463 1
1 1088 . 6 1 1 A 100 100 TYR CA C 100 55.786 55.691 0.095 1
1 1089 . 6 1 1 A 100 100 TYR CB C 100 41.090 41.492 -0.402 1
1 1092 . 6 1 1 A 100 100 TYR N N 100 115.081 120.855 -5.774 1
1 1093 . 6 1 1 A 101 101 HIS H H 101 8.829 8.793 0.036 1
1 1094 . 6 1 1 A 101 101 HIS HA H 101 4.525 4.863 -0.338 1
1 1099 . 6 1 1 A 101 101 HIS C C 101 174.935 173.907 1.028 1
1 1100 . 6 1 1 A 101 101 HIS CA C 101 56.327 55.230 1.097 1
1 1101 . 6 1 1 A 101 101 HIS CB C 101 31.020 30.020 1.000 1
1 1104 . 6 1 1 A 101 101 HIS N N 101 120.894 123.344 -2.450 1
1 1105 . 6 1 1 A 102 102 CYS H H 102 7.427 8.217 -0.790 1
1 1106 . 6 1 1 A 102 102 CYS HA H 102 4.561 4.429 0.132 1
1 1109 . 6 1 1 A 102 102 CYS C C 102 175.765 175.629 0.136 1
1 1110 . 6 1 1 A 102 102 CYS CA C 102 57.707 58.609 -0.902 1
1 1111 . 6 1 1 A 102 102 CYS CB C 102 29.130 28.866 0.264 1
1 1112 . 6 1 1 A 102 102 CYS N N 102 131.256 126.615 4.641 1
1 1113 . 6 1 1 A 103 103 GLU H H 103 9.497 8.960 0.537 1
1 1114 . 6 1 1 A 103 103 GLU HA H 103 4.003 4.006 -0.003 1
1 1119 . 6 1 1 A 103 103 GLU C C 103 176.540 178.722 -2.182 1
1 1120 . 6 1 1 A 103 103 GLU CA C 103 58.796 59.422 -0.626 1
1 1121 . 6 1 1 A 103 103 GLU CB C 103 29.280 29.735 -0.455 1
1 1123 . 6 1 1 A 103 103 GLU N N 103 129.829 127.818 2.011 1
1 1124 . 6 1 1 A 104 104 ASN H H 104 7.832 7.857 -0.025 1
1 1125 . 6 1 1 A 104 104 ASN HA H 104 4.457 4.455 0.002 1
1 1130 . 6 1 1 A 104 104 ASN C C 104 176.401 177.598 -1.197 1
1 1131 . 6 1 1 A 104 104 ASN CA C 104 56.053 56.191 -0.138 1
1 1132 . 6 1 1 A 104 104 ASN CB C 104 38.400 38.006 0.394 1
1 1133 . 6 1 1 A 104 104 ASN N N 104 117.703 117.522 0.181 1
1 1135 . 6 1 1 A 105 105 CYS H H 105 9.415 7.155 2.260 1
1 1136 . 6 1 1 A 105 105 CYS HA H 105 4.137 4.440 -0.303 1
1 1139 . 6 1 1 A 105 105 CYS C C 105 176.844 175.324 1.520 1
1 1140 . 6 1 1 A 105 105 CYS CA C 105 64.328 59.325 5.003 1
1 1141 . 6 1 1 A 105 105 CYS CB C 105 30.350 28.107 2.243 1
1 1142 . 6 1 1 A 105 105 CYS N N 105 124.939 115.280 9.659 1
1 1143 . 6 1 1 A 106 106 GLY H H 106 8.145 8.703 -0.558 1
1 1144 . 6 1 1 A 106 106 GLY HA2 H 106 3.980 3.830 0.150 1
1 1145 . 6 1 1 A 106 106 GLY HA3 H 106 3.502 3.854 -0.352 1
1 1146 . 6 1 1 A 106 106 GLY C C 106 172.500 173.462 -0.962 1
1 1147 . 6 1 1 A 106 106 GLY CA C 106 44.968 45.751 -0.783 1
1 1148 . 6 1 1 A 106 106 GLY N N 106 106.090 109.722 -3.632 1
1 1149 . 6 1 1 A 107 107 ILE H H 107 6.465 7.218 -0.753 1
1 1150 . 6 1 1 A 107 107 ILE HA H 107 4.878 4.903 -0.025 1
1 1160 . 6 1 1 A 107 107 ILE C C 107 174.824 173.922 0.902 1
1 1161 . 6 1 1 A 107 107 ILE CA C 107 58.226 58.598 -0.372 1
1 1162 . 6 1 1 A 107 107 ILE CB C 107 44.460 42.576 1.884 1
1 1166 . 6 1 1 A 107 107 ILE N N 107 107.914 114.897 -6.983 1
1 1167 . 6 1 1 A 108 108 CYS H H 108 7.041 8.747 -1.706 1
1 1168 . 6 1 1 A 108 108 CYS HA H 108 5.018 5.214 -0.196 1
1 1171 . 6 1 1 A 108 108 CYS C C 108 175.461 173.139 2.322 1
1 1172 . 6 1 1 A 108 108 CYS CA C 108 62.097 58.108 3.989 1
1 1173 . 6 1 1 A 108 108 CYS CB C 108 31.353 30.166 1.187 1
1 1174 . 6 1 1 A 108 108 CYS N N 108 122.441 120.204 2.237 1
1 1175 . 6 1 1 A 109 109 ARG H H 109 8.561 8.322 0.239 1
1 1176 . 6 1 1 A 109 109 ARG HA H 109 4.239 4.760 -0.521 1
1 1183 . 6 1 1 A 109 109 ARG C C 109 174.271 175.808 -1.537 1
1 1184 . 6 1 1 A 109 109 ARG CA C 109 52.962 53.820 -0.858 1
1 1185 . 6 1 1 A 109 109 ARG CB C 109 33.903 34.437 -0.534 1
1 1188 . 6 1 1 A 109 109 ARG N N 109 121.163 123.948 -2.785 1
1 1189 . 6 1 1 A 110 110 ILE H H 110 7.847 8.460 -0.613 1
1 1190 . 6 1 1 A 110 110 ILE HA H 110 3.531 3.925 -0.394 1
1 1200 . 6 1 1 A 110 110 ILE C C 110 175.405 175.847 -0.442 1
1 1201 . 6 1 1 A 110 110 ILE CA C 110 62.201 62.574 -0.373 1
1 1202 . 6 1 1 A 110 110 ILE CB C 110 36.860 36.838 0.022 1
1 1206 . 6 1 1 A 110 110 ILE N N 110 118.955 120.878 -1.923 1
1 1207 . 6 1 1 A 111 111 GLY H H 111 6.928 8.289 -1.361 1
1 1208 . 6 1 1 A 111 111 GLY HA2 H 111 4.564 4.075 0.489 1
1 1209 . 6 1 1 A 111 111 GLY HA3 H 111 4.135 4.088 0.047 1
1 1210 . 6 1 1 A 111 111 GLY CA C 111 43.068 45.455 -2.387 1
1 1211 . 6 1 1 A 111 111 GLY N N 111 113.782 114.338 -0.556 1
1 1212 . 6 1 1 A 112 112 PRO HA H 112 4.990 4.708 0.282 1
1 1219 . 6 1 1 A 112 112 PRO C C 112 177.342 177.756 -0.414 1
1 1220 . 6 1 1 A 112 112 PRO CA C 112 62.920 63.147 -0.227 1
1 1221 . 6 1 1 A 112 112 PRO CB C 112 34.807 31.810 2.997 1
1 1224 . 6 1 1 A 113 113 LYS H H 113 8.989 8.077 0.912 1
1 1225 . 6 1 1 A 113 113 LYS HA H 113 3.144 3.578 -0.434 1
1 1234 . 6 1 1 A 113 113 LYS C C 113 177.536 178.010 -0.474 1
1 1235 . 6 1 1 A 113 113 LYS CA C 113 59.883 58.619 1.264 1
1 1236 . 6 1 1 A 113 113 LYS CB C 113 32.260 31.576 0.684 1
1 1240 . 6 1 1 A 113 113 LYS N N 113 123.545 123.389 0.156 1
1 1241 . 6 1 1 A 114 114 GLU H H 114 9.080 8.715 0.365 1
1 1242 . 6 1 1 A 114 114 GLU HA H 114 4.199 4.018 0.181 1
1 1247 . 6 1 1 A 114 114 GLU C C 114 176.374 178.370 -1.996 1
1 1248 . 6 1 1 A 114 114 GLU CA C 114 58.733 59.541 -0.808 1
1 1249 . 6 1 1 A 114 114 GLU CB C 114 28.077 29.066 -0.989 1
1 1251 . 6 1 1 A 114 114 GLU N N 114 114.832 120.951 -6.119 1
1 1252 . 6 1 1 A 115 115 ASP H H 115 7.799 7.616 0.183 1
1 1253 . 6 1 1 A 115 115 ASP HA H 115 4.642 4.551 0.091 1
1 1256 . 6 1 1 A 115 115 ASP C C 115 176.374 176.392 -0.018 1
1 1257 . 6 1 1 A 115 115 ASP CA C 115 54.470 56.279 -1.809 1
1 1258 . 6 1 1 A 115 115 ASP CB C 115 40.850 41.920 -1.070 1
1 1259 . 6 1 1 A 115 115 ASP N N 115 118.858 117.835 1.023 1
1 1260 . 6 1 1 A 116 116 PHE H H 116 8.063 8.403 -0.340 1
1 1261 . 6 1 1 A 116 116 PHE HA H 116 5.239 5.302 -0.063 1
1 1264 . 6 1 1 A 116 116 PHE C C 116 173.413 175.481 -2.068 1
1 1265 . 6 1 1 A 116 116 PHE CA C 116 57.708 56.625 1.083 1
1 1266 . 6 1 1 A 116 116 PHE CB C 116 44.557 39.792 4.765 1
1 1267 . 6 1 1 A 116 116 PHE N N 116 120.567 116.099 4.468 1
1 1268 . 6 1 1 A 117 117 PHE H H 117 9.439 8.974 0.465 1
1 1269 . 6 1 1 A 117 117 PHE HA H 117 5.091 5.685 -0.594 1
1 1277 . 6 1 1 A 117 117 PHE C C 117 171.614 172.790 -1.176 1
1 1278 . 6 1 1 A 117 117 PHE CA C 117 55.311 55.274 0.037 1
1 1279 . 6 1 1 A 117 117 PHE CB C 117 41.887 42.465 -0.578 1
1 1283 . 6 1 1 A 117 117 PHE N N 117 118.040 120.562 -2.522 1
1 1284 . 6 1 1 A 118 118 HIS H H 118 8.779 9.007 -0.228 1
1 1285 . 6 1 1 A 118 118 HIS HA H 118 4.836 4.923 -0.087 1
1 1289 . 6 1 1 A 118 118 HIS C C 118 174.879 173.789 1.090 1
1 1290 . 6 1 1 A 118 118 HIS CA C 118 55.322 55.678 -0.356 1
1 1291 . 6 1 1 A 118 118 HIS CB C 118 30.950 31.853 -0.903 1
1 1293 . 6 1 1 A 118 118 HIS N N 118 121.208 121.620 -0.412 1
1 1294 . 6 1 1 A 119 119 CYS H H 119 8.123 8.064 0.059 1
1 1295 . 6 1 1 A 119 119 CYS HA H 119 4.529 4.815 -0.286 1
1 1298 . 6 1 1 A 119 119 CYS C C 119 176.567 176.310 0.257 1
1 1299 . 6 1 1 A 119 119 CYS CA C 119 58.957 57.264 1.693 1
1 1300 . 6 1 1 A 119 119 CYS CB C 119 30.090 29.586 0.504 1
1 1301 . 6 1 1 A 119 119 CYS N N 119 131.659 127.148 4.511 1
1 1302 . 6 1 1 A 120 120 LEU H H 120 8.970 8.878 0.092 1
1 1303 . 6 1 1 A 120 120 LEU N N 120 130.361 124.049 6.312 1
1 1304 . 6 1 1 A 121 121 LYS HA H 121 4.299 4.508 -0.209 1
1 1313 . 6 1 1 A 121 121 LYS CA C 121 58.727 55.134 3.593 1
1 1314 . 6 1 1 A 121 121 LYS CB C 121 33.210 34.053 -0.843 1
1 1318 . 6 1 1 A 123 123 ASN HA H 123 4.438 4.736 -0.298 1
1 1323 . 6 1 1 A 123 123 ASN C C 123 172.444 174.795 -2.351 1
1 1324 . 6 1 1 A 123 123 ASN CA C 123 53.448 53.626 -0.178 1
1 1325 . 6 1 1 A 123 123 ASN CB C 123 37.130 37.584 -0.454 1
1 1327 . 6 1 1 A 124 124 LEU H H 124 6.596 7.308 -0.712 1
1 1328 . 6 1 1 A 124 124 LEU HA H 124 4.576 4.839 -0.263 1
1 1338 . 6 1 1 A 124 124 LEU C C 124 175.903 175.361 0.542 1
1 1339 . 6 1 1 A 124 124 LEU CA C 124 54.043 53.206 0.837 1
1 1340 . 6 1 1 A 124 124 LEU CB C 124 45.837 45.033 0.804 1
1 1344 . 6 1 1 A 124 124 LEU N N 124 115.443 121.531 -6.088 1
1 1345 . 6 1 1 A 125 125 CYS H H 125 6.342 8.663 -2.321 1
1 1346 . 6 1 1 A 125 125 CYS HA H 125 5.033 4.892 0.141 1
1 1349 . 6 1 1 A 125 125 CYS C C 125 175.101 174.583 0.518 1
1 1350 . 6 1 1 A 125 125 CYS CA C 125 62.046 57.293 4.753 1
1 1351 . 6 1 1 A 125 125 CYS CB C 125 30.840 28.510 2.330 1
1 1352 . 6 1 1 A 125 125 CYS N N 125 118.685 122.912 -4.227 1
1 1353 . 6 1 1 A 126 126 LEU H H 126 8.894 8.249 0.645 1
1 1354 . 6 1 1 A 126 126 LEU HA H 126 4.565 4.581 -0.016 1
1 1364 . 6 1 1 A 126 126 LEU C C 126 174.879 176.679 -1.800 1
1 1365 . 6 1 1 A 126 126 LEU CA C 126 52.751 53.296 -0.545 1
1 1366 . 6 1 1 A 126 126 LEU CB C 126 46.090 42.564 3.526 1
1 1370 . 6 1 1 A 126 126 LEU N N 126 124.501 126.328 -1.827 1
1 1371 . 6 1 1 A 127 127 ALA H H 127 8.378 8.630 -0.252 1
1 1372 . 6 1 1 A 127 127 ALA HA H 127 3.957 4.405 -0.448 1
1 1376 . 6 1 1 A 127 127 ALA C C 127 179.085 178.260 0.825 1
1 1377 . 6 1 1 A 127 127 ALA CA C 127 52.554 51.075 1.479 1
1 1378 . 6 1 1 A 127 127 ALA CB C 127 18.527 20.224 -1.697 1
1 1379 . 6 1 1 A 127 127 ALA N N 127 123.011 124.178 -1.167 1
1 1380 . 6 1 1 A 128 128 MET H H 128 8.237 8.464 -0.227 1
1 1385 . 6 1 1 A 128 128 MET N N 128 120.642 119.144 1.498 1
1 1386 . 6 1 1 A 129 129 ASN HA H 129 4.502 4.593 -0.091 1
1 1389 . 6 1 1 A 129 129 ASN C C 129 175.931 176.595 -0.664 1
1 1390 . 6 1 1 A 129 129 ASN CA C 129 55.064 55.407 -0.343 1
1 1391 . 6 1 1 A 129 129 ASN CB C 129 36.920 38.596 -1.676 1
1 1392 . 6 1 1 A 130 130 LEU H H 130 8.211 7.772 0.439 1
1 1393 . 6 1 1 A 130 130 LEU HA H 130 4.489 4.512 -0.023 1
1 1403 . 6 1 1 A 130 130 LEU C C 130 178.836 176.608 2.228 1
1 1404 . 6 1 1 A 130 130 LEU CA C 130 54.653 55.718 -1.065 1
1 1405 . 6 1 1 A 130 130 LEU CB C 130 41.887 42.123 -0.236 1
1 1409 . 6 1 1 A 130 130 LEU N N 130 118.563 118.001 0.562 1
1 1410 . 6 1 1 A 131 131 GLN H H 131 7.953 7.620 0.333 1
1 1411 . 6 1 1 A 131 131 GLN HA H 131 3.729 4.862 -1.133 1
1 1418 . 6 1 1 A 131 131 GLN CA C 131 59.310 56.968 2.342 1
1 1419 . 6 1 1 A 131 131 GLN CB C 131 28.340 28.756 -0.416 1
1 1421 . 6 1 1 A 131 131 GLN N N 131 123.929 116.981 6.948 1
1 1423 . 6 1 1 A 132 132 GLY HA2 H 132 4.034 3.896 0.138 1
1 1424 . 6 1 1 A 132 132 GLY HA3 H 132 3.865 3.981 -0.116 1
1 1425 . 6 1 1 A 132 132 GLY C C 132 174.547 175.977 -1.430 1
1 1426 . 6 1 1 A 132 132 GLY CA C 132 45.902 45.107 0.795 1
1 1427 . 6 1 1 A 133 133 ARG H H 133 7.735 7.951 -0.216 1
1 1428 . 6 1 1 A 133 133 ARG HA H 133 4.611 4.082 0.529 1
1 1435 . 6 1 1 A 133 133 ARG C C 133 175.461 176.697 -1.236 1
1 1436 . 6 1 1 A 133 133 ARG CA C 133 54.987 59.006 -4.019 1
1 1437 . 6 1 1 A 133 133 ARG CB C 133 31.470 30.075 1.395 1
1 1440 . 6 1 1 A 133 133 ARG N N 133 118.194 119.494 -1.300 1
1 1441 . 6 1 1 A 134 134 HIS H H 134 7.803 8.071 -0.268 1
1 1444 . 6 1 1 A 134 134 HIS N N 134 118.700 116.651 2.049 1
1 1445 . 6 1 1 A 135 135 LYS HA H 135 4.331 4.286 0.045 1
1 1454 . 6 1 1 A 135 135 LYS C C 135 174.852 177.228 -2.376 1
1 1455 . 6 1 1 A 135 135 LYS CA C 135 55.390 56.582 -1.192 1
1 1456 . 6 1 1 A 135 135 LYS CB C 135 32.970 32.600 0.370 1
1 1460 . 6 1 1 A 136 136 CYS H H 136 7.801 8.445 -0.644 1
1 1461 . 6 1 1 A 136 136 CYS HA H 136 4.113 4.816 -0.703 1
1 1464 . 6 1 1 A 136 136 CYS C C 136 174.879 174.800 0.079 1
1 1465 . 6 1 1 A 136 136 CYS CA C 136 60.028 58.282 1.746 1
1 1466 . 6 1 1 A 136 136 CYS CB C 136 30.350 28.706 1.644 1
1 1467 . 6 1 1 A 136 136 CYS N N 136 126.055 120.374 5.681 1
1 10 . 7 1 1 A 2 2 ALA H H 2 8.220 8.614 -0.394 1
1 11 . 7 1 1 A 2 2 ALA HA H 2 4.321 4.581 -0.260 1
1 15 . 7 1 1 A 2 2 ALA C C 2 177.564 175.580 1.984 1
1 16 . 7 1 1 A 2 2 ALA CA C 2 52.383 50.964 1.419 1
1 17 . 7 1 1 A 2 2 ALA CB C 2 19.290 22.860 -3.570 1
1 18 . 7 1 1 A 2 2 ALA N N 2 125.223 126.501 -1.278 1
1 19 . 7 1 1 A 3 3 ALA H H 3 8.246 8.498 -0.252 1
1 20 . 7 1 1 A 3 3 ALA N N 3 123.250 118.918 4.332 1
1 21 . 7 1 1 A 5 5 ALA HA H 5 4.415 5.018 -0.603 1
1 25 . 7 1 1 A 5 5 ALA C C 5 177.481 175.546 1.935 1
1 26 . 7 1 1 A 5 5 ALA CA C 5 52.423 51.035 1.388 1
1 27 . 7 1 1 A 5 5 ALA CB C 5 19.420 24.158 -4.738 1
1 28 . 7 1 1 A 6 6 ARG H H 6 8.239 8.688 -0.449 1
1 29 . 7 1 1 A 6 6 ARG HA H 6 4.371 4.824 -0.453 1
1 36 . 7 1 1 A 6 6 ARG C C 6 176.180 173.983 2.197 1
1 37 . 7 1 1 A 6 6 ARG CA C 6 56.353 55.648 0.705 1
1 38 . 7 1 1 A 6 6 ARG CB C 6 31.170 34.221 -3.051 1
1 41 . 7 1 1 A 6 6 ARG N N 6 120.436 118.684 1.752 1
1 42 . 7 1 1 A 7 7 GLU H H 7 8.535 8.604 -0.069 1
1 43 . 7 1 1 A 7 7 GLU HA H 7 4.335 4.914 -0.579 1
1 48 . 7 1 1 A 7 7 GLU C C 7 176.346 176.437 -0.091 1
1 49 . 7 1 1 A 7 7 GLU CA C 7 56.740 54.899 1.841 1
1 50 . 7 1 1 A 7 7 GLU CB C 7 30.390 31.047 -0.657 1
1 52 . 7 1 1 A 7 7 GLU N N 7 122.189 125.892 -3.703 1
1 53 . 7 1 1 A 8 8 ASP H H 8 8.347 8.863 -0.516 1
1 54 . 7 1 1 A 8 8 ASP N N 8 121.112 125.202 -4.090 1
1 55 . 7 1 1 A 9 9 GLY HA2 H 9 3.975 4.035 -0.060 1
1 56 . 7 1 1 A 9 9 GLY HA3 H 9 3.975 4.035 -0.060 1
1 57 . 7 1 1 A 9 9 GLY C C 9 174.243 172.425 1.818 1
1 58 . 7 1 1 A 9 9 GLY CA C 9 45.933 45.642 0.291 1
1 59 . 7 1 1 A 10 10 ALA H H 10 8.111 8.362 -0.251 1
1 60 . 7 1 1 A 10 10 ALA N N 10 123.721 126.018 -2.297 1
1 61 . 7 1 1 A 12 12 GLY HA2 H 12 3.992 4.140 -0.148 1
1 62 . 7 1 1 A 12 12 GLY HA3 H 12 3.992 4.140 -0.148 1
1 63 . 7 1 1 A 12 12 GLY C C 12 173.883 171.298 2.585 1
1 64 . 7 1 1 A 12 12 GLY CA C 12 45.381 45.399 -0.018 1
1 65 . 7 1 1 A 13 13 GLU H H 13 8.224 8.853 -0.629 1
1 66 . 7 1 1 A 13 13 GLU HA H 13 4.367 5.246 -0.879 1
1 71 . 7 1 1 A 13 13 GLU C C 13 176.125 174.210 1.915 1
1 72 . 7 1 1 A 13 13 GLU CA C 13 56.349 54.735 1.614 1
1 73 . 7 1 1 A 13 13 GLU CB C 13 29.560 33.545 -3.985 1
1 75 . 7 1 1 A 13 13 GLU N N 13 120.148 117.209 2.939 1
1 76 . 7 1 1 A 14 14 GLU H H 14 8.508 8.676 -0.168 1
1 77 . 7 1 1 A 14 14 GLU HA H 14 4.302 5.074 -0.772 1
1 82 . 7 1 1 A 14 14 GLU C C 14 176.623 175.886 0.737 1
1 83 . 7 1 1 A 14 14 GLU CA C 14 56.497 54.596 1.901 1
1 84 . 7 1 1 A 14 14 GLU CB C 14 30.110 33.515 -3.405 1
1 86 . 7 1 1 A 14 14 GLU N N 14 122.160 119.674 2.486 1
1 87 . 7 1 1 A 15 15 ARG H H 15 8.356 8.703 -0.347 1
1 88 . 7 1 1 A 15 15 ARG HA H 15 4.366 4.164 0.202 1
1 95 . 7 1 1 A 15 15 ARG C C 15 176.844 177.220 -0.376 1
1 96 . 7 1 1 A 15 15 ARG CA C 15 56.010 57.523 -1.513 1
1 97 . 7 1 1 A 15 15 ARG CB C 15 30.890 30.792 0.098 1
1 100 . 7 1 1 A 15 15 ARG N N 15 121.945 122.454 -0.509 1
1 101 . 7 1 1 A 16 16 GLY H H 16 8.414 7.851 0.563 1
1 102 . 7 1 1 A 16 16 GLY HA2 H 16 4.022 3.912 0.110 1
1 103 . 7 1 1 A 16 16 GLY HA3 H 16 4.022 3.915 0.107 1
1 104 . 7 1 1 A 16 16 GLY C C 16 174.326 174.507 -0.181 1
1 105 . 7 1 1 A 16 16 GLY CA C 16 45.620 46.350 -0.730 1
1 106 . 7 1 1 A 16 16 GLY N N 16 109.734 107.997 1.737 1
1 107 . 7 1 1 A 17 17 GLN H H 17 8.184 7.819 0.365 1
1 108 . 7 1 1 A 17 17 GLN HA H 17 4.366 4.430 -0.064 1
1 113 . 7 1 1 A 17 17 GLN C C 17 175.544 174.883 0.661 1
1 114 . 7 1 1 A 17 17 GLN CA C 17 55.749 54.512 1.237 1
1 115 . 7 1 1 A 17 17 GLN CB C 17 29.367 27.581 1.786 1
1 117 . 7 1 1 A 17 17 GLN N N 17 119.546 121.223 -1.677 1
1 118 . 7 1 1 A 18 18 ARG H H 18 8.366 8.080 0.286 1
1 119 . 7 1 1 A 18 18 ARG HA H 18 4.487 4.391 0.096 1
1 126 . 7 1 1 A 18 18 ARG C C 18 176.042 175.896 0.146 1
1 127 . 7 1 1 A 18 18 ARG CA C 18 55.735 55.907 -0.172 1
1 128 . 7 1 1 A 18 18 ARG CB C 18 31.170 31.462 -0.292 1
1 131 . 7 1 1 A 18 18 ARG N N 18 122.330 123.116 -0.786 1
1 132 . 7 1 1 A 19 19 GLY H H 19 8.192 8.413 -0.221 1
1 133 . 7 1 1 A 19 19 GLY HA2 H 19 4.852 4.134 0.718 1
1 134 . 7 1 1 A 19 19 GLY HA3 H 19 3.894 4.157 -0.263 1
1 135 . 7 1 1 A 19 19 GLY C C 19 172.361 171.872 0.489 1
1 136 . 7 1 1 A 19 19 GLY CA C 19 45.580 44.670 0.910 1
1 137 . 7 1 1 A 19 19 GLY N N 19 109.658 108.185 1.473 1
1 138 . 7 1 1 A 20 20 CYS H H 20 8.843 8.019 0.824 1
1 139 . 7 1 1 A 20 20 CYS HA H 20 5.147 5.063 0.084 1
1 142 . 7 1 1 A 20 20 CYS C C 20 175.211 174.251 0.960 1
1 143 . 7 1 1 A 20 20 CYS CA C 20 56.712 58.204 -1.492 1
1 144 . 7 1 1 A 20 20 CYS CB C 20 33.530 30.835 2.695 1
1 145 . 7 1 1 A 20 20 CYS N N 20 120.185 118.462 1.723 1
1 146 . 7 1 1 A 21 21 GLU H H 21 8.981 8.936 0.045 1
1 147 . 7 1 1 A 21 21 GLU HA H 21 4.100 4.056 0.044 1
1 152 . 7 1 1 A 21 21 GLU C C 21 176.014 178.143 -2.129 1
1 153 . 7 1 1 A 21 21 GLU CA C 21 57.134 58.562 -1.428 1
1 154 . 7 1 1 A 21 21 GLU CB C 21 28.890 28.888 0.002 1
1 156 . 7 1 1 A 21 21 GLU N N 21 116.078 124.177 -8.099 1
1 157 . 7 1 1 A 22 22 HIS H H 22 9.342 7.686 1.656 1
1 158 . 7 1 1 A 22 22 HIS HA H 22 4.210 4.232 -0.022 1
1 161 . 7 1 1 A 22 22 HIS C C 22 175.128 174.827 0.301 1
1 162 . 7 1 1 A 22 22 HIS CA C 22 58.945 59.087 -0.142 1
1 163 . 7 1 1 A 22 22 HIS CB C 22 33.160 30.587 2.573 1
1 164 . 7 1 1 A 22 22 HIS N N 22 122.296 117.158 5.138 1
1 165 . 7 1 1 A 23 23 TYR H H 23 7.931 7.935 -0.004 1
1 166 . 7 1 1 A 23 23 TYR HA H 23 4.856 5.137 -0.281 1
1 171 . 7 1 1 A 23 23 TYR C C 23 173.108 174.753 -1.645 1
1 172 . 7 1 1 A 23 23 TYR CA C 23 57.852 56.238 1.614 1
1 173 . 7 1 1 A 23 23 TYR CB C 23 45.300 41.402 3.898 1
1 175 . 7 1 1 A 23 23 TYR N N 23 115.205 115.480 -0.275 1
1 176 . 7 1 1 A 24 24 ASP H H 24 8.384 8.846 -0.462 1
1 177 . 7 1 1 A 24 24 ASP HA H 24 5.160 4.908 0.252 1
1 180 . 7 1 1 A 24 24 ASP C C 24 174.437 175.114 -0.677 1
1 181 . 7 1 1 A 24 24 ASP CA C 24 53.343 54.008 -0.665 1
1 182 . 7 1 1 A 24 24 ASP CB C 24 41.470 39.268 2.202 1
1 183 . 7 1 1 A 24 24 ASP N N 24 122.016 125.192 -3.176 1
1 184 . 7 1 1 A 25 25 ARG H H 25 7.313 8.084 -0.771 1
1 185 . 7 1 1 A 25 25 ARG HA H 25 5.331 5.338 -0.007 1
1 192 . 7 1 1 A 25 25 ARG C C 25 175.045 176.174 -1.129 1
1 193 . 7 1 1 A 25 25 ARG CA C 25 54.224 54.643 -0.419 1
1 194 . 7 1 1 A 25 25 ARG CB C 25 34.090 34.229 -0.139 1
1 197 . 7 1 1 A 25 25 ARG N N 25 115.898 125.439 -9.541 1
1 198 . 7 1 1 A 26 26 GLY H H 26 9.387 9.238 0.149 1
1 199 . 7 1 1 A 26 26 GLY HA2 H 26 4.622 3.924 0.698 1
1 200 . 7 1 1 A 26 26 GLY HA3 H 26 3.788 3.992 -0.204 1
1 201 . 7 1 1 A 26 26 GLY C C 26 170.978 174.757 -3.779 1
1 202 . 7 1 1 A 26 26 GLY CA C 26 44.794 45.855 -1.061 1
1 203 . 7 1 1 A 26 26 GLY N N 26 105.653 114.228 -8.575 1
1 204 . 7 1 1 A 27 27 CYS H H 27 6.864 7.682 -0.818 1
1 205 . 7 1 1 A 27 27 CYS HA H 27 5.195 4.964 0.231 1
1 208 . 7 1 1 A 27 27 CYS C C 27 171.144 172.883 -1.739 1
1 209 . 7 1 1 A 27 27 CYS CA C 27 52.349 57.230 -4.881 1
1 210 . 7 1 1 A 27 27 CYS CB C 27 30.997 30.710 0.287 1
1 211 . 7 1 1 A 27 27 CYS N N 27 110.921 117.304 -6.383 1
1 212 . 7 1 1 A 28 28 LEU H H 28 8.310 8.631 -0.321 1
1 213 . 7 1 1 A 28 28 LEU HA H 28 4.651 4.883 -0.232 1
1 223 . 7 1 1 A 28 28 LEU C C 28 176.827 176.782 0.045 1
1 224 . 7 1 1 A 28 28 LEU CA C 28 53.054 53.717 -0.663 1
1 225 . 7 1 1 A 28 28 LEU CB C 28 44.200 43.913 0.287 1
1 229 . 7 1 1 A 28 28 LEU N N 28 115.519 123.047 -7.528 1
1 230 . 7 1 1 A 29 29 LEU H H 29 8.800 8.853 -0.053 1
1 231 . 7 1 1 A 29 29 LEU HA H 29 4.313 4.588 -0.275 1
1 240 . 7 1 1 A 29 29 LEU C C 29 175.571 175.486 0.085 1
1 241 . 7 1 1 A 29 29 LEU CA C 29 54.388 54.363 0.025 1
1 242 . 7 1 1 A 29 29 LEU CB C 29 42.780 41.690 1.090 1
1 245 . 7 1 1 A 29 29 LEU N N 29 118.712 124.955 -6.243 1
1 246 . 7 1 1 A 30 30 LYS H H 30 8.009 8.459 -0.450 1
1 247 . 7 1 1 A 30 30 LYS HA H 30 4.592 4.646 -0.054 1
1 256 . 7 1 1 A 30 30 LYS C C 30 174.990 174.887 0.103 1
1 257 . 7 1 1 A 30 30 LYS CA C 30 54.999 56.408 -1.409 1
1 258 . 7 1 1 A 30 30 LYS CB C 30 32.330 32.747 -0.417 1
1 262 . 7 1 1 A 30 30 LYS N N 30 122.310 126.015 -3.705 1
1 263 . 7 1 1 A 31 31 ALA H H 31 9.238 8.619 0.619 1
1 264 . 7 1 1 A 31 31 ALA HA H 31 4.477 4.466 0.011 1
1 268 . 7 1 1 A 31 31 ALA CA C 31 50.190 49.578 0.612 1
1 269 . 7 1 1 A 31 31 ALA CB C 31 21.637 19.916 1.721 1
1 270 . 7 1 1 A 31 31 ALA N N 31 133.864 130.333 3.531 1
1 271 . 7 1 1 A 32 32 PRO HA H 32 4.637 4.451 0.186 1
1 278 . 7 1 1 A 32 32 PRO C C 32 175.737 177.232 -1.495 1
1 279 . 7 1 1 A 32 32 PRO CA C 32 64.259 64.196 0.063 1
1 280 . 7 1 1 A 32 32 PRO CB C 32 31.740 31.805 -0.065 1
1 283 . 7 1 1 A 33 33 CYS H H 33 8.779 8.301 0.478 1
1 284 . 7 1 1 A 33 33 CYS HA H 33 4.321 4.299 0.022 1
1 287 . 7 1 1 A 33 33 CYS C C 33 176.733 175.055 1.678 1
1 288 . 7 1 1 A 33 33 CYS CA C 33 54.398 61.022 -6.624 1
1 289 . 7 1 1 A 33 33 CYS CB C 33 30.697 27.633 3.064 1
1 290 . 7 1 1 A 33 33 CYS N N 33 120.005 116.090 3.915 1
1 291 . 7 1 1 A 34 34 CYS H H 34 7.424 7.539 -0.115 1
1 292 . 7 1 1 A 34 34 CYS HA H 34 4.896 4.666 0.230 1
1 295 . 7 1 1 A 34 34 CYS C C 34 174.935 175.079 -0.144 1
1 296 . 7 1 1 A 34 34 CYS CA C 34 56.962 58.482 -1.520 1
1 297 . 7 1 1 A 34 34 CYS CB C 34 31.067 29.392 1.675 1
1 298 . 7 1 1 A 34 34 CYS N N 34 115.034 117.959 -2.925 1
1 299 . 7 1 1 A 35 35 ASP H H 35 8.368 8.089 0.279 1
1 300 . 7 1 1 A 35 35 ASP HA H 35 4.454 4.271 0.183 1
1 303 . 7 1 1 A 35 35 ASP C C 35 174.354 174.910 -0.556 1
1 304 . 7 1 1 A 35 35 ASP CA C 35 56.222 55.596 0.626 1
1 305 . 7 1 1 A 35 35 ASP CB C 35 39.730 39.369 0.361 1
1 306 . 7 1 1 A 35 35 ASP N N 35 121.381 116.881 4.500 1
1 307 . 7 1 1 A 36 36 LYS H H 36 7.227 7.883 -0.656 1
1 308 . 7 1 1 A 36 36 LYS HA H 36 4.451 4.591 -0.140 1
1 317 . 7 1 1 A 36 36 LYS C C 36 175.433 175.710 -0.277 1
1 318 . 7 1 1 A 36 36 LYS CA C 36 56.270 54.807 1.463 1
1 319 . 7 1 1 A 36 36 LYS CB C 36 36.620 34.091 2.529 1
1 323 . 7 1 1 A 36 36 LYS N N 36 117.673 118.601 -0.928 1
1 324 . 7 1 1 A 37 37 LEU H H 37 8.053 8.343 -0.290 1
1 325 . 7 1 1 A 37 37 LEU HA H 37 5.292 5.096 0.196 1
1 335 . 7 1 1 A 37 37 LEU C C 37 176.484 174.915 1.569 1
1 336 . 7 1 1 A 37 37 LEU CA C 37 53.348 52.873 0.475 1
1 337 . 7 1 1 A 37 37 LEU CB C 37 42.400 43.552 -1.152 1
1 341 . 7 1 1 A 37 37 LEU N N 37 120.994 121.396 -0.402 1
1 342 . 7 1 1 A 38 38 TYR H H 38 8.741 8.500 0.241 1
1 343 . 7 1 1 A 38 38 TYR HA H 38 5.002 4.879 0.123 1
1 350 . 7 1 1 A 38 38 TYR C C 38 176.374 176.020 0.354 1
1 351 . 7 1 1 A 38 38 TYR CA C 38 57.081 56.730 0.351 1
1 352 . 7 1 1 A 38 38 TYR CB C 38 45.647 41.649 3.998 1
1 355 . 7 1 1 A 38 38 TYR N N 38 121.128 122.060 -0.932 1
1 356 . 7 1 1 A 39 39 THR H H 39 9.402 8.721 0.681 1
1 357 . 7 1 1 A 39 39 THR HA H 39 4.098 4.105 -0.007 1
1 362 . 7 1 1 A 39 39 THR C C 39 173.496 174.944 -1.448 1
1 363 . 7 1 1 A 39 39 THR CA C 39 67.062 65.630 1.432 1
1 364 . 7 1 1 A 39 39 THR CB C 39 68.047 68.423 -0.376 1
1 366 . 7 1 1 A 39 39 THR N N 39 116.641 117.903 -1.262 1
1 367 . 7 1 1 A 40 40 CYS H H 40 7.317 8.082 -0.765 1
1 368 . 7 1 1 A 40 40 CYS HA H 40 4.771 4.823 -0.052 1
1 371 . 7 1 1 A 40 40 CYS C C 40 175.128 175.241 -0.113 1
1 372 . 7 1 1 A 40 40 CYS CA C 40 56.577 57.938 -1.361 1
1 373 . 7 1 1 A 40 40 CYS CB C 40 35.087 31.358 3.729 1
1 374 . 7 1 1 A 40 40 CYS N N 40 109.059 118.171 -9.112 1
1 375 . 7 1 1 A 41 41 ARG H H 41 9.201 8.963 0.238 1
1 376 . 7 1 1 A 41 41 ARG HA H 41 3.982 4.003 -0.021 1
1 383 . 7 1 1 A 41 41 ARG C C 41 175.101 177.647 -2.546 1
1 384 . 7 1 1 A 41 41 ARG CA C 41 58.591 58.770 -0.179 1
1 385 . 7 1 1 A 41 41 ARG CB C 41 29.640 29.804 -0.164 1
1 388 . 7 1 1 A 41 41 ARG N N 41 121.737 123.196 -1.459 1
1 389 . 7 1 1 A 42 42 LEU H H 42 9.116 7.754 1.362 1
1 390 . 7 1 1 A 42 42 LEU HA H 42 4.029 4.023 0.006 1
1 400 . 7 1 1 A 42 42 LEU C C 42 179.943 179.283 0.660 1
1 401 . 7 1 1 A 42 42 LEU CA C 42 58.005 57.723 0.282 1
1 402 . 7 1 1 A 42 42 LEU CB C 42 38.960 41.233 -2.273 1
1 406 . 7 1 1 A 42 42 LEU N N 42 126.364 116.997 9.367 1
1 407 . 7 1 1 A 43 43 CYS H H 43 8.785 8.255 0.530 1
1 408 . 7 1 1 A 43 43 CYS HA H 43 4.187 4.187 0.000 1
1 411 . 7 1 1 A 43 43 CYS C C 43 177.785 177.094 0.691 1
1 412 . 7 1 1 A 43 43 CYS CA C 43 66.415 62.638 3.777 1
1 413 . 7 1 1 A 43 43 CYS CB C 43 28.870 27.002 1.868 1
1 414 . 7 1 1 A 43 43 CYS N N 43 124.519 118.269 6.250 1
1 415 . 7 1 1 A 44 44 HIS H H 44 7.604 7.446 0.158 1
1 416 . 7 1 1 A 44 44 HIS HA H 44 1.983 2.800 -0.817 1
1 420 . 7 1 1 A 44 44 HIS C C 44 176.429 176.128 0.301 1
1 421 . 7 1 1 A 44 44 HIS CA C 44 58.760 58.870 -0.110 1
1 422 . 7 1 1 A 44 44 HIS CB C 44 27.990 29.567 -1.577 1
1 423 . 7 1 1 A 44 44 HIS N N 44 117.024 121.198 -4.174 1
1 424 . 7 1 1 A 45 45 ASP H H 45 8.750 8.009 0.741 1
1 425 . 7 1 1 A 45 45 ASP HA H 45 4.116 4.130 -0.014 1
1 428 . 7 1 1 A 45 45 ASP C C 45 177.453 178.115 -0.662 1
1 429 . 7 1 1 A 45 45 ASP CA C 45 56.840 57.416 -0.576 1
1 430 . 7 1 1 A 45 45 ASP CB C 45 38.960 41.765 -2.805 1
1 431 . 7 1 1 A 45 45 ASP N N 45 120.440 119.183 1.257 1
1 432 . 7 1 1 A 46 46 ASN H H 46 7.888 8.310 -0.422 1
1 433 . 7 1 1 A 46 46 ASN HA H 46 4.612 4.419 0.193 1
1 438 . 7 1 1 A 46 46 ASN C C 46 175.903 176.625 -0.722 1
1 439 . 7 1 1 A 46 46 ASN CA C 46 54.342 56.891 -2.549 1
1 440 . 7 1 1 A 46 46 ASN CB C 46 38.790 39.573 -0.783 1
1 441 . 7 1 1 A 46 46 ASN N N 46 115.758 117.110 -1.352 1
1 443 . 7 1 1 A 47 47 ASN H H 47 7.384 7.467 -0.083 1
1 444 . 7 1 1 A 47 47 ASN HA H 47 4.893 4.667 0.226 1
1 449 . 7 1 1 A 47 47 ASN C C 47 173.579 175.642 -2.063 1
1 450 . 7 1 1 A 47 47 ASN CA C 47 53.937 54.149 -0.212 1
1 451 . 7 1 1 A 47 47 ASN CB C 47 43.130 39.417 3.713 1
1 452 . 7 1 1 A 47 47 ASN N N 47 116.576 114.807 1.769 1
1 454 . 7 1 1 A 48 48 GLU H H 48 7.143 7.523 -0.380 1
1 455 . 7 1 1 A 48 48 GLU HA H 48 4.572 4.500 0.072 1
1 460 . 7 1 1 A 48 48 GLU C C 48 175.627 176.000 -0.373 1
1 461 . 7 1 1 A 48 48 GLU CA C 48 53.727 54.386 -0.659 1
1 462 . 7 1 1 A 48 48 GLU CB C 48 32.480 30.324 2.156 1
1 464 . 7 1 1 A 48 48 GLU N N 48 116.967 117.726 -0.759 1
1 465 . 7 1 1 A 49 49 ASP H H 49 8.748 8.877 -0.129 1
1 466 . 7 1 1 A 49 49 ASP HA H 49 4.576 4.733 -0.157 1
1 469 . 7 1 1 A 49 49 ASP C C 49 174.796 175.759 -0.963 1
1 470 . 7 1 1 A 49 49 ASP CA C 49 53.027 55.049 -2.022 1
1 471 . 7 1 1 A 49 49 ASP CB C 49 40.340 41.638 -1.298 1
1 472 . 7 1 1 A 49 49 ASP N N 49 119.296 121.108 -1.812 1
1 473 . 7 1 1 A 50 50 HIS H H 50 6.919 7.275 -0.356 1
1 474 . 7 1 1 A 50 50 HIS HA H 50 4.880 5.114 -0.234 1
1 477 . 7 1 1 A 50 50 HIS C C 50 172.942 172.478 0.464 1
1 478 . 7 1 1 A 50 50 HIS CA C 50 53.978 54.384 -0.406 1
1 479 . 7 1 1 A 50 50 HIS CB C 50 30.330 31.500 -1.170 1
1 480 . 7 1 1 A 50 50 HIS N N 50 113.709 115.714 -2.005 1
1 481 . 7 1 1 A 51 51 GLN H H 51 8.646 8.553 0.093 1
1 482 . 7 1 1 A 51 51 GLN HA H 51 4.896 5.004 -0.108 1
1 487 . 7 1 1 A 51 51 GLN C C 51 176.512 174.412 2.100 1
1 488 . 7 1 1 A 51 51 GLN CA C 51 54.872 54.598 0.274 1
1 489 . 7 1 1 A 51 51 GLN CB C 51 30.950 30.838 0.112 1
1 491 . 7 1 1 A 51 51 GLN N N 51 119.379 118.933 0.446 1
1 492 . 7 1 1 A 52 52 LEU H H 52 9.646 8.503 1.143 1
1 493 . 7 1 1 A 52 52 LEU HA H 52 4.206 4.544 -0.338 1
1 503 . 7 1 1 A 52 52 LEU C C 52 175.793 174.913 0.880 1
1 504 . 7 1 1 A 52 52 LEU CA C 52 55.450 53.851 1.599 1
1 505 . 7 1 1 A 52 52 LEU CB C 52 41.407 43.365 -1.958 1
1 509 . 7 1 1 A 52 52 LEU N N 52 128.069 124.450 3.619 1
1 510 . 7 1 1 A 53 53 ASP H H 53 9.281 8.552 0.729 1
1 511 . 7 1 1 A 53 53 ASP HA H 53 4.725 4.737 -0.012 1
1 514 . 7 1 1 A 53 53 ASP C C 53 176.401 177.280 -0.879 1
1 515 . 7 1 1 A 53 53 ASP CA C 53 52.590 53.770 -1.180 1
1 516 . 7 1 1 A 53 53 ASP CB C 53 39.990 42.618 -2.628 1
1 517 . 7 1 1 A 53 53 ASP N N 53 128.783 127.137 1.646 1
1 518 . 7 1 1 A 54 54 ARG H H 54 8.496 8.521 -0.025 1
1 519 . 7 1 1 A 54 54 ARG HA H 54 3.859 3.853 0.006 1
1 526 . 7 1 1 A 54 54 ARG C C 54 176.346 176.610 -0.264 1
1 527 . 7 1 1 A 54 54 ARG CA C 54 57.357 57.908 -0.551 1
1 528 . 7 1 1 A 54 54 ARG CB C 54 28.890 29.250 -0.360 1
1 531 . 7 1 1 A 54 54 ARG N N 54 125.813 125.012 0.801 1
1 532 . 7 1 1 A 55 55 PHE H H 55 8.005 7.181 0.824 1
1 533 . 7 1 1 A 55 55 PHE HA H 55 4.712 4.340 0.372 1
1 540 . 7 1 1 A 55 55 PHE C C 55 177.481 177.455 0.026 1
1 541 . 7 1 1 A 55 55 PHE CA C 55 59.080 59.910 -0.830 1
1 542 . 7 1 1 A 55 55 PHE CB C 55 37.447 40.093 -2.646 1
1 545 . 7 1 1 A 55 55 PHE N N 55 120.168 117.835 2.333 1
1 546 . 7 1 1 A 56 56 LYS H H 56 7.681 7.142 0.539 1
1 547 . 7 1 1 A 56 56 LYS HA H 56 4.411 4.334 0.077 1
1 556 . 7 1 1 A 56 56 LYS C C 56 175.959 176.396 -0.437 1
1 557 . 7 1 1 A 56 56 LYS CA C 56 55.459 56.798 -1.339 1
1 558 . 7 1 1 A 56 56 LYS CB C 56 33.590 33.048 0.542 1
1 562 . 7 1 1 A 56 56 LYS N N 56 116.937 117.307 -0.370 1
1 563 . 7 1 1 A 57 57 VAL H H 57 6.553 6.881 -0.328 1
1 564 . 7 1 1 A 57 57 VAL HA H 57 3.408 3.962 -0.554 1
1 572 . 7 1 1 A 57 57 VAL C C 57 173.911 175.359 -1.448 1
1 573 . 7 1 1 A 57 57 VAL CA C 57 65.025 61.840 3.185 1
1 574 . 7 1 1 A 57 57 VAL CB C 57 32.663 32.275 0.388 1
1 577 . 7 1 1 A 57 57 VAL N N 57 119.519 117.426 2.093 1
1 578 . 7 1 1 A 58 58 LYS H H 58 9.182 8.988 0.194 1
1 579 . 7 1 1 A 58 58 LYS HA H 58 4.489 4.496 -0.007 1
1 588 . 7 1 1 A 58 58 LYS C C 58 176.927 176.750 0.177 1
1 589 . 7 1 1 A 58 58 LYS CA C 58 55.913 57.382 -1.469 1
1 590 . 7 1 1 A 58 58 LYS CB C 58 36.340 34.617 1.723 1
1 594 . 7 1 1 A 58 58 LYS N N 58 124.985 126.059 -1.074 1
1 595 . 7 1 1 A 59 59 GLU H H 59 8.799 7.902 0.897 1
1 596 . 7 1 1 A 59 59 GLU HA H 59 5.209 4.715 0.494 1
1 601 . 7 1 1 A 59 59 GLU C C 59 173.911 176.088 -2.177 1
1 602 . 7 1 1 A 59 59 GLU CA C 59 54.670 55.687 -1.017 1
1 603 . 7 1 1 A 59 59 GLU CB C 59 35.180 31.080 4.100 1
1 605 . 7 1 1 A 59 59 GLU N N 59 121.493 118.428 3.065 1
1 606 . 7 1 1 A 60 60 VAL H H 60 8.917 8.755 0.162 1
1 607 . 7 1 1 A 60 60 VAL HA H 60 4.983 4.927 0.056 1
1 615 . 7 1 1 A 60 60 VAL C C 60 173.441 174.739 -1.298 1
1 616 . 7 1 1 A 60 60 VAL CA C 60 57.497 58.836 -1.339 1
1 617 . 7 1 1 A 60 60 VAL CB C 60 35.460 35.842 -0.382 1
1 620 . 7 1 1 A 60 60 VAL N N 60 109.266 118.444 -9.178 1
1 621 . 7 1 1 A 61 61 GLN H H 61 8.970 8.320 0.650 1
1 622 . 7 1 1 A 61 61 GLN HA H 61 5.024 5.062 -0.038 1
1 629 . 7 1 1 A 61 61 GLN C C 61 175.045 174.669 0.376 1
1 630 . 7 1 1 A 61 61 GLN CA C 61 53.128 54.959 -1.831 1
1 631 . 7 1 1 A 61 61 GLN CB C 61 33.980 30.836 3.144 1
1 633 . 7 1 1 A 61 61 GLN N N 61 118.525 120.401 -1.876 1
1 635 . 7 1 1 A 62 62 CYS H H 62 7.688 8.154 -0.466 1
1 636 . 7 1 1 A 62 62 CYS HA H 62 4.210 5.273 -1.063 1
1 639 . 7 1 1 A 62 62 CYS C C 62 177.951 173.176 4.775 1
1 640 . 7 1 1 A 62 62 CYS CA C 62 59.845 57.044 2.801 1
1 641 . 7 1 1 A 62 62 CYS CB C 62 33.120 30.279 2.841 1
1 642 . 7 1 1 A 62 62 CYS N N 62 128.772 119.535 9.237 1
1 643 . 7 1 1 A 63 63 ILE H H 63 8.192 8.706 -0.514 1
1 644 . 7 1 1 A 63 63 ILE HA H 63 3.984 4.364 -0.380 1
1 654 . 7 1 1 A 63 63 ILE C C 63 175.433 175.627 -0.194 1
1 655 . 7 1 1 A 63 63 ILE CA C 63 63.657 61.222 2.435 1
1 656 . 7 1 1 A 63 63 ILE CB C 63 38.506 35.740 2.766 1
1 660 . 7 1 1 A 63 63 ILE N N 63 127.455 128.823 -1.368 1
1 661 . 7 1 1 A 64 64 ASN H H 64 9.181 8.525 0.656 1
1 662 . 7 1 1 A 64 64 ASN HA H 64 4.810 4.987 -0.177 1
1 667 . 7 1 1 A 64 64 ASN C C 64 175.931 176.125 -0.194 1
1 668 . 7 1 1 A 64 64 ASN CA C 64 55.617 54.745 0.872 1
1 669 . 7 1 1 A 64 64 ASN CB C 64 40.640 40.270 0.370 1
1 670 . 7 1 1 A 64 64 ASN N N 64 122.104 125.377 -3.273 1
1 672 . 7 1 1 A 65 65 CYS H H 65 9.065 8.010 1.055 1
1 673 . 7 1 1 A 65 65 CYS HA H 65 4.979 4.447 0.532 1
1 676 . 7 1 1 A 65 65 CYS C C 65 176.291 174.680 1.611 1
1 677 . 7 1 1 A 65 65 CYS CA C 65 59.027 59.026 0.001 1
1 678 . 7 1 1 A 65 65 CYS CB C 65 32.030 28.832 3.198 1
1 679 . 7 1 1 A 65 65 CYS N N 65 120.368 116.099 4.269 1
1 680 . 7 1 1 A 66 66 GLU H H 66 7.281 8.105 -0.824 1
1 681 . 7 1 1 A 66 66 GLU HA H 66 4.046 4.136 -0.090 1
1 686 . 7 1 1 A 66 66 GLU C C 66 175.211 174.298 0.913 1
1 687 . 7 1 1 A 66 66 GLU CA C 66 58.591 57.495 1.096 1
1 688 . 7 1 1 A 66 66 GLU CB C 66 27.067 27.219 -0.152 1
1 690 . 7 1 1 A 66 66 GLU N N 66 115.012 116.741 -1.729 1
1 691 . 7 1 1 A 67 67 LYS H H 67 8.481 7.724 0.757 1
1 692 . 7 1 1 A 67 67 LYS HA H 67 4.326 4.696 -0.370 1
1 701 . 7 1 1 A 67 67 LYS C C 67 177.923 175.872 2.051 1
1 702 . 7 1 1 A 67 67 LYS CA C 67 57.628 55.133 2.495 1
1 703 . 7 1 1 A 67 67 LYS CB C 67 33.617 34.357 -0.740 1
1 707 . 7 1 1 A 67 67 LYS N N 67 123.514 119.112 4.402 1
1 708 . 7 1 1 A 68 68 ILE H H 68 8.867 8.337 0.530 1
1 709 . 7 1 1 A 68 68 ILE HA H 68 4.976 4.541 0.435 1
1 719 . 7 1 1 A 68 68 ILE C C 68 175.018 175.496 -0.478 1
1 720 . 7 1 1 A 68 68 ILE CA C 68 60.919 60.532 0.387 1
1 721 . 7 1 1 A 68 68 ILE CB C 68 37.090 37.343 -0.253 1
1 725 . 7 1 1 A 68 68 ILE N N 68 133.478 124.721 8.757 1
1 726 . 7 1 1 A 69 69 GLN H H 69 9.269 8.796 0.473 1
1 727 . 7 1 1 A 69 69 GLN HA H 69 5.036 4.773 0.263 1
1 732 . 7 1 1 A 69 69 GLN C C 69 173.607 174.632 -1.025 1
1 733 . 7 1 1 A 69 69 GLN CA C 69 53.419 53.655 -0.236 1
1 734 . 7 1 1 A 69 69 GLN CB C 69 34.997 32.257 2.740 1
1 736 . 7 1 1 A 69 69 GLN N N 69 125.104 124.136 0.968 1
1 737 . 7 1 1 A 70 70 HIS H H 70 8.829 8.166 0.663 1
1 738 . 7 1 1 A 70 70 HIS HA H 70 4.865 4.754 0.111 1
1 741 . 7 1 1 A 70 70 HIS C C 70 174.852 175.252 -0.400 1
1 742 . 7 1 1 A 70 70 HIS CA C 70 56.304 57.202 -0.898 1
1 743 . 7 1 1 A 70 70 HIS CB C 70 30.050 30.329 -0.279 1
1 744 . 7 1 1 A 70 70 HIS N N 70 118.576 119.607 -1.031 1
1 745 . 7 1 1 A 71 71 ALA H H 71 7.768 8.530 -0.762 1
1 746 . 7 1 1 A 71 71 ALA HA H 71 3.977 4.524 -0.547 1
1 750 . 7 1 1 A 71 71 ALA C C 71 175.433 177.237 -1.804 1
1 751 . 7 1 1 A 71 71 ALA CA C 71 54.393 52.782 1.611 1
1 752 . 7 1 1 A 71 71 ALA CB C 71 18.000 19.508 -1.508 1
1 753 . 7 1 1 A 71 71 ALA N N 71 121.438 124.912 -3.474 1
1 754 . 7 1 1 A 72 72 GLN H H 72 7.227 8.444 -1.217 1
1 755 . 7 1 1 A 72 72 GLN HA H 72 4.371 4.528 -0.157 1
1 762 . 7 1 1 A 72 72 GLN C C 72 173.053 175.242 -2.189 1
1 763 . 7 1 1 A 72 72 GLN CA C 72 54.290 54.923 -0.633 1
1 764 . 7 1 1 A 72 72 GLN CB C 72 28.623 28.989 -0.366 1
1 766 . 7 1 1 A 72 72 GLN N N 72 115.858 120.380 -4.522 1
1 768 . 7 1 1 A 73 73 GLN H H 73 8.481 8.504 -0.023 1
1 769 . 7 1 1 A 73 73 GLN HA H 73 3.570 3.935 -0.365 1
1 776 . 7 1 1 A 73 73 GLN C C 73 174.243 175.328 -1.085 1
1 777 . 7 1 1 A 73 73 GLN CA C 73 60.206 57.312 2.894 1
1 778 . 7 1 1 A 73 73 GLN CB C 73 28.850 29.276 -0.426 1
1 780 . 7 1 1 A 73 73 GLN N N 73 116.433 118.326 -1.893 1
1 782 . 7 1 1 A 74 74 THR H H 74 7.211 7.403 -0.192 1
1 783 . 7 1 1 A 74 74 THR HA H 74 4.160 4.487 -0.327 1
1 788 . 7 1 1 A 74 74 THR C C 74 171.836 172.641 -0.805 1
1 789 . 7 1 1 A 74 74 THR CA C 74 59.072 58.904 0.168 1
1 790 . 7 1 1 A 74 74 THR CB C 74 71.560 71.069 0.491 1
1 792 . 7 1 1 A 74 74 THR N N 74 108.717 107.932 0.785 1
1 793 . 7 1 1 A 75 75 CYS H H 75 7.676 8.035 -0.359 1
1 794 . 7 1 1 A 75 75 CYS HA H 75 4.158 4.536 -0.378 1
1 797 . 7 1 1 A 75 75 CYS C C 75 178.781 175.888 2.893 1
1 798 . 7 1 1 A 75 75 CYS CA C 75 58.661 58.488 0.173 1
1 799 . 7 1 1 A 75 75 CYS CB C 75 30.840 28.359 2.481 1
1 800 . 7 1 1 A 75 75 CYS N N 75 123.108 122.054 1.054 1
1 801 . 7 1 1 A 76 76 GLU H H 76 9.203 8.850 0.353 1
1 802 . 7 1 1 A 76 76 GLU HA H 76 4.187 4.054 0.133 1
1 807 . 7 1 1 A 76 76 GLU C C 76 175.488 178.709 -3.221 1
1 808 . 7 1 1 A 76 76 GLU CA C 76 57.306 58.673 -1.367 1
1 809 . 7 1 1 A 76 76 GLU CB C 76 29.347 29.255 0.092 1
1 811 . 7 1 1 A 76 76 GLU N N 76 129.817 127.136 2.681 1
1 812 . 7 1 1 A 77 77 GLU H H 77 9.496 7.491 2.005 1
1 813 . 7 1 1 A 77 77 GLU HA H 77 4.599 4.201 0.398 1
1 818 . 7 1 1 A 77 77 GLU C C 77 177.148 177.221 -0.073 1
1 819 . 7 1 1 A 77 77 GLU CA C 77 57.554 58.499 -0.945 1
1 820 . 7 1 1 A 77 77 GLU CB C 77 31.980 30.735 1.245 1
1 822 . 7 1 1 A 77 77 GLU N N 77 124.795 120.550 4.245 1
1 823 . 7 1 1 A 78 78 CYS H H 78 8.967 7.423 1.544 1
1 824 . 7 1 1 A 78 78 CYS HA H 78 5.073 4.635 0.438 1
1 827 . 7 1 1 A 78 78 CYS C C 78 176.374 174.905 1.469 1
1 828 . 7 1 1 A 78 78 CYS CA C 78 58.537 58.096 0.441 1
1 829 . 7 1 1 A 78 78 CYS CB C 78 31.597 28.689 2.908 1
1 830 . 7 1 1 A 78 78 CYS N N 78 119.692 115.301 4.391 1
1 831 . 7 1 1 A 79 79 SER H H 79 7.474 8.240 -0.766 1
1 832 . 7 1 1 A 79 79 SER HA H 79 4.113 4.034 0.079 1
1 835 . 7 1 1 A 79 79 SER C C 79 172.915 173.354 -0.439 1
1 836 . 7 1 1 A 79 79 SER CA C 79 60.440 59.536 0.904 1
1 837 . 7 1 1 A 79 79 SER CB C 79 61.421 61.313 0.108 1
1 838 . 7 1 1 A 79 79 SER N N 79 113.385 112.178 1.207 1
1 839 . 7 1 1 A 80 80 THR H H 80 7.907 7.683 0.224 1
1 840 . 7 1 1 A 80 80 THR HA H 80 3.913 4.143 -0.230 1
1 845 . 7 1 1 A 80 80 THR C C 80 172.306 173.961 -1.655 1
1 846 . 7 1 1 A 80 80 THR CA C 80 65.262 63.867 1.395 1
1 847 . 7 1 1 A 80 80 THR CB C 80 69.910 69.144 0.766 1
1 849 . 7 1 1 A 80 80 THR N N 80 120.005 115.608 4.397 1
1 850 . 7 1 1 A 81 81 LEU H H 81 8.556 8.433 0.123 1
1 851 . 7 1 1 A 81 81 LEU HA H 81 4.172 4.186 -0.014 1
1 861 . 7 1 1 A 81 81 LEU C C 81 177.121 176.350 0.771 1
1 862 . 7 1 1 A 81 81 LEU CA C 81 54.996 54.868 0.128 1
1 863 . 7 1 1 A 81 81 LEU CB C 81 42.147 42.515 -0.368 1
1 867 . 7 1 1 A 81 81 LEU N N 81 128.272 128.789 -0.517 1
1 868 . 7 1 1 A 82 82 PHE H H 82 9.251 8.740 0.511 1
1 869 . 7 1 1 A 82 82 PHE HA H 82 4.576 4.474 0.102 1
1 874 . 7 1 1 A 82 82 PHE C C 82 177.785 175.994 1.791 1
1 875 . 7 1 1 A 82 82 PHE CA C 82 56.470 59.935 -3.465 1
1 876 . 7 1 1 A 82 82 PHE CB C 82 38.210 38.770 -0.560 1
1 878 . 7 1 1 A 82 82 PHE N N 82 129.268 126.403 2.865 1
1 879 . 7 1 1 A 83 83 GLY H H 83 7.047 7.365 -0.318 1
1 880 . 7 1 1 A 83 83 GLY HA2 H 83 4.783 4.207 0.576 1
1 881 . 7 1 1 A 83 83 GLY HA3 H 83 3.876 4.280 -0.404 1
1 882 . 7 1 1 A 83 83 GLY C C 83 171.642 174.722 -3.080 1
1 883 . 7 1 1 A 83 83 GLY CA C 83 45.826 46.223 -0.397 1
1 884 . 7 1 1 A 83 83 GLY N N 83 102.168 104.763 -2.595 1
1 885 . 7 1 1 A 84 84 GLU H H 84 8.444 8.803 -0.359 1
1 886 . 7 1 1 A 84 84 GLU HA H 84 4.111 4.165 -0.054 1
1 891 . 7 1 1 A 84 84 GLU C C 84 177.259 176.597 0.662 1
1 892 . 7 1 1 A 84 84 GLU CA C 84 59.438 58.741 0.697 1
1 893 . 7 1 1 A 84 84 GLU CB C 84 30.670 30.294 0.376 1
1 895 . 7 1 1 A 84 84 GLU N N 84 127.546 121.483 6.063 1
1 896 . 7 1 1 A 85 85 TYR H H 85 9.344 7.995 1.349 1
1 897 . 7 1 1 A 85 85 TYR HA H 85 4.599 5.115 -0.516 1
1 902 . 7 1 1 A 85 85 TYR C C 85 173.302 173.886 -0.584 1
1 903 . 7 1 1 A 85 85 TYR CA C 85 57.261 56.569 0.692 1
1 904 . 7 1 1 A 85 85 TYR CB C 85 40.850 40.410 0.440 1
1 906 . 7 1 1 A 85 85 TYR N N 85 118.936 121.394 -2.458 1
1 907 . 7 1 1 A 86 86 TYR H H 86 7.323 8.732 -1.409 1
1 908 . 7 1 1 A 86 86 TYR HA H 86 5.298 6.132 -0.834 1
1 911 . 7 1 1 A 86 86 TYR C C 86 172.804 173.761 -0.957 1
1 912 . 7 1 1 A 86 86 TYR CA C 86 54.041 55.507 -1.466 1
1 913 . 7 1 1 A 86 86 TYR CB C 86 40.987 42.384 -1.397 1
1 914 . 7 1 1 A 86 86 TYR N N 86 124.965 123.315 1.650 1
1 915 . 7 1 1 A 87 87 CYS H H 87 7.046 9.056 -2.010 1
1 916 . 7 1 1 A 87 87 CYS HA H 87 3.842 4.914 -1.072 1
1 919 . 7 1 1 A 87 87 CYS C C 87 174.243 174.254 -0.011 1
1 920 . 7 1 1 A 87 87 CYS CA C 87 56.377 58.941 -2.564 1
1 921 . 7 1 1 A 87 87 CYS CB C 87 33.230 30.372 2.858 1
1 922 . 7 1 1 A 87 87 CYS N N 87 128.735 118.615 10.120 1
1 923 . 7 1 1 A 88 88 ASP H H 88 8.002 8.973 -0.971 1
1 924 . 7 1 1 A 88 88 ASP HA H 88 3.761 4.617 -0.856 1
1 927 . 7 1 1 A 88 88 ASP C C 88 173.579 178.073 -4.494 1
1 928 . 7 1 1 A 88 88 ASP CA C 88 53.958 55.853 -1.895 1
1 929 . 7 1 1 A 88 88 ASP CB C 88 41.240 40.898 0.342 1
1 930 . 7 1 1 A 88 88 ASP N N 88 127.013 127.211 -0.198 1
1 931 . 7 1 1 A 89 89 ILE H H 89 7.972 7.813 0.159 1
1 932 . 7 1 1 A 89 89 ILE HA H 89 3.660 3.726 -0.066 1
1 942 . 7 1 1 A 89 89 ILE C C 89 177.259 177.786 -0.527 1
1 943 . 7 1 1 A 89 89 ILE CA C 89 63.107 65.227 -2.120 1
1 944 . 7 1 1 A 89 89 ILE CB C 89 39.430 38.109 1.321 1
1 948 . 7 1 1 A 89 89 ILE N N 89 120.357 119.550 0.807 1
1 949 . 7 1 1 A 90 90 CYS H H 90 8.554 7.925 0.629 1
1 950 . 7 1 1 A 90 90 CYS HA H 90 3.677 4.854 -1.177 1
1 953 . 7 1 1 A 90 90 CYS C C 90 175.128 174.684 0.444 1
1 954 . 7 1 1 A 90 90 CYS CA C 90 60.791 60.064 0.727 1
1 955 . 7 1 1 A 90 90 CYS CB C 90 30.427 28.377 2.050 1
1 956 . 7 1 1 A 90 90 CYS N N 90 119.564 117.624 1.940 1
1 957 . 7 1 1 A 91 91 HIS H H 91 7.364 8.212 -0.848 1
1 958 . 7 1 1 A 91 91 HIS HA H 91 3.512 4.028 -0.516 1
1 963 . 7 1 1 A 91 91 HIS C C 91 170.590 173.631 -3.041 1
1 964 . 7 1 1 A 91 91 HIS CA C 91 58.739 56.593 2.146 1
1 965 . 7 1 1 A 91 91 HIS CB C 91 24.810 28.256 -3.446 1
1 968 . 7 1 1 A 91 91 HIS N N 91 111.440 118.655 -7.215 1
1 969 . 7 1 1 A 92 92 LEU H H 92 6.214 7.132 -0.918 1
1 970 . 7 1 1 A 92 92 LEU HA H 92 4.191 4.605 -0.414 1
1 980 . 7 1 1 A 92 92 LEU C C 92 173.911 174.882 -0.971 1
1 981 . 7 1 1 A 92 92 LEU CA C 92 53.717 52.808 0.909 1
1 982 . 7 1 1 A 92 92 LEU CB C 92 45.360 45.823 -0.463 1
1 986 . 7 1 1 A 92 92 LEU N N 92 115.684 114.810 0.874 1
1 987 . 7 1 1 A 93 93 PHE H H 93 6.669 8.584 -1.915 1
1 988 . 7 1 1 A 93 93 PHE HA H 93 5.622 5.223 0.399 1
1 995 . 7 1 1 A 93 93 PHE C C 93 175.765 173.879 1.886 1
1 996 . 7 1 1 A 93 93 PHE CA C 93 55.387 56.562 -1.175 1
1 997 . 7 1 1 A 93 93 PHE CB C 93 42.700 41.048 1.652 1
1 1000 . 7 1 1 A 93 93 PHE N N 93 121.535 119.443 2.092 1
1 1001 . 7 1 1 A 94 94 ASP H H 94 9.209 8.891 0.318 1
1 1002 . 7 1 1 A 94 94 ASP HA H 94 5.819 5.296 0.523 1
1 1005 . 7 1 1 A 94 94 ASP C C 94 175.654 175.038 0.616 1
1 1006 . 7 1 1 A 94 94 ASP CA C 94 53.330 53.166 0.164 1
1 1007 . 7 1 1 A 94 94 ASP CB C 94 44.720 45.114 -0.394 1
1 1008 . 7 1 1 A 94 94 ASP N N 94 123.504 123.529 -0.025 1
1 1009 . 7 1 1 A 95 95 LYS H H 95 9.043 8.337 0.706 1
1 1010 . 7 1 1 A 95 95 LYS HA H 95 4.527 4.443 0.084 1
1 1019 . 7 1 1 A 95 95 LYS C C 95 174.879 176.422 -1.543 1
1 1020 . 7 1 1 A 95 95 LYS CA C 95 56.620 57.319 -0.699 1
1 1021 . 7 1 1 A 95 95 LYS CB C 95 33.720 33.135 0.585 1
1 1025 . 7 1 1 A 95 95 LYS N N 95 120.380 124.765 -4.385 1
1 1026 . 7 1 1 A 96 96 ASP H H 96 8.999 8.729 0.270 1
1 1027 . 7 1 1 A 96 96 ASP HA H 96 4.724 4.789 -0.065 1
1 1030 . 7 1 1 A 96 96 ASP C C 96 176.401 174.996 1.405 1
1 1031 . 7 1 1 A 96 96 ASP CA C 96 56.147 53.693 2.454 1
1 1032 . 7 1 1 A 96 96 ASP CB C 96 40.790 41.205 -0.415 1
1 1033 . 7 1 1 A 96 96 ASP N N 96 120.784 124.293 -3.509 1
1 1034 . 7 1 1 A 97 97 LYS H H 97 9.382 8.647 0.735 1
1 1035 . 7 1 1 A 97 97 LYS HA H 97 4.473 4.651 -0.178 1
1 1044 . 7 1 1 A 97 97 LYS C C 97 175.903 176.290 -0.387 1
1 1045 . 7 1 1 A 97 97 LYS CA C 97 54.771 54.891 -0.120 1
1 1046 . 7 1 1 A 97 97 LYS CB C 97 33.270 32.743 0.527 1
1 1050 . 7 1 1 A 97 97 LYS N N 97 131.617 126.422 5.195 1
1 1051 . 7 1 1 A 98 98 LYS H H 98 8.940 8.279 0.661 1
1 1052 . 7 1 1 A 98 98 LYS HA H 98 4.118 3.867 0.251 1
1 1061 . 7 1 1 A 98 98 LYS C C 98 177.065 175.226 1.839 1
1 1062 . 7 1 1 A 98 98 LYS CA C 98 56.297 57.664 -1.367 1
1 1063 . 7 1 1 A 98 98 LYS CB C 98 28.467 29.623 -1.156 1
1 1067 . 7 1 1 A 98 98 LYS N N 98 115.034 117.091 -2.057 1
1 1068 . 7 1 1 A 99 99 GLN H H 99 9.266 7.948 1.318 1
1 1069 . 7 1 1 A 99 99 GLN HA H 99 4.460 4.784 -0.324 1
1 1074 . 7 1 1 A 99 99 GLN C C 99 174.990 175.043 -0.053 1
1 1075 . 7 1 1 A 99 99 GLN CA C 99 57.563 54.970 2.593 1
1 1076 . 7 1 1 A 99 99 GLN CB C 99 27.280 30.187 -2.907 1
1 1078 . 7 1 1 A 99 99 GLN N N 99 117.717 117.935 -0.218 1
1 1079 . 7 1 1 A 100 100 TYR H H 100 8.402 8.845 -0.443 1
1 1080 . 7 1 1 A 100 100 TYR HA H 100 4.935 5.273 -0.338 1
1 1087 . 7 1 1 A 100 100 TYR C C 100 171.504 172.570 -1.066 1
1 1088 . 7 1 1 A 100 100 TYR CA C 100 55.786 56.063 -0.277 1
1 1089 . 7 1 1 A 100 100 TYR CB C 100 41.090 41.473 -0.383 1
1 1092 . 7 1 1 A 100 100 TYR N N 100 115.081 115.923 -0.842 1
1 1093 . 7 1 1 A 101 101 HIS H H 101 8.829 8.968 -0.139 1
1 1094 . 7 1 1 A 101 101 HIS HA H 101 4.525 4.908 -0.383 1
1 1099 . 7 1 1 A 101 101 HIS C C 101 174.935 173.817 1.118 1
1 1100 . 7 1 1 A 101 101 HIS CA C 101 56.327 54.997 1.330 1
1 1101 . 7 1 1 A 101 101 HIS CB C 101 31.020 30.285 0.735 1
1 1104 . 7 1 1 A 101 101 HIS N N 101 120.894 122.121 -1.227 1
1 1105 . 7 1 1 A 102 102 CYS H H 102 7.427 8.204 -0.777 1
1 1106 . 7 1 1 A 102 102 CYS HA H 102 4.561 4.371 0.190 1
1 1109 . 7 1 1 A 102 102 CYS C C 102 175.765 175.477 0.288 1
1 1110 . 7 1 1 A 102 102 CYS CA C 102 57.707 59.010 -1.303 1
1 1111 . 7 1 1 A 102 102 CYS CB C 102 29.130 28.087 1.043 1
1 1112 . 7 1 1 A 102 102 CYS N N 102 131.256 126.605 4.651 1
1 1113 . 7 1 1 A 103 103 GLU H H 103 9.497 8.823 0.674 1
1 1114 . 7 1 1 A 103 103 GLU HA H 103 4.003 4.076 -0.073 1
1 1119 . 7 1 1 A 103 103 GLU C C 103 176.540 178.518 -1.978 1
1 1120 . 7 1 1 A 103 103 GLU CA C 103 58.796 59.391 -0.595 1
1 1121 . 7 1 1 A 103 103 GLU CB C 103 29.280 29.699 -0.419 1
1 1123 . 7 1 1 A 103 103 GLU N N 103 129.829 127.800 2.029 1
1 1124 . 7 1 1 A 104 104 ASN H H 104 7.832 8.523 -0.691 1
1 1125 . 7 1 1 A 104 104 ASN HA H 104 4.457 4.384 0.073 1
1 1130 . 7 1 1 A 104 104 ASN C C 104 176.401 177.836 -1.435 1
1 1131 . 7 1 1 A 104 104 ASN CA C 104 56.053 55.931 0.122 1
1 1132 . 7 1 1 A 104 104 ASN CB C 104 38.400 37.394 1.006 1
1 1133 . 7 1 1 A 104 104 ASN N N 104 117.703 117.116 0.587 1
1 1135 . 7 1 1 A 105 105 CYS H H 105 9.415 7.613 1.802 1
1 1136 . 7 1 1 A 105 105 CYS HA H 105 4.137 4.395 -0.258 1
1 1139 . 7 1 1 A 105 105 CYS C C 105 176.844 175.257 1.587 1
1 1140 . 7 1 1 A 105 105 CYS CA C 105 64.328 59.367 4.961 1
1 1141 . 7 1 1 A 105 105 CYS CB C 105 30.350 28.143 2.207 1
1 1142 . 7 1 1 A 105 105 CYS N N 105 124.939 116.586 8.353 1
1 1143 . 7 1 1 A 106 106 GLY H H 106 8.145 8.604 -0.459 1
1 1144 . 7 1 1 A 106 106 GLY HA2 H 106 3.980 3.902 0.078 1
1 1145 . 7 1 1 A 106 106 GLY HA3 H 106 3.502 3.933 -0.431 1
1 1146 . 7 1 1 A 106 106 GLY C C 106 172.500 173.638 -1.138 1
1 1147 . 7 1 1 A 106 106 GLY CA C 106 44.968 46.196 -1.228 1
1 1148 . 7 1 1 A 106 106 GLY N N 106 106.090 109.599 -3.509 1
1 1149 . 7 1 1 A 107 107 ILE H H 107 6.465 6.851 -0.386 1
1 1150 . 7 1 1 A 107 107 ILE HA H 107 4.878 5.418 -0.540 1
1 1160 . 7 1 1 A 107 107 ILE C C 107 174.824 174.309 0.515 1
1 1161 . 7 1 1 A 107 107 ILE CA C 107 58.226 58.381 -0.155 1
1 1162 . 7 1 1 A 107 107 ILE CB C 107 44.460 42.510 1.950 1
1 1166 . 7 1 1 A 107 107 ILE N N 107 107.914 114.571 -6.657 1
1 1167 . 7 1 1 A 108 108 CYS H H 108 7.041 9.052 -2.011 1
1 1168 . 7 1 1 A 108 108 CYS HA H 108 5.018 5.328 -0.310 1
1 1171 . 7 1 1 A 108 108 CYS C C 108 175.461 173.195 2.266 1
1 1172 . 7 1 1 A 108 108 CYS CA C 108 62.097 58.017 4.080 1
1 1173 . 7 1 1 A 108 108 CYS CB C 108 31.353 31.093 0.260 1
1 1174 . 7 1 1 A 108 108 CYS N N 108 122.441 121.145 1.296 1
1 1175 . 7 1 1 A 109 109 ARG H H 109 8.561 8.402 0.159 1
1 1176 . 7 1 1 A 109 109 ARG HA H 109 4.239 4.848 -0.609 1
1 1183 . 7 1 1 A 109 109 ARG C C 109 174.271 176.032 -1.761 1
1 1184 . 7 1 1 A 109 109 ARG CA C 109 52.962 53.886 -0.924 1
1 1185 . 7 1 1 A 109 109 ARG CB C 109 33.903 34.677 -0.774 1
1 1188 . 7 1 1 A 109 109 ARG N N 109 121.163 122.905 -1.742 1
1 1189 . 7 1 1 A 110 110 ILE H H 110 7.847 8.426 -0.579 1
1 1190 . 7 1 1 A 110 110 ILE HA H 110 3.531 3.945 -0.414 1
1 1200 . 7 1 1 A 110 110 ILE C C 110 175.405 176.163 -0.758 1
1 1201 . 7 1 1 A 110 110 ILE CA C 110 62.201 62.604 -0.403 1
1 1202 . 7 1 1 A 110 110 ILE CB C 110 36.860 36.978 -0.118 1
1 1206 . 7 1 1 A 110 110 ILE N N 110 118.955 120.893 -1.938 1
1 1207 . 7 1 1 A 111 111 GLY H H 111 6.928 8.309 -1.381 1
1 1208 . 7 1 1 A 111 111 GLY HA2 H 111 4.564 4.063 0.501 1
1 1209 . 7 1 1 A 111 111 GLY HA3 H 111 4.135 4.255 -0.120 1
1 1210 . 7 1 1 A 111 111 GLY CA C 111 43.068 45.502 -2.434 1
1 1211 . 7 1 1 A 111 111 GLY N N 111 113.782 114.574 -0.792 1
1 1212 . 7 1 1 A 112 112 PRO HA H 112 4.990 4.852 0.138 1
1 1219 . 7 1 1 A 112 112 PRO C C 112 177.342 177.510 -0.168 1
1 1220 . 7 1 1 A 112 112 PRO CA C 112 62.920 62.676 0.244 1
1 1221 . 7 1 1 A 112 112 PRO CB C 112 34.807 31.714 3.093 1
1 1224 . 7 1 1 A 113 113 LYS H H 113 8.989 8.439 0.550 1
1 1225 . 7 1 1 A 113 113 LYS HA H 113 3.144 3.769 -0.625 1
1 1234 . 7 1 1 A 113 113 LYS C C 113 177.536 178.111 -0.575 1
1 1235 . 7 1 1 A 113 113 LYS CA C 113 59.883 58.765 1.118 1
1 1236 . 7 1 1 A 113 113 LYS CB C 113 32.260 31.673 0.587 1
1 1240 . 7 1 1 A 113 113 LYS N N 113 123.545 123.616 -0.071 1
1 1241 . 7 1 1 A 114 114 GLU H H 114 9.080 9.181 -0.101 1
1 1242 . 7 1 1 A 114 114 GLU HA H 114 4.199 4.018 0.181 1
1 1247 . 7 1 1 A 114 114 GLU C C 114 176.374 177.307 -0.933 1
1 1248 . 7 1 1 A 114 114 GLU CA C 114 58.733 59.439 -0.706 1
1 1249 . 7 1 1 A 114 114 GLU CB C 114 28.077 28.926 -0.849 1
1 1251 . 7 1 1 A 114 114 GLU N N 114 114.832 120.334 -5.502 1
1 1252 . 7 1 1 A 115 115 ASP H H 115 7.799 8.099 -0.300 1
1 1253 . 7 1 1 A 115 115 ASP HA H 115 4.642 4.831 -0.189 1
1 1256 . 7 1 1 A 115 115 ASP C C 115 176.374 175.212 1.162 1
1 1257 . 7 1 1 A 115 115 ASP CA C 115 54.470 54.249 0.221 1
1 1258 . 7 1 1 A 115 115 ASP CB C 115 40.850 42.559 -1.709 1
1 1259 . 7 1 1 A 115 115 ASP N N 115 118.858 117.794 1.064 1
1 1260 . 7 1 1 A 116 116 PHE H H 116 8.063 7.406 0.657 1
1 1261 . 7 1 1 A 116 116 PHE HA H 116 5.239 5.009 0.230 1
1 1264 . 7 1 1 A 116 116 PHE C C 116 173.413 173.275 0.138 1
1 1265 . 7 1 1 A 116 116 PHE CA C 116 57.708 57.501 0.207 1
1 1266 . 7 1 1 A 116 116 PHE CB C 116 44.557 42.215 2.342 1
1 1267 . 7 1 1 A 116 116 PHE N N 116 120.567 120.346 0.221 1
1 1268 . 7 1 1 A 117 117 PHE H H 117 9.439 8.769 0.670 1
1 1269 . 7 1 1 A 117 117 PHE HA H 117 5.091 5.160 -0.069 1
1 1277 . 7 1 1 A 117 117 PHE C C 117 171.614 172.216 -0.602 1
1 1278 . 7 1 1 A 117 117 PHE CA C 117 55.311 55.166 0.145 1
1 1279 . 7 1 1 A 117 117 PHE CB C 117 41.887 41.576 0.311 1
1 1283 . 7 1 1 A 117 117 PHE N N 117 118.040 121.065 -3.025 1
1 1284 . 7 1 1 A 118 118 HIS H H 118 8.779 8.928 -0.149 1
1 1285 . 7 1 1 A 118 118 HIS HA H 118 4.836 4.753 0.083 1
1 1289 . 7 1 1 A 118 118 HIS C C 118 174.879 173.604 1.275 1
1 1290 . 7 1 1 A 118 118 HIS CA C 118 55.322 54.459 0.863 1
1 1291 . 7 1 1 A 118 118 HIS CB C 118 30.950 31.612 -0.662 1
1 1293 . 7 1 1 A 118 118 HIS N N 118 121.208 119.292 1.916 1
1 1294 . 7 1 1 A 119 119 CYS H H 119 8.123 7.760 0.363 1
1 1295 . 7 1 1 A 119 119 CYS HA H 119 4.529 4.520 0.009 1
1 1298 . 7 1 1 A 119 119 CYS C C 119 176.567 175.847 0.720 1
1 1299 . 7 1 1 A 119 119 CYS CA C 119 58.957 59.144 -0.187 1
1 1300 . 7 1 1 A 119 119 CYS CB C 119 30.090 28.166 1.924 1
1 1301 . 7 1 1 A 119 119 CYS N N 119 131.659 126.368 5.291 1
1 1302 . 7 1 1 A 120 120 LEU H H 120 8.970 8.846 0.124 1
1 1303 . 7 1 1 A 120 120 LEU N N 120 130.361 128.582 1.779 1
1 1304 . 7 1 1 A 121 121 LYS HA H 121 4.299 4.398 -0.099 1
1 1313 . 7 1 1 A 121 121 LYS CA C 121 58.727 56.022 2.705 1
1 1314 . 7 1 1 A 121 121 LYS CB C 121 33.210 30.613 2.597 1
1 1318 . 7 1 1 A 123 123 ASN HA H 123 4.438 4.875 -0.437 1
1 1323 . 7 1 1 A 123 123 ASN C C 123 172.444 174.488 -2.044 1
1 1324 . 7 1 1 A 123 123 ASN CA C 123 53.448 53.104 0.344 1
1 1325 . 7 1 1 A 123 123 ASN CB C 123 37.130 38.000 -0.870 1
1 1327 . 7 1 1 A 124 124 LEU H H 124 6.596 7.218 -0.622 1
1 1328 . 7 1 1 A 124 124 LEU HA H 124 4.576 4.744 -0.168 1
1 1338 . 7 1 1 A 124 124 LEU C C 124 175.903 174.023 1.880 1
1 1339 . 7 1 1 A 124 124 LEU CA C 124 54.043 53.866 0.177 1
1 1340 . 7 1 1 A 124 124 LEU CB C 124 45.837 45.578 0.259 1
1 1344 . 7 1 1 A 124 124 LEU N N 124 115.443 120.110 -4.667 1
1 1345 . 7 1 1 A 125 125 CYS H H 125 6.342 8.428 -2.086 1
1 1346 . 7 1 1 A 125 125 CYS HA H 125 5.033 4.602 0.431 1
1 1349 . 7 1 1 A 125 125 CYS C C 125 175.101 174.152 0.949 1
1 1350 . 7 1 1 A 125 125 CYS CA C 125 62.046 57.491 4.555 1
1 1351 . 7 1 1 A 125 125 CYS CB C 125 30.840 27.602 3.238 1
1 1352 . 7 1 1 A 125 125 CYS N N 125 118.685 123.355 -4.670 1
1 1353 . 7 1 1 A 126 126 LEU H H 126 8.894 7.607 1.287 1
1 1354 . 7 1 1 A 126 126 LEU HA H 126 4.565 4.834 -0.269 1
1 1364 . 7 1 1 A 126 126 LEU C C 126 174.879 175.636 -0.757 1
1 1365 . 7 1 1 A 126 126 LEU CA C 126 52.751 53.053 -0.302 1
1 1366 . 7 1 1 A 126 126 LEU CB C 126 46.090 44.522 1.568 1
1 1370 . 7 1 1 A 126 126 LEU N N 126 124.501 125.201 -0.700 1
1 1371 . 7 1 1 A 127 127 ALA H H 127 8.378 8.881 -0.503 1
1 1372 . 7 1 1 A 127 127 ALA HA H 127 3.957 4.939 -0.982 1
1 1376 . 7 1 1 A 127 127 ALA C C 127 179.085 178.232 0.853 1
1 1377 . 7 1 1 A 127 127 ALA CA C 127 52.554 51.912 0.642 1
1 1378 . 7 1 1 A 127 127 ALA CB C 127 18.527 19.759 -1.232 1
1 1379 . 7 1 1 A 127 127 ALA N N 127 123.011 123.731 -0.720 1
1 1380 . 7 1 1 A 128 128 MET H H 128 8.237 9.080 -0.843 1
1 1385 . 7 1 1 A 128 128 MET N N 128 120.642 122.033 -1.391 1
1 1386 . 7 1 1 A 129 129 ASN HA H 129 4.502 4.512 -0.010 1
1 1389 . 7 1 1 A 129 129 ASN C C 129 175.931 177.729 -1.798 1
1 1390 . 7 1 1 A 129 129 ASN CA C 129 55.064 55.678 -0.614 1
1 1391 . 7 1 1 A 129 129 ASN CB C 129 36.920 38.592 -1.672 1
1 1392 . 7 1 1 A 130 130 LEU H H 130 8.211 7.959 0.252 1
1 1393 . 7 1 1 A 130 130 LEU HA H 130 4.489 4.237 0.252 1
1 1403 . 7 1 1 A 130 130 LEU C C 130 178.836 176.416 2.420 1
1 1404 . 7 1 1 A 130 130 LEU CA C 130 54.653 56.715 -2.062 1
1 1405 . 7 1 1 A 130 130 LEU CB C 130 41.887 42.264 -0.377 1
1 1409 . 7 1 1 A 130 130 LEU N N 130 118.563 119.805 -1.242 1
1 1410 . 7 1 1 A 131 131 GLN H H 131 7.953 7.274 0.679 1
1 1411 . 7 1 1 A 131 131 GLN HA H 131 3.729 4.375 -0.646 1
1 1418 . 7 1 1 A 131 131 GLN CA C 131 59.310 56.795 2.515 1
1 1419 . 7 1 1 A 131 131 GLN CB C 131 28.340 28.687 -0.347 1
1 1421 . 7 1 1 A 131 131 GLN N N 131 123.929 116.878 7.051 1
1 1423 . 7 1 1 A 132 132 GLY HA2 H 132 4.034 3.848 0.186 1
1 1424 . 7 1 1 A 132 132 GLY HA3 H 132 3.865 3.877 -0.012 1
1 1425 . 7 1 1 A 132 132 GLY C C 132 174.547 174.828 -0.281 1
1 1426 . 7 1 1 A 132 132 GLY CA C 132 45.902 45.318 0.584 1
1 1427 . 7 1 1 A 133 133 ARG H H 133 7.735 7.347 0.388 1
1 1428 . 7 1 1 A 133 133 ARG HA H 133 4.611 4.302 0.309 1
1 1435 . 7 1 1 A 133 133 ARG C C 133 175.461 175.193 0.268 1
1 1436 . 7 1 1 A 133 133 ARG CA C 133 54.987 55.529 -0.542 1
1 1437 . 7 1 1 A 133 133 ARG CB C 133 31.470 30.012 1.458 1
1 1440 . 7 1 1 A 133 133 ARG N N 133 118.194 117.905 0.289 1
1 1441 . 7 1 1 A 134 134 HIS H H 134 7.803 7.258 0.545 1
1 1444 . 7 1 1 A 134 134 HIS N N 134 118.700 118.949 -0.249 1
1 1445 . 7 1 1 A 135 135 LYS HA H 135 4.331 4.379 -0.048 1
1 1454 . 7 1 1 A 135 135 LYS C C 135 174.852 175.570 -0.718 1
1 1455 . 7 1 1 A 135 135 LYS CA C 135 55.390 56.093 -0.703 1
1 1456 . 7 1 1 A 135 135 LYS CB C 135 32.970 31.299 1.671 1
1 1460 . 7 1 1 A 136 136 CYS H H 136 7.801 8.364 -0.563 1
1 1461 . 7 1 1 A 136 136 CYS HA H 136 4.113 4.610 -0.497 1
1 1464 . 7 1 1 A 136 136 CYS C C 136 174.879 173.601 1.278 1
1 1465 . 7 1 1 A 136 136 CYS CA C 136 60.028 58.287 1.741 1
1 1466 . 7 1 1 A 136 136 CYS CB C 136 30.350 25.954 4.396 1
1 1467 . 7 1 1 A 136 136 CYS N N 136 126.055 123.897 2.158 1
1 10 . 8 1 1 A 2 2 ALA H H 2 8.220 8.801 -0.581 1
1 11 . 8 1 1 A 2 2 ALA HA H 2 4.321 4.757 -0.436 1
1 15 . 8 1 1 A 2 2 ALA C C 2 177.564 176.355 1.209 1
1 16 . 8 1 1 A 2 2 ALA CA C 2 52.383 51.146 1.237 1
1 17 . 8 1 1 A 2 2 ALA CB C 2 19.290 20.101 -0.811 1
1 18 . 8 1 1 A 2 2 ALA N N 2 125.223 127.036 -1.813 1
1 19 . 8 1 1 A 3 3 ALA H H 3 8.246 8.745 -0.499 1
1 20 . 8 1 1 A 3 3 ALA N N 3 123.250 127.343 -4.093 1
1 21 . 8 1 1 A 5 5 ALA HA H 5 4.415 4.657 -0.242 1
1 25 . 8 1 1 A 5 5 ALA C C 5 177.481 176.652 0.829 1
1 26 . 8 1 1 A 5 5 ALA CA C 5 52.423 51.309 1.114 1
1 27 . 8 1 1 A 5 5 ALA CB C 5 19.420 19.800 -0.380 1
1 28 . 8 1 1 A 6 6 ARG H H 6 8.239 8.838 -0.599 1
1 29 . 8 1 1 A 6 6 ARG HA H 6 4.371 4.491 -0.120 1
1 36 . 8 1 1 A 6 6 ARG C C 6 176.180 176.514 -0.334 1
1 37 . 8 1 1 A 6 6 ARG CA C 6 56.353 55.171 1.182 1
1 38 . 8 1 1 A 6 6 ARG CB C 6 31.170 28.988 2.182 1
1 41 . 8 1 1 A 6 6 ARG N N 6 120.436 124.119 -3.683 1
1 42 . 8 1 1 A 7 7 GLU H H 7 8.535 8.245 0.290 1
1 43 . 8 1 1 A 7 7 GLU HA H 7 4.335 4.594 -0.259 1
1 48 . 8 1 1 A 7 7 GLU C C 7 176.346 176.445 -0.099 1
1 49 . 8 1 1 A 7 7 GLU CA C 7 56.740 55.763 0.977 1
1 50 . 8 1 1 A 7 7 GLU CB C 7 30.390 30.366 0.024 1
1 52 . 8 1 1 A 7 7 GLU N N 7 122.189 120.302 1.887 1
1 53 . 8 1 1 A 8 8 ASP H H 8 8.347 7.543 0.804 1
1 54 . 8 1 1 A 8 8 ASP N N 8 121.112 120.722 0.390 1
1 55 . 8 1 1 A 9 9 GLY HA2 H 9 3.975 4.205 -0.230 1
1 56 . 8 1 1 A 9 9 GLY HA3 H 9 3.975 4.205 -0.230 1
1 57 . 8 1 1 A 9 9 GLY C C 9 174.243 172.051 2.192 1
1 58 . 8 1 1 A 9 9 GLY CA C 9 45.933 45.501 0.432 1
1 59 . 8 1 1 A 10 10 ALA H H 10 8.111 8.240 -0.129 1
1 60 . 8 1 1 A 10 10 ALA N N 10 123.721 122.907 0.814 1
1 61 . 8 1 1 A 12 12 GLY HA2 H 12 3.992 4.166 -0.174 1
1 62 . 8 1 1 A 12 12 GLY HA3 H 12 3.992 4.170 -0.178 1
1 63 . 8 1 1 A 12 12 GLY C C 12 173.883 171.736 2.147 1
1 64 . 8 1 1 A 12 12 GLY CA C 12 45.381 45.816 -0.435 1
1 65 . 8 1 1 A 13 13 GLU H H 13 8.224 8.895 -0.671 1
1 66 . 8 1 1 A 13 13 GLU HA H 13 4.367 4.817 -0.450 1
1 71 . 8 1 1 A 13 13 GLU C C 13 176.125 175.641 0.484 1
1 72 . 8 1 1 A 13 13 GLU CA C 13 56.349 54.968 1.381 1
1 73 . 8 1 1 A 13 13 GLU CB C 13 29.560 33.153 -3.593 1
1 75 . 8 1 1 A 13 13 GLU N N 13 120.148 124.824 -4.676 1
1 76 . 8 1 1 A 14 14 GLU H H 14 8.508 8.715 -0.207 1
1 77 . 8 1 1 A 14 14 GLU HA H 14 4.302 4.516 -0.214 1
1 82 . 8 1 1 A 14 14 GLU C C 14 176.623 176.049 0.574 1
1 83 . 8 1 1 A 14 14 GLU CA C 14 56.497 56.017 0.480 1
1 84 . 8 1 1 A 14 14 GLU CB C 14 30.110 29.519 0.591 1
1 86 . 8 1 1 A 14 14 GLU N N 14 122.160 124.305 -2.145 1
1 87 . 8 1 1 A 15 15 ARG H H 15 8.356 8.408 -0.052 1
1 88 . 8 1 1 A 15 15 ARG HA H 15 4.366 4.271 0.095 1
1 95 . 8 1 1 A 15 15 ARG C C 15 176.844 175.033 1.811 1
1 96 . 8 1 1 A 15 15 ARG CA C 15 56.010 57.671 -1.661 1
1 97 . 8 1 1 A 15 15 ARG CB C 15 30.890 29.753 1.137 1
1 100 . 8 1 1 A 15 15 ARG N N 15 121.945 126.466 -4.521 1
1 101 . 8 1 1 A 16 16 GLY H H 16 8.414 8.489 -0.075 1
1 102 . 8 1 1 A 16 16 GLY HA2 H 16 4.022 4.194 -0.172 1
1 103 . 8 1 1 A 16 16 GLY HA3 H 16 4.022 4.198 -0.176 1
1 104 . 8 1 1 A 16 16 GLY C C 16 174.326 174.562 -0.236 1
1 105 . 8 1 1 A 16 16 GLY CA C 16 45.620 45.276 0.344 1
1 106 . 8 1 1 A 16 16 GLY N N 16 109.734 112.258 -2.524 1
1 107 . 8 1 1 A 17 17 GLN H H 17 8.184 8.850 -0.666 1
1 108 . 8 1 1 A 17 17 GLN HA H 17 4.366 4.103 0.263 1
1 113 . 8 1 1 A 17 17 GLN C C 17 175.544 176.339 -0.795 1
1 114 . 8 1 1 A 17 17 GLN CA C 17 55.749 58.360 -2.611 1
1 115 . 8 1 1 A 17 17 GLN CB C 17 29.367 29.377 -0.010 1
1 117 . 8 1 1 A 17 17 GLN N N 17 119.546 121.145 -1.599 1
1 118 . 8 1 1 A 18 18 ARG H H 18 8.366 7.985 0.381 1
1 119 . 8 1 1 A 18 18 ARG HA H 18 4.487 4.666 -0.179 1
1 126 . 8 1 1 A 18 18 ARG C C 18 176.042 174.900 1.142 1
1 127 . 8 1 1 A 18 18 ARG CA C 18 55.735 55.441 0.294 1
1 128 . 8 1 1 A 18 18 ARG CB C 18 31.170 30.746 0.424 1
1 131 . 8 1 1 A 18 18 ARG N N 18 122.330 116.550 5.780 1
1 132 . 8 1 1 A 19 19 GLY H H 19 8.192 8.358 -0.166 1
1 133 . 8 1 1 A 19 19 GLY HA2 H 19 4.852 4.239 0.613 1
1 134 . 8 1 1 A 19 19 GLY HA3 H 19 3.894 4.246 -0.352 1
1 135 . 8 1 1 A 19 19 GLY C C 19 172.361 171.285 1.076 1
1 136 . 8 1 1 A 19 19 GLY CA C 19 45.580 45.118 0.462 1
1 137 . 8 1 1 A 19 19 GLY N N 19 109.658 108.894 0.764 1
1 138 . 8 1 1 A 20 20 CYS H H 20 8.843 8.054 0.789 1
1 139 . 8 1 1 A 20 20 CYS HA H 20 5.147 5.189 -0.042 1
1 142 . 8 1 1 A 20 20 CYS C C 20 175.211 174.982 0.229 1
1 143 . 8 1 1 A 20 20 CYS CA C 20 56.712 58.310 -1.598 1
1 144 . 8 1 1 A 20 20 CYS CB C 20 33.530 31.533 1.997 1
1 145 . 8 1 1 A 20 20 CYS N N 20 120.185 118.765 1.420 1
1 146 . 8 1 1 A 21 21 GLU H H 21 8.981 8.905 0.076 1
1 147 . 8 1 1 A 21 21 GLU HA H 21 4.100 4.077 0.023 1
1 152 . 8 1 1 A 21 21 GLU C C 21 176.014 178.165 -2.151 1
1 153 . 8 1 1 A 21 21 GLU CA C 21 57.134 58.808 -1.674 1
1 154 . 8 1 1 A 21 21 GLU CB C 21 28.890 28.946 -0.056 1
1 156 . 8 1 1 A 21 21 GLU N N 21 116.078 125.936 -9.858 1
1 157 . 8 1 1 A 22 22 HIS H H 22 9.342 7.778 1.564 1
1 158 . 8 1 1 A 22 22 HIS HA H 22 4.210 4.255 -0.045 1
1 161 . 8 1 1 A 22 22 HIS C C 22 175.128 174.917 0.211 1
1 162 . 8 1 1 A 22 22 HIS CA C 22 58.945 58.605 0.340 1
1 163 . 8 1 1 A 22 22 HIS CB C 22 33.160 29.891 3.269 1
1 164 . 8 1 1 A 22 22 HIS N N 22 122.296 117.842 4.454 1
1 165 . 8 1 1 A 23 23 TYR H H 23 7.931 7.619 0.312 1
1 166 . 8 1 1 A 23 23 TYR HA H 23 4.856 5.151 -0.295 1
1 171 . 8 1 1 A 23 23 TYR C C 23 173.108 174.395 -1.287 1
1 172 . 8 1 1 A 23 23 TYR CA C 23 57.852 56.324 1.528 1
1 173 . 8 1 1 A 23 23 TYR CB C 23 45.300 41.786 3.514 1
1 175 . 8 1 1 A 23 23 TYR N N 23 115.205 115.006 0.199 1
1 176 . 8 1 1 A 24 24 ASP H H 24 8.384 9.067 -0.683 1
1 177 . 8 1 1 A 24 24 ASP HA H 24 5.160 4.877 0.283 1
1 180 . 8 1 1 A 24 24 ASP C C 24 174.437 175.405 -0.968 1
1 181 . 8 1 1 A 24 24 ASP CA C 24 53.343 53.671 -0.328 1
1 182 . 8 1 1 A 24 24 ASP CB C 24 41.470 40.913 0.557 1
1 183 . 8 1 1 A 24 24 ASP N N 24 122.016 125.471 -3.455 1
1 184 . 8 1 1 A 25 25 ARG H H 25 7.313 8.044 -0.731 1
1 185 . 8 1 1 A 25 25 ARG HA H 25 5.331 5.096 0.235 1
1 192 . 8 1 1 A 25 25 ARG C C 25 175.045 175.767 -0.722 1
1 193 . 8 1 1 A 25 25 ARG CA C 25 54.224 54.697 -0.473 1
1 194 . 8 1 1 A 25 25 ARG CB C 25 34.090 33.959 0.131 1
1 197 . 8 1 1 A 25 25 ARG N N 25 115.898 123.958 -8.060 1
1 198 . 8 1 1 A 26 26 GLY H H 26 9.387 9.115 0.272 1
1 199 . 8 1 1 A 26 26 GLY HA2 H 26 4.622 3.876 0.746 1
1 200 . 8 1 1 A 26 26 GLY HA3 H 26 3.788 3.966 -0.178 1
1 201 . 8 1 1 A 26 26 GLY C C 26 170.978 174.725 -3.747 1
1 202 . 8 1 1 A 26 26 GLY CA C 26 44.794 46.403 -1.609 1
1 203 . 8 1 1 A 26 26 GLY N N 26 105.653 107.865 -2.212 1
1 204 . 8 1 1 A 27 27 CYS H H 27 6.864 7.695 -0.831 1
1 205 . 8 1 1 A 27 27 CYS HA H 27 5.195 5.254 -0.059 1
1 208 . 8 1 1 A 27 27 CYS C C 27 171.144 172.570 -1.426 1
1 209 . 8 1 1 A 27 27 CYS CA C 27 52.349 57.218 -4.869 1
1 210 . 8 1 1 A 27 27 CYS CB C 27 30.997 30.393 0.604 1
1 211 . 8 1 1 A 27 27 CYS N N 27 110.921 117.205 -6.284 1
1 212 . 8 1 1 A 28 28 LEU H H 28 8.310 8.900 -0.590 1
1 213 . 8 1 1 A 28 28 LEU HA H 28 4.651 5.094 -0.443 1
1 223 . 8 1 1 A 28 28 LEU C C 28 176.827 176.820 0.007 1
1 224 . 8 1 1 A 28 28 LEU CA C 28 53.054 53.352 -0.298 1
1 225 . 8 1 1 A 28 28 LEU CB C 28 44.200 43.866 0.334 1
1 229 . 8 1 1 A 28 28 LEU N N 28 115.519 122.025 -6.506 1
1 230 . 8 1 1 A 29 29 LEU H H 29 8.800 8.839 -0.039 1
1 231 . 8 1 1 A 29 29 LEU HA H 29 4.313 4.231 0.082 1
1 240 . 8 1 1 A 29 29 LEU C C 29 175.571 176.614 -1.043 1
1 241 . 8 1 1 A 29 29 LEU CA C 29 54.388 55.119 -0.731 1
1 242 . 8 1 1 A 29 29 LEU CB C 29 42.780 41.175 1.605 1
1 245 . 8 1 1 A 29 29 LEU N N 29 118.712 125.580 -6.868 1
1 246 . 8 1 1 A 30 30 LYS H H 30 8.009 8.335 -0.326 1
1 247 . 8 1 1 A 30 30 LYS HA H 30 4.592 4.566 0.026 1
1 256 . 8 1 1 A 30 30 LYS C C 30 174.990 174.964 0.026 1
1 257 . 8 1 1 A 30 30 LYS CA C 30 54.999 56.451 -1.452 1
1 258 . 8 1 1 A 30 30 LYS CB C 30 32.330 32.754 -0.424 1
1 262 . 8 1 1 A 30 30 LYS N N 30 122.310 126.090 -3.780 1
1 263 . 8 1 1 A 31 31 ALA H H 31 9.238 8.404 0.834 1
1 264 . 8 1 1 A 31 31 ALA HA H 31 4.477 4.588 -0.111 1
1 268 . 8 1 1 A 31 31 ALA CA C 31 50.190 48.866 1.324 1
1 269 . 8 1 1 A 31 31 ALA CB C 31 21.637 20.081 1.556 1
1 270 . 8 1 1 A 31 31 ALA N N 31 133.864 130.201 3.663 1
1 271 . 8 1 1 A 32 32 PRO HA H 32 4.637 4.437 0.200 1
1 278 . 8 1 1 A 32 32 PRO C C 32 175.737 177.191 -1.454 1
1 279 . 8 1 1 A 32 32 PRO CA C 32 64.259 64.144 0.115 1
1 280 . 8 1 1 A 32 32 PRO CB C 32 31.740 31.905 -0.165 1
1 283 . 8 1 1 A 33 33 CYS H H 33 8.779 8.310 0.469 1
1 284 . 8 1 1 A 33 33 CYS HA H 33 4.321 4.258 0.063 1
1 287 . 8 1 1 A 33 33 CYS C C 33 176.733 175.188 1.545 1
1 288 . 8 1 1 A 33 33 CYS CA C 33 54.398 61.183 -6.785 1
1 289 . 8 1 1 A 33 33 CYS CB C 33 30.697 27.353 3.344 1
1 290 . 8 1 1 A 33 33 CYS N N 33 120.005 117.243 2.762 1
1 291 . 8 1 1 A 34 34 CYS H H 34 7.424 7.520 -0.096 1
1 292 . 8 1 1 A 34 34 CYS HA H 34 4.896 4.701 0.195 1
1 295 . 8 1 1 A 34 34 CYS C C 34 174.935 174.995 -0.060 1
1 296 . 8 1 1 A 34 34 CYS CA C 34 56.962 58.490 -1.528 1
1 297 . 8 1 1 A 34 34 CYS CB C 34 31.067 29.596 1.471 1
1 298 . 8 1 1 A 34 34 CYS N N 34 115.034 118.062 -3.028 1
1 299 . 8 1 1 A 35 35 ASP H H 35 8.368 8.059 0.309 1
1 300 . 8 1 1 A 35 35 ASP HA H 35 4.454 4.250 0.204 1
1 303 . 8 1 1 A 35 35 ASP C C 35 174.354 174.747 -0.393 1
1 304 . 8 1 1 A 35 35 ASP CA C 35 56.222 55.499 0.723 1
1 305 . 8 1 1 A 35 35 ASP CB C 35 39.730 39.450 0.280 1
1 306 . 8 1 1 A 35 35 ASP N N 35 121.381 117.164 4.217 1
1 307 . 8 1 1 A 36 36 LYS H H 36 7.227 7.435 -0.208 1
1 308 . 8 1 1 A 36 36 LYS HA H 36 4.451 4.745 -0.294 1
1 317 . 8 1 1 A 36 36 LYS C C 36 175.433 175.522 -0.089 1
1 318 . 8 1 1 A 36 36 LYS CA C 36 56.270 54.900 1.370 1
1 319 . 8 1 1 A 36 36 LYS CB C 36 36.620 34.663 1.957 1
1 323 . 8 1 1 A 36 36 LYS N N 36 117.673 118.138 -0.465 1
1 324 . 8 1 1 A 37 37 LEU H H 37 8.053 8.577 -0.524 1
1 325 . 8 1 1 A 37 37 LEU HA H 37 5.292 4.883 0.409 1
1 335 . 8 1 1 A 37 37 LEU C C 37 176.484 175.185 1.299 1
1 336 . 8 1 1 A 37 37 LEU CA C 37 53.348 52.939 0.409 1
1 337 . 8 1 1 A 37 37 LEU CB C 37 42.400 43.030 -0.630 1
1 341 . 8 1 1 A 37 37 LEU N N 37 120.994 123.038 -2.044 1
1 342 . 8 1 1 A 38 38 TYR H H 38 8.741 8.531 0.210 1
1 343 . 8 1 1 A 38 38 TYR HA H 38 5.002 4.900 0.102 1
1 350 . 8 1 1 A 38 38 TYR C C 38 176.374 176.005 0.369 1
1 351 . 8 1 1 A 38 38 TYR CA C 38 57.081 56.718 0.363 1
1 352 . 8 1 1 A 38 38 TYR CB C 38 45.647 41.801 3.846 1
1 355 . 8 1 1 A 38 38 TYR N N 38 121.128 122.065 -0.937 1
1 356 . 8 1 1 A 39 39 THR H H 39 9.402 8.867 0.535 1
1 357 . 8 1 1 A 39 39 THR HA H 39 4.098 4.086 0.012 1
1 362 . 8 1 1 A 39 39 THR C C 39 173.496 175.018 -1.522 1
1 363 . 8 1 1 A 39 39 THR CA C 39 67.062 65.769 1.293 1
1 364 . 8 1 1 A 39 39 THR CB C 39 68.047 68.409 -0.362 1
1 366 . 8 1 1 A 39 39 THR N N 39 116.641 117.916 -1.275 1
1 367 . 8 1 1 A 40 40 CYS H H 40 7.317 8.138 -0.821 1
1 368 . 8 1 1 A 40 40 CYS HA H 40 4.771 4.674 0.097 1
1 371 . 8 1 1 A 40 40 CYS C C 40 175.128 175.304 -0.176 1
1 372 . 8 1 1 A 40 40 CYS CA C 40 56.577 57.838 -1.261 1
1 373 . 8 1 1 A 40 40 CYS CB C 40 35.087 29.536 5.551 1
1 374 . 8 1 1 A 40 40 CYS N N 40 109.059 118.612 -9.553 1
1 375 . 8 1 1 A 41 41 ARG H H 41 9.201 8.633 0.568 1
1 376 . 8 1 1 A 41 41 ARG HA H 41 3.982 3.961 0.021 1
1 383 . 8 1 1 A 41 41 ARG C C 41 175.101 177.377 -2.276 1
1 384 . 8 1 1 A 41 41 ARG CA C 41 58.591 58.717 -0.126 1
1 385 . 8 1 1 A 41 41 ARG CB C 41 29.640 29.625 0.015 1
1 388 . 8 1 1 A 41 41 ARG N N 41 121.737 124.659 -2.922 1
1 389 . 8 1 1 A 42 42 LEU H H 42 9.116 7.656 1.460 1
1 390 . 8 1 1 A 42 42 LEU HA H 42 4.029 4.104 -0.075 1
1 400 . 8 1 1 A 42 42 LEU C C 42 179.943 179.499 0.444 1
1 401 . 8 1 1 A 42 42 LEU CA C 42 58.005 57.440 0.565 1
1 402 . 8 1 1 A 42 42 LEU CB C 42 38.960 41.223 -2.263 1
1 406 . 8 1 1 A 42 42 LEU N N 42 126.364 116.769 9.595 1
1 407 . 8 1 1 A 43 43 CYS H H 43 8.785 8.284 0.501 1
1 408 . 8 1 1 A 43 43 CYS HA H 43 4.187 4.167 0.020 1
1 411 . 8 1 1 A 43 43 CYS C C 43 177.785 177.076 0.709 1
1 412 . 8 1 1 A 43 43 CYS CA C 43 66.415 63.163 3.252 1
1 413 . 8 1 1 A 43 43 CYS CB C 43 28.870 27.455 1.415 1
1 414 . 8 1 1 A 43 43 CYS N N 43 124.519 117.434 7.085 1
1 415 . 8 1 1 A 44 44 HIS H H 44 7.604 7.667 -0.063 1
1 416 . 8 1 1 A 44 44 HIS HA H 44 1.983 2.749 -0.766 1
1 420 . 8 1 1 A 44 44 HIS C C 44 176.429 175.995 0.434 1
1 421 . 8 1 1 A 44 44 HIS CA C 44 58.760 58.912 -0.152 1
1 422 . 8 1 1 A 44 44 HIS CB C 44 27.990 29.258 -1.268 1
1 423 . 8 1 1 A 44 44 HIS N N 44 117.024 120.687 -3.663 1
1 424 . 8 1 1 A 45 45 ASP H H 45 8.750 8.016 0.734 1
1 425 . 8 1 1 A 45 45 ASP HA H 45 4.116 4.147 -0.031 1
1 428 . 8 1 1 A 45 45 ASP C C 45 177.453 178.139 -0.686 1
1 429 . 8 1 1 A 45 45 ASP CA C 45 56.840 57.842 -1.002 1
1 430 . 8 1 1 A 45 45 ASP CB C 45 38.960 42.242 -3.282 1
1 431 . 8 1 1 A 45 45 ASP N N 45 120.440 118.902 1.538 1
1 432 . 8 1 1 A 46 46 ASN H H 46 7.888 7.871 0.017 1
1 433 . 8 1 1 A 46 46 ASN HA H 46 4.612 4.405 0.207 1
1 438 . 8 1 1 A 46 46 ASN C C 46 175.903 176.570 -0.667 1
1 439 . 8 1 1 A 46 46 ASN CA C 46 54.342 55.510 -1.168 1
1 440 . 8 1 1 A 46 46 ASN CB C 46 38.790 38.252 0.538 1
1 441 . 8 1 1 A 46 46 ASN N N 46 115.758 117.044 -1.286 1
1 443 . 8 1 1 A 47 47 ASN H H 47 7.384 7.387 -0.003 1
1 444 . 8 1 1 A 47 47 ASN HA H 47 4.893 4.670 0.223 1
1 449 . 8 1 1 A 47 47 ASN C C 47 173.579 175.325 -1.746 1
1 450 . 8 1 1 A 47 47 ASN CA C 47 53.937 54.736 -0.799 1
1 451 . 8 1 1 A 47 47 ASN CB C 47 43.130 39.588 3.542 1
1 452 . 8 1 1 A 47 47 ASN N N 47 116.576 115.419 1.157 1
1 454 . 8 1 1 A 48 48 GLU H H 48 7.143 7.275 -0.132 1
1 455 . 8 1 1 A 48 48 GLU HA H 48 4.572 4.527 0.045 1
1 460 . 8 1 1 A 48 48 GLU C C 48 175.627 176.316 -0.689 1
1 461 . 8 1 1 A 48 48 GLU CA C 48 53.727 54.673 -0.946 1
1 462 . 8 1 1 A 48 48 GLU CB C 48 32.480 31.533 0.947 1
1 464 . 8 1 1 A 48 48 GLU N N 48 116.967 117.258 -0.291 1
1 465 . 8 1 1 A 49 49 ASP H H 49 8.748 8.832 -0.084 1
1 466 . 8 1 1 A 49 49 ASP HA H 49 4.576 4.471 0.105 1
1 469 . 8 1 1 A 49 49 ASP C C 49 174.796 176.008 -1.212 1
1 470 . 8 1 1 A 49 49 ASP CA C 49 53.027 55.751 -2.724 1
1 471 . 8 1 1 A 49 49 ASP CB C 49 40.340 41.844 -1.504 1
1 472 . 8 1 1 A 49 49 ASP N N 49 119.296 121.903 -2.607 1
1 473 . 8 1 1 A 50 50 HIS H H 50 6.919 7.331 -0.412 1
1 474 . 8 1 1 A 50 50 HIS HA H 50 4.880 5.139 -0.259 1
1 477 . 8 1 1 A 50 50 HIS C C 50 172.942 174.822 -1.880 1
1 478 . 8 1 1 A 50 50 HIS CA C 50 53.978 53.148 0.830 1
1 479 . 8 1 1 A 50 50 HIS CB C 50 30.330 32.906 -2.576 1
1 480 . 8 1 1 A 50 50 HIS N N 50 113.709 113.495 0.214 1
1 481 . 8 1 1 A 51 51 GLN H H 51 8.646 8.505 0.141 1
1 482 . 8 1 1 A 51 51 GLN HA H 51 4.896 4.500 0.396 1
1 487 . 8 1 1 A 51 51 GLN C C 51 176.512 175.102 1.410 1
1 488 . 8 1 1 A 51 51 GLN CA C 51 54.872 55.566 -0.694 1
1 489 . 8 1 1 A 51 51 GLN CB C 51 30.950 29.849 1.101 1
1 491 . 8 1 1 A 51 51 GLN N N 51 119.379 118.938 0.441 1
1 492 . 8 1 1 A 52 52 LEU H H 52 9.646 8.311 1.335 1
1 493 . 8 1 1 A 52 52 LEU HA H 52 4.206 4.476 -0.270 1
1 503 . 8 1 1 A 52 52 LEU C C 52 175.793 175.267 0.526 1
1 504 . 8 1 1 A 52 52 LEU CA C 52 55.450 54.387 1.063 1
1 505 . 8 1 1 A 52 52 LEU CB C 52 41.407 42.620 -1.213 1
1 509 . 8 1 1 A 52 52 LEU N N 52 128.069 124.606 3.463 1
1 510 . 8 1 1 A 53 53 ASP H H 53 9.281 8.581 0.700 1
1 511 . 8 1 1 A 53 53 ASP HA H 53 4.725 4.783 -0.058 1
1 514 . 8 1 1 A 53 53 ASP C C 53 176.401 177.436 -1.035 1
1 515 . 8 1 1 A 53 53 ASP CA C 53 52.590 53.521 -0.931 1
1 516 . 8 1 1 A 53 53 ASP CB C 53 39.990 42.115 -2.125 1
1 517 . 8 1 1 A 53 53 ASP N N 53 128.783 127.478 1.305 1
1 518 . 8 1 1 A 54 54 ARG H H 54 8.496 8.488 0.008 1
1 519 . 8 1 1 A 54 54 ARG HA H 54 3.859 3.857 0.002 1
1 526 . 8 1 1 A 54 54 ARG C C 54 176.346 175.535 0.811 1
1 527 . 8 1 1 A 54 54 ARG CA C 54 57.357 57.528 -0.171 1
1 528 . 8 1 1 A 54 54 ARG CB C 54 28.890 28.917 -0.027 1
1 531 . 8 1 1 A 54 54 ARG N N 54 125.813 124.406 1.407 1
1 532 . 8 1 1 A 55 55 PHE H H 55 8.005 7.185 0.820 1
1 533 . 8 1 1 A 55 55 PHE HA H 55 4.712 4.446 0.266 1
1 540 . 8 1 1 A 55 55 PHE C C 55 177.481 177.296 0.185 1
1 541 . 8 1 1 A 55 55 PHE CA C 55 59.080 59.462 -0.382 1
1 542 . 8 1 1 A 55 55 PHE CB C 55 37.447 40.565 -3.118 1
1 545 . 8 1 1 A 55 55 PHE N N 55 120.168 117.136 3.032 1
1 546 . 8 1 1 A 56 56 LYS H H 56 7.681 7.514 0.167 1
1 547 . 8 1 1 A 56 56 LYS HA H 56 4.411 4.255 0.156 1
1 556 . 8 1 1 A 56 56 LYS C C 56 175.959 176.614 -0.655 1
1 557 . 8 1 1 A 56 56 LYS CA C 56 55.459 58.393 -2.934 1
1 558 . 8 1 1 A 56 56 LYS CB C 56 33.590 32.585 1.005 1
1 562 . 8 1 1 A 56 56 LYS N N 56 116.937 118.875 -1.938 1
1 563 . 8 1 1 A 57 57 VAL H H 57 6.553 6.859 -0.306 1
1 564 . 8 1 1 A 57 57 VAL HA H 57 3.408 3.946 -0.538 1
1 572 . 8 1 1 A 57 57 VAL C C 57 173.911 175.801 -1.890 1
1 573 . 8 1 1 A 57 57 VAL CA C 57 65.025 61.773 3.252 1
1 574 . 8 1 1 A 57 57 VAL CB C 57 32.663 31.446 1.217 1
1 577 . 8 1 1 A 57 57 VAL N N 57 119.519 117.041 2.478 1
1 578 . 8 1 1 A 58 58 LYS H H 58 9.182 8.803 0.379 1
1 579 . 8 1 1 A 58 58 LYS HA H 58 4.489 4.301 0.188 1
1 588 . 8 1 1 A 58 58 LYS C C 58 176.927 176.106 0.821 1
1 589 . 8 1 1 A 58 58 LYS CA C 58 55.913 57.876 -1.963 1
1 590 . 8 1 1 A 58 58 LYS CB C 58 36.340 33.675 2.665 1
1 594 . 8 1 1 A 58 58 LYS N N 58 124.985 126.456 -1.471 1
1 595 . 8 1 1 A 59 59 GLU H H 59 8.799 7.710 1.089 1
1 596 . 8 1 1 A 59 59 GLU HA H 59 5.209 4.882 0.327 1
1 601 . 8 1 1 A 59 59 GLU C C 59 173.911 175.574 -1.663 1
1 602 . 8 1 1 A 59 59 GLU CA C 59 54.670 54.929 -0.259 1
1 603 . 8 1 1 A 59 59 GLU CB C 59 35.180 32.919 2.261 1
1 605 . 8 1 1 A 59 59 GLU N N 59 121.493 116.701 4.792 1
1 606 . 8 1 1 A 60 60 VAL H H 60 8.917 8.642 0.275 1
1 607 . 8 1 1 A 60 60 VAL HA H 60 4.983 5.023 -0.040 1
1 615 . 8 1 1 A 60 60 VAL C C 60 173.441 173.793 -0.352 1
1 616 . 8 1 1 A 60 60 VAL CA C 60 57.497 58.802 -1.305 1
1 617 . 8 1 1 A 60 60 VAL CB C 60 35.460 36.126 -0.666 1
1 620 . 8 1 1 A 60 60 VAL N N 60 109.266 117.310 -8.044 1
1 621 . 8 1 1 A 61 61 GLN H H 61 8.970 8.616 0.354 1
1 622 . 8 1 1 A 61 61 GLN HA H 61 5.024 4.983 0.041 1
1 629 . 8 1 1 A 61 61 GLN C C 61 175.045 174.081 0.964 1
1 630 . 8 1 1 A 61 61 GLN CA C 61 53.128 53.790 -0.662 1
1 631 . 8 1 1 A 61 61 GLN CB C 61 33.980 32.306 1.674 1
1 633 . 8 1 1 A 61 61 GLN N N 61 118.525 118.827 -0.302 1
1 635 . 8 1 1 A 62 62 CYS H H 62 7.688 8.868 -1.180 1
1 636 . 8 1 1 A 62 62 CYS HA H 62 4.210 4.594 -0.384 1
1 639 . 8 1 1 A 62 62 CYS C C 62 177.951 176.084 1.867 1
1 640 . 8 1 1 A 62 62 CYS CA C 62 59.845 58.888 0.957 1
1 641 . 8 1 1 A 62 62 CYS CB C 62 33.120 27.993 5.127 1
1 642 . 8 1 1 A 62 62 CYS N N 62 128.772 121.662 7.110 1
1 643 . 8 1 1 A 63 63 ILE H H 63 8.192 8.606 -0.414 1
1 644 . 8 1 1 A 63 63 ILE HA H 63 3.984 3.941 0.043 1
1 654 . 8 1 1 A 63 63 ILE C C 63 175.433 177.456 -2.023 1
1 655 . 8 1 1 A 63 63 ILE CA C 63 63.657 64.398 -0.741 1
1 656 . 8 1 1 A 63 63 ILE CB C 63 38.506 37.839 0.667 1
1 660 . 8 1 1 A 63 63 ILE N N 63 127.455 127.708 -0.253 1
1 661 . 8 1 1 A 64 64 ASN H H 64 9.181 8.068 1.113 1
1 662 . 8 1 1 A 64 64 ASN HA H 64 4.810 4.764 0.046 1
1 667 . 8 1 1 A 64 64 ASN C C 64 175.931 175.287 0.644 1
1 668 . 8 1 1 A 64 64 ASN CA C 64 55.617 52.187 3.430 1
1 669 . 8 1 1 A 64 64 ASN CB C 64 40.640 36.980 3.660 1
1 670 . 8 1 1 A 64 64 ASN N N 64 122.104 117.911 4.193 1
1 672 . 8 1 1 A 65 65 CYS H H 65 9.065 7.749 1.316 1
1 673 . 8 1 1 A 65 65 CYS HA H 65 4.979 4.512 0.467 1
1 676 . 8 1 1 A 65 65 CYS C C 65 176.291 174.997 1.294 1
1 677 . 8 1 1 A 65 65 CYS CA C 65 59.027 59.319 -0.292 1
1 678 . 8 1 1 A 65 65 CYS CB C 65 32.030 29.091 2.939 1
1 679 . 8 1 1 A 65 65 CYS N N 65 120.368 119.226 1.142 1
1 680 . 8 1 1 A 66 66 GLU H H 66 7.281 8.427 -1.146 1
1 681 . 8 1 1 A 66 66 GLU HA H 66 4.046 4.065 -0.019 1
1 686 . 8 1 1 A 66 66 GLU C C 66 175.211 174.822 0.389 1
1 687 . 8 1 1 A 66 66 GLU CA C 66 58.591 58.043 0.548 1
1 688 . 8 1 1 A 66 66 GLU CB C 66 27.067 27.263 -0.196 1
1 690 . 8 1 1 A 66 66 GLU N N 66 115.012 116.425 -1.413 1
1 691 . 8 1 1 A 67 67 LYS H H 67 8.481 7.804 0.677 1
1 692 . 8 1 1 A 67 67 LYS HA H 67 4.326 4.525 -0.199 1
1 701 . 8 1 1 A 67 67 LYS C C 67 177.923 176.015 1.908 1
1 702 . 8 1 1 A 67 67 LYS CA C 67 57.628 55.738 1.890 1
1 703 . 8 1 1 A 67 67 LYS CB C 67 33.617 34.062 -0.445 1
1 707 . 8 1 1 A 67 67 LYS N N 67 123.514 120.497 3.017 1
1 708 . 8 1 1 A 68 68 ILE H H 68 8.867 8.354 0.513 1
1 709 . 8 1 1 A 68 68 ILE HA H 68 4.976 4.425 0.551 1
1 719 . 8 1 1 A 68 68 ILE C C 68 175.018 175.246 -0.228 1
1 720 . 8 1 1 A 68 68 ILE CA C 68 60.919 60.472 0.447 1
1 721 . 8 1 1 A 68 68 ILE CB C 68 37.090 37.800 -0.710 1
1 725 . 8 1 1 A 68 68 ILE N N 68 133.478 125.351 8.127 1
1 726 . 8 1 1 A 69 69 GLN H H 69 9.269 8.557 0.712 1
1 727 . 8 1 1 A 69 69 GLN HA H 69 5.036 5.021 0.015 1
1 732 . 8 1 1 A 69 69 GLN C C 69 173.607 174.626 -1.019 1
1 733 . 8 1 1 A 69 69 GLN CA C 69 53.419 53.812 -0.393 1
1 734 . 8 1 1 A 69 69 GLN CB C 69 34.997 32.192 2.805 1
1 736 . 8 1 1 A 69 69 GLN N N 69 125.104 123.941 1.163 1
1 737 . 8 1 1 A 70 70 HIS H H 70 8.829 8.700 0.129 1
1 738 . 8 1 1 A 70 70 HIS HA H 70 4.865 4.568 0.297 1
1 741 . 8 1 1 A 70 70 HIS C C 70 174.852 174.978 -0.126 1
1 742 . 8 1 1 A 70 70 HIS CA C 70 56.304 55.515 0.789 1
1 743 . 8 1 1 A 70 70 HIS CB C 70 30.050 31.149 -1.099 1
1 744 . 8 1 1 A 70 70 HIS N N 70 118.576 118.820 -0.244 1
1 745 . 8 1 1 A 71 71 ALA H H 71 7.768 8.111 -0.343 1
1 746 . 8 1 1 A 71 71 ALA HA H 71 3.977 4.524 -0.547 1
1 750 . 8 1 1 A 71 71 ALA C C 71 175.433 177.570 -2.137 1
1 751 . 8 1 1 A 71 71 ALA CA C 71 54.393 52.709 1.684 1
1 752 . 8 1 1 A 71 71 ALA CB C 71 18.000 19.189 -1.189 1
1 753 . 8 1 1 A 71 71 ALA N N 71 121.438 123.101 -1.663 1
1 754 . 8 1 1 A 72 72 GLN H H 72 7.227 8.316 -1.089 1
1 755 . 8 1 1 A 72 72 GLN HA H 72 4.371 4.595 -0.224 1
1 762 . 8 1 1 A 72 72 GLN C C 72 173.053 175.501 -2.448 1
1 763 . 8 1 1 A 72 72 GLN CA C 72 54.290 54.342 -0.052 1
1 764 . 8 1 1 A 72 72 GLN CB C 72 28.623 30.478 -1.855 1
1 766 . 8 1 1 A 72 72 GLN N N 72 115.858 123.581 -7.723 1
1 768 . 8 1 1 A 73 73 GLN H H 73 8.481 8.668 -0.187 1
1 769 . 8 1 1 A 73 73 GLN HA H 73 3.570 3.983 -0.413 1
1 776 . 8 1 1 A 73 73 GLN C C 73 174.243 174.866 -0.623 1
1 777 . 8 1 1 A 73 73 GLN CA C 73 60.206 56.790 3.416 1
1 778 . 8 1 1 A 73 73 GLN CB C 73 28.850 29.984 -1.134 1
1 780 . 8 1 1 A 73 73 GLN N N 73 116.433 118.224 -1.791 1
1 782 . 8 1 1 A 74 74 THR H H 74 7.211 7.626 -0.415 1
1 783 . 8 1 1 A 74 74 THR HA H 74 4.160 4.557 -0.397 1
1 788 . 8 1 1 A 74 74 THR C C 74 171.836 173.162 -1.326 1
1 789 . 8 1 1 A 74 74 THR CA C 74 59.072 60.682 -1.610 1
1 790 . 8 1 1 A 74 74 THR CB C 74 71.560 70.984 0.576 1
1 792 . 8 1 1 A 74 74 THR N N 74 108.717 111.658 -2.941 1
1 793 . 8 1 1 A 75 75 CYS H H 75 7.676 7.816 -0.140 1
1 794 . 8 1 1 A 75 75 CYS HA H 75 4.158 4.318 -0.160 1
1 797 . 8 1 1 A 75 75 CYS C C 75 178.781 175.745 3.036 1
1 798 . 8 1 1 A 75 75 CYS CA C 75 58.661 59.511 -0.850 1
1 799 . 8 1 1 A 75 75 CYS CB C 75 30.840 28.324 2.516 1
1 800 . 8 1 1 A 75 75 CYS N N 75 123.108 125.519 -2.411 1
1 801 . 8 1 1 A 76 76 GLU H H 76 9.203 8.755 0.448 1
1 802 . 8 1 1 A 76 76 GLU HA H 76 4.187 4.001 0.186 1
1 807 . 8 1 1 A 76 76 GLU C C 76 175.488 178.603 -3.115 1
1 808 . 8 1 1 A 76 76 GLU CA C 76 57.306 59.173 -1.867 1
1 809 . 8 1 1 A 76 76 GLU CB C 76 29.347 28.927 0.420 1
1 811 . 8 1 1 A 76 76 GLU N N 76 129.817 127.066 2.751 1
1 812 . 8 1 1 A 77 77 GLU H H 77 9.496 7.707 1.789 1
1 813 . 8 1 1 A 77 77 GLU HA H 77 4.599 4.137 0.462 1
1 818 . 8 1 1 A 77 77 GLU C C 77 177.148 177.242 -0.094 1
1 819 . 8 1 1 A 77 77 GLU CA C 77 57.554 58.652 -1.098 1
1 820 . 8 1 1 A 77 77 GLU CB C 77 31.980 30.867 1.113 1
1 822 . 8 1 1 A 77 77 GLU N N 77 124.795 120.378 4.417 1
1 823 . 8 1 1 A 78 78 CYS H H 78 8.967 7.352 1.615 1
1 824 . 8 1 1 A 78 78 CYS HA H 78 5.073 4.632 0.441 1
1 827 . 8 1 1 A 78 78 CYS C C 78 176.374 174.501 1.873 1
1 828 . 8 1 1 A 78 78 CYS CA C 78 58.537 58.097 0.440 1
1 829 . 8 1 1 A 78 78 CYS CB C 78 31.597 28.830 2.767 1
1 830 . 8 1 1 A 78 78 CYS N N 78 119.692 114.870 4.822 1
1 831 . 8 1 1 A 79 79 SER H H 79 7.474 8.247 -0.773 1
1 832 . 8 1 1 A 79 79 SER HA H 79 4.113 4.034 0.079 1
1 835 . 8 1 1 A 79 79 SER C C 79 172.915 173.356 -0.441 1
1 836 . 8 1 1 A 79 79 SER CA C 79 60.440 59.253 1.187 1
1 837 . 8 1 1 A 79 79 SER CB C 79 61.421 61.094 0.327 1
1 838 . 8 1 1 A 79 79 SER N N 79 113.385 112.479 0.906 1
1 839 . 8 1 1 A 80 80 THR H H 80 7.907 7.726 0.181 1
1 840 . 8 1 1 A 80 80 THR HA H 80 3.913 4.127 -0.214 1
1 845 . 8 1 1 A 80 80 THR C C 80 172.306 173.575 -1.269 1
1 846 . 8 1 1 A 80 80 THR CA C 80 65.262 63.190 2.072 1
1 847 . 8 1 1 A 80 80 THR CB C 80 69.910 68.982 0.928 1
1 849 . 8 1 1 A 80 80 THR N N 80 120.005 115.554 4.451 1
1 850 . 8 1 1 A 81 81 LEU H H 81 8.556 8.477 0.079 1
1 851 . 8 1 1 A 81 81 LEU HA H 81 4.172 4.414 -0.242 1
1 861 . 8 1 1 A 81 81 LEU C C 81 177.121 177.119 0.002 1
1 862 . 8 1 1 A 81 81 LEU CA C 81 54.996 54.826 0.170 1
1 863 . 8 1 1 A 81 81 LEU CB C 81 42.147 42.107 0.040 1
1 867 . 8 1 1 A 81 81 LEU N N 81 128.272 128.362 -0.090 1
1 868 . 8 1 1 A 82 82 PHE H H 82 9.251 9.004 0.247 1
1 869 . 8 1 1 A 82 82 PHE HA H 82 4.576 4.620 -0.044 1
1 874 . 8 1 1 A 82 82 PHE C C 82 177.785 174.829 2.956 1
1 875 . 8 1 1 A 82 82 PHE CA C 82 56.470 58.033 -1.563 1
1 876 . 8 1 1 A 82 82 PHE CB C 82 38.210 39.334 -1.124 1
1 878 . 8 1 1 A 82 82 PHE N N 82 129.268 126.642 2.626 1
1 879 . 8 1 1 A 83 83 GLY H H 83 7.047 7.265 -0.218 1
1 880 . 8 1 1 A 83 83 GLY HA2 H 83 4.783 4.253 0.530 1
1 881 . 8 1 1 A 83 83 GLY HA3 H 83 3.876 4.331 -0.455 1
1 882 . 8 1 1 A 83 83 GLY C C 83 171.642 174.946 -3.304 1
1 883 . 8 1 1 A 83 83 GLY CA C 83 45.826 45.295 0.531 1
1 884 . 8 1 1 A 83 83 GLY N N 83 102.168 107.484 -5.316 1
1 885 . 8 1 1 A 84 84 GLU H H 84 8.444 9.058 -0.614 1
1 886 . 8 1 1 A 84 84 GLU HA H 84 4.111 4.176 -0.065 1
1 891 . 8 1 1 A 84 84 GLU C C 84 177.259 176.632 0.627 1
1 892 . 8 1 1 A 84 84 GLU CA C 84 59.438 59.362 0.076 1
1 893 . 8 1 1 A 84 84 GLU CB C 84 30.670 30.331 0.339 1
1 895 . 8 1 1 A 84 84 GLU N N 84 127.546 121.018 6.528 1
1 896 . 8 1 1 A 85 85 TYR H H 85 9.344 8.225 1.119 1
1 897 . 8 1 1 A 85 85 TYR HA H 85 4.599 4.762 -0.163 1
1 902 . 8 1 1 A 85 85 TYR C C 85 173.302 174.345 -1.043 1
1 903 . 8 1 1 A 85 85 TYR CA C 85 57.261 58.945 -1.684 1
1 904 . 8 1 1 A 85 85 TYR CB C 85 40.850 39.846 1.004 1
1 906 . 8 1 1 A 85 85 TYR N N 85 118.936 120.441 -1.505 1
1 907 . 8 1 1 A 86 86 TYR H H 86 7.323 8.218 -0.895 1
1 908 . 8 1 1 A 86 86 TYR HA H 86 5.298 5.989 -0.691 1
1 911 . 8 1 1 A 86 86 TYR C C 86 172.804 173.423 -0.619 1
1 912 . 8 1 1 A 86 86 TYR CA C 86 54.041 55.539 -1.498 1
1 913 . 8 1 1 A 86 86 TYR CB C 86 40.987 42.113 -1.126 1
1 914 . 8 1 1 A 86 86 TYR N N 86 124.965 120.596 4.369 1
1 915 . 8 1 1 A 87 87 CYS H H 87 7.046 8.970 -1.924 1
1 916 . 8 1 1 A 87 87 CYS HA H 87 3.842 4.778 -0.936 1
1 919 . 8 1 1 A 87 87 CYS C C 87 174.243 174.402 -0.159 1
1 920 . 8 1 1 A 87 87 CYS CA C 87 56.377 58.790 -2.413 1
1 921 . 8 1 1 A 87 87 CYS CB C 87 33.230 30.291 2.939 1
1 922 . 8 1 1 A 87 87 CYS N N 87 128.735 118.547 10.188 1
1 923 . 8 1 1 A 88 88 ASP H H 88 8.002 9.023 -1.021 1
1 924 . 8 1 1 A 88 88 ASP HA H 88 3.761 4.373 -0.612 1
1 927 . 8 1 1 A 88 88 ASP C C 88 173.579 177.642 -4.063 1
1 928 . 8 1 1 A 88 88 ASP CA C 88 53.958 58.146 -4.188 1
1 929 . 8 1 1 A 88 88 ASP CB C 88 41.240 41.368 -0.128 1
1 930 . 8 1 1 A 88 88 ASP N N 88 127.013 127.069 -0.056 1
1 931 . 8 1 1 A 89 89 ILE H H 89 7.972 8.095 -0.123 1
1 932 . 8 1 1 A 89 89 ILE HA H 89 3.660 3.797 -0.137 1
1 942 . 8 1 1 A 89 89 ILE C C 89 177.259 177.740 -0.481 1
1 943 . 8 1 1 A 89 89 ILE CA C 89 63.107 65.025 -1.918 1
1 944 . 8 1 1 A 89 89 ILE CB C 89 39.430 37.994 1.436 1
1 948 . 8 1 1 A 89 89 ILE N N 89 120.357 118.792 1.565 1
1 949 . 8 1 1 A 90 90 CYS H H 90 8.554 7.848 0.706 1
1 950 . 8 1 1 A 90 90 CYS HA H 90 3.677 4.416 -0.739 1
1 953 . 8 1 1 A 90 90 CYS C C 90 175.128 174.296 0.832 1
1 954 . 8 1 1 A 90 90 CYS CA C 90 60.791 61.266 -0.475 1
1 955 . 8 1 1 A 90 90 CYS CB C 90 30.427 27.792 2.635 1
1 956 . 8 1 1 A 90 90 CYS N N 90 119.564 117.698 1.866 1
1 957 . 8 1 1 A 91 91 HIS H H 91 7.364 7.625 -0.261 1
1 958 . 8 1 1 A 91 91 HIS HA H 91 3.512 3.901 -0.389 1
1 963 . 8 1 1 A 91 91 HIS C C 91 170.590 173.042 -2.452 1
1 964 . 8 1 1 A 91 91 HIS CA C 91 58.739 56.374 2.365 1
1 965 . 8 1 1 A 91 91 HIS CB C 91 24.810 26.507 -1.697 1
1 968 . 8 1 1 A 91 91 HIS N N 91 111.440 115.700 -4.260 1
1 969 . 8 1 1 A 92 92 LEU H H 92 6.214 6.594 -0.380 1
1 970 . 8 1 1 A 92 92 LEU HA H 92 4.191 4.493 -0.302 1
1 980 . 8 1 1 A 92 92 LEU C C 92 173.911 175.093 -1.182 1
1 981 . 8 1 1 A 92 92 LEU CA C 92 53.717 52.703 1.014 1
1 982 . 8 1 1 A 92 92 LEU CB C 92 45.360 45.141 0.219 1
1 986 . 8 1 1 A 92 92 LEU N N 92 115.684 114.473 1.211 1
1 987 . 8 1 1 A 93 93 PHE H H 93 6.669 8.438 -1.769 1
1 988 . 8 1 1 A 93 93 PHE HA H 93 5.622 5.366 0.256 1
1 995 . 8 1 1 A 93 93 PHE C C 93 175.765 174.547 1.218 1
1 996 . 8 1 1 A 93 93 PHE CA C 93 55.387 56.676 -1.289 1
1 997 . 8 1 1 A 93 93 PHE CB C 93 42.700 41.329 1.371 1
1 1000 . 8 1 1 A 93 93 PHE N N 93 121.535 120.198 1.337 1
1 1001 . 8 1 1 A 94 94 ASP H H 94 9.209 9.174 0.035 1
1 1002 . 8 1 1 A 94 94 ASP HA H 94 5.819 5.421 0.398 1
1 1005 . 8 1 1 A 94 94 ASP C C 94 175.654 175.389 0.265 1
1 1006 . 8 1 1 A 94 94 ASP CA C 94 53.330 52.972 0.358 1
1 1007 . 8 1 1 A 94 94 ASP CB C 94 44.720 43.498 1.222 1
1 1008 . 8 1 1 A 94 94 ASP N N 94 123.504 120.162 3.342 1
1 1009 . 8 1 1 A 95 95 LYS H H 95 9.043 8.415 0.628 1
1 1010 . 8 1 1 A 95 95 LYS HA H 95 4.527 4.320 0.207 1
1 1019 . 8 1 1 A 95 95 LYS C C 95 174.879 176.460 -1.581 1
1 1020 . 8 1 1 A 95 95 LYS CA C 95 56.620 57.094 -0.474 1
1 1021 . 8 1 1 A 95 95 LYS CB C 95 33.720 32.507 1.213 1
1 1025 . 8 1 1 A 95 95 LYS N N 95 120.380 119.237 1.143 1
1 1026 . 8 1 1 A 96 96 ASP H H 96 8.999 8.826 0.173 1
1 1027 . 8 1 1 A 96 96 ASP HA H 96 4.724 4.746 -0.022 1
1 1030 . 8 1 1 A 96 96 ASP C C 96 176.401 175.100 1.301 1
1 1031 . 8 1 1 A 96 96 ASP CA C 96 56.147 53.819 2.328 1
1 1032 . 8 1 1 A 96 96 ASP CB C 96 40.790 41.234 -0.444 1
1 1033 . 8 1 1 A 96 96 ASP N N 96 120.784 125.866 -5.082 1
1 1034 . 8 1 1 A 97 97 LYS H H 97 9.382 8.605 0.777 1
1 1035 . 8 1 1 A 97 97 LYS HA H 97 4.473 4.650 -0.177 1
1 1044 . 8 1 1 A 97 97 LYS C C 97 175.903 176.281 -0.378 1
1 1045 . 8 1 1 A 97 97 LYS CA C 97 54.771 55.004 -0.233 1
1 1046 . 8 1 1 A 97 97 LYS CB C 97 33.270 33.169 0.101 1
1 1050 . 8 1 1 A 97 97 LYS N N 97 131.617 126.479 5.138 1
1 1051 . 8 1 1 A 98 98 LYS H H 98 8.940 8.200 0.740 1
1 1052 . 8 1 1 A 98 98 LYS HA H 98 4.118 3.829 0.289 1
1 1061 . 8 1 1 A 98 98 LYS C C 98 177.065 175.240 1.825 1
1 1062 . 8 1 1 A 98 98 LYS CA C 98 56.297 57.486 -1.189 1
1 1063 . 8 1 1 A 98 98 LYS CB C 98 28.467 29.411 -0.944 1
1 1067 . 8 1 1 A 98 98 LYS N N 98 115.034 118.124 -3.090 1
1 1068 . 8 1 1 A 99 99 GLN H H 99 9.266 7.397 1.869 1
1 1069 . 8 1 1 A 99 99 GLN HA H 99 4.460 4.135 0.325 1
1 1074 . 8 1 1 A 99 99 GLN C C 99 174.990 174.974 0.016 1
1 1075 . 8 1 1 A 99 99 GLN CA C 99 57.563 55.896 1.667 1
1 1076 . 8 1 1 A 99 99 GLN CB C 99 27.280 29.288 -2.008 1
1 1078 . 8 1 1 A 99 99 GLN N N 99 117.717 119.394 -1.677 1
1 1079 . 8 1 1 A 100 100 TYR H H 100 8.402 8.510 -0.108 1
1 1080 . 8 1 1 A 100 100 TYR HA H 100 4.935 5.731 -0.796 1
1 1087 . 8 1 1 A 100 100 TYR C C 100 171.504 172.962 -1.458 1
1 1088 . 8 1 1 A 100 100 TYR CA C 100 55.786 55.092 0.694 1
1 1089 . 8 1 1 A 100 100 TYR CB C 100 41.090 41.372 -0.282 1
1 1092 . 8 1 1 A 100 100 TYR N N 100 115.081 122.662 -7.581 1
1 1093 . 8 1 1 A 101 101 HIS H H 101 8.829 8.955 -0.126 1
1 1094 . 8 1 1 A 101 101 HIS HA H 101 4.525 4.886 -0.361 1
1 1099 . 8 1 1 A 101 101 HIS C C 101 174.935 173.912 1.023 1
1 1100 . 8 1 1 A 101 101 HIS CA C 101 56.327 54.850 1.477 1
1 1101 . 8 1 1 A 101 101 HIS CB C 101 31.020 31.402 -0.382 1
1 1104 . 8 1 1 A 101 101 HIS N N 101 120.894 122.252 -1.358 1
1 1105 . 8 1 1 A 102 102 CYS H H 102 7.427 8.157 -0.730 1
1 1106 . 8 1 1 A 102 102 CYS HA H 102 4.561 4.403 0.158 1
1 1109 . 8 1 1 A 102 102 CYS C C 102 175.765 175.421 0.344 1
1 1110 . 8 1 1 A 102 102 CYS CA C 102 57.707 58.652 -0.945 1
1 1111 . 8 1 1 A 102 102 CYS CB C 102 29.130 27.686 1.444 1
1 1112 . 8 1 1 A 102 102 CYS N N 102 131.256 127.084 4.172 1
1 1113 . 8 1 1 A 103 103 GLU H H 103 9.497 8.772 0.725 1
1 1114 . 8 1 1 A 103 103 GLU HA H 103 4.003 4.212 -0.209 1
1 1119 . 8 1 1 A 103 103 GLU C C 103 176.540 178.679 -2.139 1
1 1120 . 8 1 1 A 103 103 GLU CA C 103 58.796 59.188 -0.392 1
1 1121 . 8 1 1 A 103 103 GLU CB C 103 29.280 29.174 0.106 1
1 1123 . 8 1 1 A 103 103 GLU N N 103 129.829 127.133 2.696 1
1 1124 . 8 1 1 A 104 104 ASN H H 104 7.832 8.537 -0.705 1
1 1125 . 8 1 1 A 104 104 ASN HA H 104 4.457 4.417 0.040 1
1 1130 . 8 1 1 A 104 104 ASN C C 104 176.401 178.104 -1.703 1
1 1131 . 8 1 1 A 104 104 ASN CA C 104 56.053 56.048 0.005 1
1 1132 . 8 1 1 A 104 104 ASN CB C 104 38.400 37.490 0.910 1
1 1133 . 8 1 1 A 104 104 ASN N N 104 117.703 117.615 0.088 1
1 1135 . 8 1 1 A 105 105 CYS H H 105 9.415 7.660 1.755 1
1 1136 . 8 1 1 A 105 105 CYS HA H 105 4.137 4.398 -0.261 1
1 1139 . 8 1 1 A 105 105 CYS C C 105 176.844 175.421 1.423 1
1 1140 . 8 1 1 A 105 105 CYS CA C 105 64.328 59.624 4.704 1
1 1141 . 8 1 1 A 105 105 CYS CB C 105 30.350 27.817 2.533 1
1 1142 . 8 1 1 A 105 105 CYS N N 105 124.939 116.717 8.222 1
1 1143 . 8 1 1 A 106 106 GLY H H 106 8.145 8.618 -0.473 1
1 1144 . 8 1 1 A 106 106 GLY HA2 H 106 3.980 4.011 -0.031 1
1 1145 . 8 1 1 A 106 106 GLY HA3 H 106 3.502 4.042 -0.540 1
1 1146 . 8 1 1 A 106 106 GLY C C 106 172.500 173.911 -1.411 1
1 1147 . 8 1 1 A 106 106 GLY CA C 106 44.968 46.122 -1.154 1
1 1148 . 8 1 1 A 106 106 GLY N N 106 106.090 109.275 -3.185 1
1 1149 . 8 1 1 A 107 107 ILE H H 107 6.465 6.909 -0.444 1
1 1150 . 8 1 1 A 107 107 ILE HA H 107 4.878 4.963 -0.085 1
1 1160 . 8 1 1 A 107 107 ILE C C 107 174.824 174.307 0.517 1
1 1161 . 8 1 1 A 107 107 ILE CA C 107 58.226 58.363 -0.137 1
1 1162 . 8 1 1 A 107 107 ILE CB C 107 44.460 42.031 2.429 1
1 1166 . 8 1 1 A 107 107 ILE N N 107 107.914 114.782 -6.868 1
1 1167 . 8 1 1 A 108 108 CYS H H 108 7.041 8.711 -1.670 1
1 1168 . 8 1 1 A 108 108 CYS HA H 108 5.018 5.038 -0.020 1
1 1171 . 8 1 1 A 108 108 CYS C C 108 175.461 172.914 2.547 1
1 1172 . 8 1 1 A 108 108 CYS CA C 108 62.097 57.406 4.691 1
1 1173 . 8 1 1 A 108 108 CYS CB C 108 31.353 31.041 0.312 1
1 1174 . 8 1 1 A 108 108 CYS N N 108 122.441 119.881 2.560 1
1 1175 . 8 1 1 A 109 109 ARG H H 109 8.561 8.041 0.520 1
1 1176 . 8 1 1 A 109 109 ARG HA H 109 4.239 4.638 -0.399 1
1 1183 . 8 1 1 A 109 109 ARG C C 109 174.271 175.640 -1.369 1
1 1184 . 8 1 1 A 109 109 ARG CA C 109 52.962 53.803 -0.841 1
1 1185 . 8 1 1 A 109 109 ARG CB C 109 33.903 34.471 -0.568 1
1 1188 . 8 1 1 A 109 109 ARG N N 109 121.163 121.621 -0.458 1
1 1189 . 8 1 1 A 110 110 ILE H H 110 7.847 8.409 -0.562 1
1 1190 . 8 1 1 A 110 110 ILE HA H 110 3.531 3.824 -0.293 1
1 1200 . 8 1 1 A 110 110 ILE C C 110 175.405 176.782 -1.377 1
1 1201 . 8 1 1 A 110 110 ILE CA C 110 62.201 63.020 -0.819 1
1 1202 . 8 1 1 A 110 110 ILE CB C 110 36.860 37.447 -0.587 1
1 1206 . 8 1 1 A 110 110 ILE N N 110 118.955 120.642 -1.687 1
1 1207 . 8 1 1 A 111 111 GLY H H 111 6.928 7.757 -0.829 1
1 1208 . 8 1 1 A 111 111 GLY HA2 H 111 4.564 4.219 0.345 1
1 1209 . 8 1 1 A 111 111 GLY HA3 H 111 4.135 4.316 -0.181 1
1 1210 . 8 1 1 A 111 111 GLY CA C 111 43.068 45.589 -2.521 1
1 1211 . 8 1 1 A 111 111 GLY N N 111 113.782 113.529 0.253 1
1 1212 . 8 1 1 A 112 112 PRO HA H 112 4.990 4.817 0.173 1
1 1219 . 8 1 1 A 112 112 PRO C C 112 177.342 177.626 -0.284 1
1 1220 . 8 1 1 A 112 112 PRO CA C 112 62.920 62.505 0.415 1
1 1221 . 8 1 1 A 112 112 PRO CB C 112 34.807 31.919 2.888 1
1 1224 . 8 1 1 A 113 113 LYS H H 113 8.989 8.489 0.500 1
1 1225 . 8 1 1 A 113 113 LYS HA H 113 3.144 4.100 -0.956 1
1 1234 . 8 1 1 A 113 113 LYS C C 113 177.536 177.922 -0.386 1
1 1235 . 8 1 1 A 113 113 LYS CA C 113 59.883 58.981 0.902 1
1 1236 . 8 1 1 A 113 113 LYS CB C 113 32.260 32.044 0.216 1
1 1240 . 8 1 1 A 113 113 LYS N N 113 123.545 121.944 1.601 1
1 1241 . 8 1 1 A 114 114 GLU H H 114 9.080 9.085 -0.005 1
1 1242 . 8 1 1 A 114 114 GLU HA H 114 4.199 4.206 -0.007 1
1 1247 . 8 1 1 A 114 114 GLU C C 114 176.374 176.315 0.059 1
1 1248 . 8 1 1 A 114 114 GLU CA C 114 58.733 58.591 0.142 1
1 1249 . 8 1 1 A 114 114 GLU CB C 114 28.077 28.476 -0.399 1
1 1251 . 8 1 1 A 114 114 GLU N N 114 114.832 119.633 -4.801 1
1 1252 . 8 1 1 A 115 115 ASP H H 115 7.799 7.882 -0.083 1
1 1253 . 8 1 1 A 115 115 ASP HA H 115 4.642 4.905 -0.263 1
1 1256 . 8 1 1 A 115 115 ASP C C 115 176.374 174.494 1.880 1
1 1257 . 8 1 1 A 115 115 ASP CA C 115 54.470 52.865 1.605 1
1 1258 . 8 1 1 A 115 115 ASP CB C 115 40.850 41.084 -0.234 1
1 1259 . 8 1 1 A 115 115 ASP N N 115 118.858 120.429 -1.571 1
1 1260 . 8 1 1 A 116 116 PHE H H 116 8.063 8.207 -0.144 1
1 1261 . 8 1 1 A 116 116 PHE HA H 116 5.239 5.492 -0.253 1
1 1264 . 8 1 1 A 116 116 PHE C C 116 173.413 173.089 0.324 1
1 1265 . 8 1 1 A 116 116 PHE CA C 116 57.708 55.483 2.225 1
1 1266 . 8 1 1 A 116 116 PHE CB C 116 44.557 42.441 2.116 1
1 1267 . 8 1 1 A 116 116 PHE N N 116 120.567 118.995 1.572 1
1 1268 . 8 1 1 A 117 117 PHE H H 117 9.439 8.847 0.592 1
1 1269 . 8 1 1 A 117 117 PHE HA H 117 5.091 4.808 0.283 1
1 1277 . 8 1 1 A 117 117 PHE C C 117 171.614 172.509 -0.895 1
1 1278 . 8 1 1 A 117 117 PHE CA C 117 55.311 55.764 -0.453 1
1 1279 . 8 1 1 A 117 117 PHE CB C 117 41.887 41.849 0.038 1
1 1283 . 8 1 1 A 117 117 PHE N N 117 118.040 115.525 2.515 1
1 1284 . 8 1 1 A 118 118 HIS H H 118 8.779 8.923 -0.144 1
1 1285 . 8 1 1 A 118 118 HIS HA H 118 4.836 4.675 0.161 1
1 1289 . 8 1 1 A 118 118 HIS C C 118 174.879 173.867 1.012 1
1 1290 . 8 1 1 A 118 118 HIS CA C 118 55.322 55.074 0.248 1
1 1291 . 8 1 1 A 118 118 HIS CB C 118 30.950 30.700 0.250 1
1 1293 . 8 1 1 A 118 118 HIS N N 118 121.208 121.933 -0.725 1
1 1294 . 8 1 1 A 119 119 CYS H H 119 8.123 7.971 0.152 1
1 1295 . 8 1 1 A 119 119 CYS HA H 119 4.529 4.529 0.000 1
1 1298 . 8 1 1 A 119 119 CYS C C 119 176.567 175.730 0.837 1
1 1299 . 8 1 1 A 119 119 CYS CA C 119 58.957 59.542 -0.585 1
1 1300 . 8 1 1 A 119 119 CYS CB C 119 30.090 28.514 1.576 1
1 1301 . 8 1 1 A 119 119 CYS N N 119 131.659 126.571 5.088 1
1 1302 . 8 1 1 A 120 120 LEU H H 120 8.970 8.464 0.506 1
1 1303 . 8 1 1 A 120 120 LEU N N 120 130.361 129.004 1.357 1
1 1304 . 8 1 1 A 121 121 LYS HA H 121 4.299 4.377 -0.078 1
1 1313 . 8 1 1 A 121 121 LYS CA C 121 58.727 56.198 2.529 1
1 1314 . 8 1 1 A 121 121 LYS CB C 121 33.210 33.075 0.135 1
1 1318 . 8 1 1 A 123 123 ASN HA H 123 4.438 5.089 -0.651 1
1 1323 . 8 1 1 A 123 123 ASN C C 123 172.444 174.420 -1.976 1
1 1324 . 8 1 1 A 123 123 ASN CA C 123 53.448 53.033 0.415 1
1 1325 . 8 1 1 A 123 123 ASN CB C 123 37.130 37.246 -0.116 1
1 1327 . 8 1 1 A 124 124 LEU H H 124 6.596 8.127 -1.531 1
1 1328 . 8 1 1 A 124 124 LEU HA H 124 4.576 4.847 -0.271 1
1 1338 . 8 1 1 A 124 124 LEU C C 124 175.903 174.457 1.446 1
1 1339 . 8 1 1 A 124 124 LEU CA C 124 54.043 53.933 0.110 1
1 1340 . 8 1 1 A 124 124 LEU CB C 124 45.837 44.617 1.220 1
1 1344 . 8 1 1 A 124 124 LEU N N 124 115.443 118.091 -2.648 1
1 1345 . 8 1 1 A 125 125 CYS H H 125 6.342 9.017 -2.675 1
1 1346 . 8 1 1 A 125 125 CYS HA H 125 5.033 5.476 -0.443 1
1 1349 . 8 1 1 A 125 125 CYS C C 125 175.101 173.391 1.710 1
1 1350 . 8 1 1 A 125 125 CYS CA C 125 62.046 57.161 4.885 1
1 1351 . 8 1 1 A 125 125 CYS CB C 125 30.840 29.990 0.850 1
1 1352 . 8 1 1 A 125 125 CYS N N 125 118.685 117.850 0.835 1
1 1353 . 8 1 1 A 126 126 LEU H H 126 8.894 7.961 0.933 1
1 1354 . 8 1 1 A 126 126 LEU HA H 126 4.565 4.868 -0.303 1
1 1364 . 8 1 1 A 126 126 LEU C C 126 174.879 175.955 -1.076 1
1 1365 . 8 1 1 A 126 126 LEU CA C 126 52.751 53.110 -0.359 1
1 1366 . 8 1 1 A 126 126 LEU CB C 126 46.090 44.199 1.891 1
1 1370 . 8 1 1 A 126 126 LEU N N 126 124.501 125.397 -0.896 1
1 1371 . 8 1 1 A 127 127 ALA H H 127 8.378 8.826 -0.448 1
1 1372 . 8 1 1 A 127 127 ALA HA H 127 3.957 4.956 -0.999 1
1 1376 . 8 1 1 A 127 127 ALA C C 127 179.085 178.442 0.643 1
1 1377 . 8 1 1 A 127 127 ALA CA C 127 52.554 51.587 0.967 1
1 1378 . 8 1 1 A 127 127 ALA CB C 127 18.527 20.591 -2.064 1
1 1379 . 8 1 1 A 127 127 ALA N N 127 123.011 122.435 0.576 1
1 1380 . 8 1 1 A 128 128 MET H H 128 8.237 8.682 -0.445 1
1 1385 . 8 1 1 A 128 128 MET N N 128 120.642 121.452 -0.810 1
1 1386 . 8 1 1 A 129 129 ASN HA H 129 4.502 4.629 -0.127 1
1 1389 . 8 1 1 A 129 129 ASN C C 129 175.931 176.189 -0.258 1
1 1390 . 8 1 1 A 129 129 ASN CA C 129 55.064 54.169 0.895 1
1 1391 . 8 1 1 A 129 129 ASN CB C 129 36.920 38.650 -1.730 1
1 1392 . 8 1 1 A 130 130 LEU H H 130 8.211 7.755 0.456 1
1 1393 . 8 1 1 A 130 130 LEU HA H 130 4.489 4.647 -0.158 1
1 1403 . 8 1 1 A 130 130 LEU C C 130 178.836 177.495 1.341 1
1 1404 . 8 1 1 A 130 130 LEU CA C 130 54.653 53.682 0.971 1
1 1405 . 8 1 1 A 130 130 LEU CB C 130 41.887 43.239 -1.352 1
1 1409 . 8 1 1 A 130 130 LEU N N 130 118.563 120.531 -1.968 1
1 1410 . 8 1 1 A 131 131 GLN H H 131 7.953 7.946 0.007 1
1 1411 . 8 1 1 A 131 131 GLN HA H 131 3.729 3.945 -0.216 1
1 1418 . 8 1 1 A 131 131 GLN CA C 131 59.310 59.412 -0.102 1
1 1419 . 8 1 1 A 131 131 GLN CB C 131 28.340 27.751 0.589 1
1 1421 . 8 1 1 A 131 131 GLN N N 131 123.929 119.627 4.302 1
1 1423 . 8 1 1 A 132 132 GLY HA2 H 132 4.034 3.939 0.095 1
1 1424 . 8 1 1 A 132 132 GLY HA3 H 132 3.865 3.941 -0.076 1
1 1425 . 8 1 1 A 132 132 GLY C C 132 174.547 175.534 -0.987 1
1 1426 . 8 1 1 A 132 132 GLY CA C 132 45.902 46.370 -0.468 1
1 1427 . 8 1 1 A 133 133 ARG H H 133 7.735 8.007 -0.272 1
1 1428 . 8 1 1 A 133 133 ARG HA H 133 4.611 4.062 0.549 1
1 1435 . 8 1 1 A 133 133 ARG C C 133 175.461 176.876 -1.415 1
1 1436 . 8 1 1 A 133 133 ARG CA C 133 54.987 58.770 -3.783 1
1 1437 . 8 1 1 A 133 133 ARG CB C 133 31.470 29.901 1.569 1
1 1440 . 8 1 1 A 133 133 ARG N N 133 118.194 120.920 -2.726 1
1 1441 . 8 1 1 A 134 134 HIS H H 134 7.803 7.603 0.200 1
1 1444 . 8 1 1 A 134 134 HIS N N 134 118.700 116.777 1.923 1
1 1445 . 8 1 1 A 135 135 LYS HA H 135 4.331 4.624 -0.293 1
1 1454 . 8 1 1 A 135 135 LYS C C 135 174.852 176.627 -1.775 1
1 1455 . 8 1 1 A 135 135 LYS CA C 135 55.390 55.726 -0.336 1
1 1456 . 8 1 1 A 135 135 LYS CB C 135 32.970 32.354 0.616 1
1 1460 . 8 1 1 A 136 136 CYS H H 136 7.801 8.662 -0.861 1
1 1461 . 8 1 1 A 136 136 CYS HA H 136 4.113 4.558 -0.445 1
1 1464 . 8 1 1 A 136 136 CYS C C 136 174.879 174.833 0.046 1
1 1465 . 8 1 1 A 136 136 CYS CA C 136 60.028 58.668 1.360 1
1 1466 . 8 1 1 A 136 136 CYS CB C 136 30.350 28.111 2.239 1
1 1467 . 8 1 1 A 136 136 CYS N N 136 126.055 124.461 1.594 1
1 10 . 9 1 1 A 2 2 ALA H H 2 8.220 8.651 -0.431 1
1 11 . 9 1 1 A 2 2 ALA HA H 2 4.321 4.922 -0.601 1
1 15 . 9 1 1 A 2 2 ALA C C 2 177.564 176.033 1.531 1
1 16 . 9 1 1 A 2 2 ALA CA C 2 52.383 51.947 0.436 1
1 17 . 9 1 1 A 2 2 ALA CB C 2 19.290 19.909 -0.619 1
1 18 . 9 1 1 A 2 2 ALA N N 2 125.223 125.553 -0.330 1
1 19 . 9 1 1 A 3 3 ALA H H 3 8.246 8.918 -0.672 1
1 20 . 9 1 1 A 3 3 ALA N N 3 123.250 127.028 -3.778 1
1 21 . 9 1 1 A 5 5 ALA HA H 5 4.415 5.171 -0.756 1
1 25 . 9 1 1 A 5 5 ALA C C 5 177.481 176.114 1.367 1
1 26 . 9 1 1 A 5 5 ALA CA C 5 52.423 50.788 1.635 1
1 27 . 9 1 1 A 5 5 ALA CB C 5 19.420 21.808 -2.388 1
1 28 . 9 1 1 A 6 6 ARG H H 6 8.239 8.948 -0.709 1
1 29 . 9 1 1 A 6 6 ARG HA H 6 4.371 5.185 -0.814 1
1 36 . 9 1 1 A 6 6 ARG C C 6 176.180 174.780 1.400 1
1 37 . 9 1 1 A 6 6 ARG CA C 6 56.353 54.502 1.851 1
1 38 . 9 1 1 A 6 6 ARG CB C 6 31.170 32.922 -1.752 1
1 41 . 9 1 1 A 6 6 ARG N N 6 120.436 116.130 4.306 1
1 42 . 9 1 1 A 7 7 GLU H H 7 8.535 8.784 -0.249 1
1 43 . 9 1 1 A 7 7 GLU HA H 7 4.335 4.926 -0.591 1
1 48 . 9 1 1 A 7 7 GLU C C 7 176.346 174.177 2.169 1
1 49 . 9 1 1 A 7 7 GLU CA C 7 56.740 55.952 0.788 1
1 50 . 9 1 1 A 7 7 GLU CB C 7 30.390 33.343 -2.953 1
1 52 . 9 1 1 A 7 7 GLU N N 7 122.189 121.880 0.309 1
1 53 . 9 1 1 A 8 8 ASP H H 8 8.347 8.725 -0.378 1
1 54 . 9 1 1 A 8 8 ASP N N 8 121.112 124.591 -3.479 1
1 55 . 9 1 1 A 9 9 GLY HA2 H 9 3.975 4.288 -0.313 1
1 56 . 9 1 1 A 9 9 GLY HA3 H 9 3.975 4.288 -0.313 1
1 57 . 9 1 1 A 9 9 GLY C C 9 174.243 173.551 0.692 1
1 58 . 9 1 1 A 9 9 GLY CA C 9 45.933 45.754 0.179 1
1 59 . 9 1 1 A 10 10 ALA H H 10 8.111 7.453 0.658 1
1 60 . 9 1 1 A 10 10 ALA N N 10 123.721 122.595 1.126 1
1 61 . 9 1 1 A 12 12 GLY HA2 H 12 3.992 3.888 0.104 1
1 62 . 9 1 1 A 12 12 GLY HA3 H 12 3.992 3.889 0.103 1
1 63 . 9 1 1 A 12 12 GLY C C 12 173.883 174.920 -1.037 1
1 64 . 9 1 1 A 12 12 GLY CA C 12 45.381 47.397 -2.016 1
1 65 . 9 1 1 A 13 13 GLU H H 13 8.224 7.821 0.403 1
1 66 . 9 1 1 A 13 13 GLU HA H 13 4.367 3.932 0.435 1
1 71 . 9 1 1 A 13 13 GLU C C 13 176.125 175.872 0.253 1
1 72 . 9 1 1 A 13 13 GLU CA C 13 56.349 59.419 -3.070 1
1 73 . 9 1 1 A 13 13 GLU CB C 13 29.560 27.762 1.798 1
1 75 . 9 1 1 A 13 13 GLU N N 13 120.148 115.164 4.984 1
1 76 . 9 1 1 A 14 14 GLU H H 14 8.508 7.935 0.573 1
1 77 . 9 1 1 A 14 14 GLU HA H 14 4.302 4.201 0.101 1
1 82 . 9 1 1 A 14 14 GLU C C 14 176.623 175.872 0.751 1
1 83 . 9 1 1 A 14 14 GLU CA C 14 56.497 56.780 -0.283 1
1 84 . 9 1 1 A 14 14 GLU CB C 14 30.110 30.163 -0.053 1
1 86 . 9 1 1 A 14 14 GLU N N 14 122.160 119.335 2.825 1
1 87 . 9 1 1 A 15 15 ARG H H 15 8.356 8.816 -0.460 1
1 88 . 9 1 1 A 15 15 ARG HA H 15 4.366 4.582 -0.216 1
1 95 . 9 1 1 A 15 15 ARG C C 15 176.844 177.337 -0.493 1
1 96 . 9 1 1 A 15 15 ARG CA C 15 56.010 56.125 -0.115 1
1 97 . 9 1 1 A 15 15 ARG CB C 15 30.890 31.577 -0.687 1
1 100 . 9 1 1 A 15 15 ARG N N 15 121.945 125.758 -3.813 1
1 101 . 9 1 1 A 16 16 GLY H H 16 8.414 8.054 0.360 1
1 102 . 9 1 1 A 16 16 GLY HA2 H 16 4.022 3.865 0.157 1
1 103 . 9 1 1 A 16 16 GLY HA3 H 16 4.022 3.870 0.152 1
1 104 . 9 1 1 A 16 16 GLY C C 16 174.326 174.477 -0.151 1
1 105 . 9 1 1 A 16 16 GLY CA C 16 45.620 47.350 -1.730 1
1 106 . 9 1 1 A 16 16 GLY N N 16 109.734 108.321 1.413 1
1 107 . 9 1 1 A 17 17 GLN H H 17 8.184 7.892 0.292 1
1 108 . 9 1 1 A 17 17 GLN HA H 17 4.366 4.572 -0.206 1
1 113 . 9 1 1 A 17 17 GLN C C 17 175.544 175.468 0.076 1
1 114 . 9 1 1 A 17 17 GLN CA C 17 55.749 56.549 -0.800 1
1 115 . 9 1 1 A 17 17 GLN CB C 17 29.367 30.038 -0.671 1
1 117 . 9 1 1 A 17 17 GLN N N 17 119.546 121.117 -1.571 1
1 118 . 9 1 1 A 18 18 ARG H H 18 8.366 7.876 0.490 1
1 119 . 9 1 1 A 18 18 ARG HA H 18 4.487 4.688 -0.201 1
1 126 . 9 1 1 A 18 18 ARG C C 18 176.042 175.970 0.072 1
1 127 . 9 1 1 A 18 18 ARG CA C 18 55.735 54.776 0.959 1
1 128 . 9 1 1 A 18 18 ARG CB C 18 31.170 33.754 -2.584 1
1 131 . 9 1 1 A 18 18 ARG N N 18 122.330 117.834 4.496 1
1 132 . 9 1 1 A 19 19 GLY H H 19 8.192 8.334 -0.142 1
1 133 . 9 1 1 A 19 19 GLY HA2 H 19 4.852 3.985 0.867 1
1 134 . 9 1 1 A 19 19 GLY HA3 H 19 3.894 4.006 -0.112 1
1 135 . 9 1 1 A 19 19 GLY C C 19 172.361 172.035 0.326 1
1 136 . 9 1 1 A 19 19 GLY CA C 19 45.580 46.049 -0.469 1
1 137 . 9 1 1 A 19 19 GLY N N 19 109.658 109.451 0.207 1
1 138 . 9 1 1 A 20 20 CYS H H 20 8.843 8.169 0.674 1
1 139 . 9 1 1 A 20 20 CYS HA H 20 5.147 5.043 0.104 1
1 142 . 9 1 1 A 20 20 CYS C C 20 175.211 174.392 0.819 1
1 143 . 9 1 1 A 20 20 CYS CA C 20 56.712 58.195 -1.483 1
1 144 . 9 1 1 A 20 20 CYS CB C 20 33.530 30.637 2.893 1
1 145 . 9 1 1 A 20 20 CYS N N 20 120.185 121.414 -1.229 1
1 146 . 9 1 1 A 21 21 GLU H H 21 8.981 8.916 0.065 1
1 147 . 9 1 1 A 21 21 GLU HA H 21 4.100 4.031 0.069 1
1 152 . 9 1 1 A 21 21 GLU C C 21 176.014 178.529 -2.515 1
1 153 . 9 1 1 A 21 21 GLU CA C 21 57.134 58.614 -1.480 1
1 154 . 9 1 1 A 21 21 GLU CB C 21 28.890 29.036 -0.146 1
1 156 . 9 1 1 A 21 21 GLU N N 21 116.078 124.241 -8.163 1
1 157 . 9 1 1 A 22 22 HIS H H 22 9.342 7.702 1.640 1
1 158 . 9 1 1 A 22 22 HIS HA H 22 4.210 4.176 0.034 1
1 161 . 9 1 1 A 22 22 HIS C C 22 175.128 174.797 0.331 1
1 162 . 9 1 1 A 22 22 HIS CA C 22 58.945 58.932 0.013 1
1 163 . 9 1 1 A 22 22 HIS CB C 22 33.160 29.911 3.249 1
1 164 . 9 1 1 A 22 22 HIS N N 22 122.296 117.720 4.576 1
1 165 . 9 1 1 A 23 23 TYR H H 23 7.931 7.777 0.154 1
1 166 . 9 1 1 A 23 23 TYR HA H 23 4.856 5.230 -0.374 1
1 171 . 9 1 1 A 23 23 TYR C C 23 173.108 174.232 -1.124 1
1 172 . 9 1 1 A 23 23 TYR CA C 23 57.852 56.136 1.716 1
1 173 . 9 1 1 A 23 23 TYR CB C 23 45.300 42.059 3.241 1
1 175 . 9 1 1 A 23 23 TYR N N 23 115.205 115.080 0.125 1
1 176 . 9 1 1 A 24 24 ASP H H 24 8.384 8.819 -0.435 1
1 177 . 9 1 1 A 24 24 ASP HA H 24 5.160 5.105 0.055 1
1 180 . 9 1 1 A 24 24 ASP C C 24 174.437 175.099 -0.662 1
1 181 . 9 1 1 A 24 24 ASP CA C 24 53.343 53.713 -0.370 1
1 182 . 9 1 1 A 24 24 ASP CB C 24 41.470 40.409 1.061 1
1 183 . 9 1 1 A 24 24 ASP N N 24 122.016 124.058 -2.042 1
1 184 . 9 1 1 A 25 25 ARG H H 25 7.313 8.155 -0.842 1
1 185 . 9 1 1 A 25 25 ARG HA H 25 5.331 5.122 0.209 1
1 192 . 9 1 1 A 25 25 ARG C C 25 175.045 175.830 -0.785 1
1 193 . 9 1 1 A 25 25 ARG CA C 25 54.224 54.681 -0.457 1
1 194 . 9 1 1 A 25 25 ARG CB C 25 34.090 33.805 0.285 1
1 197 . 9 1 1 A 25 25 ARG N N 25 115.898 121.845 -5.947 1
1 198 . 9 1 1 A 26 26 GLY H H 26 9.387 8.960 0.427 1
1 199 . 9 1 1 A 26 26 GLY HA2 H 26 4.622 3.892 0.730 1
1 200 . 9 1 1 A 26 26 GLY HA3 H 26 3.788 3.997 -0.209 1
1 201 . 9 1 1 A 26 26 GLY C C 26 170.978 174.305 -3.327 1
1 202 . 9 1 1 A 26 26 GLY CA C 26 44.794 45.493 -0.699 1
1 203 . 9 1 1 A 26 26 GLY N N 26 105.653 108.141 -2.488 1
1 204 . 9 1 1 A 27 27 CYS H H 27 6.864 7.654 -0.790 1
1 205 . 9 1 1 A 27 27 CYS HA H 27 5.195 5.287 -0.092 1
1 208 . 9 1 1 A 27 27 CYS C C 27 171.144 172.887 -1.743 1
1 209 . 9 1 1 A 27 27 CYS CA C 27 52.349 57.203 -4.854 1
1 210 . 9 1 1 A 27 27 CYS CB C 27 30.997 30.729 0.268 1
1 211 . 9 1 1 A 27 27 CYS N N 27 110.921 117.195 -6.274 1
1 212 . 9 1 1 A 28 28 LEU H H 28 8.310 8.497 -0.187 1
1 213 . 9 1 1 A 28 28 LEU HA H 28 4.651 4.941 -0.290 1
1 223 . 9 1 1 A 28 28 LEU C C 28 176.827 177.014 -0.187 1
1 224 . 9 1 1 A 28 28 LEU CA C 28 53.054 53.508 -0.454 1
1 225 . 9 1 1 A 28 28 LEU CB C 28 44.200 43.697 0.503 1
1 229 . 9 1 1 A 28 28 LEU N N 28 115.519 124.189 -8.670 1
1 230 . 9 1 1 A 29 29 LEU H H 29 8.800 8.509 0.291 1
1 231 . 9 1 1 A 29 29 LEU HA H 29 4.313 4.269 0.044 1
1 240 . 9 1 1 A 29 29 LEU C C 29 175.571 176.554 -0.983 1
1 241 . 9 1 1 A 29 29 LEU CA C 29 54.388 54.951 -0.563 1
1 242 . 9 1 1 A 29 29 LEU CB C 29 42.780 41.282 1.498 1
1 245 . 9 1 1 A 29 29 LEU N N 29 118.712 125.323 -6.611 1
1 246 . 9 1 1 A 30 30 LYS H H 30 8.009 8.539 -0.530 1
1 247 . 9 1 1 A 30 30 LYS HA H 30 4.592 4.955 -0.363 1
1 256 . 9 1 1 A 30 30 LYS C C 30 174.990 176.006 -1.016 1
1 257 . 9 1 1 A 30 30 LYS CA C 30 54.999 56.561 -1.562 1
1 258 . 9 1 1 A 30 30 LYS CB C 30 32.330 32.835 -0.505 1
1 262 . 9 1 1 A 30 30 LYS N N 30 122.310 125.890 -3.580 1
1 263 . 9 1 1 A 31 31 ALA H H 31 9.238 8.552 0.686 1
1 264 . 9 1 1 A 31 31 ALA HA H 31 4.477 4.340 0.137 1
1 268 . 9 1 1 A 31 31 ALA CA C 31 50.190 50.474 -0.284 1
1 269 . 9 1 1 A 31 31 ALA CB C 31 21.637 19.725 1.912 1
1 270 . 9 1 1 A 31 31 ALA N N 31 133.864 129.698 4.166 1
1 271 . 9 1 1 A 32 32 PRO HA H 32 4.637 4.462 0.175 1
1 278 . 9 1 1 A 32 32 PRO C C 32 175.737 177.401 -1.664 1
1 279 . 9 1 1 A 32 32 PRO CA C 32 64.259 64.495 -0.236 1
1 280 . 9 1 1 A 32 32 PRO CB C 32 31.740 31.983 -0.243 1
1 283 . 9 1 1 A 33 33 CYS H H 33 8.779 8.265 0.514 1
1 284 . 9 1 1 A 33 33 CYS HA H 33 4.321 4.327 -0.006 1
1 287 . 9 1 1 A 33 33 CYS C C 33 176.733 175.472 1.261 1
1 288 . 9 1 1 A 33 33 CYS CA C 33 54.398 60.896 -6.498 1
1 289 . 9 1 1 A 33 33 CYS CB C 33 30.697 27.327 3.370 1
1 290 . 9 1 1 A 33 33 CYS N N 33 120.005 115.578 4.427 1
1 291 . 9 1 1 A 34 34 CYS H H 34 7.424 7.547 -0.123 1
1 292 . 9 1 1 A 34 34 CYS HA H 34 4.896 4.708 0.188 1
1 295 . 9 1 1 A 34 34 CYS C C 34 174.935 173.789 1.146 1
1 296 . 9 1 1 A 34 34 CYS CA C 34 56.962 58.785 -1.823 1
1 297 . 9 1 1 A 34 34 CYS CB C 34 31.067 30.043 1.024 1
1 298 . 9 1 1 A 34 34 CYS N N 34 115.034 119.354 -4.320 1
1 299 . 9 1 1 A 35 35 ASP H H 35 8.368 8.017 0.351 1
1 300 . 9 1 1 A 35 35 ASP HA H 35 4.454 4.240 0.214 1
1 303 . 9 1 1 A 35 35 ASP C C 35 174.354 174.984 -0.630 1
1 304 . 9 1 1 A 35 35 ASP CA C 35 56.222 55.501 0.721 1
1 305 . 9 1 1 A 35 35 ASP CB C 35 39.730 39.689 0.041 1
1 306 . 9 1 1 A 35 35 ASP N N 35 121.381 118.274 3.107 1
1 307 . 9 1 1 A 36 36 LYS H H 36 7.227 7.484 -0.257 1
1 308 . 9 1 1 A 36 36 LYS HA H 36 4.451 4.499 -0.048 1
1 317 . 9 1 1 A 36 36 LYS C C 36 175.433 175.673 -0.240 1
1 318 . 9 1 1 A 36 36 LYS CA C 36 56.270 55.475 0.795 1
1 319 . 9 1 1 A 36 36 LYS CB C 36 36.620 33.815 2.805 1
1 323 . 9 1 1 A 36 36 LYS N N 36 117.673 118.378 -0.705 1
1 324 . 9 1 1 A 37 37 LEU H H 37 8.053 8.379 -0.326 1
1 325 . 9 1 1 A 37 37 LEU HA H 37 5.292 4.986 0.306 1
1 335 . 9 1 1 A 37 37 LEU C C 37 176.484 174.667 1.817 1
1 336 . 9 1 1 A 37 37 LEU CA C 37 53.348 52.993 0.355 1
1 337 . 9 1 1 A 37 37 LEU CB C 37 42.400 43.565 -1.165 1
1 341 . 9 1 1 A 37 37 LEU N N 37 120.994 121.201 -0.207 1
1 342 . 9 1 1 A 38 38 TYR H H 38 8.741 8.918 -0.177 1
1 343 . 9 1 1 A 38 38 TYR HA H 38 5.002 4.830 0.172 1
1 350 . 9 1 1 A 38 38 TYR C C 38 176.374 176.118 0.256 1
1 351 . 9 1 1 A 38 38 TYR CA C 38 57.081 56.877 0.204 1
1 352 . 9 1 1 A 38 38 TYR CB C 38 45.647 41.462 4.185 1
1 355 . 9 1 1 A 38 38 TYR N N 38 121.128 122.808 -1.680 1
1 356 . 9 1 1 A 39 39 THR H H 39 9.402 8.853 0.549 1
1 357 . 9 1 1 A 39 39 THR HA H 39 4.098 4.060 0.038 1
1 362 . 9 1 1 A 39 39 THR C C 39 173.496 175.277 -1.781 1
1 363 . 9 1 1 A 39 39 THR CA C 39 67.062 65.747 1.315 1
1 364 . 9 1 1 A 39 39 THR CB C 39 68.047 68.473 -0.426 1
1 366 . 9 1 1 A 39 39 THR N N 39 116.641 117.701 -1.060 1
1 367 . 9 1 1 A 40 40 CYS H H 40 7.317 8.093 -0.776 1
1 368 . 9 1 1 A 40 40 CYS HA H 40 4.771 4.907 -0.136 1
1 371 . 9 1 1 A 40 40 CYS C C 40 175.128 175.167 -0.039 1
1 372 . 9 1 1 A 40 40 CYS CA C 40 56.577 57.960 -1.383 1
1 373 . 9 1 1 A 40 40 CYS CB C 40 35.087 30.039 5.048 1
1 374 . 9 1 1 A 40 40 CYS N N 40 109.059 118.577 -9.518 1
1 375 . 9 1 1 A 41 41 ARG H H 41 9.201 8.803 0.398 1
1 376 . 9 1 1 A 41 41 ARG HA H 41 3.982 4.024 -0.042 1
1 383 . 9 1 1 A 41 41 ARG C C 41 175.101 177.702 -2.601 1
1 384 . 9 1 1 A 41 41 ARG CA C 41 58.591 58.766 -0.175 1
1 385 . 9 1 1 A 41 41 ARG CB C 41 29.640 29.718 -0.078 1
1 388 . 9 1 1 A 41 41 ARG N N 41 121.737 124.730 -2.993 1
1 389 . 9 1 1 A 42 42 LEU H H 42 9.116 7.736 1.380 1
1 390 . 9 1 1 A 42 42 LEU HA H 42 4.029 4.114 -0.085 1
1 400 . 9 1 1 A 42 42 LEU C C 42 179.943 179.386 0.557 1
1 401 . 9 1 1 A 42 42 LEU CA C 42 58.005 57.645 0.360 1
1 402 . 9 1 1 A 42 42 LEU CB C 42 38.960 41.062 -2.102 1
1 406 . 9 1 1 A 42 42 LEU N N 42 126.364 116.818 9.546 1
1 407 . 9 1 1 A 43 43 CYS H H 43 8.785 8.251 0.534 1
1 408 . 9 1 1 A 43 43 CYS HA H 43 4.187 4.197 -0.010 1
1 411 . 9 1 1 A 43 43 CYS C C 43 177.785 177.177 0.608 1
1 412 . 9 1 1 A 43 43 CYS CA C 43 66.415 62.535 3.880 1
1 413 . 9 1 1 A 43 43 CYS CB C 43 28.870 26.926 1.944 1
1 414 . 9 1 1 A 43 43 CYS N N 43 124.519 117.290 7.229 1
1 415 . 9 1 1 A 44 44 HIS H H 44 7.604 7.374 0.230 1
1 416 . 9 1 1 A 44 44 HIS HA H 44 1.983 2.871 -0.888 1
1 420 . 9 1 1 A 44 44 HIS C C 44 176.429 176.378 0.051 1
1 421 . 9 1 1 A 44 44 HIS CA C 44 58.760 58.849 -0.089 1
1 422 . 9 1 1 A 44 44 HIS CB C 44 27.990 29.495 -1.505 1
1 423 . 9 1 1 A 44 44 HIS N N 44 117.024 121.245 -4.221 1
1 424 . 9 1 1 A 45 45 ASP H H 45 8.750 7.899 0.851 1
1 425 . 9 1 1 A 45 45 ASP HA H 45 4.116 4.280 -0.164 1
1 428 . 9 1 1 A 45 45 ASP C C 45 177.453 178.342 -0.889 1
1 429 . 9 1 1 A 45 45 ASP CA C 45 56.840 57.306 -0.466 1
1 430 . 9 1 1 A 45 45 ASP CB C 45 38.960 41.539 -2.579 1
1 431 . 9 1 1 A 45 45 ASP N N 45 120.440 118.927 1.513 1
1 432 . 9 1 1 A 46 46 ASN H H 46 7.888 8.237 -0.349 1
1 433 . 9 1 1 A 46 46 ASN HA H 46 4.612 4.409 0.203 1
1 438 . 9 1 1 A 46 46 ASN C C 46 175.903 176.554 -0.651 1
1 439 . 9 1 1 A 46 46 ASN CA C 46 54.342 56.336 -1.994 1
1 440 . 9 1 1 A 46 46 ASN CB C 46 38.790 38.661 0.129 1
1 441 . 9 1 1 A 46 46 ASN N N 46 115.758 117.273 -1.515 1
1 443 . 9 1 1 A 47 47 ASN H H 47 7.384 7.540 -0.156 1
1 444 . 9 1 1 A 47 47 ASN HA H 47 4.893 4.675 0.218 1
1 449 . 9 1 1 A 47 47 ASN C C 47 173.579 175.256 -1.677 1
1 450 . 9 1 1 A 47 47 ASN CA C 47 53.937 54.548 -0.611 1
1 451 . 9 1 1 A 47 47 ASN CB C 47 43.130 39.777 3.353 1
1 452 . 9 1 1 A 47 47 ASN N N 47 116.576 114.759 1.817 1
1 454 . 9 1 1 A 48 48 GLU H H 48 7.143 7.513 -0.370 1
1 455 . 9 1 1 A 48 48 GLU HA H 48 4.572 4.504 0.068 1
1 460 . 9 1 1 A 48 48 GLU C C 48 175.627 175.923 -0.296 1
1 461 . 9 1 1 A 48 48 GLU CA C 48 53.727 54.352 -0.625 1
1 462 . 9 1 1 A 48 48 GLU CB C 48 32.480 32.033 0.447 1
1 464 . 9 1 1 A 48 48 GLU N N 48 116.967 117.221 -0.254 1
1 465 . 9 1 1 A 49 49 ASP H H 49 8.748 8.464 0.284 1
1 466 . 9 1 1 A 49 49 ASP HA H 49 4.576 4.512 0.064 1
1 469 . 9 1 1 A 49 49 ASP C C 49 174.796 176.232 -1.436 1
1 470 . 9 1 1 A 49 49 ASP CA C 49 53.027 56.545 -3.518 1
1 471 . 9 1 1 A 49 49 ASP CB C 49 40.340 42.584 -2.244 1
1 472 . 9 1 1 A 49 49 ASP N N 49 119.296 121.134 -1.838 1
1 473 . 9 1 1 A 50 50 HIS H H 50 6.919 7.108 -0.189 1
1 474 . 9 1 1 A 50 50 HIS HA H 50 4.880 5.179 -0.299 1
1 477 . 9 1 1 A 50 50 HIS C C 50 172.942 174.754 -1.812 1
1 478 . 9 1 1 A 50 50 HIS CA C 50 53.978 53.017 0.961 1
1 479 . 9 1 1 A 50 50 HIS CB C 50 30.330 33.071 -2.741 1
1 480 . 9 1 1 A 50 50 HIS N N 50 113.709 114.588 -0.879 1
1 481 . 9 1 1 A 51 51 GLN H H 51 8.646 8.430 0.216 1
1 482 . 9 1 1 A 51 51 GLN HA H 51 4.896 4.533 0.363 1
1 487 . 9 1 1 A 51 51 GLN C C 51 176.512 174.657 1.855 1
1 488 . 9 1 1 A 51 51 GLN CA C 51 54.872 55.648 -0.776 1
1 489 . 9 1 1 A 51 51 GLN CB C 51 30.950 29.578 1.372 1
1 491 . 9 1 1 A 51 51 GLN N N 51 119.379 118.359 1.020 1
1 492 . 9 1 1 A 52 52 LEU H H 52 9.646 8.739 0.907 1
1 493 . 9 1 1 A 52 52 LEU HA H 52 4.206 5.089 -0.883 1
1 503 . 9 1 1 A 52 52 LEU C C 52 175.793 173.718 2.075 1
1 504 . 9 1 1 A 52 52 LEU CA C 52 55.450 53.554 1.896 1
1 505 . 9 1 1 A 52 52 LEU CB C 52 41.407 44.673 -3.266 1
1 509 . 9 1 1 A 52 52 LEU N N 52 128.069 124.476 3.593 1
1 510 . 9 1 1 A 53 53 ASP H H 53 9.281 8.595 0.686 1
1 511 . 9 1 1 A 53 53 ASP HA H 53 4.725 4.804 -0.079 1
1 514 . 9 1 1 A 53 53 ASP C C 53 176.401 177.199 -0.798 1
1 515 . 9 1 1 A 53 53 ASP CA C 53 52.590 53.198 -0.608 1
1 516 . 9 1 1 A 53 53 ASP CB C 53 39.990 42.760 -2.770 1
1 517 . 9 1 1 A 53 53 ASP N N 53 128.783 126.227 2.556 1
1 518 . 9 1 1 A 54 54 ARG H H 54 8.496 8.447 0.049 1
1 519 . 9 1 1 A 54 54 ARG HA H 54 3.859 3.892 -0.033 1
1 526 . 9 1 1 A 54 54 ARG C C 54 176.346 177.653 -1.307 1
1 527 . 9 1 1 A 54 54 ARG CA C 54 57.357 58.292 -0.935 1
1 528 . 9 1 1 A 54 54 ARG CB C 54 28.890 29.639 -0.749 1
1 531 . 9 1 1 A 54 54 ARG N N 54 125.813 124.707 1.106 1
1 532 . 9 1 1 A 55 55 PHE H H 55 8.005 7.005 1.000 1
1 533 . 9 1 1 A 55 55 PHE HA H 55 4.712 4.476 0.236 1
1 540 . 9 1 1 A 55 55 PHE C C 55 177.481 178.449 -0.968 1
1 541 . 9 1 1 A 55 55 PHE CA C 55 59.080 61.096 -2.016 1
1 542 . 9 1 1 A 55 55 PHE CB C 55 37.447 38.698 -1.251 1
1 545 . 9 1 1 A 55 55 PHE N N 55 120.168 118.109 2.059 1
1 546 . 9 1 1 A 56 56 LYS H H 56 7.681 7.463 0.218 1
1 547 . 9 1 1 A 56 56 LYS HA H 56 4.411 4.282 0.129 1
1 556 . 9 1 1 A 56 56 LYS C C 56 175.959 176.472 -0.513 1
1 557 . 9 1 1 A 56 56 LYS CA C 56 55.459 58.133 -2.674 1
1 558 . 9 1 1 A 56 56 LYS CB C 56 33.590 32.836 0.754 1
1 562 . 9 1 1 A 56 56 LYS N N 56 116.937 118.013 -1.076 1
1 563 . 9 1 1 A 57 57 VAL H H 57 6.553 7.271 -0.718 1
1 564 . 9 1 1 A 57 57 VAL HA H 57 3.408 3.906 -0.498 1
1 572 . 9 1 1 A 57 57 VAL C C 57 173.911 175.071 -1.160 1
1 573 . 9 1 1 A 57 57 VAL CA C 57 65.025 61.872 3.153 1
1 574 . 9 1 1 A 57 57 VAL CB C 57 32.663 32.831 -0.168 1
1 577 . 9 1 1 A 57 57 VAL N N 57 119.519 117.421 2.098 1
1 578 . 9 1 1 A 58 58 LYS H H 58 9.182 8.893 0.289 1
1 579 . 9 1 1 A 58 58 LYS HA H 58 4.489 4.561 -0.072 1
1 588 . 9 1 1 A 58 58 LYS C C 58 176.927 175.974 0.953 1
1 589 . 9 1 1 A 58 58 LYS CA C 58 55.913 57.439 -1.526 1
1 590 . 9 1 1 A 58 58 LYS CB C 58 36.340 35.929 0.411 1
1 594 . 9 1 1 A 58 58 LYS N N 58 124.985 124.208 0.777 1
1 595 . 9 1 1 A 59 59 GLU H H 59 8.799 7.997 0.802 1
1 596 . 9 1 1 A 59 59 GLU HA H 59 5.209 4.907 0.302 1
1 601 . 9 1 1 A 59 59 GLU C C 59 173.911 175.604 -1.693 1
1 602 . 9 1 1 A 59 59 GLU CA C 59 54.670 54.832 -0.162 1
1 603 . 9 1 1 A 59 59 GLU CB C 59 35.180 31.959 3.221 1
1 605 . 9 1 1 A 59 59 GLU N N 59 121.493 118.012 3.481 1
1 606 . 9 1 1 A 60 60 VAL H H 60 8.917 8.862 0.055 1
1 607 . 9 1 1 A 60 60 VAL HA H 60 4.983 5.144 -0.161 1
1 615 . 9 1 1 A 60 60 VAL C C 60 173.441 174.397 -0.956 1
1 616 . 9 1 1 A 60 60 VAL CA C 60 57.497 59.534 -2.037 1
1 617 . 9 1 1 A 60 60 VAL CB C 60 35.460 35.883 -0.423 1
1 620 . 9 1 1 A 60 60 VAL N N 60 109.266 117.647 -8.381 1
1 621 . 9 1 1 A 61 61 GLN H H 61 8.970 8.230 0.740 1
1 622 . 9 1 1 A 61 61 GLN HA H 61 5.024 4.791 0.233 1
1 629 . 9 1 1 A 61 61 GLN C C 61 175.045 174.597 0.448 1
1 630 . 9 1 1 A 61 61 GLN CA C 61 53.128 55.006 -1.878 1
1 631 . 9 1 1 A 61 61 GLN CB C 61 33.980 29.898 4.082 1
1 633 . 9 1 1 A 61 61 GLN N N 61 118.525 122.985 -4.460 1
1 635 . 9 1 1 A 62 62 CYS H H 62 7.688 8.850 -1.162 1
1 636 . 9 1 1 A 62 62 CYS HA H 62 4.210 4.597 -0.387 1
1 639 . 9 1 1 A 62 62 CYS C C 62 177.951 174.645 3.306 1
1 640 . 9 1 1 A 62 62 CYS CA C 62 59.845 57.843 2.002 1
1 641 . 9 1 1 A 62 62 CYS CB C 62 33.120 28.995 4.125 1
1 642 . 9 1 1 A 62 62 CYS N N 62 128.772 121.306 7.466 1
1 643 . 9 1 1 A 63 63 ILE H H 63 8.192 8.608 -0.416 1
1 644 . 9 1 1 A 63 63 ILE HA H 63 3.984 4.388 -0.404 1
1 654 . 9 1 1 A 63 63 ILE C C 63 175.433 175.657 -0.224 1
1 655 . 9 1 1 A 63 63 ILE CA C 63 63.657 61.042 2.615 1
1 656 . 9 1 1 A 63 63 ILE CB C 63 38.506 35.481 3.025 1
1 660 . 9 1 1 A 63 63 ILE N N 63 127.455 128.558 -1.103 1
1 661 . 9 1 1 A 64 64 ASN H H 64 9.181 8.419 0.762 1
1 662 . 9 1 1 A 64 64 ASN HA H 64 4.810 5.021 -0.211 1
1 667 . 9 1 1 A 64 64 ASN C C 64 175.931 176.086 -0.155 1
1 668 . 9 1 1 A 64 64 ASN CA C 64 55.617 54.741 0.876 1
1 669 . 9 1 1 A 64 64 ASN CB C 64 40.640 40.880 -0.240 1
1 670 . 9 1 1 A 64 64 ASN N N 64 122.104 122.673 -0.569 1
1 672 . 9 1 1 A 65 65 CYS H H 65 9.065 8.060 1.005 1
1 673 . 9 1 1 A 65 65 CYS HA H 65 4.979 4.547 0.432 1
1 676 . 9 1 1 A 65 65 CYS C C 65 176.291 174.918 1.373 1
1 677 . 9 1 1 A 65 65 CYS CA C 65 59.027 58.159 0.868 1
1 678 . 9 1 1 A 65 65 CYS CB C 65 32.030 28.911 3.119 1
1 679 . 9 1 1 A 65 65 CYS N N 65 120.368 115.950 4.418 1
1 680 . 9 1 1 A 66 66 GLU H H 66 7.281 8.000 -0.719 1
1 681 . 9 1 1 A 66 66 GLU HA H 66 4.046 4.089 -0.043 1
1 686 . 9 1 1 A 66 66 GLU C C 66 175.211 175.226 -0.015 1
1 687 . 9 1 1 A 66 66 GLU CA C 66 58.591 57.841 0.750 1
1 688 . 9 1 1 A 66 66 GLU CB C 66 27.067 27.517 -0.450 1
1 690 . 9 1 1 A 66 66 GLU N N 66 115.012 115.876 -0.864 1
1 691 . 9 1 1 A 67 67 LYS H H 67 8.481 7.819 0.662 1
1 692 . 9 1 1 A 67 67 LYS HA H 67 4.326 4.279 0.047 1
1 701 . 9 1 1 A 67 67 LYS C C 67 177.923 176.305 1.618 1
1 702 . 9 1 1 A 67 67 LYS CA C 67 57.628 56.274 1.354 1
1 703 . 9 1 1 A 67 67 LYS CB C 67 33.617 33.388 0.229 1
1 707 . 9 1 1 A 67 67 LYS N N 67 123.514 120.986 2.528 1
1 708 . 9 1 1 A 68 68 ILE H H 68 8.867 8.477 0.390 1
1 709 . 9 1 1 A 68 68 ILE HA H 68 4.976 4.376 0.600 1
1 719 . 9 1 1 A 68 68 ILE C C 68 175.018 175.755 -0.737 1
1 720 . 9 1 1 A 68 68 ILE CA C 68 60.919 60.580 0.339 1
1 721 . 9 1 1 A 68 68 ILE CB C 68 37.090 37.578 -0.488 1
1 725 . 9 1 1 A 68 68 ILE N N 68 133.478 125.971 7.507 1
1 726 . 9 1 1 A 69 69 GLN H H 69 9.269 8.811 0.458 1
1 727 . 9 1 1 A 69 69 GLN HA H 69 5.036 4.947 0.089 1
1 732 . 9 1 1 A 69 69 GLN C C 69 173.607 175.317 -1.710 1
1 733 . 9 1 1 A 69 69 GLN CA C 69 53.419 53.921 -0.502 1
1 734 . 9 1 1 A 69 69 GLN CB C 69 34.997 32.732 2.265 1
1 736 . 9 1 1 A 69 69 GLN N N 69 125.104 126.555 -1.451 1
1 737 . 9 1 1 A 70 70 HIS H H 70 8.829 9.004 -0.175 1
1 738 . 9 1 1 A 70 70 HIS HA H 70 4.865 4.873 -0.008 1
1 741 . 9 1 1 A 70 70 HIS C C 70 174.852 175.196 -0.344 1
1 742 . 9 1 1 A 70 70 HIS CA C 70 56.304 55.525 0.779 1
1 743 . 9 1 1 A 70 70 HIS CB C 70 30.050 31.464 -1.414 1
1 744 . 9 1 1 A 70 70 HIS N N 70 118.576 118.604 -0.028 1
1 745 . 9 1 1 A 71 71 ALA H H 71 7.768 8.449 -0.681 1
1 746 . 9 1 1 A 71 71 ALA HA H 71 3.977 4.568 -0.591 1
1 750 . 9 1 1 A 71 71 ALA C C 71 175.433 177.378 -1.945 1
1 751 . 9 1 1 A 71 71 ALA CA C 71 54.393 52.621 1.772 1
1 752 . 9 1 1 A 71 71 ALA CB C 71 18.000 19.032 -1.032 1
1 753 . 9 1 1 A 71 71 ALA N N 71 121.438 122.972 -1.534 1
1 754 . 9 1 1 A 72 72 GLN H H 72 7.227 8.113 -0.886 1
1 755 . 9 1 1 A 72 72 GLN HA H 72 4.371 4.526 -0.155 1
1 762 . 9 1 1 A 72 72 GLN C C 72 173.053 175.103 -2.050 1
1 763 . 9 1 1 A 72 72 GLN CA C 72 54.290 54.393 -0.103 1
1 764 . 9 1 1 A 72 72 GLN CB C 72 28.623 31.969 -3.346 1
1 766 . 9 1 1 A 72 72 GLN N N 72 115.858 122.352 -6.494 1
1 768 . 9 1 1 A 73 73 GLN H H 73 8.481 8.601 -0.120 1
1 769 . 9 1 1 A 73 73 GLN HA H 73 3.570 3.804 -0.234 1
1 776 . 9 1 1 A 73 73 GLN C C 73 174.243 174.937 -0.694 1
1 777 . 9 1 1 A 73 73 GLN CA C 73 60.206 57.723 2.483 1
1 778 . 9 1 1 A 73 73 GLN CB C 73 28.850 28.861 -0.011 1
1 780 . 9 1 1 A 73 73 GLN N N 73 116.433 122.635 -6.202 1
1 782 . 9 1 1 A 74 74 THR H H 74 7.211 7.330 -0.119 1
1 783 . 9 1 1 A 74 74 THR HA H 74 4.160 4.575 -0.415 1
1 788 . 9 1 1 A 74 74 THR C C 74 171.836 172.225 -0.389 1
1 789 . 9 1 1 A 74 74 THR CA C 74 59.072 60.803 -1.731 1
1 790 . 9 1 1 A 74 74 THR CB C 74 71.560 71.720 -0.160 1
1 792 . 9 1 1 A 74 74 THR N N 74 108.717 110.037 -1.320 1
1 793 . 9 1 1 A 75 75 CYS H H 75 7.676 8.016 -0.340 1
1 794 . 9 1 1 A 75 75 CYS HA H 75 4.158 4.406 -0.248 1
1 797 . 9 1 1 A 75 75 CYS C C 75 178.781 175.649 3.132 1
1 798 . 9 1 1 A 75 75 CYS CA C 75 58.661 57.962 0.699 1
1 799 . 9 1 1 A 75 75 CYS CB C 75 30.840 28.318 2.522 1
1 800 . 9 1 1 A 75 75 CYS N N 75 123.108 123.440 -0.332 1
1 801 . 9 1 1 A 76 76 GLU H H 76 9.203 8.757 0.446 1
1 802 . 9 1 1 A 76 76 GLU HA H 76 4.187 4.019 0.168 1
1 807 . 9 1 1 A 76 76 GLU C C 76 175.488 179.043 -3.555 1
1 808 . 9 1 1 A 76 76 GLU CA C 76 57.306 58.869 -1.563 1
1 809 . 9 1 1 A 76 76 GLU CB C 76 29.347 29.089 0.258 1
1 811 . 9 1 1 A 76 76 GLU N N 76 129.817 127.202 2.615 1
1 812 . 9 1 1 A 77 77 GLU H H 77 9.496 7.757 1.739 1
1 813 . 9 1 1 A 77 77 GLU HA H 77 4.599 4.080 0.519 1
1 818 . 9 1 1 A 77 77 GLU C C 77 177.148 177.253 -0.105 1
1 819 . 9 1 1 A 77 77 GLU CA C 77 57.554 58.935 -1.381 1
1 820 . 9 1 1 A 77 77 GLU CB C 77 31.980 30.315 1.665 1
1 822 . 9 1 1 A 77 77 GLU N N 77 124.795 120.422 4.373 1
1 823 . 9 1 1 A 78 78 CYS H H 78 8.967 7.366 1.601 1
1 824 . 9 1 1 A 78 78 CYS HA H 78 5.073 4.604 0.469 1
1 827 . 9 1 1 A 78 78 CYS C C 78 176.374 174.713 1.661 1
1 828 . 9 1 1 A 78 78 CYS CA C 78 58.537 58.073 0.464 1
1 829 . 9 1 1 A 78 78 CYS CB C 78 31.597 28.750 2.847 1
1 830 . 9 1 1 A 78 78 CYS N N 78 119.692 115.185 4.507 1
1 831 . 9 1 1 A 79 79 SER H H 79 7.474 8.167 -0.693 1
1 832 . 9 1 1 A 79 79 SER HA H 79 4.113 4.146 -0.033 1
1 835 . 9 1 1 A 79 79 SER C C 79 172.915 173.431 -0.516 1
1 836 . 9 1 1 A 79 79 SER CA C 79 60.440 59.342 1.098 1
1 837 . 9 1 1 A 79 79 SER CB C 79 61.421 61.166 0.255 1
1 838 . 9 1 1 A 79 79 SER N N 79 113.385 112.525 0.860 1
1 839 . 9 1 1 A 80 80 THR H H 80 7.907 7.778 0.129 1
1 840 . 9 1 1 A 80 80 THR HA H 80 3.913 4.166 -0.253 1
1 845 . 9 1 1 A 80 80 THR C C 80 172.306 173.751 -1.445 1
1 846 . 9 1 1 A 80 80 THR CA C 80 65.262 63.211 2.051 1
1 847 . 9 1 1 A 80 80 THR CB C 80 69.910 69.048 0.862 1
1 849 . 9 1 1 A 80 80 THR N N 80 120.005 115.852 4.153 1
1 850 . 9 1 1 A 81 81 LEU H H 81 8.556 8.551 0.005 1
1 851 . 9 1 1 A 81 81 LEU HA H 81 4.172 4.376 -0.204 1
1 861 . 9 1 1 A 81 81 LEU C C 81 177.121 176.398 0.723 1
1 862 . 9 1 1 A 81 81 LEU CA C 81 54.996 54.705 0.291 1
1 863 . 9 1 1 A 81 81 LEU CB C 81 42.147 42.089 0.058 1
1 867 . 9 1 1 A 81 81 LEU N N 81 128.272 128.268 0.004 1
1 868 . 9 1 1 A 82 82 PHE H H 82 9.251 8.835 0.416 1
1 869 . 9 1 1 A 82 82 PHE HA H 82 4.576 4.447 0.129 1
1 874 . 9 1 1 A 82 82 PHE C C 82 177.785 176.081 1.704 1
1 875 . 9 1 1 A 82 82 PHE CA C 82 56.470 60.297 -3.827 1
1 876 . 9 1 1 A 82 82 PHE CB C 82 38.210 38.659 -0.449 1
1 878 . 9 1 1 A 82 82 PHE N N 82 129.268 126.386 2.882 1
1 879 . 9 1 1 A 83 83 GLY H H 83 7.047 7.363 -0.316 1
1 880 . 9 1 1 A 83 83 GLY HA2 H 83 4.783 4.151 0.632 1
1 881 . 9 1 1 A 83 83 GLY HA3 H 83 3.876 4.221 -0.345 1
1 882 . 9 1 1 A 83 83 GLY C C 83 171.642 174.645 -3.003 1
1 883 . 9 1 1 A 83 83 GLY CA C 83 45.826 46.227 -0.401 1
1 884 . 9 1 1 A 83 83 GLY N N 83 102.168 103.701 -1.533 1
1 885 . 9 1 1 A 84 84 GLU H H 84 8.444 8.826 -0.382 1
1 886 . 9 1 1 A 84 84 GLU HA H 84 4.111 4.160 -0.049 1
1 891 . 9 1 1 A 84 84 GLU C C 84 177.259 176.390 0.869 1
1 892 . 9 1 1 A 84 84 GLU CA C 84 59.438 58.991 0.447 1
1 893 . 9 1 1 A 84 84 GLU CB C 84 30.670 30.553 0.117 1
1 895 . 9 1 1 A 84 84 GLU N N 84 127.546 121.261 6.285 1
1 896 . 9 1 1 A 85 85 TYR H H 85 9.344 8.087 1.257 1
1 897 . 9 1 1 A 85 85 TYR HA H 85 4.599 5.002 -0.403 1
1 902 . 9 1 1 A 85 85 TYR C C 85 173.302 174.286 -0.984 1
1 903 . 9 1 1 A 85 85 TYR CA C 85 57.261 58.134 -0.873 1
1 904 . 9 1 1 A 85 85 TYR CB C 85 40.850 40.176 0.674 1
1 906 . 9 1 1 A 85 85 TYR N N 85 118.936 120.476 -1.540 1
1 907 . 9 1 1 A 86 86 TYR H H 86 7.323 8.780 -1.457 1
1 908 . 9 1 1 A 86 86 TYR HA H 86 5.298 6.042 -0.744 1
1 911 . 9 1 1 A 86 86 TYR C C 86 172.804 173.615 -0.811 1
1 912 . 9 1 1 A 86 86 TYR CA C 86 54.041 55.756 -1.715 1
1 913 . 9 1 1 A 86 86 TYR CB C 86 40.987 42.241 -1.254 1
1 914 . 9 1 1 A 86 86 TYR N N 86 124.965 121.262 3.703 1
1 915 . 9 1 1 A 87 87 CYS H H 87 7.046 8.674 -1.628 1
1 916 . 9 1 1 A 87 87 CYS HA H 87 3.842 4.707 -0.865 1
1 919 . 9 1 1 A 87 87 CYS C C 87 174.243 174.159 0.084 1
1 920 . 9 1 1 A 87 87 CYS CA C 87 56.377 58.827 -2.450 1
1 921 . 9 1 1 A 87 87 CYS CB C 87 33.230 30.591 2.639 1
1 922 . 9 1 1 A 87 87 CYS N N 87 128.735 118.470 10.265 1
1 923 . 9 1 1 A 88 88 ASP H H 88 8.002 8.940 -0.938 1
1 924 . 9 1 1 A 88 88 ASP HA H 88 3.761 4.198 -0.437 1
1 927 . 9 1 1 A 88 88 ASP C C 88 173.579 177.582 -4.003 1
1 928 . 9 1 1 A 88 88 ASP CA C 88 53.958 56.522 -2.564 1
1 929 . 9 1 1 A 88 88 ASP CB C 88 41.240 40.636 0.604 1
1 930 . 9 1 1 A 88 88 ASP N N 88 127.013 127.345 -0.332 1
1 931 . 9 1 1 A 89 89 ILE H H 89 7.972 7.798 0.174 1
1 932 . 9 1 1 A 89 89 ILE HA H 89 3.660 3.683 -0.023 1
1 942 . 9 1 1 A 89 89 ILE C C 89 177.259 177.115 0.144 1
1 943 . 9 1 1 A 89 89 ILE CA C 89 63.107 65.114 -2.007 1
1 944 . 9 1 1 A 89 89 ILE CB C 89 39.430 37.861 1.569 1
1 948 . 9 1 1 A 89 89 ILE N N 89 120.357 119.431 0.926 1
1 949 . 9 1 1 A 90 90 CYS H H 90 8.554 7.748 0.806 1
1 950 . 9 1 1 A 90 90 CYS HA H 90 3.677 4.825 -1.148 1
1 953 . 9 1 1 A 90 90 CYS C C 90 175.128 174.734 0.394 1
1 954 . 9 1 1 A 90 90 CYS CA C 90 60.791 59.045 1.746 1
1 955 . 9 1 1 A 90 90 CYS CB C 90 30.427 28.648 1.779 1
1 956 . 9 1 1 A 90 90 CYS N N 90 119.564 116.636 2.928 1
1 957 . 9 1 1 A 91 91 HIS H H 91 7.364 7.859 -0.495 1
1 958 . 9 1 1 A 91 91 HIS HA H 91 3.512 3.906 -0.394 1
1 963 . 9 1 1 A 91 91 HIS C C 91 170.590 173.196 -2.606 1
1 964 . 9 1 1 A 91 91 HIS CA C 91 58.739 56.761 1.978 1
1 965 . 9 1 1 A 91 91 HIS CB C 91 24.810 26.615 -1.805 1
1 968 . 9 1 1 A 91 91 HIS N N 91 111.440 116.298 -4.858 1
1 969 . 9 1 1 A 92 92 LEU H H 92 6.214 7.326 -1.112 1
1 970 . 9 1 1 A 92 92 LEU HA H 92 4.191 4.215 -0.024 1
1 980 . 9 1 1 A 92 92 LEU C C 92 173.911 175.411 -1.500 1
1 981 . 9 1 1 A 92 92 LEU CA C 92 53.717 53.241 0.476 1
1 982 . 9 1 1 A 92 92 LEU CB C 92 45.360 42.695 2.665 1
1 986 . 9 1 1 A 92 92 LEU N N 92 115.684 117.667 -1.983 1
1 987 . 9 1 1 A 93 93 PHE H H 93 6.669 8.859 -2.190 1
1 988 . 9 1 1 A 93 93 PHE HA H 93 5.622 5.304 0.318 1
1 995 . 9 1 1 A 93 93 PHE C C 93 175.765 174.473 1.292 1
1 996 . 9 1 1 A 93 93 PHE CA C 93 55.387 56.602 -1.215 1
1 997 . 9 1 1 A 93 93 PHE CB C 93 42.700 41.496 1.204 1
1 1000 . 9 1 1 A 93 93 PHE N N 93 121.535 119.848 1.687 1
1 1001 . 9 1 1 A 94 94 ASP H H 94 9.209 9.008 0.201 1
1 1002 . 9 1 1 A 94 94 ASP HA H 94 5.819 5.242 0.577 1
1 1005 . 9 1 1 A 94 94 ASP C C 94 175.654 175.387 0.267 1
1 1006 . 9 1 1 A 94 94 ASP CA C 94 53.330 53.133 0.197 1
1 1007 . 9 1 1 A 94 94 ASP CB C 94 44.720 44.248 0.472 1
1 1008 . 9 1 1 A 94 94 ASP N N 94 123.504 120.925 2.579 1
1 1009 . 9 1 1 A 95 95 LYS H H 95 9.043 8.249 0.794 1
1 1010 . 9 1 1 A 95 95 LYS HA H 95 4.527 4.345 0.182 1
1 1019 . 9 1 1 A 95 95 LYS C C 95 174.879 176.520 -1.641 1
1 1020 . 9 1 1 A 95 95 LYS CA C 95 56.620 57.461 -0.841 1
1 1021 . 9 1 1 A 95 95 LYS CB C 95 33.720 32.928 0.792 1
1 1025 . 9 1 1 A 95 95 LYS N N 95 120.380 119.638 0.742 1
1 1026 . 9 1 1 A 96 96 ASP H H 96 8.999 8.343 0.656 1
1 1027 . 9 1 1 A 96 96 ASP HA H 96 4.724 4.803 -0.079 1
1 1030 . 9 1 1 A 96 96 ASP C C 96 176.401 175.969 0.432 1
1 1031 . 9 1 1 A 96 96 ASP CA C 96 56.147 54.036 2.111 1
1 1032 . 9 1 1 A 96 96 ASP CB C 96 40.790 41.081 -0.291 1
1 1033 . 9 1 1 A 96 96 ASP N N 96 120.784 124.735 -3.951 1
1 1034 . 9 1 1 A 97 97 LYS H H 97 9.382 8.591 0.791 1
1 1035 . 9 1 1 A 97 97 LYS HA H 97 4.473 4.597 -0.124 1
1 1044 . 9 1 1 A 97 97 LYS C C 97 175.903 175.826 0.077 1
1 1045 . 9 1 1 A 97 97 LYS CA C 97 54.771 55.240 -0.469 1
1 1046 . 9 1 1 A 97 97 LYS CB C 97 33.270 32.730 0.540 1
1 1050 . 9 1 1 A 97 97 LYS N N 97 131.617 126.391 5.226 1
1 1051 . 9 1 1 A 98 98 LYS H H 98 8.940 8.047 0.893 1
1 1052 . 9 1 1 A 98 98 LYS HA H 98 4.118 3.928 0.190 1
1 1061 . 9 1 1 A 98 98 LYS C C 98 177.065 175.390 1.675 1
1 1062 . 9 1 1 A 98 98 LYS CA C 98 56.297 57.828 -1.531 1
1 1063 . 9 1 1 A 98 98 LYS CB C 98 28.467 29.900 -1.433 1
1 1067 . 9 1 1 A 98 98 LYS N N 98 115.034 114.747 0.287 1
1 1068 . 9 1 1 A 99 99 GLN H H 99 9.266 7.888 1.378 1
1 1069 . 9 1 1 A 99 99 GLN HA H 99 4.460 4.467 -0.007 1
1 1074 . 9 1 1 A 99 99 GLN C C 99 174.990 174.944 0.046 1
1 1075 . 9 1 1 A 99 99 GLN CA C 99 57.563 55.940 1.623 1
1 1076 . 9 1 1 A 99 99 GLN CB C 99 27.280 29.166 -1.886 1
1 1078 . 9 1 1 A 99 99 GLN N N 99 117.717 118.407 -0.690 1
1 1079 . 9 1 1 A 100 100 TYR H H 100 8.402 8.423 -0.021 1
1 1080 . 9 1 1 A 100 100 TYR HA H 100 4.935 5.746 -0.811 1
1 1087 . 9 1 1 A 100 100 TYR C C 100 171.504 173.032 -1.528 1
1 1088 . 9 1 1 A 100 100 TYR CA C 100 55.786 55.228 0.558 1
1 1089 . 9 1 1 A 100 100 TYR CB C 100 41.090 41.456 -0.366 1
1 1092 . 9 1 1 A 100 100 TYR N N 100 115.081 117.189 -2.108 1
1 1093 . 9 1 1 A 101 101 HIS H H 101 8.829 8.764 0.065 1
1 1094 . 9 1 1 A 101 101 HIS HA H 101 4.525 4.673 -0.148 1
1 1099 . 9 1 1 A 101 101 HIS C C 101 174.935 173.870 1.065 1
1 1100 . 9 1 1 A 101 101 HIS CA C 101 56.327 54.994 1.333 1
1 1101 . 9 1 1 A 101 101 HIS CB C 101 31.020 30.368 0.652 1
1 1104 . 9 1 1 A 101 101 HIS N N 101 120.894 123.342 -2.448 1
1 1105 . 9 1 1 A 102 102 CYS H H 102 7.427 8.314 -0.887 1
1 1106 . 9 1 1 A 102 102 CYS HA H 102 4.561 4.394 0.167 1
1 1109 . 9 1 1 A 102 102 CYS C C 102 175.765 175.651 0.114 1
1 1110 . 9 1 1 A 102 102 CYS CA C 102 57.707 59.487 -1.780 1
1 1111 . 9 1 1 A 102 102 CYS CB C 102 29.130 28.789 0.341 1
1 1112 . 9 1 1 A 102 102 CYS N N 102 131.256 126.605 4.651 1
1 1113 . 9 1 1 A 103 103 GLU H H 103 9.497 8.853 0.644 1
1 1114 . 9 1 1 A 103 103 GLU HA H 103 4.003 3.967 0.036 1
1 1119 . 9 1 1 A 103 103 GLU C C 103 176.540 178.870 -2.330 1
1 1120 . 9 1 1 A 103 103 GLU CA C 103 58.796 59.473 -0.677 1
1 1121 . 9 1 1 A 103 103 GLU CB C 103 29.280 29.740 -0.460 1
1 1123 . 9 1 1 A 103 103 GLU N N 103 129.829 127.835 1.994 1
1 1124 . 9 1 1 A 104 104 ASN H H 104 7.832 8.177 -0.345 1
1 1125 . 9 1 1 A 104 104 ASN HA H 104 4.457 4.355 0.102 1
1 1130 . 9 1 1 A 104 104 ASN C C 104 176.401 177.157 -0.756 1
1 1131 . 9 1 1 A 104 104 ASN CA C 104 56.053 56.613 -0.560 1
1 1132 . 9 1 1 A 104 104 ASN CB C 104 38.400 39.002 -0.602 1
1 1133 . 9 1 1 A 104 104 ASN N N 104 117.703 117.895 -0.192 1
1 1135 . 9 1 1 A 105 105 CYS H H 105 9.415 7.580 1.835 1
1 1136 . 9 1 1 A 105 105 CYS HA H 105 4.137 4.447 -0.310 1
1 1139 . 9 1 1 A 105 105 CYS C C 105 176.844 175.226 1.618 1
1 1140 . 9 1 1 A 105 105 CYS CA C 105 64.328 59.305 5.023 1
1 1141 . 9 1 1 A 105 105 CYS CB C 105 30.350 28.049 2.301 1
1 1142 . 9 1 1 A 105 105 CYS N N 105 124.939 115.273 9.666 1
1 1143 . 9 1 1 A 106 106 GLY H H 106 8.145 8.592 -0.447 1
1 1144 . 9 1 1 A 106 106 GLY HA2 H 106 3.980 3.821 0.159 1
1 1145 . 9 1 1 A 106 106 GLY HA3 H 106 3.502 3.836 -0.334 1
1 1146 . 9 1 1 A 106 106 GLY C C 106 172.500 173.441 -0.941 1
1 1147 . 9 1 1 A 106 106 GLY CA C 106 44.968 46.003 -1.035 1
1 1148 . 9 1 1 A 106 106 GLY N N 106 106.090 109.677 -3.587 1
1 1149 . 9 1 1 A 107 107 ILE H H 107 6.465 6.833 -0.368 1
1 1150 . 9 1 1 A 107 107 ILE HA H 107 4.878 5.267 -0.389 1
1 1160 . 9 1 1 A 107 107 ILE C C 107 174.824 174.385 0.439 1
1 1161 . 9 1 1 A 107 107 ILE CA C 107 58.226 58.611 -0.385 1
1 1162 . 9 1 1 A 107 107 ILE CB C 107 44.460 42.380 2.080 1
1 1166 . 9 1 1 A 107 107 ILE N N 107 107.914 114.611 -6.697 1
1 1167 . 9 1 1 A 108 108 CYS H H 108 7.041 9.285 -2.244 1
1 1168 . 9 1 1 A 108 108 CYS HA H 108 5.018 5.488 -0.470 1
1 1171 . 9 1 1 A 108 108 CYS C C 108 175.461 173.247 2.214 1
1 1172 . 9 1 1 A 108 108 CYS CA C 108 62.097 56.698 5.399 1
1 1173 . 9 1 1 A 108 108 CYS CB C 108 31.353 30.833 0.520 1
1 1174 . 9 1 1 A 108 108 CYS N N 108 122.441 121.306 1.135 1
1 1175 . 9 1 1 A 109 109 ARG H H 109 8.561 8.473 0.088 1
1 1176 . 9 1 1 A 109 109 ARG HA H 109 4.239 4.887 -0.648 1
1 1183 . 9 1 1 A 109 109 ARG C C 109 174.271 174.589 -0.318 1
1 1184 . 9 1 1 A 109 109 ARG CA C 109 52.962 54.109 -1.147 1
1 1185 . 9 1 1 A 109 109 ARG CB C 109 33.903 33.864 0.039 1
1 1188 . 9 1 1 A 109 109 ARG N N 109 121.163 119.220 1.943 1
1 1189 . 9 1 1 A 110 110 ILE H H 110 7.847 8.392 -0.545 1
1 1190 . 9 1 1 A 110 110 ILE HA H 110 3.531 4.148 -0.617 1
1 1200 . 9 1 1 A 110 110 ILE C C 110 175.405 176.190 -0.785 1
1 1201 . 9 1 1 A 110 110 ILE CA C 110 62.201 61.619 0.582 1
1 1202 . 9 1 1 A 110 110 ILE CB C 110 36.860 37.083 -0.223 1
1 1206 . 9 1 1 A 110 110 ILE N N 110 118.955 121.890 -2.935 1
1 1207 . 9 1 1 A 111 111 GLY H H 111 6.928 8.269 -1.341 1
1 1208 . 9 1 1 A 111 111 GLY HA2 H 111 4.564 4.254 0.310 1
1 1209 . 9 1 1 A 111 111 GLY HA3 H 111 4.135 4.377 -0.242 1
1 1210 . 9 1 1 A 111 111 GLY CA C 111 43.068 45.448 -2.380 1
1 1211 . 9 1 1 A 111 111 GLY N N 111 113.782 113.968 -0.186 1
1 1212 . 9 1 1 A 112 112 PRO HA H 112 4.990 4.745 0.245 1
1 1219 . 9 1 1 A 112 112 PRO C C 112 177.342 177.489 -0.147 1
1 1220 . 9 1 1 A 112 112 PRO CA C 112 62.920 62.869 0.051 1
1 1221 . 9 1 1 A 112 112 PRO CB C 112 34.807 31.725 3.082 1
1 1224 . 9 1 1 A 113 113 LYS H H 113 8.989 8.609 0.380 1
1 1225 . 9 1 1 A 113 113 LYS HA H 113 3.144 4.078 -0.934 1
1 1234 . 9 1 1 A 113 113 LYS C C 113 177.536 178.149 -0.613 1
1 1235 . 9 1 1 A 113 113 LYS CA C 113 59.883 58.997 0.886 1
1 1236 . 9 1 1 A 113 113 LYS CB C 113 32.260 32.056 0.204 1
1 1240 . 9 1 1 A 113 113 LYS N N 113 123.545 123.958 -0.413 1
1 1241 . 9 1 1 A 114 114 GLU H H 114 9.080 9.254 -0.174 1
1 1242 . 9 1 1 A 114 114 GLU HA H 114 4.199 4.139 0.060 1
1 1247 . 9 1 1 A 114 114 GLU C C 114 176.374 177.107 -0.733 1
1 1248 . 9 1 1 A 114 114 GLU CA C 114 58.733 59.211 -0.478 1
1 1249 . 9 1 1 A 114 114 GLU CB C 114 28.077 28.693 -0.616 1
1 1251 . 9 1 1 A 114 114 GLU N N 114 114.832 120.579 -5.747 1
1 1252 . 9 1 1 A 115 115 ASP H H 115 7.799 7.813 -0.014 1
1 1253 . 9 1 1 A 115 115 ASP HA H 115 4.642 4.771 -0.129 1
1 1256 . 9 1 1 A 115 115 ASP C C 115 176.374 175.676 0.698 1
1 1257 . 9 1 1 A 115 115 ASP CA C 115 54.470 53.561 0.909 1
1 1258 . 9 1 1 A 115 115 ASP CB C 115 40.850 41.234 -0.384 1
1 1259 . 9 1 1 A 115 115 ASP N N 115 118.858 119.180 -0.322 1
1 1260 . 9 1 1 A 116 116 PHE H H 116 8.063 7.739 0.324 1
1 1261 . 9 1 1 A 116 116 PHE HA H 116 5.239 4.773 0.466 1
1 1264 . 9 1 1 A 116 116 PHE C C 116 173.413 174.931 -1.518 1
1 1265 . 9 1 1 A 116 116 PHE CA C 116 57.708 55.249 2.459 1
1 1266 . 9 1 1 A 116 116 PHE CB C 116 44.557 41.127 3.430 1
1 1267 . 9 1 1 A 116 116 PHE N N 116 120.567 116.516 4.051 1
1 1268 . 9 1 1 A 117 117 PHE H H 117 9.439 8.791 0.648 1
1 1269 . 9 1 1 A 117 117 PHE HA H 117 5.091 4.649 0.442 1
1 1277 . 9 1 1 A 117 117 PHE C C 117 171.614 172.599 -0.985 1
1 1278 . 9 1 1 A 117 117 PHE CA C 117 55.311 55.732 -0.421 1
1 1279 . 9 1 1 A 117 117 PHE CB C 117 41.887 41.534 0.353 1
1 1283 . 9 1 1 A 117 117 PHE N N 117 118.040 114.991 3.049 1
1 1284 . 9 1 1 A 118 118 HIS H H 118 8.779 8.887 -0.108 1
1 1285 . 9 1 1 A 118 118 HIS HA H 118 4.836 4.831 0.005 1
1 1289 . 9 1 1 A 118 118 HIS C C 118 174.879 174.812 0.067 1
1 1290 . 9 1 1 A 118 118 HIS CA C 118 55.322 56.239 -0.917 1
1 1291 . 9 1 1 A 118 118 HIS CB C 118 30.950 30.812 0.138 1
1 1293 . 9 1 1 A 118 118 HIS N N 118 121.208 121.866 -0.658 1
1 1294 . 9 1 1 A 119 119 CYS H H 119 8.123 8.263 -0.140 1
1 1295 . 9 1 1 A 119 119 CYS HA H 119 4.529 4.500 0.029 1
1 1298 . 9 1 1 A 119 119 CYS C C 119 176.567 174.583 1.984 1
1 1299 . 9 1 1 A 119 119 CYS CA C 119 58.957 58.772 0.185 1
1 1300 . 9 1 1 A 119 119 CYS CB C 119 30.090 27.650 2.440 1
1 1301 . 9 1 1 A 119 119 CYS N N 119 131.659 125.893 5.766 1
1 1302 . 9 1 1 A 120 120 LEU H H 120 8.970 8.736 0.234 1
1 1303 . 9 1 1 A 120 120 LEU N N 120 130.361 127.357 3.004 1
1 1304 . 9 1 1 A 121 121 LYS HA H 121 4.299 4.439 -0.140 1
1 1313 . 9 1 1 A 121 121 LYS CA C 121 58.727 55.488 3.239 1
1 1314 . 9 1 1 A 121 121 LYS CB C 121 33.210 30.826 2.384 1
1 1318 . 9 1 1 A 123 123 ASN HA H 123 4.438 4.702 -0.264 1
1 1323 . 9 1 1 A 123 123 ASN C C 123 172.444 174.795 -2.351 1
1 1324 . 9 1 1 A 123 123 ASN CA C 123 53.448 54.904 -1.456 1
1 1325 . 9 1 1 A 123 123 ASN CB C 123 37.130 38.196 -1.066 1
1 1327 . 9 1 1 A 124 124 LEU H H 124 6.596 7.841 -1.245 1
1 1328 . 9 1 1 A 124 124 LEU HA H 124 4.576 4.243 0.333 1
1 1338 . 9 1 1 A 124 124 LEU C C 124 175.903 176.057 -0.154 1
1 1339 . 9 1 1 A 124 124 LEU CA C 124 54.043 55.455 -1.412 1
1 1340 . 9 1 1 A 124 124 LEU CB C 124 45.837 42.987 2.850 1
1 1344 . 9 1 1 A 124 124 LEU N N 124 115.443 122.897 -7.454 1
1 1345 . 9 1 1 A 125 125 CYS H H 125 6.342 8.752 -2.410 1
1 1346 . 9 1 1 A 125 125 CYS HA H 125 5.033 5.132 -0.099 1
1 1349 . 9 1 1 A 125 125 CYS C C 125 175.101 174.010 1.091 1
1 1350 . 9 1 1 A 125 125 CYS CA C 125 62.046 57.155 4.891 1
1 1351 . 9 1 1 A 125 125 CYS CB C 125 30.840 29.129 1.711 1
1 1352 . 9 1 1 A 125 125 CYS N N 125 118.685 125.054 -6.369 1
1 1353 . 9 1 1 A 126 126 LEU H H 126 8.894 8.184 0.710 1
1 1354 . 9 1 1 A 126 126 LEU HA H 126 4.565 4.654 -0.089 1
1 1364 . 9 1 1 A 126 126 LEU C C 126 174.879 176.209 -1.330 1
1 1365 . 9 1 1 A 126 126 LEU CA C 126 52.751 53.665 -0.914 1
1 1366 . 9 1 1 A 126 126 LEU CB C 126 46.090 41.816 4.274 1
1 1370 . 9 1 1 A 126 126 LEU N N 126 124.501 126.165 -1.664 1
1 1371 . 9 1 1 A 127 127 ALA H H 127 8.378 8.359 0.019 1
1 1372 . 9 1 1 A 127 127 ALA HA H 127 3.957 4.715 -0.758 1
1 1376 . 9 1 1 A 127 127 ALA C C 127 179.085 178.504 0.581 1
1 1377 . 9 1 1 A 127 127 ALA CA C 127 52.554 50.589 1.965 1
1 1378 . 9 1 1 A 127 127 ALA CB C 127 18.527 21.253 -2.726 1
1 1379 . 9 1 1 A 127 127 ALA N N 127 123.011 123.228 -0.217 1
1 1380 . 9 1 1 A 128 128 MET H H 128 8.237 8.971 -0.734 1
1 1385 . 9 1 1 A 128 128 MET N N 128 120.642 119.597 1.045 1
1 1386 . 9 1 1 A 129 129 ASN HA H 129 4.502 4.641 -0.139 1
1 1389 . 9 1 1 A 129 129 ASN C C 129 175.931 176.627 -0.696 1
1 1390 . 9 1 1 A 129 129 ASN CA C 129 55.064 56.119 -1.055 1
1 1391 . 9 1 1 A 129 129 ASN CB C 129 36.920 38.763 -1.843 1
1 1392 . 9 1 1 A 130 130 LEU H H 130 8.211 7.814 0.397 1
1 1393 . 9 1 1 A 130 130 LEU HA H 130 4.489 4.470 0.019 1
1 1403 . 9 1 1 A 130 130 LEU C C 130 178.836 178.092 0.744 1
1 1404 . 9 1 1 A 130 130 LEU CA C 130 54.653 54.851 -0.198 1
1 1405 . 9 1 1 A 130 130 LEU CB C 130 41.887 42.285 -0.398 1
1 1409 . 9 1 1 A 130 130 LEU N N 130 118.563 119.620 -1.057 1
1 1410 . 9 1 1 A 131 131 GLN H H 131 7.953 8.937 -0.984 1
1 1411 . 9 1 1 A 131 131 GLN HA H 131 3.729 4.397 -0.668 1
1 1418 . 9 1 1 A 131 131 GLN CA C 131 59.310 57.809 1.501 1
1 1419 . 9 1 1 A 131 131 GLN CB C 131 28.340 27.312 1.028 1
1 1421 . 9 1 1 A 131 131 GLN N N 131 123.929 118.209 5.720 1
1 1423 . 9 1 1 A 132 132 GLY HA2 H 132 4.034 4.087 -0.053 1
1 1424 . 9 1 1 A 132 132 GLY HA3 H 132 3.865 4.134 -0.269 1
1 1425 . 9 1 1 A 132 132 GLY C C 132 174.547 174.579 -0.032 1
1 1426 . 9 1 1 A 132 132 GLY CA C 132 45.902 45.458 0.444 1
1 1427 . 9 1 1 A 133 133 ARG H H 133 7.735 7.798 -0.063 1
1 1428 . 9 1 1 A 133 133 ARG HA H 133 4.611 4.451 0.160 1
1 1435 . 9 1 1 A 133 133 ARG C C 133 175.461 174.646 0.815 1
1 1436 . 9 1 1 A 133 133 ARG CA C 133 54.987 55.398 -0.411 1
1 1437 . 9 1 1 A 133 133 ARG CB C 133 31.470 29.900 1.570 1
1 1440 . 9 1 1 A 133 133 ARG N N 133 118.194 119.205 -1.011 1
1 1441 . 9 1 1 A 134 134 HIS H H 134 7.803 7.863 -0.060 1
1 1444 . 9 1 1 A 134 134 HIS N N 134 118.700 114.968 3.732 1
1 1445 . 9 1 1 A 135 135 LYS HA H 135 4.331 4.233 0.098 1
1 1454 . 9 1 1 A 135 135 LYS C C 135 174.852 176.541 -1.689 1
1 1455 . 9 1 1 A 135 135 LYS CA C 135 55.390 56.075 -0.685 1
1 1456 . 9 1 1 A 135 135 LYS CB C 135 32.970 31.372 1.598 1
1 1460 . 9 1 1 A 136 136 CYS H H 136 7.801 8.457 -0.656 1
1 1461 . 9 1 1 A 136 136 CYS HA H 136 4.113 4.673 -0.560 1
1 1464 . 9 1 1 A 136 136 CYS C C 136 174.879 175.138 -0.259 1
1 1465 . 9 1 1 A 136 136 CYS CA C 136 60.028 59.376 0.652 1
1 1466 . 9 1 1 A 136 136 CYS CB C 136 30.350 27.219 3.131 1
1 1467 . 9 1 1 A 136 136 CYS N N 136 126.055 122.468 3.587 1
1 10 . 10 1 1 A 2 2 ALA H H 2 8.220 7.823 0.397 1
1 11 . 10 1 1 A 2 2 ALA HA H 2 4.321 4.509 -0.188 1
1 15 . 10 1 1 A 2 2 ALA C C 2 177.564 177.197 0.367 1
1 16 . 10 1 1 A 2 2 ALA CA C 2 52.383 53.213 -0.830 1
1 17 . 10 1 1 A 2 2 ALA CB C 2 19.290 20.777 -1.487 1
1 18 . 10 1 1 A 2 2 ALA N N 2 125.223 118.168 7.055 1
1 19 . 10 1 1 A 3 3 ALA H H 3 8.246 7.847 0.399 1
1 20 . 10 1 1 A 3 3 ALA N N 3 123.250 120.611 2.639 1
1 21 . 10 1 1 A 5 5 ALA HA H 5 4.415 4.851 -0.436 1
1 25 . 10 1 1 A 5 5 ALA C C 5 177.481 176.696 0.785 1
1 26 . 10 1 1 A 5 5 ALA CA C 5 52.423 50.621 1.802 1
1 27 . 10 1 1 A 5 5 ALA CB C 5 19.420 20.088 -0.668 1
1 28 . 10 1 1 A 6 6 ARG H H 6 8.239 8.807 -0.568 1
1 29 . 10 1 1 A 6 6 ARG HA H 6 4.371 4.703 -0.332 1
1 36 . 10 1 1 A 6 6 ARG C C 6 176.180 175.743 0.437 1
1 37 . 10 1 1 A 6 6 ARG CA C 6 56.353 54.703 1.650 1
1 38 . 10 1 1 A 6 6 ARG CB C 6 31.170 31.225 -0.055 1
1 41 . 10 1 1 A 6 6 ARG N N 6 120.436 123.164 -2.728 1
1 42 . 10 1 1 A 7 7 GLU H H 7 8.535 8.463 0.072 1
1 43 . 10 1 1 A 7 7 GLU HA H 7 4.335 4.421 -0.086 1
1 48 . 10 1 1 A 7 7 GLU C C 7 176.346 176.851 -0.505 1
1 49 . 10 1 1 A 7 7 GLU CA C 7 56.740 56.869 -0.129 1
1 50 . 10 1 1 A 7 7 GLU CB C 7 30.390 29.811 0.579 1
1 52 . 10 1 1 A 7 7 GLU N N 7 122.189 122.303 -0.114 1
1 53 . 10 1 1 A 8 8 ASP H H 8 8.347 8.663 -0.316 1
1 54 . 10 1 1 A 8 8 ASP N N 8 121.112 123.496 -2.384 1
1 55 . 10 1 1 A 9 9 GLY HA2 H 9 3.975 3.875 0.100 1
1 56 . 10 1 1 A 9 9 GLY HA3 H 9 3.975 3.875 0.100 1
1 57 . 10 1 1 A 9 9 GLY C C 9 174.243 172.973 1.270 1
1 58 . 10 1 1 A 9 9 GLY CA C 9 45.933 46.713 -0.780 1
1 59 . 10 1 1 A 10 10 ALA H H 10 8.111 8.575 -0.464 1
1 60 . 10 1 1 A 10 10 ALA N N 10 123.721 128.397 -4.676 1
1 61 . 10 1 1 A 12 12 GLY HA2 H 12 3.992 4.012 -0.020 1
1 62 . 10 1 1 A 12 12 GLY HA3 H 12 3.992 4.012 -0.020 1
1 63 . 10 1 1 A 12 12 GLY C C 12 173.883 174.136 -0.253 1
1 64 . 10 1 1 A 12 12 GLY CA C 12 45.381 45.825 -0.444 1
1 65 . 10 1 1 A 13 13 GLU H H 13 8.224 7.804 0.420 1
1 66 . 10 1 1 A 13 13 GLU HA H 13 4.367 4.608 -0.241 1
1 71 . 10 1 1 A 13 13 GLU C C 13 176.125 177.213 -1.088 1
1 72 . 10 1 1 A 13 13 GLU CA C 13 56.349 55.364 0.985 1
1 73 . 10 1 1 A 13 13 GLU CB C 13 29.560 27.921 1.639 1
1 75 . 10 1 1 A 13 13 GLU N N 13 120.148 119.782 0.366 1
1 76 . 10 1 1 A 14 14 GLU H H 14 8.508 8.266 0.242 1
1 77 . 10 1 1 A 14 14 GLU HA H 14 4.302 4.229 0.073 1
1 82 . 10 1 1 A 14 14 GLU C C 14 176.623 176.443 0.180 1
1 83 . 10 1 1 A 14 14 GLU CA C 14 56.497 57.886 -1.389 1
1 84 . 10 1 1 A 14 14 GLU CB C 14 30.110 29.539 0.571 1
1 86 . 10 1 1 A 14 14 GLU N N 14 122.160 122.337 -0.177 1
1 87 . 10 1 1 A 15 15 ARG H H 15 8.356 7.693 0.663 1
1 88 . 10 1 1 A 15 15 ARG HA H 15 4.366 4.017 0.349 1
1 95 . 10 1 1 A 15 15 ARG C C 15 176.844 175.943 0.901 1
1 96 . 10 1 1 A 15 15 ARG CA C 15 56.010 58.075 -2.065 1
1 97 . 10 1 1 A 15 15 ARG CB C 15 30.890 29.932 0.958 1
1 100 . 10 1 1 A 15 15 ARG N N 15 121.945 121.453 0.492 1
1 101 . 10 1 1 A 16 16 GLY H H 16 8.414 8.351 0.063 1
1 102 . 10 1 1 A 16 16 GLY HA2 H 16 4.022 4.132 -0.110 1
1 103 . 10 1 1 A 16 16 GLY HA3 H 16 4.022 4.133 -0.111 1
1 104 . 10 1 1 A 16 16 GLY C C 16 174.326 174.025 0.301 1
1 105 . 10 1 1 A 16 16 GLY CA C 16 45.620 45.465 0.155 1
1 106 . 10 1 1 A 16 16 GLY N N 16 109.734 113.748 -4.014 1
1 107 . 10 1 1 A 17 17 GLN H H 17 8.184 8.574 -0.390 1
1 108 . 10 1 1 A 17 17 GLN HA H 17 4.366 4.458 -0.092 1
1 113 . 10 1 1 A 17 17 GLN C C 17 175.544 175.403 0.141 1
1 114 . 10 1 1 A 17 17 GLN CA C 17 55.749 55.771 -0.022 1
1 115 . 10 1 1 A 17 17 GLN CB C 17 29.367 30.060 -0.693 1
1 117 . 10 1 1 A 17 17 GLN N N 17 119.546 121.671 -2.125 1
1 118 . 10 1 1 A 18 18 ARG H H 18 8.366 8.709 -0.343 1
1 119 . 10 1 1 A 18 18 ARG HA H 18 4.487 5.049 -0.562 1
1 126 . 10 1 1 A 18 18 ARG C C 18 176.042 174.883 1.159 1
1 127 . 10 1 1 A 18 18 ARG CA C 18 55.735 54.450 1.285 1
1 128 . 10 1 1 A 18 18 ARG CB C 18 31.170 33.213 -2.043 1
1 131 . 10 1 1 A 18 18 ARG N N 18 122.330 122.660 -0.330 1
1 132 . 10 1 1 A 19 19 GLY H H 19 8.192 8.362 -0.170 1
1 133 . 10 1 1 A 19 19 GLY HA2 H 19 4.852 4.128 0.724 1
1 134 . 10 1 1 A 19 19 GLY HA3 H 19 3.894 4.135 -0.241 1
1 135 . 10 1 1 A 19 19 GLY C C 19 172.361 171.402 0.959 1
1 136 . 10 1 1 A 19 19 GLY CA C 19 45.580 44.157 1.423 1
1 137 . 10 1 1 A 19 19 GLY N N 19 109.658 107.085 2.573 1
1 138 . 10 1 1 A 20 20 CYS H H 20 8.843 7.998 0.845 1
1 139 . 10 1 1 A 20 20 CYS HA H 20 5.147 5.145 0.002 1
1 142 . 10 1 1 A 20 20 CYS C C 20 175.211 174.885 0.326 1
1 143 . 10 1 1 A 20 20 CYS CA C 20 56.712 58.266 -1.554 1
1 144 . 10 1 1 A 20 20 CYS CB C 20 33.530 31.044 2.486 1
1 145 . 10 1 1 A 20 20 CYS N N 20 120.185 118.648 1.537 1
1 146 . 10 1 1 A 21 21 GLU H H 21 8.981 8.926 0.055 1
1 147 . 10 1 1 A 21 21 GLU HA H 21 4.100 4.024 0.076 1
1 152 . 10 1 1 A 21 21 GLU C C 21 176.014 177.863 -1.849 1
1 153 . 10 1 1 A 21 21 GLU CA C 21 57.134 58.679 -1.545 1
1 154 . 10 1 1 A 21 21 GLU CB C 21 28.890 28.883 0.007 1
1 156 . 10 1 1 A 21 21 GLU N N 21 116.078 124.199 -8.121 1
1 157 . 10 1 1 A 22 22 HIS H H 22 9.342 7.670 1.672 1
1 158 . 10 1 1 A 22 22 HIS HA H 22 4.210 4.295 -0.085 1
1 161 . 10 1 1 A 22 22 HIS C C 22 175.128 174.648 0.480 1
1 162 . 10 1 1 A 22 22 HIS CA C 22 58.945 57.682 1.263 1
1 163 . 10 1 1 A 22 22 HIS CB C 22 33.160 31.186 1.974 1
1 164 . 10 1 1 A 22 22 HIS N N 22 122.296 117.104 5.192 1
1 165 . 10 1 1 A 23 23 TYR H H 23 7.931 7.904 0.027 1
1 166 . 10 1 1 A 23 23 TYR HA H 23 4.856 5.177 -0.321 1
1 171 . 10 1 1 A 23 23 TYR C C 23 173.108 174.629 -1.521 1
1 172 . 10 1 1 A 23 23 TYR CA C 23 57.852 56.327 1.525 1
1 173 . 10 1 1 A 23 23 TYR CB C 23 45.300 41.290 4.010 1
1 175 . 10 1 1 A 23 23 TYR N N 23 115.205 116.257 -1.052 1
1 176 . 10 1 1 A 24 24 ASP H H 24 8.384 8.873 -0.489 1
1 177 . 10 1 1 A 24 24 ASP HA H 24 5.160 4.982 0.178 1
1 180 . 10 1 1 A 24 24 ASP C C 24 174.437 175.428 -0.991 1
1 181 . 10 1 1 A 24 24 ASP CA C 24 53.343 53.823 -0.480 1
1 182 . 10 1 1 A 24 24 ASP CB C 24 41.470 39.744 1.726 1
1 183 . 10 1 1 A 24 24 ASP N N 24 122.016 124.840 -2.824 1
1 184 . 10 1 1 A 25 25 ARG H H 25 7.313 8.401 -1.088 1
1 185 . 10 1 1 A 25 25 ARG HA H 25 5.331 5.163 0.168 1
1 192 . 10 1 1 A 25 25 ARG C C 25 175.045 175.901 -0.856 1
1 193 . 10 1 1 A 25 25 ARG CA C 25 54.224 54.619 -0.395 1
1 194 . 10 1 1 A 25 25 ARG CB C 25 34.090 33.972 0.118 1
1 197 . 10 1 1 A 25 25 ARG N N 25 115.898 121.685 -5.787 1
1 198 . 10 1 1 A 26 26 GLY H H 26 9.387 8.837 0.550 1
1 199 . 10 1 1 A 26 26 GLY HA2 H 26 4.622 3.795 0.827 1
1 200 . 10 1 1 A 26 26 GLY HA3 H 26 3.788 3.810 -0.022 1
1 201 . 10 1 1 A 26 26 GLY C C 26 170.978 172.913 -1.935 1
1 202 . 10 1 1 A 26 26 GLY CA C 26 44.794 45.593 -0.799 1
1 203 . 10 1 1 A 26 26 GLY N N 26 105.653 108.066 -2.413 1
1 204 . 10 1 1 A 27 27 CYS H H 27 6.864 7.602 -0.738 1
1 205 . 10 1 1 A 27 27 CYS HA H 27 5.195 4.992 0.203 1
1 208 . 10 1 1 A 27 27 CYS C C 27 171.144 172.945 -1.801 1
1 209 . 10 1 1 A 27 27 CYS CA C 27 52.349 58.105 -5.756 1
1 210 . 10 1 1 A 27 27 CYS CB C 27 30.997 32.381 -1.384 1
1 211 . 10 1 1 A 27 27 CYS N N 27 110.921 117.248 -6.327 1
1 212 . 10 1 1 A 28 28 LEU H H 28 8.310 8.713 -0.403 1
1 213 . 10 1 1 A 28 28 LEU HA H 28 4.651 4.943 -0.292 1
1 223 . 10 1 1 A 28 28 LEU C C 28 176.827 176.916 -0.089 1
1 224 . 10 1 1 A 28 28 LEU CA C 28 53.054 53.450 -0.396 1
1 225 . 10 1 1 A 28 28 LEU CB C 28 44.200 44.169 0.031 1
1 229 . 10 1 1 A 28 28 LEU N N 28 115.519 122.536 -7.017 1
1 230 . 10 1 1 A 29 29 LEU H H 29 8.800 8.535 0.265 1
1 231 . 10 1 1 A 29 29 LEU HA H 29 4.313 4.386 -0.073 1
1 240 . 10 1 1 A 29 29 LEU C C 29 175.571 175.821 -0.250 1
1 241 . 10 1 1 A 29 29 LEU CA C 29 54.388 54.466 -0.078 1
1 242 . 10 1 1 A 29 29 LEU CB C 29 42.780 41.987 0.793 1
1 245 . 10 1 1 A 29 29 LEU N N 29 118.712 123.912 -5.200 1
1 246 . 10 1 1 A 30 30 LYS H H 30 8.009 8.699 -0.690 1
1 247 . 10 1 1 A 30 30 LYS HA H 30 4.592 4.760 -0.168 1
1 256 . 10 1 1 A 30 30 LYS C C 30 174.990 175.458 -0.468 1
1 257 . 10 1 1 A 30 30 LYS CA C 30 54.999 55.940 -0.941 1
1 258 . 10 1 1 A 30 30 LYS CB C 30 32.330 33.235 -0.905 1
1 262 . 10 1 1 A 30 30 LYS N N 30 122.310 125.721 -3.411 1
1 263 . 10 1 1 A 31 31 ALA H H 31 9.238 8.550 0.688 1
1 264 . 10 1 1 A 31 31 ALA HA H 31 4.477 4.360 0.117 1
1 268 . 10 1 1 A 31 31 ALA CA C 31 50.190 50.288 -0.098 1
1 269 . 10 1 1 A 31 31 ALA CB C 31 21.637 19.743 1.894 1
1 270 . 10 1 1 A 31 31 ALA N N 31 133.864 130.024 3.840 1
1 271 . 10 1 1 A 32 32 PRO HA H 32 4.637 4.493 0.144 1
1 278 . 10 1 1 A 32 32 PRO C C 32 175.737 177.311 -1.574 1
1 279 . 10 1 1 A 32 32 PRO CA C 32 64.259 64.291 -0.032 1
1 280 . 10 1 1 A 32 32 PRO CB C 32 31.740 31.854 -0.114 1
1 283 . 10 1 1 A 33 33 CYS H H 33 8.779 8.267 0.512 1
1 284 . 10 1 1 A 33 33 CYS HA H 33 4.321 4.302 0.019 1
1 287 . 10 1 1 A 33 33 CYS C C 33 176.733 175.626 1.107 1
1 288 . 10 1 1 A 33 33 CYS CA C 33 54.398 61.115 -6.717 1
1 289 . 10 1 1 A 33 33 CYS CB C 33 30.697 27.287 3.410 1
1 290 . 10 1 1 A 33 33 CYS N N 33 120.005 116.377 3.628 1
1 291 . 10 1 1 A 34 34 CYS H H 34 7.424 7.519 -0.095 1
1 292 . 10 1 1 A 34 34 CYS HA H 34 4.896 4.687 0.209 1
1 295 . 10 1 1 A 34 34 CYS C C 34 174.935 173.892 1.043 1
1 296 . 10 1 1 A 34 34 CYS CA C 34 56.962 58.946 -1.984 1
1 297 . 10 1 1 A 34 34 CYS CB C 34 31.067 30.112 0.955 1
1 298 . 10 1 1 A 34 34 CYS N N 34 115.034 119.010 -3.976 1
1 299 . 10 1 1 A 35 35 ASP H H 35 8.368 8.066 0.302 1
1 300 . 10 1 1 A 35 35 ASP HA H 35 4.454 4.232 0.222 1
1 303 . 10 1 1 A 35 35 ASP C C 35 174.354 174.773 -0.419 1
1 304 . 10 1 1 A 35 35 ASP CA C 35 56.222 55.540 0.682 1
1 305 . 10 1 1 A 35 35 ASP CB C 35 39.730 39.489 0.241 1
1 306 . 10 1 1 A 35 35 ASP N N 35 121.381 118.650 2.731 1
1 307 . 10 1 1 A 36 36 LYS H H 36 7.227 7.722 -0.495 1
1 308 . 10 1 1 A 36 36 LYS HA H 36 4.451 4.714 -0.263 1
1 317 . 10 1 1 A 36 36 LYS C C 36 175.433 175.357 0.076 1
1 318 . 10 1 1 A 36 36 LYS CA C 36 56.270 54.240 2.030 1
1 319 . 10 1 1 A 36 36 LYS CB C 36 36.620 34.639 1.981 1
1 323 . 10 1 1 A 36 36 LYS N N 36 117.673 117.980 -0.307 1
1 324 . 10 1 1 A 37 37 LEU H H 37 8.053 8.341 -0.288 1
1 325 . 10 1 1 A 37 37 LEU HA H 37 5.292 4.961 0.331 1
1 335 . 10 1 1 A 37 37 LEU C C 37 176.484 175.087 1.397 1
1 336 . 10 1 1 A 37 37 LEU CA C 37 53.348 52.839 0.509 1
1 337 . 10 1 1 A 37 37 LEU CB C 37 42.400 42.928 -0.528 1
1 341 . 10 1 1 A 37 37 LEU N N 37 120.994 121.864 -0.870 1
1 342 . 10 1 1 A 38 38 TYR H H 38 8.741 8.914 -0.173 1
1 343 . 10 1 1 A 38 38 TYR HA H 38 5.002 4.952 0.050 1
1 350 . 10 1 1 A 38 38 TYR C C 38 176.374 176.119 0.255 1
1 351 . 10 1 1 A 38 38 TYR CA C 38 57.081 56.605 0.476 1
1 352 . 10 1 1 A 38 38 TYR CB C 38 45.647 41.477 4.170 1
1 355 . 10 1 1 A 38 38 TYR N N 38 121.128 121.976 -0.848 1
1 356 . 10 1 1 A 39 39 THR H H 39 9.402 8.773 0.629 1
1 357 . 10 1 1 A 39 39 THR HA H 39 4.098 4.082 0.016 1
1 362 . 10 1 1 A 39 39 THR C C 39 173.496 175.060 -1.564 1
1 363 . 10 1 1 A 39 39 THR CA C 39 67.062 65.787 1.275 1
1 364 . 10 1 1 A 39 39 THR CB C 39 68.047 68.473 -0.426 1
1 366 . 10 1 1 A 39 39 THR N N 39 116.641 118.769 -2.128 1
1 367 . 10 1 1 A 40 40 CYS H H 40 7.317 8.024 -0.707 1
1 368 . 10 1 1 A 40 40 CYS HA H 40 4.771 4.979 -0.208 1
1 371 . 10 1 1 A 40 40 CYS C C 40 175.128 175.291 -0.163 1
1 372 . 10 1 1 A 40 40 CYS CA C 40 56.577 57.748 -1.171 1
1 373 . 10 1 1 A 40 40 CYS CB C 40 35.087 30.578 4.509 1
1 374 . 10 1 1 A 40 40 CYS N N 40 109.059 118.628 -9.569 1
1 375 . 10 1 1 A 41 41 ARG H H 41 9.201 8.896 0.305 1
1 376 . 10 1 1 A 41 41 ARG HA H 41 3.982 3.975 0.007 1
1 383 . 10 1 1 A 41 41 ARG C C 41 175.101 177.792 -2.691 1
1 384 . 10 1 1 A 41 41 ARG CA C 41 58.591 58.758 -0.167 1
1 385 . 10 1 1 A 41 41 ARG CB C 41 29.640 29.680 -0.040 1
1 388 . 10 1 1 A 41 41 ARG N N 41 121.737 124.492 -2.755 1
1 389 . 10 1 1 A 42 42 LEU H H 42 9.116 7.761 1.355 1
1 390 . 10 1 1 A 42 42 LEU HA H 42 4.029 4.075 -0.046 1
1 400 . 10 1 1 A 42 42 LEU C C 42 179.943 179.410 0.533 1
1 401 . 10 1 1 A 42 42 LEU CA C 42 58.005 57.695 0.310 1
1 402 . 10 1 1 A 42 42 LEU CB C 42 38.960 41.009 -2.049 1
1 406 . 10 1 1 A 42 42 LEU N N 42 126.364 116.837 9.527 1
1 407 . 10 1 1 A 43 43 CYS H H 43 8.785 8.219 0.566 1
1 408 . 10 1 1 A 43 43 CYS HA H 43 4.187 4.257 -0.070 1
1 411 . 10 1 1 A 43 43 CYS C C 43 177.785 177.332 0.453 1
1 412 . 10 1 1 A 43 43 CYS CA C 43 66.415 62.514 3.901 1
1 413 . 10 1 1 A 43 43 CYS CB C 43 28.870 26.716 2.154 1
1 414 . 10 1 1 A 43 43 CYS N N 43 124.519 117.825 6.694 1
1 415 . 10 1 1 A 44 44 HIS H H 44 7.604 7.300 0.304 1
1 416 . 10 1 1 A 44 44 HIS HA H 44 1.983 3.046 -1.063 1
1 420 . 10 1 1 A 44 44 HIS C C 44 176.429 176.257 0.172 1
1 421 . 10 1 1 A 44 44 HIS CA C 44 58.760 58.804 -0.044 1
1 422 . 10 1 1 A 44 44 HIS CB C 44 27.990 29.246 -1.256 1
1 423 . 10 1 1 A 44 44 HIS N N 44 117.024 121.366 -4.342 1
1 424 . 10 1 1 A 45 45 ASP H H 45 8.750 7.893 0.857 1
1 425 . 10 1 1 A 45 45 ASP HA H 45 4.116 4.120 -0.004 1
1 428 . 10 1 1 A 45 45 ASP C C 45 177.453 177.957 -0.504 1
1 429 . 10 1 1 A 45 45 ASP CA C 45 56.840 57.798 -0.958 1
1 430 . 10 1 1 A 45 45 ASP CB C 45 38.960 42.300 -3.340 1
1 431 . 10 1 1 A 45 45 ASP N N 45 120.440 118.816 1.624 1
1 432 . 10 1 1 A 46 46 ASN H H 46 7.888 8.356 -0.468 1
1 433 . 10 1 1 A 46 46 ASN HA H 46 4.612 4.417 0.195 1
1 438 . 10 1 1 A 46 46 ASN C C 46 175.903 176.781 -0.878 1
1 439 . 10 1 1 A 46 46 ASN CA C 46 54.342 57.164 -2.822 1
1 440 . 10 1 1 A 46 46 ASN CB C 46 38.790 40.057 -1.267 1
1 441 . 10 1 1 A 46 46 ASN N N 46 115.758 117.020 -1.262 1
1 443 . 10 1 1 A 47 47 ASN H H 47 7.384 7.340 0.044 1
1 444 . 10 1 1 A 47 47 ASN HA H 47 4.893 4.648 0.245 1
1 449 . 10 1 1 A 47 47 ASN C C 47 173.579 175.212 -1.633 1
1 450 . 10 1 1 A 47 47 ASN CA C 47 53.937 54.712 -0.775 1
1 451 . 10 1 1 A 47 47 ASN CB C 47 43.130 39.358 3.772 1
1 452 . 10 1 1 A 47 47 ASN N N 47 116.576 114.969 1.607 1
1 454 . 10 1 1 A 48 48 GLU H H 48 7.143 7.297 -0.154 1
1 455 . 10 1 1 A 48 48 GLU HA H 48 4.572 4.558 0.014 1
1 460 . 10 1 1 A 48 48 GLU C C 48 175.627 176.250 -0.623 1
1 461 . 10 1 1 A 48 48 GLU CA C 48 53.727 54.616 -0.889 1
1 462 . 10 1 1 A 48 48 GLU CB C 48 32.480 31.291 1.189 1
1 464 . 10 1 1 A 48 48 GLU N N 48 116.967 117.651 -0.684 1
1 465 . 10 1 1 A 49 49 ASP H H 49 8.748 8.348 0.400 1
1 466 . 10 1 1 A 49 49 ASP HA H 49 4.576 4.522 0.054 1
1 469 . 10 1 1 A 49 49 ASP C C 49 174.796 176.182 -1.386 1
1 470 . 10 1 1 A 49 49 ASP CA C 49 53.027 56.786 -3.759 1
1 471 . 10 1 1 A 49 49 ASP CB C 49 40.340 42.643 -2.303 1
1 472 . 10 1 1 A 49 49 ASP N N 49 119.296 121.128 -1.832 1
1 473 . 10 1 1 A 50 50 HIS H H 50 6.919 7.392 -0.473 1
1 474 . 10 1 1 A 50 50 HIS HA H 50 4.880 5.071 -0.191 1
1 477 . 10 1 1 A 50 50 HIS C C 50 172.942 173.724 -0.782 1
1 478 . 10 1 1 A 50 50 HIS CA C 50 53.978 53.337 0.641 1
1 479 . 10 1 1 A 50 50 HIS CB C 50 30.330 32.676 -2.346 1
1 480 . 10 1 1 A 50 50 HIS N N 50 113.709 115.887 -2.178 1
1 481 . 10 1 1 A 51 51 GLN H H 51 8.646 8.833 -0.187 1
1 482 . 10 1 1 A 51 51 GLN HA H 51 4.896 4.779 0.117 1
1 487 . 10 1 1 A 51 51 GLN C C 51 176.512 175.513 0.999 1
1 488 . 10 1 1 A 51 51 GLN CA C 51 54.872 54.619 0.253 1
1 489 . 10 1 1 A 51 51 GLN CB C 51 30.950 30.477 0.473 1
1 491 . 10 1 1 A 51 51 GLN N N 51 119.379 120.644 -1.265 1
1 492 . 10 1 1 A 52 52 LEU H H 52 9.646 8.463 1.183 1
1 493 . 10 1 1 A 52 52 LEU HA H 52 4.206 4.684 -0.478 1
1 503 . 10 1 1 A 52 52 LEU C C 52 175.793 174.750 1.043 1
1 504 . 10 1 1 A 52 52 LEU CA C 52 55.450 53.981 1.469 1
1 505 . 10 1 1 A 52 52 LEU CB C 52 41.407 43.753 -2.346 1
1 509 . 10 1 1 A 52 52 LEU N N 52 128.069 127.362 0.707 1
1 510 . 10 1 1 A 53 53 ASP H H 53 9.281 8.331 0.950 1
1 511 . 10 1 1 A 53 53 ASP HA H 53 4.725 4.956 -0.231 1
1 514 . 10 1 1 A 53 53 ASP C C 53 176.401 176.968 -0.567 1
1 515 . 10 1 1 A 53 53 ASP CA C 53 52.590 52.865 -0.275 1
1 516 . 10 1 1 A 53 53 ASP CB C 53 39.990 43.617 -3.627 1
1 517 . 10 1 1 A 53 53 ASP N N 53 128.783 126.113 2.670 1
1 518 . 10 1 1 A 54 54 ARG H H 54 8.496 8.692 -0.196 1
1 519 . 10 1 1 A 54 54 ARG HA H 54 3.859 3.879 -0.020 1
1 526 . 10 1 1 A 54 54 ARG C C 54 176.346 176.576 -0.230 1
1 527 . 10 1 1 A 54 54 ARG CA C 54 57.357 57.850 -0.493 1
1 528 . 10 1 1 A 54 54 ARG CB C 54 28.890 29.197 -0.307 1
1 531 . 10 1 1 A 54 54 ARG N N 54 125.813 124.351 1.462 1
1 532 . 10 1 1 A 55 55 PHE H H 55 8.005 7.299 0.706 1
1 533 . 10 1 1 A 55 55 PHE HA H 55 4.712 4.434 0.278 1
1 540 . 10 1 1 A 55 55 PHE C C 55 177.481 178.107 -0.626 1
1 541 . 10 1 1 A 55 55 PHE CA C 55 59.080 60.984 -1.904 1
1 542 . 10 1 1 A 55 55 PHE CB C 55 37.447 39.380 -1.933 1
1 545 . 10 1 1 A 55 55 PHE N N 55 120.168 117.629 2.539 1
1 546 . 10 1 1 A 56 56 LYS H H 56 7.681 7.356 0.325 1
1 547 . 10 1 1 A 56 56 LYS HA H 56 4.411 4.331 0.080 1
1 556 . 10 1 1 A 56 56 LYS C C 56 175.959 176.492 -0.533 1
1 557 . 10 1 1 A 56 56 LYS CA C 56 55.459 57.671 -2.212 1
1 558 . 10 1 1 A 56 56 LYS CB C 56 33.590 33.170 0.420 1
1 562 . 10 1 1 A 56 56 LYS N N 56 116.937 117.292 -0.355 1
1 563 . 10 1 1 A 57 57 VAL H H 57 6.553 7.269 -0.716 1
1 564 . 10 1 1 A 57 57 VAL HA H 57 3.408 3.863 -0.455 1
1 572 . 10 1 1 A 57 57 VAL C C 57 173.911 175.045 -1.134 1
1 573 . 10 1 1 A 57 57 VAL CA C 57 65.025 61.857 3.168 1
1 574 . 10 1 1 A 57 57 VAL CB C 57 32.663 32.248 0.415 1
1 577 . 10 1 1 A 57 57 VAL N N 57 119.519 117.339 2.180 1
1 578 . 10 1 1 A 58 58 LYS H H 58 9.182 8.935 0.247 1
1 579 . 10 1 1 A 58 58 LYS HA H 58 4.489 4.557 -0.068 1
1 588 . 10 1 1 A 58 58 LYS C C 58 176.927 176.355 0.572 1
1 589 . 10 1 1 A 58 58 LYS CA C 58 55.913 57.373 -1.460 1
1 590 . 10 1 1 A 58 58 LYS CB C 58 36.340 35.575 0.765 1
1 594 . 10 1 1 A 58 58 LYS N N 58 124.985 125.075 -0.090 1
1 595 . 10 1 1 A 59 59 GLU H H 59 8.799 7.968 0.831 1
1 596 . 10 1 1 A 59 59 GLU HA H 59 5.209 4.833 0.376 1
1 601 . 10 1 1 A 59 59 GLU C C 59 173.911 175.473 -1.562 1
1 602 . 10 1 1 A 59 59 GLU CA C 59 54.670 55.593 -0.923 1
1 603 . 10 1 1 A 59 59 GLU CB C 59 35.180 31.563 3.617 1
1 605 . 10 1 1 A 59 59 GLU N N 59 121.493 118.596 2.897 1
1 606 . 10 1 1 A 60 60 VAL H H 60 8.917 8.911 0.006 1
1 607 . 10 1 1 A 60 60 VAL HA H 60 4.983 5.036 -0.053 1
1 615 . 10 1 1 A 60 60 VAL C C 60 173.441 173.962 -0.521 1
1 616 . 10 1 1 A 60 60 VAL CA C 60 57.497 59.035 -1.538 1
1 617 . 10 1 1 A 60 60 VAL CB C 60 35.460 36.309 -0.849 1
1 620 . 10 1 1 A 60 60 VAL N N 60 109.266 117.522 -8.256 1
1 621 . 10 1 1 A 61 61 GLN H H 61 8.970 8.684 0.286 1
1 622 . 10 1 1 A 61 61 GLN HA H 61 5.024 5.328 -0.304 1
1 629 . 10 1 1 A 61 61 GLN C C 61 175.045 173.633 1.412 1
1 630 . 10 1 1 A 61 61 GLN CA C 61 53.128 53.969 -0.841 1
1 631 . 10 1 1 A 61 61 GLN CB C 61 33.980 32.542 1.438 1
1 633 . 10 1 1 A 61 61 GLN N N 61 118.525 118.440 0.085 1
1 635 . 10 1 1 A 62 62 CYS H H 62 7.688 8.394 -0.706 1
1 636 . 10 1 1 A 62 62 CYS HA H 62 4.210 4.612 -0.402 1
1 639 . 10 1 1 A 62 62 CYS C C 62 177.951 173.730 4.221 1
1 640 . 10 1 1 A 62 62 CYS CA C 62 59.845 57.913 1.932 1
1 641 . 10 1 1 A 62 62 CYS CB C 62 33.120 29.055 4.065 1
1 642 . 10 1 1 A 62 62 CYS N N 62 128.772 121.232 7.540 1
1 643 . 10 1 1 A 63 63 ILE H H 63 8.192 8.565 -0.373 1
1 644 . 10 1 1 A 63 63 ILE HA H 63 3.984 4.296 -0.312 1
1 654 . 10 1 1 A 63 63 ILE C C 63 175.433 175.722 -0.289 1
1 655 . 10 1 1 A 63 63 ILE CA C 63 63.657 61.140 2.517 1
1 656 . 10 1 1 A 63 63 ILE CB C 63 38.506 35.711 2.795 1
1 660 . 10 1 1 A 63 63 ILE N N 63 127.455 128.550 -1.095 1
1 661 . 10 1 1 A 64 64 ASN H H 64 9.181 8.219 0.962 1
1 662 . 10 1 1 A 64 64 ASN HA H 64 4.810 4.954 -0.144 1
1 667 . 10 1 1 A 64 64 ASN C C 64 175.931 175.992 -0.061 1
1 668 . 10 1 1 A 64 64 ASN CA C 64 55.617 54.654 0.963 1
1 669 . 10 1 1 A 64 64 ASN CB C 64 40.640 40.554 0.086 1
1 670 . 10 1 1 A 64 64 ASN N N 64 122.104 124.296 -2.192 1
1 672 . 10 1 1 A 65 65 CYS H H 65 9.065 7.705 1.360 1
1 673 . 10 1 1 A 65 65 CYS HA H 65 4.979 4.434 0.545 1
1 676 . 10 1 1 A 65 65 CYS C C 65 176.291 174.563 1.728 1
1 677 . 10 1 1 A 65 65 CYS CA C 65 59.027 59.592 -0.565 1
1 678 . 10 1 1 A 65 65 CYS CB C 65 32.030 28.681 3.349 1
1 679 . 10 1 1 A 65 65 CYS N N 65 120.368 116.840 3.528 1
1 680 . 10 1 1 A 66 66 GLU H H 66 7.281 8.077 -0.796 1
1 681 . 10 1 1 A 66 66 GLU HA H 66 4.046 3.963 0.083 1
1 686 . 10 1 1 A 66 66 GLU C C 66 175.211 175.129 0.082 1
1 687 . 10 1 1 A 66 66 GLU CA C 66 58.591 57.650 0.941 1
1 688 . 10 1 1 A 66 66 GLU CB C 66 27.067 27.243 -0.176 1
1 690 . 10 1 1 A 66 66 GLU N N 66 115.012 117.232 -2.220 1
1 691 . 10 1 1 A 67 67 LYS H H 67 8.481 7.807 0.674 1
1 692 . 10 1 1 A 67 67 LYS HA H 67 4.326 4.325 0.001 1
1 701 . 10 1 1 A 67 67 LYS C C 67 177.923 176.112 1.811 1
1 702 . 10 1 1 A 67 67 LYS CA C 67 57.628 56.482 1.146 1
1 703 . 10 1 1 A 67 67 LYS CB C 67 33.617 33.053 0.564 1
1 707 . 10 1 1 A 67 67 LYS N N 67 123.514 120.613 2.901 1
1 708 . 10 1 1 A 68 68 ILE H H 68 8.867 8.554 0.313 1
1 709 . 10 1 1 A 68 68 ILE HA H 68 4.976 4.622 0.354 1
1 719 . 10 1 1 A 68 68 ILE C C 68 175.018 175.383 -0.365 1
1 720 . 10 1 1 A 68 68 ILE CA C 68 60.919 60.819 0.100 1
1 721 . 10 1 1 A 68 68 ILE CB C 68 37.090 36.940 0.150 1
1 725 . 10 1 1 A 68 68 ILE N N 68 133.478 127.084 6.394 1
1 726 . 10 1 1 A 69 69 GLN H H 69 9.269 8.741 0.528 1
1 727 . 10 1 1 A 69 69 GLN HA H 69 5.036 5.046 -0.010 1
1 732 . 10 1 1 A 69 69 GLN C C 69 173.607 174.629 -1.022 1
1 733 . 10 1 1 A 69 69 GLN CA C 69 53.419 54.011 -0.592 1
1 734 . 10 1 1 A 69 69 GLN CB C 69 34.997 32.474 2.523 1
1 736 . 10 1 1 A 69 69 GLN N N 69 125.104 123.981 1.123 1
1 737 . 10 1 1 A 70 70 HIS H H 70 8.829 9.001 -0.172 1
1 738 . 10 1 1 A 70 70 HIS HA H 70 4.865 4.667 0.198 1
1 741 . 10 1 1 A 70 70 HIS C C 70 174.852 174.926 -0.074 1
1 742 . 10 1 1 A 70 70 HIS CA C 70 56.304 55.535 0.769 1
1 743 . 10 1 1 A 70 70 HIS CB C 70 30.050 31.321 -1.271 1
1 744 . 10 1 1 A 70 70 HIS N N 70 118.576 119.173 -0.597 1
1 745 . 10 1 1 A 71 71 ALA H H 71 7.768 8.195 -0.427 1
1 746 . 10 1 1 A 71 71 ALA HA H 71 3.977 4.583 -0.606 1
1 750 . 10 1 1 A 71 71 ALA C C 71 175.433 176.667 -1.234 1
1 751 . 10 1 1 A 71 71 ALA CA C 71 54.393 52.107 2.286 1
1 752 . 10 1 1 A 71 71 ALA CB C 71 18.000 18.452 -0.452 1
1 753 . 10 1 1 A 71 71 ALA N N 71 121.438 123.462 -2.024 1
1 754 . 10 1 1 A 72 72 GLN H H 72 7.227 7.771 -0.544 1
1 755 . 10 1 1 A 72 72 GLN HA H 72 4.371 4.475 -0.104 1
1 762 . 10 1 1 A 72 72 GLN C C 72 173.053 174.840 -1.787 1
1 763 . 10 1 1 A 72 72 GLN CA C 72 54.290 53.610 0.680 1
1 764 . 10 1 1 A 72 72 GLN CB C 72 28.623 31.471 -2.848 1
1 766 . 10 1 1 A 72 72 GLN N N 72 115.858 123.481 -7.623 1
1 768 . 10 1 1 A 73 73 GLN H H 73 8.481 8.407 0.074 1
1 769 . 10 1 1 A 73 73 GLN HA H 73 3.570 3.601 -0.031 1
1 776 . 10 1 1 A 73 73 GLN C C 73 174.243 174.938 -0.695 1
1 777 . 10 1 1 A 73 73 GLN CA C 73 60.206 56.870 3.336 1
1 778 . 10 1 1 A 73 73 GLN CB C 73 28.850 29.596 -0.746 1
1 780 . 10 1 1 A 73 73 GLN N N 73 116.433 122.195 -5.762 1
1 782 . 10 1 1 A 74 74 THR H H 74 7.211 7.388 -0.177 1
1 783 . 10 1 1 A 74 74 THR HA H 74 4.160 5.020 -0.860 1
1 788 . 10 1 1 A 74 74 THR C C 74 171.836 173.085 -1.249 1
1 789 . 10 1 1 A 74 74 THR CA C 74 59.072 61.034 -1.962 1
1 790 . 10 1 1 A 74 74 THR CB C 74 71.560 71.786 -0.226 1
1 792 . 10 1 1 A 74 74 THR N N 74 108.717 110.809 -2.092 1
1 793 . 10 1 1 A 75 75 CYS H H 75 7.676 8.829 -1.153 1
1 794 . 10 1 1 A 75 75 CYS HA H 75 4.158 4.789 -0.631 1
1 797 . 10 1 1 A 75 75 CYS C C 75 178.781 175.673 3.108 1
1 798 . 10 1 1 A 75 75 CYS CA C 75 58.661 58.550 0.111 1
1 799 . 10 1 1 A 75 75 CYS CB C 75 30.840 28.648 2.192 1
1 800 . 10 1 1 A 75 75 CYS N N 75 123.108 124.896 -1.788 1
1 801 . 10 1 1 A 76 76 GLU H H 76 9.203 8.898 0.305 1
1 802 . 10 1 1 A 76 76 GLU HA H 76 4.187 4.076 0.111 1
1 807 . 10 1 1 A 76 76 GLU C C 76 175.488 178.082 -2.594 1
1 808 . 10 1 1 A 76 76 GLU CA C 76 57.306 59.511 -2.205 1
1 809 . 10 1 1 A 76 76 GLU CB C 76 29.347 29.092 0.255 1
1 811 . 10 1 1 A 76 76 GLU N N 76 129.817 127.191 2.626 1
1 812 . 10 1 1 A 77 77 GLU H H 77 9.496 8.560 0.936 1
1 813 . 10 1 1 A 77 77 GLU HA H 77 4.599 4.162 0.437 1
1 818 . 10 1 1 A 77 77 GLU C C 77 177.148 177.293 -0.145 1
1 819 . 10 1 1 A 77 77 GLU CA C 77 57.554 58.405 -0.851 1
1 820 . 10 1 1 A 77 77 GLU CB C 77 31.980 28.718 3.262 1
1 822 . 10 1 1 A 77 77 GLU N N 77 124.795 118.083 6.712 1
1 823 . 10 1 1 A 78 78 CYS H H 78 8.967 7.869 1.098 1
1 824 . 10 1 1 A 78 78 CYS HA H 78 5.073 4.545 0.528 1
1 827 . 10 1 1 A 78 78 CYS C C 78 176.374 175.141 1.233 1
1 828 . 10 1 1 A 78 78 CYS CA C 78 58.537 58.518 0.019 1
1 829 . 10 1 1 A 78 78 CYS CB C 78 31.597 29.860 1.737 1
1 830 . 10 1 1 A 78 78 CYS N N 78 119.692 118.013 1.679 1
1 831 . 10 1 1 A 79 79 SER H H 79 7.474 8.242 -0.768 1
1 832 . 10 1 1 A 79 79 SER HA H 79 4.113 4.227 -0.114 1
1 835 . 10 1 1 A 79 79 SER C C 79 172.915 173.039 -0.124 1
1 836 . 10 1 1 A 79 79 SER CA C 79 60.440 59.229 1.211 1
1 837 . 10 1 1 A 79 79 SER CB C 79 61.421 61.838 -0.417 1
1 838 . 10 1 1 A 79 79 SER N N 79 113.385 115.849 -2.464 1
1 839 . 10 1 1 A 80 80 THR H H 80 7.907 7.876 0.031 1
1 840 . 10 1 1 A 80 80 THR HA H 80 3.913 4.341 -0.428 1
1 845 . 10 1 1 A 80 80 THR C C 80 172.306 173.686 -1.380 1
1 846 . 10 1 1 A 80 80 THR CA C 80 65.262 62.675 2.587 1
1 847 . 10 1 1 A 80 80 THR CB C 80 69.910 69.689 0.221 1
1 849 . 10 1 1 A 80 80 THR N N 80 120.005 115.531 4.474 1
1 850 . 10 1 1 A 81 81 LEU H H 81 8.556 8.664 -0.108 1
1 851 . 10 1 1 A 81 81 LEU HA H 81 4.172 4.480 -0.308 1
1 861 . 10 1 1 A 81 81 LEU C C 81 177.121 177.034 0.087 1
1 862 . 10 1 1 A 81 81 LEU CA C 81 54.996 55.887 -0.891 1
1 863 . 10 1 1 A 81 81 LEU CB C 81 42.147 43.244 -1.097 1
1 867 . 10 1 1 A 81 81 LEU N N 81 128.272 128.178 0.094 1
1 868 . 10 1 1 A 82 82 PHE H H 82 9.251 9.188 0.063 1
1 869 . 10 1 1 A 82 82 PHE HA H 82 4.576 4.488 0.088 1
1 874 . 10 1 1 A 82 82 PHE C C 82 177.785 176.307 1.478 1
1 875 . 10 1 1 A 82 82 PHE CA C 82 56.470 60.844 -4.374 1
1 876 . 10 1 1 A 82 82 PHE CB C 82 38.210 39.473 -1.263 1
1 878 . 10 1 1 A 82 82 PHE N N 82 129.268 125.140 4.128 1
1 879 . 10 1 1 A 83 83 GLY H H 83 7.047 7.400 -0.353 1
1 880 . 10 1 1 A 83 83 GLY HA2 H 83 4.783 4.144 0.639 1
1 881 . 10 1 1 A 83 83 GLY HA3 H 83 3.876 4.197 -0.321 1
1 882 . 10 1 1 A 83 83 GLY C C 83 171.642 174.764 -3.122 1
1 883 . 10 1 1 A 83 83 GLY CA C 83 45.826 46.206 -0.380 1
1 884 . 10 1 1 A 83 83 GLY N N 83 102.168 103.726 -1.558 1
1 885 . 10 1 1 A 84 84 GLU H H 84 8.444 8.912 -0.468 1
1 886 . 10 1 1 A 84 84 GLU HA H 84 4.111 4.092 0.019 1
1 891 . 10 1 1 A 84 84 GLU C C 84 177.259 176.836 0.423 1
1 892 . 10 1 1 A 84 84 GLU CA C 84 59.438 59.359 0.079 1
1 893 . 10 1 1 A 84 84 GLU CB C 84 30.670 30.021 0.649 1
1 895 . 10 1 1 A 84 84 GLU N N 84 127.546 121.028 6.518 1
1 896 . 10 1 1 A 85 85 TYR H H 85 9.344 8.209 1.135 1
1 897 . 10 1 1 A 85 85 TYR HA H 85 4.599 4.864 -0.265 1
1 902 . 10 1 1 A 85 85 TYR C C 85 173.302 174.325 -1.023 1
1 903 . 10 1 1 A 85 85 TYR CA C 85 57.261 58.126 -0.865 1
1 904 . 10 1 1 A 85 85 TYR CB C 85 40.850 39.627 1.223 1
1 906 . 10 1 1 A 85 85 TYR N N 85 118.936 120.719 -1.783 1
1 907 . 10 1 1 A 86 86 TYR H H 86 7.323 8.677 -1.354 1
1 908 . 10 1 1 A 86 86 TYR HA H 86 5.298 5.163 0.135 1
1 911 . 10 1 1 A 86 86 TYR C C 86 172.804 173.694 -0.890 1
1 912 . 10 1 1 A 86 86 TYR CA C 86 54.041 56.132 -2.091 1
1 913 . 10 1 1 A 86 86 TYR CB C 86 40.987 41.624 -0.637 1
1 914 . 10 1 1 A 86 86 TYR N N 86 124.965 129.375 -4.410 1
1 915 . 10 1 1 A 87 87 CYS H H 87 7.046 8.487 -1.441 1
1 916 . 10 1 1 A 87 87 CYS HA H 87 3.842 4.481 -0.639 1
1 919 . 10 1 1 A 87 87 CYS C C 87 174.243 174.167 0.076 1
1 920 . 10 1 1 A 87 87 CYS CA C 87 56.377 57.359 -0.982 1
1 921 . 10 1 1 A 87 87 CYS CB C 87 33.230 29.499 3.731 1
1 922 . 10 1 1 A 87 87 CYS N N 87 128.735 126.216 2.519 1
1 923 . 10 1 1 A 88 88 ASP H H 88 8.002 8.952 -0.950 1
1 924 . 10 1 1 A 88 88 ASP HA H 88 3.761 4.044 -0.283 1
1 927 . 10 1 1 A 88 88 ASP C C 88 173.579 178.060 -4.481 1
1 928 . 10 1 1 A 88 88 ASP CA C 88 53.958 56.630 -2.672 1
1 929 . 10 1 1 A 88 88 ASP CB C 88 41.240 39.411 1.829 1
1 930 . 10 1 1 A 88 88 ASP N N 88 127.013 127.111 -0.098 1
1 931 . 10 1 1 A 89 89 ILE H H 89 7.972 7.749 0.223 1
1 932 . 10 1 1 A 89 89 ILE HA H 89 3.660 3.687 -0.027 1
1 942 . 10 1 1 A 89 89 ILE C C 89 177.259 177.702 -0.443 1
1 943 . 10 1 1 A 89 89 ILE CA C 89 63.107 64.672 -1.565 1
1 944 . 10 1 1 A 89 89 ILE CB C 89 39.430 37.804 1.626 1
1 948 . 10 1 1 A 89 89 ILE N N 89 120.357 120.313 0.044 1
1 949 . 10 1 1 A 90 90 CYS H H 90 8.554 7.868 0.686 1
1 950 . 10 1 1 A 90 90 CYS HA H 90 3.677 4.290 -0.613 1
1 953 . 10 1 1 A 90 90 CYS C C 90 175.128 174.693 0.435 1
1 954 . 10 1 1 A 90 90 CYS CA C 90 60.791 60.427 0.364 1
1 955 . 10 1 1 A 90 90 CYS CB C 90 30.427 27.816 2.611 1
1 956 . 10 1 1 A 90 90 CYS N N 90 119.564 117.801 1.763 1
1 957 . 10 1 1 A 91 91 HIS H H 91 7.364 7.557 -0.193 1
1 958 . 10 1 1 A 91 91 HIS HA H 91 3.512 3.786 -0.274 1
1 963 . 10 1 1 A 91 91 HIS C C 91 170.590 173.264 -2.674 1
1 964 . 10 1 1 A 91 91 HIS CA C 91 58.739 56.975 1.764 1
1 965 . 10 1 1 A 91 91 HIS CB C 91 24.810 26.827 -2.017 1
1 968 . 10 1 1 A 91 91 HIS N N 91 111.440 115.893 -4.453 1
1 969 . 10 1 1 A 92 92 LEU H H 92 6.214 7.531 -1.317 1
1 970 . 10 1 1 A 92 92 LEU HA H 92 4.191 3.873 0.318 1
1 980 . 10 1 1 A 92 92 LEU C C 92 173.911 175.758 -1.847 1
1 981 . 10 1 1 A 92 92 LEU CA C 92 53.717 53.549 0.168 1
1 982 . 10 1 1 A 92 92 LEU CB C 92 45.360 42.033 3.327 1
1 986 . 10 1 1 A 92 92 LEU N N 92 115.684 119.425 -3.741 1
1 987 . 10 1 1 A 93 93 PHE H H 93 6.669 8.833 -2.164 1
1 988 . 10 1 1 A 93 93 PHE HA H 93 5.622 5.300 0.322 1
1 995 . 10 1 1 A 93 93 PHE C C 93 175.765 174.561 1.204 1
1 996 . 10 1 1 A 93 93 PHE CA C 93 55.387 56.668 -1.281 1
1 997 . 10 1 1 A 93 93 PHE CB C 93 42.700 42.503 0.197 1
1 1000 . 10 1 1 A 93 93 PHE N N 93 121.535 121.712 -0.177 1
1 1001 . 10 1 1 A 94 94 ASP H H 94 9.209 8.593 0.616 1
1 1002 . 10 1 1 A 94 94 ASP HA H 94 5.819 5.334 0.485 1
1 1005 . 10 1 1 A 94 94 ASP C C 94 175.654 175.237 0.417 1
1 1006 . 10 1 1 A 94 94 ASP CA C 94 53.330 53.247 0.083 1
1 1007 . 10 1 1 A 94 94 ASP CB C 94 44.720 45.107 -0.387 1
1 1008 . 10 1 1 A 94 94 ASP N N 94 123.504 120.567 2.937 1
1 1009 . 10 1 1 A 95 95 LYS H H 95 9.043 8.664 0.379 1
1 1010 . 10 1 1 A 95 95 LYS HA H 95 4.527 4.434 0.093 1
1 1019 . 10 1 1 A 95 95 LYS C C 95 174.879 176.527 -1.648 1
1 1020 . 10 1 1 A 95 95 LYS CA C 95 56.620 57.114 -0.494 1
1 1021 . 10 1 1 A 95 95 LYS CB C 95 33.720 33.072 0.648 1
1 1025 . 10 1 1 A 95 95 LYS N N 95 120.380 121.915 -1.535 1
1 1026 . 10 1 1 A 96 96 ASP H H 96 8.999 8.679 0.320 1
1 1027 . 10 1 1 A 96 96 ASP HA H 96 4.724 4.771 -0.047 1
1 1030 . 10 1 1 A 96 96 ASP C C 96 176.401 175.508 0.893 1
1 1031 . 10 1 1 A 96 96 ASP CA C 96 56.147 53.762 2.385 1
1 1032 . 10 1 1 A 96 96 ASP CB C 96 40.790 40.882 -0.092 1
1 1033 . 10 1 1 A 96 96 ASP N N 96 120.784 122.807 -2.023 1
1 1034 . 10 1 1 A 97 97 LYS H H 97 9.382 8.883 0.499 1
1 1035 . 10 1 1 A 97 97 LYS HA H 97 4.473 4.501 -0.028 1
1 1044 . 10 1 1 A 97 97 LYS C C 97 175.903 177.464 -1.561 1
1 1045 . 10 1 1 A 97 97 LYS CA C 97 54.771 57.279 -2.508 1
1 1046 . 10 1 1 A 97 97 LYS CB C 97 33.270 33.930 -0.660 1
1 1050 . 10 1 1 A 97 97 LYS N N 97 131.617 125.579 6.038 1
1 1051 . 10 1 1 A 98 98 LYS H H 98 8.940 8.162 0.778 1
1 1052 . 10 1 1 A 98 98 LYS HA H 98 4.118 4.589 -0.471 1
1 1061 . 10 1 1 A 98 98 LYS C C 98 177.065 176.109 0.956 1
1 1062 . 10 1 1 A 98 98 LYS CA C 98 56.297 55.680 0.617 1
1 1063 . 10 1 1 A 98 98 LYS CB C 98 28.467 34.110 -5.643 1
1 1067 . 10 1 1 A 98 98 LYS N N 98 115.034 117.732 -2.698 1
1 1068 . 10 1 1 A 99 99 GLN H H 99 9.266 7.442 1.824 1
1 1069 . 10 1 1 A 99 99 GLN HA H 99 4.460 4.477 -0.017 1
1 1074 . 10 1 1 A 99 99 GLN C C 99 174.990 175.484 -0.494 1
1 1075 . 10 1 1 A 99 99 GLN CA C 99 57.563 56.261 1.302 1
1 1076 . 10 1 1 A 99 99 GLN CB C 99 27.280 28.938 -1.658 1
1 1078 . 10 1 1 A 99 99 GLN N N 99 117.717 119.633 -1.916 1
1 1079 . 10 1 1 A 100 100 TYR H H 100 8.402 8.998 -0.596 1
1 1080 . 10 1 1 A 100 100 TYR HA H 100 4.935 5.741 -0.806 1
1 1087 . 10 1 1 A 100 100 TYR C C 100 171.504 173.168 -1.664 1
1 1088 . 10 1 1 A 100 100 TYR CA C 100 55.786 55.356 0.430 1
1 1089 . 10 1 1 A 100 100 TYR CB C 100 41.090 41.979 -0.889 1
1 1092 . 10 1 1 A 100 100 TYR N N 100 115.081 117.964 -2.883 1
1 1093 . 10 1 1 A 101 101 HIS H H 101 8.829 9.076 -0.247 1
1 1094 . 10 1 1 A 101 101 HIS HA H 101 4.525 4.730 -0.205 1
1 1099 . 10 1 1 A 101 101 HIS C C 101 174.935 173.885 1.050 1
1 1100 . 10 1 1 A 101 101 HIS CA C 101 56.327 55.069 1.258 1
1 1101 . 10 1 1 A 101 101 HIS CB C 101 31.020 30.663 0.357 1
1 1104 . 10 1 1 A 101 101 HIS N N 101 120.894 122.306 -1.412 1
1 1105 . 10 1 1 A 102 102 CYS H H 102 7.427 8.124 -0.697 1
1 1106 . 10 1 1 A 102 102 CYS HA H 102 4.561 4.441 0.120 1
1 1109 . 10 1 1 A 102 102 CYS C C 102 175.765 175.898 -0.133 1
1 1110 . 10 1 1 A 102 102 CYS CA C 102 57.707 58.489 -0.782 1
1 1111 . 10 1 1 A 102 102 CYS CB C 102 29.130 28.306 0.824 1
1 1112 . 10 1 1 A 102 102 CYS N N 102 131.256 127.036 4.220 1
1 1113 . 10 1 1 A 103 103 GLU H H 103 9.497 8.945 0.552 1
1 1114 . 10 1 1 A 103 103 GLU HA H 103 4.003 4.165 -0.162 1
1 1119 . 10 1 1 A 103 103 GLU C C 103 176.540 178.697 -2.157 1
1 1120 . 10 1 1 A 103 103 GLU CA C 103 58.796 59.412 -0.616 1
1 1121 . 10 1 1 A 103 103 GLU CB C 103 29.280 29.698 -0.418 1
1 1123 . 10 1 1 A 103 103 GLU N N 103 129.829 127.626 2.203 1
1 1124 . 10 1 1 A 104 104 ASN H H 104 7.832 8.196 -0.364 1
1 1125 . 10 1 1 A 104 104 ASN HA H 104 4.457 4.380 0.077 1
1 1130 . 10 1 1 A 104 104 ASN C C 104 176.401 177.882 -1.481 1
1 1131 . 10 1 1 A 104 104 ASN CA C 104 56.053 56.334 -0.281 1
1 1132 . 10 1 1 A 104 104 ASN CB C 104 38.400 37.715 0.685 1
1 1133 . 10 1 1 A 104 104 ASN N N 104 117.703 118.452 -0.749 1
1 1135 . 10 1 1 A 105 105 CYS H H 105 9.415 7.308 2.107 1
1 1136 . 10 1 1 A 105 105 CYS HA H 105 4.137 4.457 -0.320 1
1 1139 . 10 1 1 A 105 105 CYS C C 105 176.844 175.296 1.548 1
1 1140 . 10 1 1 A 105 105 CYS CA C 105 64.328 59.435 4.893 1
1 1141 . 10 1 1 A 105 105 CYS CB C 105 30.350 28.127 2.223 1
1 1142 . 10 1 1 A 105 105 CYS N N 105 124.939 115.176 9.763 1
1 1143 . 10 1 1 A 106 106 GLY H H 106 8.145 8.620 -0.475 1
1 1144 . 10 1 1 A 106 106 GLY HA2 H 106 3.980 3.880 0.100 1
1 1145 . 10 1 1 A 106 106 GLY HA3 H 106 3.502 3.901 -0.399 1
1 1146 . 10 1 1 A 106 106 GLY C C 106 172.500 173.718 -1.218 1
1 1147 . 10 1 1 A 106 106 GLY CA C 106 44.968 45.652 -0.684 1
1 1148 . 10 1 1 A 106 106 GLY N N 106 106.090 109.707 -3.617 1
1 1149 . 10 1 1 A 107 107 ILE H H 107 6.465 6.867 -0.402 1
1 1150 . 10 1 1 A 107 107 ILE HA H 107 4.878 5.059 -0.181 1
1 1160 . 10 1 1 A 107 107 ILE C C 107 174.824 174.376 0.448 1
1 1161 . 10 1 1 A 107 107 ILE CA C 107 58.226 58.550 -0.324 1
1 1162 . 10 1 1 A 107 107 ILE CB C 107 44.460 42.210 2.250 1
1 1166 . 10 1 1 A 107 107 ILE N N 107 107.914 114.940 -7.026 1
1 1167 . 10 1 1 A 108 108 CYS H H 108 7.041 9.002 -1.961 1
1 1168 . 10 1 1 A 108 108 CYS HA H 108 5.018 5.318 -0.300 1
1 1171 . 10 1 1 A 108 108 CYS C C 108 175.461 172.880 2.581 1
1 1172 . 10 1 1 A 108 108 CYS CA C 108 62.097 56.712 5.385 1
1 1173 . 10 1 1 A 108 108 CYS CB C 108 31.353 31.649 -0.296 1
1 1174 . 10 1 1 A 108 108 CYS N N 108 122.441 118.946 3.495 1
1 1175 . 10 1 1 A 109 109 ARG H H 109 8.561 8.713 -0.152 1
1 1176 . 10 1 1 A 109 109 ARG HA H 109 4.239 4.860 -0.621 1
1 1183 . 10 1 1 A 109 109 ARG C C 109 174.271 174.216 0.055 1
1 1184 . 10 1 1 A 109 109 ARG CA C 109 52.962 54.664 -1.702 1
1 1185 . 10 1 1 A 109 109 ARG CB C 109 33.903 34.585 -0.682 1
1 1188 . 10 1 1 A 109 109 ARG N N 109 121.163 121.394 -0.231 1
1 1189 . 10 1 1 A 110 110 ILE H H 110 7.847 8.469 -0.622 1
1 1190 . 10 1 1 A 110 110 ILE HA H 110 3.531 4.078 -0.547 1
1 1200 . 10 1 1 A 110 110 ILE C C 110 175.405 175.800 -0.395 1
1 1201 . 10 1 1 A 110 110 ILE CA C 110 62.201 61.967 0.234 1
1 1202 . 10 1 1 A 110 110 ILE CB C 110 36.860 36.640 0.220 1
1 1206 . 10 1 1 A 110 110 ILE N N 110 118.955 125.233 -6.278 1
1 1207 . 10 1 1 A 111 111 GLY H H 111 6.928 8.415 -1.487 1
1 1208 . 10 1 1 A 111 111 GLY HA2 H 111 4.564 4.186 0.378 1
1 1209 . 10 1 1 A 111 111 GLY HA3 H 111 4.135 4.315 -0.180 1
1 1210 . 10 1 1 A 111 111 GLY CA C 111 43.068 45.208 -2.140 1
1 1211 . 10 1 1 A 111 111 GLY N N 111 113.782 114.635 -0.853 1
1 1212 . 10 1 1 A 112 112 PRO HA H 112 4.990 4.688 0.302 1
1 1219 . 10 1 1 A 112 112 PRO C C 112 177.342 177.725 -0.383 1
1 1220 . 10 1 1 A 112 112 PRO CA C 112 62.920 62.887 0.033 1
1 1221 . 10 1 1 A 112 112 PRO CB C 112 34.807 31.741 3.066 1
1 1224 . 10 1 1 A 113 113 LYS H H 113 8.989 8.054 0.935 1
1 1225 . 10 1 1 A 113 113 LYS HA H 113 3.144 3.760 -0.616 1
1 1234 . 10 1 1 A 113 113 LYS C C 113 177.536 178.005 -0.469 1
1 1235 . 10 1 1 A 113 113 LYS CA C 113 59.883 58.738 1.145 1
1 1236 . 10 1 1 A 113 113 LYS CB C 113 32.260 31.615 0.645 1
1 1240 . 10 1 1 A 113 113 LYS N N 113 123.545 123.419 0.126 1
1 1241 . 10 1 1 A 114 114 GLU H H 114 9.080 8.997 0.083 1
1 1242 . 10 1 1 A 114 114 GLU HA H 114 4.199 4.051 0.148 1
1 1247 . 10 1 1 A 114 114 GLU C C 114 176.374 177.891 -1.517 1
1 1248 . 10 1 1 A 114 114 GLU CA C 114 58.733 59.065 -0.332 1
1 1249 . 10 1 1 A 114 114 GLU CB C 114 28.077 28.353 -0.276 1
1 1251 . 10 1 1 A 114 114 GLU N N 114 114.832 120.722 -5.890 1
1 1252 . 10 1 1 A 115 115 ASP H H 115 7.799 8.056 -0.257 1
1 1253 . 10 1 1 A 115 115 ASP HA H 115 4.642 4.738 -0.096 1
1 1256 . 10 1 1 A 115 115 ASP C C 115 176.374 176.201 0.173 1
1 1257 . 10 1 1 A 115 115 ASP CA C 115 54.470 56.054 -1.584 1
1 1258 . 10 1 1 A 115 115 ASP CB C 115 40.850 42.066 -1.216 1
1 1259 . 10 1 1 A 115 115 ASP N N 115 118.858 120.379 -1.521 1
1 1260 . 10 1 1 A 116 116 PHE H H 116 8.063 8.396 -0.333 1
1 1261 . 10 1 1 A 116 116 PHE HA H 116 5.239 4.753 0.486 1
1 1264 . 10 1 1 A 116 116 PHE C C 116 173.413 174.253 -0.840 1
1 1265 . 10 1 1 A 116 116 PHE CA C 116 57.708 57.730 -0.022 1
1 1266 . 10 1 1 A 116 116 PHE CB C 116 44.557 39.478 5.079 1
1 1267 . 10 1 1 A 116 116 PHE N N 116 120.567 119.531 1.036 1
1 1268 . 10 1 1 A 117 117 PHE H H 117 9.439 8.612 0.827 1
1 1269 . 10 1 1 A 117 117 PHE HA H 117 5.091 5.244 -0.153 1
1 1277 . 10 1 1 A 117 117 PHE C C 117 171.614 172.368 -0.754 1
1 1278 . 10 1 1 A 117 117 PHE CA C 117 55.311 55.112 0.199 1
1 1279 . 10 1 1 A 117 117 PHE CB C 117 41.887 41.736 0.151 1
1 1283 . 10 1 1 A 117 117 PHE N N 117 118.040 121.949 -3.909 1
1 1284 . 10 1 1 A 118 118 HIS H H 118 8.779 9.008 -0.229 1
1 1285 . 10 1 1 A 118 118 HIS HA H 118 4.836 4.999 -0.163 1
1 1289 . 10 1 1 A 118 118 HIS C C 118 174.879 173.430 1.449 1
1 1290 . 10 1 1 A 118 118 HIS CA C 118 55.322 54.783 0.539 1
1 1291 . 10 1 1 A 118 118 HIS CB C 118 30.950 32.756 -1.806 1
1 1293 . 10 1 1 A 118 118 HIS N N 118 121.208 119.906 1.302 1
1 1294 . 10 1 1 A 119 119 CYS H H 119 8.123 7.678 0.445 1
1 1295 . 10 1 1 A 119 119 CYS HA H 119 4.529 4.987 -0.458 1
1 1298 . 10 1 1 A 119 119 CYS C C 119 176.567 175.648 0.919 1
1 1299 . 10 1 1 A 119 119 CYS CA C 119 58.957 57.227 1.730 1
1 1300 . 10 1 1 A 119 119 CYS CB C 119 30.090 30.273 -0.183 1
1 1301 . 10 1 1 A 119 119 CYS N N 119 131.659 127.318 4.341 1
1 1302 . 10 1 1 A 120 120 LEU H H 120 8.970 8.414 0.556 1
1 1303 . 10 1 1 A 120 120 LEU N N 120 130.361 128.607 1.754 1
1 1304 . 10 1 1 A 121 121 LYS HA H 121 4.299 4.332 -0.033 1
1 1313 . 10 1 1 A 121 121 LYS CA C 121 58.727 55.955 2.772 1
1 1314 . 10 1 1 A 121 121 LYS CB C 121 33.210 33.283 -0.073 1
1 1318 . 10 1 1 A 123 123 ASN HA H 123 4.438 4.848 -0.410 1
1 1323 . 10 1 1 A 123 123 ASN C C 123 172.444 173.989 -1.545 1
1 1324 . 10 1 1 A 123 123 ASN CA C 123 53.448 52.887 0.561 1
1 1325 . 10 1 1 A 123 123 ASN CB C 123 37.130 36.791 0.339 1
1 1327 . 10 1 1 A 124 124 LEU H H 124 6.596 8.115 -1.519 1
1 1328 . 10 1 1 A 124 124 LEU HA H 124 4.576 4.586 -0.010 1
1 1338 . 10 1 1 A 124 124 LEU C C 124 175.903 174.572 1.331 1
1 1339 . 10 1 1 A 124 124 LEU CA C 124 54.043 54.169 -0.126 1
1 1340 . 10 1 1 A 124 124 LEU CB C 124 45.837 43.514 2.323 1
1 1344 . 10 1 1 A 124 124 LEU N N 124 115.443 116.934 -1.491 1
1 1345 . 10 1 1 A 125 125 CYS H H 125 6.342 8.430 -2.088 1
1 1346 . 10 1 1 A 125 125 CYS HA H 125 5.033 4.963 0.070 1
1 1349 . 10 1 1 A 125 125 CYS C C 125 175.101 173.749 1.352 1
1 1350 . 10 1 1 A 125 125 CYS CA C 125 62.046 57.116 4.930 1
1 1351 . 10 1 1 A 125 125 CYS CB C 125 30.840 28.242 2.598 1
1 1352 . 10 1 1 A 125 125 CYS N N 125 118.685 117.897 0.788 1
1 1353 . 10 1 1 A 126 126 LEU H H 126 8.894 8.018 0.876 1
1 1354 . 10 1 1 A 126 126 LEU HA H 126 4.565 4.754 -0.189 1
1 1364 . 10 1 1 A 126 126 LEU C C 126 174.879 176.006 -1.127 1
1 1365 . 10 1 1 A 126 126 LEU CA C 126 52.751 52.953 -0.202 1
1 1366 . 10 1 1 A 126 126 LEU CB C 126 46.090 44.377 1.713 1
1 1370 . 10 1 1 A 126 126 LEU N N 126 124.501 125.451 -0.950 1
1 1371 . 10 1 1 A 127 127 ALA H H 127 8.378 8.699 -0.321 1
1 1372 . 10 1 1 A 127 127 ALA HA H 127 3.957 4.760 -0.803 1
1 1376 . 10 1 1 A 127 127 ALA C C 127 179.085 178.337 0.748 1
1 1377 . 10 1 1 A 127 127 ALA CA C 127 52.554 51.912 0.642 1
1 1378 . 10 1 1 A 127 127 ALA CB C 127 18.527 20.202 -1.675 1
1 1379 . 10 1 1 A 127 127 ALA N N 127 123.011 124.561 -1.550 1
1 1380 . 10 1 1 A 128 128 MET H H 128 8.237 8.659 -0.422 1
1 1385 . 10 1 1 A 128 128 MET N N 128 120.642 120.942 -0.300 1
1 1386 . 10 1 1 A 129 129 ASN HA H 129 4.502 4.551 -0.049 1
1 1389 . 10 1 1 A 129 129 ASN C C 129 175.931 177.856 -1.925 1
1 1390 . 10 1 1 A 129 129 ASN CA C 129 55.064 55.753 -0.689 1
1 1391 . 10 1 1 A 129 129 ASN CB C 129 36.920 38.665 -1.745 1
1 1392 . 10 1 1 A 130 130 LEU H H 130 8.211 7.999 0.212 1
1 1393 . 10 1 1 A 130 130 LEU HA H 130 4.489 4.245 0.244 1
1 1403 . 10 1 1 A 130 130 LEU C C 130 178.836 177.437 1.399 1
1 1404 . 10 1 1 A 130 130 LEU CA C 130 54.653 56.870 -2.217 1
1 1405 . 10 1 1 A 130 130 LEU CB C 130 41.887 42.187 -0.300 1
1 1409 . 10 1 1 A 130 130 LEU N N 130 118.563 119.603 -1.040 1
1 1410 . 10 1 1 A 131 131 GLN H H 131 7.953 7.314 0.639 1
1 1411 . 10 1 1 A 131 131 GLN HA H 131 3.729 4.391 -0.662 1
1 1418 . 10 1 1 A 131 131 GLN CA C 131 59.310 58.207 1.103 1
1 1419 . 10 1 1 A 131 131 GLN CB C 131 28.340 28.747 -0.407 1
1 1421 . 10 1 1 A 131 131 GLN N N 131 123.929 119.232 4.697 1
1 1423 . 10 1 1 A 132 132 GLY HA2 H 132 4.034 3.950 0.084 1
1 1424 . 10 1 1 A 132 132 GLY HA3 H 132 3.865 3.982 -0.117 1
1 1425 . 10 1 1 A 132 132 GLY C C 132 174.547 174.377 0.170 1
1 1426 . 10 1 1 A 132 132 GLY CA C 132 45.902 45.456 0.446 1
1 1427 . 10 1 1 A 133 133 ARG H H 133 7.735 7.649 0.086 1
1 1428 . 10 1 1 A 133 133 ARG HA H 133 4.611 4.528 0.083 1
1 1435 . 10 1 1 A 133 133 ARG C C 133 175.461 175.751 -0.290 1
1 1436 . 10 1 1 A 133 133 ARG CA C 133 54.987 57.414 -2.427 1
1 1437 . 10 1 1 A 133 133 ARG CB C 133 31.470 32.507 -1.037 1
1 1440 . 10 1 1 A 133 133 ARG N N 133 118.194 121.058 -2.864 1
1 1441 . 10 1 1 A 134 134 HIS H H 134 7.803 7.935 -0.132 1
1 1444 . 10 1 1 A 134 134 HIS N N 134 118.700 114.836 3.864 1
1 1445 . 10 1 1 A 135 135 LYS HA H 135 4.331 4.193 0.138 1
1 1454 . 10 1 1 A 135 135 LYS C C 135 174.852 176.272 -1.420 1
1 1455 . 10 1 1 A 135 135 LYS CA C 135 55.390 57.105 -1.715 1
1 1456 . 10 1 1 A 135 135 LYS CB C 135 32.970 32.929 0.041 1
1 1460 . 10 1 1 A 136 136 CYS H H 136 7.801 8.513 -0.712 1
1 1461 . 10 1 1 A 136 136 CYS HA H 136 4.113 4.973 -0.860 1
1 1464 . 10 1 1 A 136 136 CYS C C 136 174.879 174.103 0.776 1
1 1465 . 10 1 1 A 136 136 CYS CA C 136 60.028 58.505 1.523 1
1 1466 . 10 1 1 A 136 136 CYS CB C 136 30.350 28.867 1.483 1
1 1467 . 10 1 1 A 136 136 CYS N N 136 126.055 122.922 3.133 1
1 10 . 11 1 1 A 2 2 ALA H H 2 8.220 7.527 0.693 1
1 11 . 11 1 1 A 2 2 ALA HA H 2 4.321 4.379 -0.058 1
1 15 . 11 1 1 A 2 2 ALA C C 2 177.564 177.161 0.403 1
1 16 . 11 1 1 A 2 2 ALA CA C 2 52.383 51.730 0.653 1
1 17 . 11 1 1 A 2 2 ALA CB C 2 19.290 20.913 -1.623 1
1 18 . 11 1 1 A 2 2 ALA N N 2 125.223 123.008 2.215 1
1 19 . 11 1 1 A 3 3 ALA H H 3 8.246 8.409 -0.163 1
1 20 . 11 1 1 A 3 3 ALA N N 3 123.250 121.541 1.709 1
1 21 . 11 1 1 A 5 5 ALA HA H 5 4.415 4.433 -0.018 1
1 25 . 11 1 1 A 5 5 ALA C C 5 177.481 175.836 1.645 1
1 26 . 11 1 1 A 5 5 ALA CA C 5 52.423 51.970 0.453 1
1 27 . 11 1 1 A 5 5 ALA CB C 5 19.420 19.628 -0.208 1
1 28 . 11 1 1 A 6 6 ARG H H 6 8.239 8.743 -0.504 1
1 29 . 11 1 1 A 6 6 ARG HA H 6 4.371 4.578 -0.207 1
1 36 . 11 1 1 A 6 6 ARG C C 6 176.180 175.045 1.135 1
1 37 . 11 1 1 A 6 6 ARG CA C 6 56.353 55.327 1.026 1
1 38 . 11 1 1 A 6 6 ARG CB C 6 31.170 30.359 0.811 1
1 41 . 11 1 1 A 6 6 ARG N N 6 120.436 123.693 -3.257 1
1 42 . 11 1 1 A 7 7 GLU H H 7 8.535 8.749 -0.214 1
1 43 . 11 1 1 A 7 7 GLU HA H 7 4.335 4.588 -0.253 1
1 48 . 11 1 1 A 7 7 GLU C C 7 176.346 175.416 0.930 1
1 49 . 11 1 1 A 7 7 GLU CA C 7 56.740 56.616 0.124 1
1 50 . 11 1 1 A 7 7 GLU CB C 7 30.390 31.146 -0.756 1
1 52 . 11 1 1 A 7 7 GLU N N 7 122.189 124.501 -2.312 1
1 53 . 11 1 1 A 8 8 ASP H H 8 8.347 8.780 -0.433 1
1 54 . 11 1 1 A 8 8 ASP N N 8 121.112 121.907 -0.795 1
1 55 . 11 1 1 A 9 9 GLY HA2 H 9 3.975 4.280 -0.305 1
1 56 . 11 1 1 A 9 9 GLY HA3 H 9 3.975 4.281 -0.306 1
1 57 . 11 1 1 A 9 9 GLY C C 9 174.243 173.532 0.711 1
1 58 . 11 1 1 A 9 9 GLY CA C 9 45.933 45.794 0.139 1
1 59 . 11 1 1 A 10 10 ALA H H 10 8.111 7.593 0.518 1
1 60 . 11 1 1 A 10 10 ALA N N 10 123.721 123.164 0.557 1
1 61 . 11 1 1 A 12 12 GLY HA2 H 12 3.992 4.249 -0.257 1
1 62 . 11 1 1 A 12 12 GLY HA3 H 12 3.992 4.249 -0.257 1
1 63 . 11 1 1 A 12 12 GLY C C 12 173.883 172.006 1.877 1
1 64 . 11 1 1 A 12 12 GLY CA C 12 45.381 45.362 0.019 1
1 65 . 11 1 1 A 13 13 GLU H H 13 8.224 9.033 -0.809 1
1 66 . 11 1 1 A 13 13 GLU HA H 13 4.367 5.126 -0.759 1
1 71 . 11 1 1 A 13 13 GLU C C 13 176.125 173.908 2.217 1
1 72 . 11 1 1 A 13 13 GLU CA C 13 56.349 54.700 1.649 1
1 73 . 11 1 1 A 13 13 GLU CB C 13 29.560 34.230 -4.670 1
1 75 . 11 1 1 A 13 13 GLU N N 13 120.148 122.013 -1.865 1
1 76 . 11 1 1 A 14 14 GLU H H 14 8.508 8.493 0.015 1
1 77 . 11 1 1 A 14 14 GLU HA H 14 4.302 4.993 -0.691 1
1 82 . 11 1 1 A 14 14 GLU C C 14 176.623 174.787 1.836 1
1 83 . 11 1 1 A 14 14 GLU CA C 14 56.497 55.211 1.286 1
1 84 . 11 1 1 A 14 14 GLU CB C 14 30.110 33.354 -3.244 1
1 86 . 11 1 1 A 14 14 GLU N N 14 122.160 120.607 1.553 1
1 87 . 11 1 1 A 15 15 ARG H H 15 8.356 8.577 -0.221 1
1 88 . 11 1 1 A 15 15 ARG HA H 15 4.366 5.016 -0.650 1
1 95 . 11 1 1 A 15 15 ARG C C 15 176.844 175.661 1.183 1
1 96 . 11 1 1 A 15 15 ARG CA C 15 56.010 54.046 1.964 1
1 97 . 11 1 1 A 15 15 ARG CB C 15 30.890 33.450 -2.560 1
1 100 . 11 1 1 A 15 15 ARG N N 15 121.945 123.636 -1.691 1
1 101 . 11 1 1 A 16 16 GLY H H 16 8.414 8.383 0.031 1
1 102 . 11 1 1 A 16 16 GLY HA2 H 16 4.022 4.155 -0.133 1
1 103 . 11 1 1 A 16 16 GLY HA3 H 16 4.022 4.157 -0.135 1
1 104 . 11 1 1 A 16 16 GLY C C 16 174.326 173.685 0.641 1
1 105 . 11 1 1 A 16 16 GLY CA C 16 45.620 44.977 0.643 1
1 106 . 11 1 1 A 16 16 GLY N N 16 109.734 109.063 0.671 1
1 107 . 11 1 1 A 17 17 GLN H H 17 8.184 8.499 -0.315 1
1 108 . 11 1 1 A 17 17 GLN HA H 17 4.366 4.347 0.019 1
1 113 . 11 1 1 A 17 17 GLN C C 17 175.544 175.331 0.213 1
1 114 . 11 1 1 A 17 17 GLN CA C 17 55.749 55.931 -0.182 1
1 115 . 11 1 1 A 17 17 GLN CB C 17 29.367 29.727 -0.360 1
1 117 . 11 1 1 A 17 17 GLN N N 17 119.546 123.042 -3.496 1
1 118 . 11 1 1 A 18 18 ARG H H 18 8.366 8.654 -0.288 1
1 119 . 11 1 1 A 18 18 ARG HA H 18 4.487 5.047 -0.560 1
1 126 . 11 1 1 A 18 18 ARG C C 18 176.042 174.864 1.178 1
1 127 . 11 1 1 A 18 18 ARG CA C 18 55.735 54.480 1.255 1
1 128 . 11 1 1 A 18 18 ARG CB C 18 31.170 32.591 -1.421 1
1 131 . 11 1 1 A 18 18 ARG N N 18 122.330 122.987 -0.657 1
1 132 . 11 1 1 A 19 19 GLY H H 19 8.192 8.384 -0.192 1
1 133 . 11 1 1 A 19 19 GLY HA2 H 19 4.852 4.148 0.704 1
1 134 . 11 1 1 A 19 19 GLY HA3 H 19 3.894 4.163 -0.269 1
1 135 . 11 1 1 A 19 19 GLY C C 19 172.361 171.288 1.073 1
1 136 . 11 1 1 A 19 19 GLY CA C 19 45.580 44.255 1.325 1
1 137 . 11 1 1 A 19 19 GLY N N 19 109.658 107.550 2.108 1
1 138 . 11 1 1 A 20 20 CYS H H 20 8.843 8.279 0.564 1
1 139 . 11 1 1 A 20 20 CYS HA H 20 5.147 5.066 0.081 1
1 142 . 11 1 1 A 20 20 CYS C C 20 175.211 174.503 0.708 1
1 143 . 11 1 1 A 20 20 CYS CA C 20 56.712 58.094 -1.382 1
1 144 . 11 1 1 A 20 20 CYS CB C 20 33.530 31.009 2.521 1
1 145 . 11 1 1 A 20 20 CYS N N 20 120.185 118.647 1.538 1
1 146 . 11 1 1 A 21 21 GLU H H 21 8.981 8.957 0.024 1
1 147 . 11 1 1 A 21 21 GLU HA H 21 4.100 4.012 0.088 1
1 152 . 11 1 1 A 21 21 GLU C C 21 176.014 176.821 -0.807 1
1 153 . 11 1 1 A 21 21 GLU CA C 21 57.134 58.567 -1.433 1
1 154 . 11 1 1 A 21 21 GLU CB C 21 28.890 28.851 0.039 1
1 156 . 11 1 1 A 21 21 GLU N N 21 116.078 124.172 -8.094 1
1 157 . 11 1 1 A 22 22 HIS H H 22 9.342 7.678 1.664 1
1 158 . 11 1 1 A 22 22 HIS HA H 22 4.210 4.341 -0.131 1
1 161 . 11 1 1 A 22 22 HIS C C 22 175.128 174.676 0.452 1
1 162 . 11 1 1 A 22 22 HIS CA C 22 58.945 57.329 1.616 1
1 163 . 11 1 1 A 22 22 HIS CB C 22 33.160 31.392 1.768 1
1 164 . 11 1 1 A 22 22 HIS N N 22 122.296 117.105 5.191 1
1 165 . 11 1 1 A 23 23 TYR H H 23 7.931 7.859 0.072 1
1 166 . 11 1 1 A 23 23 TYR HA H 23 4.856 5.156 -0.300 1
1 171 . 11 1 1 A 23 23 TYR C C 23 173.108 174.633 -1.525 1
1 172 . 11 1 1 A 23 23 TYR CA C 23 57.852 56.191 1.661 1
1 173 . 11 1 1 A 23 23 TYR CB C 23 45.300 41.919 3.381 1
1 175 . 11 1 1 A 23 23 TYR N N 23 115.205 115.694 -0.489 1
1 176 . 11 1 1 A 24 24 ASP H H 24 8.384 8.675 -0.291 1
1 177 . 11 1 1 A 24 24 ASP HA H 24 5.160 5.117 0.043 1
1 180 . 11 1 1 A 24 24 ASP C C 24 174.437 175.509 -1.072 1
1 181 . 11 1 1 A 24 24 ASP CA C 24 53.343 54.084 -0.741 1
1 182 . 11 1 1 A 24 24 ASP CB C 24 41.470 41.000 0.470 1
1 183 . 11 1 1 A 24 24 ASP N N 24 122.016 124.605 -2.589 1
1 184 . 11 1 1 A 25 25 ARG H H 25 7.313 8.627 -1.314 1
1 185 . 11 1 1 A 25 25 ARG HA H 25 5.331 5.350 -0.019 1
1 192 . 11 1 1 A 25 25 ARG C C 25 175.045 175.908 -0.863 1
1 193 . 11 1 1 A 25 25 ARG CA C 25 54.224 54.711 -0.487 1
1 194 . 11 1 1 A 25 25 ARG CB C 25 34.090 33.971 0.119 1
1 197 . 11 1 1 A 25 25 ARG N N 25 115.898 122.173 -6.275 1
1 198 . 11 1 1 A 26 26 GLY H H 26 9.387 8.733 0.654 1
1 199 . 11 1 1 A 26 26 GLY HA2 H 26 4.622 3.915 0.707 1
1 200 . 11 1 1 A 26 26 GLY HA3 H 26 3.788 4.029 -0.241 1
1 201 . 11 1 1 A 26 26 GLY C C 26 170.978 174.453 -3.475 1
1 202 . 11 1 1 A 26 26 GLY CA C 26 44.794 45.577 -0.783 1
1 203 . 11 1 1 A 26 26 GLY N N 26 105.653 107.907 -2.254 1
1 204 . 11 1 1 A 27 27 CYS H H 27 6.864 7.683 -0.819 1
1 205 . 11 1 1 A 27 27 CYS HA H 27 5.195 5.262 -0.067 1
1 208 . 11 1 1 A 27 27 CYS C C 27 171.144 172.177 -1.033 1
1 209 . 11 1 1 A 27 27 CYS CA C 27 52.349 56.710 -4.361 1
1 210 . 11 1 1 A 27 27 CYS CB C 27 30.997 31.253 -0.256 1
1 211 . 11 1 1 A 27 27 CYS N N 27 110.921 117.344 -6.423 1
1 212 . 11 1 1 A 28 28 LEU H H 28 8.310 8.699 -0.389 1
1 213 . 11 1 1 A 28 28 LEU HA H 28 4.651 4.945 -0.294 1
1 223 . 11 1 1 A 28 28 LEU C C 28 176.827 176.393 0.434 1
1 224 . 11 1 1 A 28 28 LEU CA C 28 53.054 53.220 -0.166 1
1 225 . 11 1 1 A 28 28 LEU CB C 28 44.200 45.126 -0.926 1
1 229 . 11 1 1 A 28 28 LEU N N 28 115.519 120.731 -5.212 1
1 230 . 11 1 1 A 29 29 LEU H H 29 8.800 8.757 0.043 1
1 231 . 11 1 1 A 29 29 LEU HA H 29 4.313 4.258 0.055 1
1 240 . 11 1 1 A 29 29 LEU C C 29 175.571 176.573 -1.002 1
1 241 . 11 1 1 A 29 29 LEU CA C 29 54.388 55.025 -0.637 1
1 242 . 11 1 1 A 29 29 LEU CB C 29 42.780 41.048 1.732 1
1 245 . 11 1 1 A 29 29 LEU N N 29 118.712 125.830 -7.118 1
1 246 . 11 1 1 A 30 30 LYS H H 30 8.009 8.427 -0.418 1
1 247 . 11 1 1 A 30 30 LYS HA H 30 4.592 4.626 -0.034 1
1 256 . 11 1 1 A 30 30 LYS C C 30 174.990 175.057 -0.067 1
1 257 . 11 1 1 A 30 30 LYS CA C 30 54.999 56.447 -1.448 1
1 258 . 11 1 1 A 30 30 LYS CB C 30 32.330 32.715 -0.385 1
1 262 . 11 1 1 A 30 30 LYS N N 30 122.310 126.219 -3.909 1
1 263 . 11 1 1 A 31 31 ALA H H 31 9.238 8.661 0.577 1
1 264 . 11 1 1 A 31 31 ALA HA H 31 4.477 4.465 0.012 1
1 268 . 11 1 1 A 31 31 ALA CA C 31 50.190 49.505 0.685 1
1 269 . 11 1 1 A 31 31 ALA CB C 31 21.637 20.038 1.599 1
1 270 . 11 1 1 A 31 31 ALA N N 31 133.864 130.210 3.654 1
1 271 . 11 1 1 A 32 32 PRO HA H 32 4.637 4.443 0.194 1
1 278 . 11 1 1 A 32 32 PRO C C 32 175.737 177.256 -1.519 1
1 279 . 11 1 1 A 32 32 PRO CA C 32 64.259 64.191 0.068 1
1 280 . 11 1 1 A 32 32 PRO CB C 32 31.740 31.788 -0.048 1
1 283 . 11 1 1 A 33 33 CYS H H 33 8.779 8.335 0.444 1
1 284 . 11 1 1 A 33 33 CYS HA H 33 4.321 4.247 0.074 1
1 287 . 11 1 1 A 33 33 CYS C C 33 176.733 175.235 1.498 1
1 288 . 11 1 1 A 33 33 CYS CA C 33 54.398 61.238 -6.840 1
1 289 . 11 1 1 A 33 33 CYS CB C 33 30.697 27.350 3.347 1
1 290 . 11 1 1 A 33 33 CYS N N 33 120.005 116.036 3.969 1
1 291 . 11 1 1 A 34 34 CYS H H 34 7.424 7.512 -0.088 1
1 292 . 11 1 1 A 34 34 CYS HA H 34 4.896 4.678 0.218 1
1 295 . 11 1 1 A 34 34 CYS C C 34 174.935 174.956 -0.021 1
1 296 . 11 1 1 A 34 34 CYS CA C 34 56.962 58.490 -1.528 1
1 297 . 11 1 1 A 34 34 CYS CB C 34 31.067 29.399 1.668 1
1 298 . 11 1 1 A 34 34 CYS N N 34 115.034 117.358 -2.324 1
1 299 . 11 1 1 A 35 35 ASP H H 35 8.368 8.206 0.162 1
1 300 . 11 1 1 A 35 35 ASP HA H 35 4.454 4.239 0.215 1
1 303 . 11 1 1 A 35 35 ASP C C 35 174.354 174.814 -0.460 1
1 304 . 11 1 1 A 35 35 ASP CA C 35 56.222 55.527 0.695 1
1 305 . 11 1 1 A 35 35 ASP CB C 35 39.730 39.372 0.358 1
1 306 . 11 1 1 A 35 35 ASP N N 35 121.381 117.007 4.374 1
1 307 . 11 1 1 A 36 36 LYS H H 36 7.227 7.403 -0.176 1
1 308 . 11 1 1 A 36 36 LYS HA H 36 4.451 4.708 -0.257 1
1 317 . 11 1 1 A 36 36 LYS C C 36 175.433 175.735 -0.302 1
1 318 . 11 1 1 A 36 36 LYS CA C 36 56.270 54.796 1.474 1
1 319 . 11 1 1 A 36 36 LYS CB C 36 36.620 34.570 2.050 1
1 323 . 11 1 1 A 36 36 LYS N N 36 117.673 118.087 -0.414 1
1 324 . 11 1 1 A 37 37 LEU H H 37 8.053 8.547 -0.494 1
1 325 . 11 1 1 A 37 37 LEU HA H 37 5.292 4.853 0.439 1
1 335 . 11 1 1 A 37 37 LEU C C 37 176.484 175.210 1.274 1
1 336 . 11 1 1 A 37 37 LEU CA C 37 53.348 53.078 0.270 1
1 337 . 11 1 1 A 37 37 LEU CB C 37 42.400 42.724 -0.324 1
1 341 . 11 1 1 A 37 37 LEU N N 37 120.994 123.067 -2.073 1
1 342 . 11 1 1 A 38 38 TYR H H 38 8.741 8.615 0.126 1
1 343 . 11 1 1 A 38 38 TYR HA H 38 5.002 4.882 0.120 1
1 350 . 11 1 1 A 38 38 TYR C C 38 176.374 175.936 0.438 1
1 351 . 11 1 1 A 38 38 TYR CA C 38 57.081 56.934 0.147 1
1 352 . 11 1 1 A 38 38 TYR CB C 38 45.647 42.102 3.545 1
1 355 . 11 1 1 A 38 38 TYR N N 38 121.128 122.131 -1.003 1
1 356 . 11 1 1 A 39 39 THR H H 39 9.402 8.646 0.756 1
1 357 . 11 1 1 A 39 39 THR HA H 39 4.098 4.147 -0.049 1
1 362 . 11 1 1 A 39 39 THR C C 39 173.496 174.934 -1.438 1
1 363 . 11 1 1 A 39 39 THR CA C 39 67.062 65.704 1.358 1
1 364 . 11 1 1 A 39 39 THR CB C 39 68.047 68.519 -0.472 1
1 366 . 11 1 1 A 39 39 THR N N 39 116.641 117.050 -0.409 1
1 367 . 11 1 1 A 40 40 CYS H H 40 7.317 7.916 -0.599 1
1 368 . 11 1 1 A 40 40 CYS HA H 40 4.771 4.925 -0.154 1
1 371 . 11 1 1 A 40 40 CYS C C 40 175.128 175.148 -0.020 1
1 372 . 11 1 1 A 40 40 CYS CA C 40 56.577 58.062 -1.485 1
1 373 . 11 1 1 A 40 40 CYS CB C 40 35.087 31.481 3.606 1
1 374 . 11 1 1 A 40 40 CYS N N 40 109.059 118.184 -9.125 1
1 375 . 11 1 1 A 41 41 ARG H H 41 9.201 8.991 0.210 1
1 376 . 11 1 1 A 41 41 ARG HA H 41 3.982 3.960 0.022 1
1 383 . 11 1 1 A 41 41 ARG C C 41 175.101 178.287 -3.186 1
1 384 . 11 1 1 A 41 41 ARG CA C 41 58.591 58.952 -0.361 1
1 385 . 11 1 1 A 41 41 ARG CB C 41 29.640 29.970 -0.330 1
1 388 . 11 1 1 A 41 41 ARG N N 41 121.737 124.020 -2.283 1
1 389 . 11 1 1 A 42 42 LEU H H 42 9.116 7.869 1.247 1
1 390 . 11 1 1 A 42 42 LEU HA H 42 4.029 3.987 0.042 1
1 400 . 11 1 1 A 42 42 LEU C C 42 179.943 179.134 0.809 1
1 401 . 11 1 1 A 42 42 LEU CA C 42 58.005 57.663 0.342 1
1 402 . 11 1 1 A 42 42 LEU CB C 42 38.960 41.090 -2.130 1
1 406 . 11 1 1 A 42 42 LEU N N 42 126.364 116.385 9.979 1
1 407 . 11 1 1 A 43 43 CYS H H 43 8.785 8.153 0.632 1
1 408 . 11 1 1 A 43 43 CYS HA H 43 4.187 4.158 0.029 1
1 411 . 11 1 1 A 43 43 CYS C C 43 177.785 177.141 0.644 1
1 412 . 11 1 1 A 43 43 CYS CA C 43 66.415 62.882 3.533 1
1 413 . 11 1 1 A 43 43 CYS CB C 43 28.870 27.360 1.510 1
1 414 . 11 1 1 A 43 43 CYS N N 43 124.519 118.100 6.419 1
1 415 . 11 1 1 A 44 44 HIS H H 44 7.604 7.367 0.237 1
1 416 . 11 1 1 A 44 44 HIS HA H 44 1.983 2.740 -0.757 1
1 420 . 11 1 1 A 44 44 HIS C C 44 176.429 176.366 0.063 1
1 421 . 11 1 1 A 44 44 HIS CA C 44 58.760 58.699 0.061 1
1 422 . 11 1 1 A 44 44 HIS CB C 44 27.990 29.366 -1.376 1
1 423 . 11 1 1 A 44 44 HIS N N 44 117.024 120.991 -3.967 1
1 424 . 11 1 1 A 45 45 ASP H H 45 8.750 8.213 0.537 1
1 425 . 11 1 1 A 45 45 ASP HA H 45 4.116 4.048 0.068 1
1 428 . 11 1 1 A 45 45 ASP C C 45 177.453 178.674 -1.221 1
1 429 . 11 1 1 A 45 45 ASP CA C 45 56.840 57.082 -0.242 1
1 430 . 11 1 1 A 45 45 ASP CB C 45 38.960 40.185 -1.225 1
1 431 . 11 1 1 A 45 45 ASP N N 45 120.440 119.035 1.405 1
1 432 . 11 1 1 A 46 46 ASN H H 46 7.888 8.053 -0.165 1
1 433 . 11 1 1 A 46 46 ASN HA H 46 4.612 4.406 0.206 1
1 438 . 11 1 1 A 46 46 ASN C C 46 175.903 176.829 -0.926 1
1 439 . 11 1 1 A 46 46 ASN CA C 46 54.342 57.033 -2.691 1
1 440 . 11 1 1 A 46 46 ASN CB C 46 38.790 39.712 -0.922 1
1 441 . 11 1 1 A 46 46 ASN N N 46 115.758 117.401 -1.643 1
1 443 . 11 1 1 A 47 47 ASN H H 47 7.384 7.625 -0.241 1
1 444 . 11 1 1 A 47 47 ASN HA H 47 4.893 4.819 0.074 1
1 449 . 11 1 1 A 47 47 ASN C C 47 173.579 175.135 -1.556 1
1 450 . 11 1 1 A 47 47 ASN CA C 47 53.937 53.770 0.167 1
1 451 . 11 1 1 A 47 47 ASN CB C 47 43.130 39.208 3.922 1
1 452 . 11 1 1 A 47 47 ASN N N 47 116.576 114.573 2.003 1
1 454 . 11 1 1 A 48 48 GLU H H 48 7.143 7.458 -0.315 1
1 455 . 11 1 1 A 48 48 GLU HA H 48 4.572 4.491 0.081 1
1 460 . 11 1 1 A 48 48 GLU C C 48 175.627 176.134 -0.507 1
1 461 . 11 1 1 A 48 48 GLU CA C 48 53.727 54.578 -0.851 1
1 462 . 11 1 1 A 48 48 GLU CB C 48 32.480 31.555 0.925 1
1 464 . 11 1 1 A 48 48 GLU N N 48 116.967 117.656 -0.689 1
1 465 . 11 1 1 A 49 49 ASP H H 49 8.748 8.852 -0.104 1
1 466 . 11 1 1 A 49 49 ASP HA H 49 4.576 4.484 0.092 1
1 469 . 11 1 1 A 49 49 ASP C C 49 174.796 176.037 -1.241 1
1 470 . 11 1 1 A 49 49 ASP CA C 49 53.027 56.089 -3.062 1
1 471 . 11 1 1 A 49 49 ASP CB C 49 40.340 41.496 -1.156 1
1 472 . 11 1 1 A 49 49 ASP N N 49 119.296 122.790 -3.494 1
1 473 . 11 1 1 A 50 50 HIS H H 50 6.919 7.384 -0.465 1
1 474 . 11 1 1 A 50 50 HIS HA H 50 4.880 5.182 -0.302 1
1 477 . 11 1 1 A 50 50 HIS C C 50 172.942 173.756 -0.814 1
1 478 . 11 1 1 A 50 50 HIS CA C 50 53.978 53.185 0.793 1
1 479 . 11 1 1 A 50 50 HIS CB C 50 30.330 33.043 -2.713 1
1 480 . 11 1 1 A 50 50 HIS N N 50 113.709 113.281 0.428 1
1 481 . 11 1 1 A 51 51 GLN H H 51 8.646 8.836 -0.190 1
1 482 . 11 1 1 A 51 51 GLN HA H 51 4.896 5.246 -0.350 1
1 487 . 11 1 1 A 51 51 GLN C C 51 176.512 174.522 1.990 1
1 488 . 11 1 1 A 51 51 GLN CA C 51 54.872 54.607 0.265 1
1 489 . 11 1 1 A 51 51 GLN CB C 51 30.950 31.163 -0.213 1
1 491 . 11 1 1 A 51 51 GLN N N 51 119.379 117.035 2.344 1
1 492 . 11 1 1 A 52 52 LEU H H 52 9.646 8.450 1.196 1
1 493 . 11 1 1 A 52 52 LEU HA H 52 4.206 4.596 -0.390 1
1 503 . 11 1 1 A 52 52 LEU C C 52 175.793 174.806 0.987 1
1 504 . 11 1 1 A 52 52 LEU CA C 52 55.450 54.136 1.314 1
1 505 . 11 1 1 A 52 52 LEU CB C 52 41.407 43.483 -2.076 1
1 509 . 11 1 1 A 52 52 LEU N N 52 128.069 124.968 3.101 1
1 510 . 11 1 1 A 53 53 ASP H H 53 9.281 8.378 0.903 1
1 511 . 11 1 1 A 53 53 ASP HA H 53 4.725 5.078 -0.353 1
1 514 . 11 1 1 A 53 53 ASP C C 53 176.401 177.062 -0.661 1
1 515 . 11 1 1 A 53 53 ASP CA C 53 52.590 52.524 0.066 1
1 516 . 11 1 1 A 53 53 ASP CB C 53 39.990 43.086 -3.096 1
1 517 . 11 1 1 A 53 53 ASP N N 53 128.783 126.606 2.177 1
1 518 . 11 1 1 A 54 54 ARG H H 54 8.496 8.766 -0.270 1
1 519 . 11 1 1 A 54 54 ARG HA H 54 3.859 3.889 -0.030 1
1 526 . 11 1 1 A 54 54 ARG C C 54 176.346 176.647 -0.301 1
1 527 . 11 1 1 A 54 54 ARG CA C 54 57.357 58.255 -0.898 1
1 528 . 11 1 1 A 54 54 ARG CB C 54 28.890 29.589 -0.699 1
1 531 . 11 1 1 A 54 54 ARG N N 54 125.813 124.737 1.076 1
1 532 . 11 1 1 A 55 55 PHE H H 55 8.005 7.643 0.362 1
1 533 . 11 1 1 A 55 55 PHE HA H 55 4.712 4.412 0.300 1
1 540 . 11 1 1 A 55 55 PHE C C 55 177.481 177.250 0.231 1
1 541 . 11 1 1 A 55 55 PHE CA C 55 59.080 59.786 -0.706 1
1 542 . 11 1 1 A 55 55 PHE CB C 55 37.447 39.138 -1.691 1
1 545 . 11 1 1 A 55 55 PHE N N 55 120.168 117.580 2.588 1
1 546 . 11 1 1 A 56 56 LYS H H 56 7.681 7.390 0.291 1
1 547 . 11 1 1 A 56 56 LYS HA H 56 4.411 4.373 0.038 1
1 556 . 11 1 1 A 56 56 LYS C C 56 175.959 176.373 -0.414 1
1 557 . 11 1 1 A 56 56 LYS CA C 56 55.459 57.473 -2.014 1
1 558 . 11 1 1 A 56 56 LYS CB C 56 33.590 33.652 -0.062 1
1 562 . 11 1 1 A 56 56 LYS N N 56 116.937 116.663 0.274 1
1 563 . 11 1 1 A 57 57 VAL H H 57 6.553 6.723 -0.170 1
1 564 . 11 1 1 A 57 57 VAL HA H 57 3.408 3.910 -0.502 1
1 572 . 11 1 1 A 57 57 VAL C C 57 173.911 175.088 -1.177 1
1 573 . 11 1 1 A 57 57 VAL CA C 57 65.025 61.869 3.156 1
1 574 . 11 1 1 A 57 57 VAL CB C 57 32.663 32.343 0.320 1
1 577 . 11 1 1 A 57 57 VAL N N 57 119.519 117.378 2.141 1
1 578 . 11 1 1 A 58 58 LYS H H 58 9.182 8.969 0.213 1
1 579 . 11 1 1 A 58 58 LYS HA H 58 4.489 4.598 -0.109 1
1 588 . 11 1 1 A 58 58 LYS C C 58 176.927 176.075 0.852 1
1 589 . 11 1 1 A 58 58 LYS CA C 58 55.913 57.450 -1.537 1
1 590 . 11 1 1 A 58 58 LYS CB C 58 36.340 35.786 0.554 1
1 594 . 11 1 1 A 58 58 LYS N N 58 124.985 124.944 0.041 1
1 595 . 11 1 1 A 59 59 GLU H H 59 8.799 7.924 0.875 1
1 596 . 11 1 1 A 59 59 GLU HA H 59 5.209 4.877 0.332 1
1 601 . 11 1 1 A 59 59 GLU C C 59 173.911 175.500 -1.589 1
1 602 . 11 1 1 A 59 59 GLU CA C 59 54.670 55.043 -0.373 1
1 603 . 11 1 1 A 59 59 GLU CB C 59 35.180 31.709 3.471 1
1 605 . 11 1 1 A 59 59 GLU N N 59 121.493 118.390 3.103 1
1 606 . 11 1 1 A 60 60 VAL H H 60 8.917 8.786 0.131 1
1 607 . 11 1 1 A 60 60 VAL HA H 60 4.983 5.203 -0.220 1
1 615 . 11 1 1 A 60 60 VAL C C 60 173.441 173.669 -0.228 1
1 616 . 11 1 1 A 60 60 VAL CA C 60 57.497 58.898 -1.401 1
1 617 . 11 1 1 A 60 60 VAL CB C 60 35.460 36.284 -0.824 1
1 620 . 11 1 1 A 60 60 VAL N N 60 109.266 117.234 -7.968 1
1 621 . 11 1 1 A 61 61 GLN H H 61 8.970 8.445 0.525 1
1 622 . 11 1 1 A 61 61 GLN HA H 61 5.024 5.187 -0.163 1
1 629 . 11 1 1 A 61 61 GLN C C 61 175.045 173.617 1.428 1
1 630 . 11 1 1 A 61 61 GLN CA C 61 53.128 53.442 -0.314 1
1 631 . 11 1 1 A 61 61 GLN CB C 61 33.980 32.552 1.428 1
1 633 . 11 1 1 A 61 61 GLN N N 61 118.525 118.042 0.483 1
1 635 . 11 1 1 A 62 62 CYS H H 62 7.688 8.484 -0.796 1
1 636 . 11 1 1 A 62 62 CYS HA H 62 4.210 4.727 -0.517 1
1 639 . 11 1 1 A 62 62 CYS C C 62 177.951 176.035 1.916 1
1 640 . 11 1 1 A 62 62 CYS CA C 62 59.845 57.535 2.310 1
1 641 . 11 1 1 A 62 62 CYS CB C 62 33.120 29.716 3.404 1
1 642 . 11 1 1 A 62 62 CYS N N 62 128.772 120.200 8.572 1
1 643 . 11 1 1 A 63 63 ILE H H 63 8.192 8.686 -0.494 1
1 644 . 11 1 1 A 63 63 ILE HA H 63 3.984 3.932 0.052 1
1 654 . 11 1 1 A 63 63 ILE C C 63 175.433 178.014 -2.581 1
1 655 . 11 1 1 A 63 63 ILE CA C 63 63.657 64.026 -0.369 1
1 656 . 11 1 1 A 63 63 ILE CB C 63 38.506 37.439 1.067 1
1 660 . 11 1 1 A 63 63 ILE N N 63 127.455 127.780 -0.325 1
1 661 . 11 1 1 A 64 64 ASN H H 64 9.181 9.093 0.088 1
1 662 . 11 1 1 A 64 64 ASN HA H 64 4.810 4.518 0.292 1
1 667 . 11 1 1 A 64 64 ASN C C 64 175.931 175.975 -0.044 1
1 668 . 11 1 1 A 64 64 ASN CA C 64 55.617 55.891 -0.274 1
1 669 . 11 1 1 A 64 64 ASN CB C 64 40.640 38.258 2.382 1
1 670 . 11 1 1 A 64 64 ASN N N 64 122.104 119.492 2.612 1
1 672 . 11 1 1 A 65 65 CYS H H 65 9.065 7.903 1.162 1
1 673 . 11 1 1 A 65 65 CYS HA H 65 4.979 4.608 0.371 1
1 676 . 11 1 1 A 65 65 CYS C C 65 176.291 174.749 1.542 1
1 677 . 11 1 1 A 65 65 CYS CA C 65 59.027 57.981 1.046 1
1 678 . 11 1 1 A 65 65 CYS CB C 65 32.030 28.678 3.352 1
1 679 . 11 1 1 A 65 65 CYS N N 65 120.368 115.465 4.903 1
1 680 . 11 1 1 A 66 66 GLU H H 66 7.281 8.131 -0.850 1
1 681 . 11 1 1 A 66 66 GLU HA H 66 4.046 3.973 0.073 1
1 686 . 11 1 1 A 66 66 GLU C C 66 175.211 175.864 -0.653 1
1 687 . 11 1 1 A 66 66 GLU CA C 66 58.591 57.960 0.631 1
1 688 . 11 1 1 A 66 66 GLU CB C 66 27.067 27.608 -0.541 1
1 690 . 11 1 1 A 66 66 GLU N N 66 115.012 115.350 -0.338 1
1 691 . 11 1 1 A 67 67 LYS H H 67 8.481 7.900 0.581 1
1 692 . 11 1 1 A 67 67 LYS HA H 67 4.326 4.288 0.038 1
1 701 . 11 1 1 A 67 67 LYS C C 67 177.923 175.675 2.248 1
1 702 . 11 1 1 A 67 67 LYS CA C 67 57.628 56.802 0.826 1
1 703 . 11 1 1 A 67 67 LYS CB C 67 33.617 33.171 0.446 1
1 707 . 11 1 1 A 67 67 LYS N N 67 123.514 119.346 4.168 1
1 708 . 11 1 1 A 68 68 ILE H H 68 8.867 8.212 0.655 1
1 709 . 11 1 1 A 68 68 ILE HA H 68 4.976 4.543 0.433 1
1 719 . 11 1 1 A 68 68 ILE C C 68 175.018 175.046 -0.028 1
1 720 . 11 1 1 A 68 68 ILE CA C 68 60.919 60.542 0.377 1
1 721 . 11 1 1 A 68 68 ILE CB C 68 37.090 38.016 -0.926 1
1 725 . 11 1 1 A 68 68 ILE N N 68 133.478 123.806 9.672 1
1 726 . 11 1 1 A 69 69 GLN H H 69 9.269 8.554 0.715 1
1 727 . 11 1 1 A 69 69 GLN HA H 69 5.036 5.017 0.019 1
1 732 . 11 1 1 A 69 69 GLN C C 69 173.607 174.517 -0.910 1
1 733 . 11 1 1 A 69 69 GLN CA C 69 53.419 54.210 -0.791 1
1 734 . 11 1 1 A 69 69 GLN CB C 69 34.997 32.097 2.900 1
1 736 . 11 1 1 A 69 69 GLN N N 69 125.104 123.962 1.142 1
1 737 . 11 1 1 A 70 70 HIS H H 70 8.829 8.789 0.040 1
1 738 . 11 1 1 A 70 70 HIS HA H 70 4.865 4.820 0.045 1
1 741 . 11 1 1 A 70 70 HIS C C 70 174.852 174.980 -0.128 1
1 742 . 11 1 1 A 70 70 HIS CA C 70 56.304 55.697 0.607 1
1 743 . 11 1 1 A 70 70 HIS CB C 70 30.050 31.397 -1.347 1
1 744 . 11 1 1 A 70 70 HIS N N 70 118.576 118.800 -0.224 1
1 745 . 11 1 1 A 71 71 ALA H H 71 7.768 8.341 -0.573 1
1 746 . 11 1 1 A 71 71 ALA HA H 71 3.977 4.434 -0.457 1
1 750 . 11 1 1 A 71 71 ALA C C 71 175.433 177.196 -1.763 1
1 751 . 11 1 1 A 71 71 ALA CA C 71 54.393 52.193 2.200 1
1 752 . 11 1 1 A 71 71 ALA CB C 71 18.000 18.784 -0.784 1
1 753 . 11 1 1 A 71 71 ALA N N 71 121.438 122.765 -1.327 1
1 754 . 11 1 1 A 72 72 GLN H H 72 7.227 8.086 -0.859 1
1 755 . 11 1 1 A 72 72 GLN HA H 72 4.371 4.595 -0.224 1
1 762 . 11 1 1 A 72 72 GLN C C 72 173.053 175.749 -2.696 1
1 763 . 11 1 1 A 72 72 GLN CA C 72 54.290 53.460 0.830 1
1 764 . 11 1 1 A 72 72 GLN CB C 72 28.623 30.743 -2.120 1
1 766 . 11 1 1 A 72 72 GLN N N 72 115.858 124.361 -8.503 1
1 768 . 11 1 1 A 73 73 GLN H H 73 8.481 8.516 -0.035 1
1 769 . 11 1 1 A 73 73 GLN HA H 73 3.570 4.155 -0.585 1
1 776 . 11 1 1 A 73 73 GLN C C 73 174.243 175.066 -0.823 1
1 777 . 11 1 1 A 73 73 GLN CA C 73 60.206 56.967 3.239 1
1 778 . 11 1 1 A 73 73 GLN CB C 73 28.850 29.941 -1.091 1
1 780 . 11 1 1 A 73 73 GLN N N 73 116.433 118.587 -2.154 1
1 782 . 11 1 1 A 74 74 THR H H 74 7.211 7.536 -0.325 1
1 783 . 11 1 1 A 74 74 THR HA H 74 4.160 4.544 -0.384 1
1 788 . 11 1 1 A 74 74 THR C C 74 171.836 172.925 -1.089 1
1 789 . 11 1 1 A 74 74 THR CA C 74 59.072 60.660 -1.588 1
1 790 . 11 1 1 A 74 74 THR CB C 74 71.560 71.678 -0.118 1
1 792 . 11 1 1 A 74 74 THR N N 74 108.717 110.869 -2.152 1
1 793 . 11 1 1 A 75 75 CYS H H 75 7.676 8.198 -0.522 1
1 794 . 11 1 1 A 75 75 CYS HA H 75 4.158 4.252 -0.094 1
1 797 . 11 1 1 A 75 75 CYS C C 75 178.781 176.822 1.959 1
1 798 . 11 1 1 A 75 75 CYS CA C 75 58.661 59.161 -0.500 1
1 799 . 11 1 1 A 75 75 CYS CB C 75 30.840 28.565 2.275 1
1 800 . 11 1 1 A 75 75 CYS N N 75 123.108 125.049 -1.941 1
1 801 . 11 1 1 A 76 76 GLU H H 76 9.203 8.784 0.419 1
1 802 . 11 1 1 A 76 76 GLU HA H 76 4.187 4.077 0.110 1
1 807 . 11 1 1 A 76 76 GLU C C 76 175.488 176.720 -1.232 1
1 808 . 11 1 1 A 76 76 GLU CA C 76 57.306 57.856 -0.550 1
1 809 . 11 1 1 A 76 76 GLU CB C 76 29.347 28.221 1.126 1
1 811 . 11 1 1 A 76 76 GLU N N 76 129.817 125.961 3.856 1
1 812 . 11 1 1 A 77 77 GLU H H 77 9.496 8.305 1.191 1
1 813 . 11 1 1 A 77 77 GLU HA H 77 4.599 4.566 0.033 1
1 818 . 11 1 1 A 77 77 GLU C C 77 177.148 177.243 -0.095 1
1 819 . 11 1 1 A 77 77 GLU CA C 77 57.554 56.515 1.039 1
1 820 . 11 1 1 A 77 77 GLU CB C 77 31.980 31.436 0.544 1
1 822 . 11 1 1 A 77 77 GLU N N 77 124.795 119.336 5.459 1
1 823 . 11 1 1 A 78 78 CYS H H 78 8.967 7.488 1.479 1
1 824 . 11 1 1 A 78 78 CYS HA H 78 5.073 4.591 0.482 1
1 827 . 11 1 1 A 78 78 CYS C C 78 176.374 175.221 1.153 1
1 828 . 11 1 1 A 78 78 CYS CA C 78 58.537 58.436 0.101 1
1 829 . 11 1 1 A 78 78 CYS CB C 78 31.597 29.319 2.278 1
1 830 . 11 1 1 A 78 78 CYS N N 78 119.692 116.770 2.922 1
1 831 . 11 1 1 A 79 79 SER H H 79 7.474 8.117 -0.643 1
1 832 . 11 1 1 A 79 79 SER HA H 79 4.113 4.047 0.066 1
1 835 . 11 1 1 A 79 79 SER C C 79 172.915 173.460 -0.545 1
1 836 . 11 1 1 A 79 79 SER CA C 79 60.440 59.538 0.902 1
1 837 . 11 1 1 A 79 79 SER CB C 79 61.421 61.170 0.251 1
1 838 . 11 1 1 A 79 79 SER N N 79 113.385 112.915 0.470 1
1 839 . 11 1 1 A 80 80 THR H H 80 7.907 7.716 0.191 1
1 840 . 11 1 1 A 80 80 THR HA H 80 3.913 4.134 -0.221 1
1 845 . 11 1 1 A 80 80 THR C C 80 172.306 173.795 -1.489 1
1 846 . 11 1 1 A 80 80 THR CA C 80 65.262 63.157 2.105 1
1 847 . 11 1 1 A 80 80 THR CB C 80 69.910 69.064 0.846 1
1 849 . 11 1 1 A 80 80 THR N N 80 120.005 115.856 4.149 1
1 850 . 11 1 1 A 81 81 LEU H H 81 8.556 8.477 0.079 1
1 851 . 11 1 1 A 81 81 LEU HA H 81 4.172 4.323 -0.151 1
1 861 . 11 1 1 A 81 81 LEU C C 81 177.121 176.609 0.512 1
1 862 . 11 1 1 A 81 81 LEU CA C 81 54.996 54.867 0.129 1
1 863 . 11 1 1 A 81 81 LEU CB C 81 42.147 42.538 -0.391 1
1 867 . 11 1 1 A 81 81 LEU N N 81 128.272 127.701 0.571 1
1 868 . 11 1 1 A 82 82 PHE H H 82 9.251 8.974 0.277 1
1 869 . 11 1 1 A 82 82 PHE HA H 82 4.576 4.420 0.156 1
1 874 . 11 1 1 A 82 82 PHE C C 82 177.785 176.263 1.522 1
1 875 . 11 1 1 A 82 82 PHE CA C 82 56.470 60.200 -3.730 1
1 876 . 11 1 1 A 82 82 PHE CB C 82 38.210 38.832 -0.622 1
1 878 . 11 1 1 A 82 82 PHE N N 82 129.268 126.274 2.994 1
1 879 . 11 1 1 A 83 83 GLY H H 83 7.047 7.527 -0.480 1
1 880 . 11 1 1 A 83 83 GLY HA2 H 83 4.783 4.201 0.582 1
1 881 . 11 1 1 A 83 83 GLY HA3 H 83 3.876 4.268 -0.392 1
1 882 . 11 1 1 A 83 83 GLY C C 83 171.642 174.913 -3.271 1
1 883 . 11 1 1 A 83 83 GLY CA C 83 45.826 46.023 -0.197 1
1 884 . 11 1 1 A 83 83 GLY N N 83 102.168 103.966 -1.798 1
1 885 . 11 1 1 A 84 84 GLU H H 84 8.444 8.814 -0.370 1
1 886 . 11 1 1 A 84 84 GLU HA H 84 4.111 4.123 -0.012 1
1 891 . 11 1 1 A 84 84 GLU C C 84 177.259 176.278 0.981 1
1 892 . 11 1 1 A 84 84 GLU CA C 84 59.438 58.868 0.570 1
1 893 . 11 1 1 A 84 84 GLU CB C 84 30.670 30.055 0.615 1
1 895 . 11 1 1 A 84 84 GLU N N 84 127.546 121.700 5.846 1
1 896 . 11 1 1 A 85 85 TYR H H 85 9.344 8.163 1.181 1
1 897 . 11 1 1 A 85 85 TYR HA H 85 4.599 4.990 -0.391 1
1 902 . 11 1 1 A 85 85 TYR C C 85 173.302 173.229 0.073 1
1 903 . 11 1 1 A 85 85 TYR CA C 85 57.261 55.850 1.411 1
1 904 . 11 1 1 A 85 85 TYR CB C 85 40.850 40.971 -0.121 1
1 906 . 11 1 1 A 85 85 TYR N N 85 118.936 120.732 -1.796 1
1 907 . 11 1 1 A 86 86 TYR H H 86 7.323 8.843 -1.520 1
1 908 . 11 1 1 A 86 86 TYR HA H 86 5.298 5.360 -0.062 1
1 911 . 11 1 1 A 86 86 TYR C C 86 172.804 174.655 -1.851 1
1 912 . 11 1 1 A 86 86 TYR CA C 86 54.041 57.023 -2.982 1
1 913 . 11 1 1 A 86 86 TYR CB C 86 40.987 41.381 -0.394 1
1 914 . 11 1 1 A 86 86 TYR N N 86 124.965 129.751 -4.786 1
1 915 . 11 1 1 A 87 87 CYS H H 87 7.046 8.394 -1.348 1
1 916 . 11 1 1 A 87 87 CYS HA H 87 3.842 4.404 -0.562 1
1 919 . 11 1 1 A 87 87 CYS C C 87 174.243 173.844 0.399 1
1 920 . 11 1 1 A 87 87 CYS CA C 87 56.377 58.375 -1.998 1
1 921 . 11 1 1 A 87 87 CYS CB C 87 33.230 30.052 3.178 1
1 922 . 11 1 1 A 87 87 CYS N N 87 128.735 125.589 3.146 1
1 923 . 11 1 1 A 88 88 ASP H H 88 8.002 8.708 -0.706 1
1 924 . 11 1 1 A 88 88 ASP HA H 88 3.761 4.195 -0.434 1
1 927 . 11 1 1 A 88 88 ASP C C 88 173.579 177.890 -4.311 1
1 928 . 11 1 1 A 88 88 ASP CA C 88 53.958 56.218 -2.260 1
1 929 . 11 1 1 A 88 88 ASP CB C 88 41.240 39.983 1.257 1
1 930 . 11 1 1 A 88 88 ASP N N 88 127.013 126.423 0.590 1
1 931 . 11 1 1 A 89 89 ILE H H 89 7.972 7.622 0.350 1
1 932 . 11 1 1 A 89 89 ILE HA H 89 3.660 3.501 0.159 1
1 942 . 11 1 1 A 89 89 ILE C C 89 177.259 177.110 0.149 1
1 943 . 11 1 1 A 89 89 ILE CA C 89 63.107 65.151 -2.044 1
1 944 . 11 1 1 A 89 89 ILE CB C 89 39.430 38.198 1.232 1
1 948 . 11 1 1 A 89 89 ILE N N 89 120.357 120.680 -0.323 1
1 949 . 11 1 1 A 90 90 CYS H H 90 8.554 7.573 0.981 1
1 950 . 11 1 1 A 90 90 CYS HA H 90 3.677 4.015 -0.338 1
1 953 . 11 1 1 A 90 90 CYS C C 90 175.128 174.169 0.959 1
1 954 . 11 1 1 A 90 90 CYS CA C 90 60.791 59.003 1.788 1
1 955 . 11 1 1 A 90 90 CYS CB C 90 30.427 28.029 2.398 1
1 956 . 11 1 1 A 90 90 CYS N N 90 119.564 116.877 2.687 1
1 957 . 11 1 1 A 91 91 HIS H H 91 7.364 7.648 -0.284 1
1 958 . 11 1 1 A 91 91 HIS HA H 91 3.512 3.762 -0.250 1
1 963 . 11 1 1 A 91 91 HIS C C 91 170.590 172.937 -2.347 1
1 964 . 11 1 1 A 91 91 HIS CA C 91 58.739 56.487 2.252 1
1 965 . 11 1 1 A 91 91 HIS CB C 91 24.810 26.356 -1.546 1
1 968 . 11 1 1 A 91 91 HIS N N 91 111.440 115.921 -4.481 1
1 969 . 11 1 1 A 92 92 LEU H H 92 6.214 7.474 -1.260 1
1 970 . 11 1 1 A 92 92 LEU HA H 92 4.191 3.920 0.271 1
1 980 . 11 1 1 A 92 92 LEU C C 92 173.911 175.533 -1.622 1
1 981 . 11 1 1 A 92 92 LEU CA C 92 53.717 53.280 0.437 1
1 982 . 11 1 1 A 92 92 LEU CB C 92 45.360 42.440 2.920 1
1 986 . 11 1 1 A 92 92 LEU N N 92 115.684 117.581 -1.897 1
1 987 . 11 1 1 A 93 93 PHE H H 93 6.669 8.714 -2.045 1
1 988 . 11 1 1 A 93 93 PHE HA H 93 5.622 5.268 0.354 1
1 995 . 11 1 1 A 93 93 PHE C C 93 175.765 174.454 1.311 1
1 996 . 11 1 1 A 93 93 PHE CA C 93 55.387 56.478 -1.091 1
1 997 . 11 1 1 A 93 93 PHE CB C 93 42.700 41.604 1.096 1
1 1000 . 11 1 1 A 93 93 PHE N N 93 121.535 121.257 0.278 1
1 1001 . 11 1 1 A 94 94 ASP H H 94 9.209 8.581 0.628 1
1 1002 . 11 1 1 A 94 94 ASP HA H 94 5.819 5.399 0.420 1
1 1005 . 11 1 1 A 94 94 ASP C C 94 175.654 175.172 0.482 1
1 1006 . 11 1 1 A 94 94 ASP CA C 94 53.330 53.143 0.187 1
1 1007 . 11 1 1 A 94 94 ASP CB C 94 44.720 44.921 -0.201 1
1 1008 . 11 1 1 A 94 94 ASP N N 94 123.504 121.589 1.915 1
1 1009 . 11 1 1 A 95 95 LYS H H 95 9.043 8.632 0.411 1
1 1010 . 11 1 1 A 95 95 LYS HA H 95 4.527 4.320 0.207 1
1 1019 . 11 1 1 A 95 95 LYS C C 95 174.879 176.343 -1.464 1
1 1020 . 11 1 1 A 95 95 LYS CA C 95 56.620 57.294 -0.674 1
1 1021 . 11 1 1 A 95 95 LYS CB C 95 33.720 33.152 0.568 1
1 1025 . 11 1 1 A 95 95 LYS N N 95 120.380 121.874 -1.494 1
1 1026 . 11 1 1 A 96 96 ASP H H 96 8.999 8.626 0.373 1
1 1027 . 11 1 1 A 96 96 ASP HA H 96 4.724 4.807 -0.083 1
1 1030 . 11 1 1 A 96 96 ASP C C 96 176.401 175.248 1.153 1
1 1031 . 11 1 1 A 96 96 ASP CA C 96 56.147 53.479 2.668 1
1 1032 . 11 1 1 A 96 96 ASP CB C 96 40.790 41.221 -0.431 1
1 1033 . 11 1 1 A 96 96 ASP N N 96 120.784 123.109 -2.325 1
1 1034 . 11 1 1 A 97 97 LYS H H 97 9.382 8.515 0.867 1
1 1035 . 11 1 1 A 97 97 LYS HA H 97 4.473 4.638 -0.165 1
1 1044 . 11 1 1 A 97 97 LYS C C 97 175.903 176.022 -0.119 1
1 1045 . 11 1 1 A 97 97 LYS CA C 97 54.771 55.307 -0.536 1
1 1046 . 11 1 1 A 97 97 LYS CB C 97 33.270 33.153 0.117 1
1 1050 . 11 1 1 A 97 97 LYS N N 97 131.617 126.473 5.144 1
1 1051 . 11 1 1 A 98 98 LYS H H 98 8.940 8.089 0.851 1
1 1052 . 11 1 1 A 98 98 LYS HA H 98 4.118 3.842 0.276 1
1 1061 . 11 1 1 A 98 98 LYS C C 98 177.065 175.346 1.719 1
1 1062 . 11 1 1 A 98 98 LYS CA C 98 56.297 57.891 -1.594 1
1 1063 . 11 1 1 A 98 98 LYS CB C 98 28.467 30.000 -1.533 1
1 1067 . 11 1 1 A 98 98 LYS N N 98 115.034 114.388 0.646 1
1 1068 . 11 1 1 A 99 99 GLN H H 99 9.266 7.858 1.408 1
1 1069 . 11 1 1 A 99 99 GLN HA H 99 4.460 4.357 0.103 1
1 1074 . 11 1 1 A 99 99 GLN C C 99 174.990 175.064 -0.074 1
1 1075 . 11 1 1 A 99 99 GLN CA C 99 57.563 55.679 1.884 1
1 1076 . 11 1 1 A 99 99 GLN CB C 99 27.280 29.431 -2.151 1
1 1078 . 11 1 1 A 99 99 GLN N N 99 117.717 118.693 -0.976 1
1 1079 . 11 1 1 A 100 100 TYR H H 100 8.402 8.770 -0.368 1
1 1080 . 11 1 1 A 100 100 TYR HA H 100 4.935 5.514 -0.579 1
1 1087 . 11 1 1 A 100 100 TYR C C 100 171.504 172.721 -1.217 1
1 1088 . 11 1 1 A 100 100 TYR CA C 100 55.786 55.715 0.071 1
1 1089 . 11 1 1 A 100 100 TYR CB C 100 41.090 41.889 -0.799 1
1 1092 . 11 1 1 A 100 100 TYR N N 100 115.081 116.767 -1.686 1
1 1093 . 11 1 1 A 101 101 HIS H H 101 8.829 8.960 -0.131 1
1 1094 . 11 1 1 A 101 101 HIS HA H 101 4.525 4.766 -0.241 1
1 1099 . 11 1 1 A 101 101 HIS C C 101 174.935 173.847 1.088 1
1 1100 . 11 1 1 A 101 101 HIS CA C 101 56.327 55.541 0.786 1
1 1101 . 11 1 1 A 101 101 HIS CB C 101 31.020 30.980 0.040 1
1 1104 . 11 1 1 A 101 101 HIS N N 101 120.894 122.313 -1.419 1
1 1105 . 11 1 1 A 102 102 CYS H H 102 7.427 8.275 -0.848 1
1 1106 . 11 1 1 A 102 102 CYS HA H 102 4.561 4.481 0.080 1
1 1109 . 11 1 1 A 102 102 CYS C C 102 175.765 174.282 1.483 1
1 1110 . 11 1 1 A 102 102 CYS CA C 102 57.707 58.289 -0.582 1
1 1111 . 11 1 1 A 102 102 CYS CB C 102 29.130 28.101 1.029 1
1 1112 . 11 1 1 A 102 102 CYS N N 102 131.256 125.943 5.313 1
1 1113 . 11 1 1 A 103 103 GLU H H 103 9.497 8.972 0.525 1
1 1114 . 11 1 1 A 103 103 GLU HA H 103 4.003 4.084 -0.081 1
1 1119 . 11 1 1 A 103 103 GLU C C 103 176.540 178.857 -2.317 1
1 1120 . 11 1 1 A 103 103 GLU CA C 103 58.796 59.425 -0.629 1
1 1121 . 11 1 1 A 103 103 GLU CB C 103 29.280 29.756 -0.476 1
1 1123 . 11 1 1 A 103 103 GLU N N 103 129.829 124.516 5.313 1
1 1124 . 11 1 1 A 104 104 ASN H H 104 7.832 8.152 -0.320 1
1 1125 . 11 1 1 A 104 104 ASN HA H 104 4.457 4.377 0.080 1
1 1130 . 11 1 1 A 104 104 ASN C C 104 176.401 177.300 -0.899 1
1 1131 . 11 1 1 A 104 104 ASN CA C 104 56.053 56.519 -0.466 1
1 1132 . 11 1 1 A 104 104 ASN CB C 104 38.400 38.766 -0.366 1
1 1133 . 11 1 1 A 104 104 ASN N N 104 117.703 117.915 -0.212 1
1 1135 . 11 1 1 A 105 105 CYS H H 105 9.415 7.611 1.804 1
1 1136 . 11 1 1 A 105 105 CYS HA H 105 4.137 4.431 -0.294 1
1 1139 . 11 1 1 A 105 105 CYS C C 105 176.844 175.210 1.634 1
1 1140 . 11 1 1 A 105 105 CYS CA C 105 64.328 59.149 5.179 1
1 1141 . 11 1 1 A 105 105 CYS CB C 105 30.350 27.745 2.605 1
1 1142 . 11 1 1 A 105 105 CYS N N 105 124.939 115.464 9.475 1
1 1143 . 11 1 1 A 106 106 GLY H H 106 8.145 8.840 -0.695 1
1 1144 . 11 1 1 A 106 106 GLY HA2 H 106 3.980 3.915 0.065 1
1 1145 . 11 1 1 A 106 106 GLY HA3 H 106 3.502 3.924 -0.422 1
1 1146 . 11 1 1 A 106 106 GLY C C 106 172.500 173.507 -1.007 1
1 1147 . 11 1 1 A 106 106 GLY CA C 106 44.968 45.594 -0.626 1
1 1148 . 11 1 1 A 106 106 GLY N N 106 106.090 109.554 -3.464 1
1 1149 . 11 1 1 A 107 107 ILE H H 107 6.465 7.233 -0.768 1
1 1150 . 11 1 1 A 107 107 ILE HA H 107 4.878 5.179 -0.301 1
1 1160 . 11 1 1 A 107 107 ILE C C 107 174.824 174.288 0.536 1
1 1161 . 11 1 1 A 107 107 ILE CA C 107 58.226 58.578 -0.352 1
1 1162 . 11 1 1 A 107 107 ILE CB C 107 44.460 42.374 2.086 1
1 1166 . 11 1 1 A 107 107 ILE N N 107 107.914 114.250 -6.336 1
1 1167 . 11 1 1 A 108 108 CYS H H 108 7.041 9.128 -2.087 1
1 1168 . 11 1 1 A 108 108 CYS HA H 108 5.018 5.502 -0.484 1
1 1171 . 11 1 1 A 108 108 CYS C C 108 175.461 172.852 2.609 1
1 1172 . 11 1 1 A 108 108 CYS CA C 108 62.097 56.806 5.291 1
1 1173 . 11 1 1 A 108 108 CYS CB C 108 31.353 31.076 0.277 1
1 1174 . 11 1 1 A 108 108 CYS N N 108 122.441 121.186 1.255 1
1 1175 . 11 1 1 A 109 109 ARG H H 109 8.561 8.400 0.161 1
1 1176 . 11 1 1 A 109 109 ARG HA H 109 4.239 4.695 -0.456 1
1 1183 . 11 1 1 A 109 109 ARG C C 109 174.271 174.072 0.199 1
1 1184 . 11 1 1 A 109 109 ARG CA C 109 52.962 54.753 -1.791 1
1 1185 . 11 1 1 A 109 109 ARG CB C 109 33.903 34.174 -0.271 1
1 1188 . 11 1 1 A 109 109 ARG N N 109 121.163 121.144 0.019 1
1 1189 . 11 1 1 A 110 110 ILE H H 110 7.847 8.281 -0.434 1
1 1190 . 11 1 1 A 110 110 ILE HA H 110 3.531 3.946 -0.415 1
1 1200 . 11 1 1 A 110 110 ILE C C 110 175.405 175.900 -0.495 1
1 1201 . 11 1 1 A 110 110 ILE CA C 110 62.201 61.861 0.340 1
1 1202 . 11 1 1 A 110 110 ILE CB C 110 36.860 36.565 0.295 1
1 1206 . 11 1 1 A 110 110 ILE N N 110 118.955 125.054 -6.099 1
1 1207 . 11 1 1 A 111 111 GLY H H 111 6.928 8.111 -1.183 1
1 1208 . 11 1 1 A 111 111 GLY HA2 H 111 4.564 3.396 1.168 1
1 1209 . 11 1 1 A 111 111 GLY HA3 H 111 4.135 3.891 0.244 1
1 1210 . 11 1 1 A 111 111 GLY CA C 111 43.068 45.223 -2.155 1
1 1211 . 11 1 1 A 111 111 GLY N N 111 113.782 113.908 -0.126 1
1 1212 . 11 1 1 A 112 112 PRO HA H 112 4.990 4.611 0.379 1
1 1219 . 11 1 1 A 112 112 PRO C C 112 177.342 177.511 -0.169 1
1 1220 . 11 1 1 A 112 112 PRO CA C 112 62.920 62.780 0.140 1
1 1221 . 11 1 1 A 112 112 PRO CB C 112 34.807 31.687 3.120 1
1 1224 . 11 1 1 A 113 113 LYS H H 113 8.989 8.442 0.547 1
1 1225 . 11 1 1 A 113 113 LYS HA H 113 3.144 3.277 -0.133 1
1 1234 . 11 1 1 A 113 113 LYS C C 113 177.536 178.062 -0.526 1
1 1235 . 11 1 1 A 113 113 LYS CA C 113 59.883 58.782 1.101 1
1 1236 . 11 1 1 A 113 113 LYS CB C 113 32.260 31.442 0.818 1
1 1240 . 11 1 1 A 113 113 LYS N N 113 123.545 123.798 -0.253 1
1 1241 . 11 1 1 A 114 114 GLU H H 114 9.080 9.129 -0.049 1
1 1242 . 11 1 1 A 114 114 GLU HA H 114 4.199 3.986 0.213 1
1 1247 . 11 1 1 A 114 114 GLU C C 114 176.374 177.934 -1.560 1
1 1248 . 11 1 1 A 114 114 GLU CA C 114 58.733 59.304 -0.571 1
1 1249 . 11 1 1 A 114 114 GLU CB C 114 28.077 29.011 -0.934 1
1 1251 . 11 1 1 A 114 114 GLU N N 114 114.832 120.053 -5.221 1
1 1252 . 11 1 1 A 115 115 ASP H H 115 7.799 8.016 -0.217 1
1 1253 . 11 1 1 A 115 115 ASP HA H 115 4.642 4.723 -0.081 1
1 1256 . 11 1 1 A 115 115 ASP C C 115 176.374 176.430 -0.056 1
1 1257 . 11 1 1 A 115 115 ASP CA C 115 54.470 55.028 -0.558 1
1 1258 . 11 1 1 A 115 115 ASP CB C 115 40.850 42.243 -1.393 1
1 1259 . 11 1 1 A 115 115 ASP N N 115 118.858 118.749 0.109 1
1 1260 . 11 1 1 A 116 116 PHE H H 116 8.063 8.026 0.037 1
1 1261 . 11 1 1 A 116 116 PHE HA H 116 5.239 5.332 -0.093 1
1 1264 . 11 1 1 A 116 116 PHE C C 116 173.413 174.798 -1.385 1
1 1265 . 11 1 1 A 116 116 PHE CA C 116 57.708 56.444 1.264 1
1 1266 . 11 1 1 A 116 116 PHE CB C 116 44.557 41.871 2.686 1
1 1267 . 11 1 1 A 116 116 PHE N N 116 120.567 119.474 1.093 1
1 1268 . 11 1 1 A 117 117 PHE H H 117 9.439 8.833 0.606 1
1 1269 . 11 1 1 A 117 117 PHE HA H 117 5.091 5.243 -0.152 1
1 1277 . 11 1 1 A 117 117 PHE C C 117 171.614 172.456 -0.842 1
1 1278 . 11 1 1 A 117 117 PHE CA C 117 55.311 55.464 -0.153 1
1 1279 . 11 1 1 A 117 117 PHE CB C 117 41.887 41.616 0.271 1
1 1283 . 11 1 1 A 117 117 PHE N N 117 118.040 119.805 -1.765 1
1 1284 . 11 1 1 A 118 118 HIS H H 118 8.779 8.234 0.545 1
1 1285 . 11 1 1 A 118 118 HIS HA H 118 4.836 5.693 -0.857 1
1 1289 . 11 1 1 A 118 118 HIS C C 118 174.879 173.880 0.999 1
1 1290 . 11 1 1 A 118 118 HIS CA C 118 55.322 53.256 2.066 1
1 1291 . 11 1 1 A 118 118 HIS CB C 118 30.950 33.117 -2.167 1
1 1293 . 11 1 1 A 118 118 HIS N N 118 121.208 115.240 5.968 1
1 1294 . 11 1 1 A 119 119 CYS H H 119 8.123 8.667 -0.544 1
1 1295 . 11 1 1 A 119 119 CYS HA H 119 4.529 4.615 -0.086 1
1 1298 . 11 1 1 A 119 119 CYS C C 119 176.567 175.376 1.191 1
1 1299 . 11 1 1 A 119 119 CYS CA C 119 58.957 59.495 -0.538 1
1 1300 . 11 1 1 A 119 119 CYS CB C 119 30.090 27.909 2.181 1
1 1301 . 11 1 1 A 119 119 CYS N N 119 131.659 120.765 10.894 1
1 1302 . 11 1 1 A 120 120 LEU H H 120 8.970 8.839 0.131 1
1 1303 . 11 1 1 A 120 120 LEU N N 120 130.361 127.665 2.696 1
1 1304 . 11 1 1 A 121 121 LYS HA H 121 4.299 4.430 -0.131 1
1 1313 . 11 1 1 A 121 121 LYS CA C 121 58.727 57.977 0.750 1
1 1314 . 11 1 1 A 121 121 LYS CB C 121 33.210 33.384 -0.174 1
1 1318 . 11 1 1 A 123 123 ASN HA H 123 4.438 4.759 -0.321 1
1 1323 . 11 1 1 A 123 123 ASN C C 123 172.444 174.330 -1.886 1
1 1324 . 11 1 1 A 123 123 ASN CA C 123 53.448 54.021 -0.573 1
1 1325 . 11 1 1 A 123 123 ASN CB C 123 37.130 38.856 -1.726 1
1 1327 . 11 1 1 A 124 124 LEU H H 124 6.596 8.369 -1.773 1
1 1328 . 11 1 1 A 124 124 LEU HA H 124 4.576 4.672 -0.096 1
1 1338 . 11 1 1 A 124 124 LEU C C 124 175.903 173.947 1.956 1
1 1339 . 11 1 1 A 124 124 LEU CA C 124 54.043 54.029 0.014 1
1 1340 . 11 1 1 A 124 124 LEU CB C 124 45.837 45.129 0.708 1
1 1344 . 11 1 1 A 124 124 LEU N N 124 115.443 124.748 -9.305 1
1 1345 . 11 1 1 A 125 125 CYS H H 125 6.342 8.687 -2.345 1
1 1346 . 11 1 1 A 125 125 CYS HA H 125 5.033 5.227 -0.194 1
1 1349 . 11 1 1 A 125 125 CYS C C 125 175.101 173.956 1.145 1
1 1350 . 11 1 1 A 125 125 CYS CA C 125 62.046 57.289 4.757 1
1 1351 . 11 1 1 A 125 125 CYS CB C 125 30.840 29.355 1.485 1
1 1352 . 11 1 1 A 125 125 CYS N N 125 118.685 124.631 -5.946 1
1 1353 . 11 1 1 A 126 126 LEU H H 126 8.894 7.991 0.903 1
1 1354 . 11 1 1 A 126 126 LEU HA H 126 4.565 4.455 0.110 1
1 1364 . 11 1 1 A 126 126 LEU C C 126 174.879 175.404 -0.525 1
1 1365 . 11 1 1 A 126 126 LEU CA C 126 52.751 52.695 0.056 1
1 1366 . 11 1 1 A 126 126 LEU CB C 126 46.090 43.409 2.681 1
1 1370 . 11 1 1 A 126 126 LEU N N 126 124.501 127.034 -2.533 1
1 1371 . 11 1 1 A 127 127 ALA H H 127 8.378 8.404 -0.026 1
1 1372 . 11 1 1 A 127 127 ALA HA H 127 3.957 4.688 -0.731 1
1 1376 . 11 1 1 A 127 127 ALA C C 127 179.085 178.345 0.740 1
1 1377 . 11 1 1 A 127 127 ALA CA C 127 52.554 51.141 1.413 1
1 1378 . 11 1 1 A 127 127 ALA CB C 127 18.527 20.578 -2.051 1
1 1379 . 11 1 1 A 127 127 ALA N N 127 123.011 122.760 0.251 1
1 1380 . 11 1 1 A 128 128 MET H H 128 8.237 8.887 -0.650 1
1 1385 . 11 1 1 A 128 128 MET N N 128 120.642 119.628 1.014 1
1 1386 . 11 1 1 A 129 129 ASN HA H 129 4.502 4.625 -0.123 1
1 1389 . 11 1 1 A 129 129 ASN C C 129 175.931 177.201 -1.270 1
1 1390 . 11 1 1 A 129 129 ASN CA C 129 55.064 55.936 -0.872 1
1 1391 . 11 1 1 A 129 129 ASN CB C 129 36.920 38.296 -1.376 1
1 1392 . 11 1 1 A 130 130 LEU H H 130 8.211 7.823 0.388 1
1 1393 . 11 1 1 A 130 130 LEU HA H 130 4.489 4.137 0.352 1
1 1403 . 11 1 1 A 130 130 LEU C C 130 178.836 177.259 1.577 1
1 1404 . 11 1 1 A 130 130 LEU CA C 130 54.653 56.637 -1.984 1
1 1405 . 11 1 1 A 130 130 LEU CB C 130 41.887 41.911 -0.024 1
1 1409 . 11 1 1 A 130 130 LEU N N 130 118.563 120.378 -1.815 1
1 1410 . 11 1 1 A 131 131 GLN H H 131 7.953 7.067 0.886 1
1 1411 . 11 1 1 A 131 131 GLN HA H 131 3.729 4.186 -0.457 1
1 1418 . 11 1 1 A 131 131 GLN CA C 131 59.310 58.119 1.191 1
1 1419 . 11 1 1 A 131 131 GLN CB C 131 28.340 28.639 -0.299 1
1 1421 . 11 1 1 A 131 131 GLN N N 131 123.929 119.197 4.732 1
1 1423 . 11 1 1 A 132 132 GLY HA2 H 132 4.034 4.029 0.005 1
1 1424 . 11 1 1 A 132 132 GLY HA3 H 132 3.865 4.032 -0.167 1
1 1425 . 11 1 1 A 132 132 GLY C C 132 174.547 175.106 -0.559 1
1 1426 . 11 1 1 A 132 132 GLY CA C 132 45.902 45.292 0.610 1
1 1427 . 11 1 1 A 133 133 ARG H H 133 7.735 8.169 -0.434 1
1 1428 . 11 1 1 A 133 133 ARG HA H 133 4.611 4.416 0.195 1
1 1435 . 11 1 1 A 133 133 ARG C C 133 175.461 176.138 -0.677 1
1 1436 . 11 1 1 A 133 133 ARG CA C 133 54.987 56.161 -1.174 1
1 1437 . 11 1 1 A 133 133 ARG CB C 133 31.470 31.594 -0.124 1
1 1440 . 11 1 1 A 133 133 ARG N N 133 118.194 118.320 -0.126 1
1 1441 . 11 1 1 A 134 134 HIS H H 134 7.803 8.126 -0.323 1
1 1444 . 11 1 1 A 134 134 HIS N N 134 118.700 117.969 0.731 1
1 1445 . 11 1 1 A 135 135 LYS HA H 135 4.331 4.217 0.114 1
1 1454 . 11 1 1 A 135 135 LYS C C 135 174.852 176.670 -1.818 1
1 1455 . 11 1 1 A 135 135 LYS CA C 135 55.390 56.123 -0.733 1
1 1456 . 11 1 1 A 135 135 LYS CB C 135 32.970 31.478 1.492 1
1 1460 . 11 1 1 A 136 136 CYS H H 136 7.801 7.989 -0.188 1
1 1461 . 11 1 1 A 136 136 CYS HA H 136 4.113 4.305 -0.192 1
1 1464 . 11 1 1 A 136 136 CYS C C 136 174.879 176.102 -1.223 1
1 1465 . 11 1 1 A 136 136 CYS CA C 136 60.028 61.580 -1.552 1
1 1466 . 11 1 1 A 136 136 CYS CB C 136 30.350 26.677 3.673 1
1 1467 . 11 1 1 A 136 136 CYS N N 136 126.055 120.973 5.082 1
1 10 . 12 1 1 A 2 2 ALA H H 2 8.220 8.597 -0.377 1
1 11 . 12 1 1 A 2 2 ALA HA H 2 4.321 4.775 -0.454 1
1 15 . 12 1 1 A 2 2 ALA C C 2 177.564 175.603 1.961 1
1 16 . 12 1 1 A 2 2 ALA CA C 2 52.383 51.355 1.028 1
1 17 . 12 1 1 A 2 2 ALA CB C 2 19.290 19.509 -0.219 1
1 18 . 12 1 1 A 2 2 ALA N N 2 125.223 122.911 2.312 1
1 19 . 12 1 1 A 3 3 ALA H H 3 8.246 8.791 -0.545 1
1 20 . 12 1 1 A 3 3 ALA N N 3 123.250 126.090 -2.840 1
1 21 . 12 1 1 A 5 5 ALA HA H 5 4.415 4.467 -0.052 1
1 25 . 12 1 1 A 5 5 ALA C C 5 177.481 176.633 0.848 1
1 26 . 12 1 1 A 5 5 ALA CA C 5 52.423 51.788 0.635 1
1 27 . 12 1 1 A 5 5 ALA CB C 5 19.420 19.100 0.320 1
1 28 . 12 1 1 A 6 6 ARG H H 6 8.239 8.776 -0.537 1
1 29 . 12 1 1 A 6 6 ARG HA H 6 4.371 4.530 -0.159 1
1 36 . 12 1 1 A 6 6 ARG C C 6 176.180 176.201 -0.021 1
1 37 . 12 1 1 A 6 6 ARG CA C 6 56.353 54.318 2.035 1
1 38 . 12 1 1 A 6 6 ARG CB C 6 31.170 28.406 2.764 1
1 41 . 12 1 1 A 6 6 ARG N N 6 120.436 124.709 -4.273 1
1 42 . 12 1 1 A 7 7 GLU H H 7 8.535 8.202 0.333 1
1 43 . 12 1 1 A 7 7 GLU HA H 7 4.335 4.184 0.151 1
1 48 . 12 1 1 A 7 7 GLU C C 7 176.346 175.915 0.431 1
1 49 . 12 1 1 A 7 7 GLU CA C 7 56.740 58.894 -2.154 1
1 50 . 12 1 1 A 7 7 GLU CB C 7 30.390 29.618 0.772 1
1 52 . 12 1 1 A 7 7 GLU N N 7 122.189 125.157 -2.968 1
1 53 . 12 1 1 A 8 8 ASP H H 8 8.347 7.454 0.893 1
1 54 . 12 1 1 A 8 8 ASP N N 8 121.112 116.262 4.850 1
1 55 . 12 1 1 A 9 9 GLY HA2 H 9 3.975 4.205 -0.230 1
1 56 . 12 1 1 A 9 9 GLY HA3 H 9 3.975 4.205 -0.230 1
1 57 . 12 1 1 A 9 9 GLY C C 9 174.243 172.686 1.557 1
1 58 . 12 1 1 A 9 9 GLY CA C 9 45.933 44.551 1.382 1
1 59 . 12 1 1 A 10 10 ALA H H 10 8.111 8.506 -0.395 1
1 60 . 12 1 1 A 10 10 ALA N N 10 123.721 125.290 -1.569 1
1 61 . 12 1 1 A 12 12 GLY HA2 H 12 3.992 4.426 -0.434 1
1 62 . 12 1 1 A 12 12 GLY HA3 H 12 3.992 4.427 -0.435 1
1 63 . 12 1 1 A 12 12 GLY C C 12 173.883 172.234 1.649 1
1 64 . 12 1 1 A 12 12 GLY CA C 12 45.381 45.376 0.005 1
1 65 . 12 1 1 A 13 13 GLU H H 13 8.224 9.052 -0.828 1
1 66 . 12 1 1 A 13 13 GLU HA H 13 4.367 5.184 -0.817 1
1 71 . 12 1 1 A 13 13 GLU C C 13 176.125 173.898 2.227 1
1 72 . 12 1 1 A 13 13 GLU CA C 13 56.349 55.151 1.198 1
1 73 . 12 1 1 A 13 13 GLU CB C 13 29.560 33.760 -4.200 1
1 75 . 12 1 1 A 13 13 GLU N N 13 120.148 117.202 2.946 1
1 76 . 12 1 1 A 14 14 GLU H H 14 8.508 8.653 -0.145 1
1 77 . 12 1 1 A 14 14 GLU HA H 14 4.302 4.910 -0.608 1
1 82 . 12 1 1 A 14 14 GLU C C 14 176.623 174.797 1.826 1
1 83 . 12 1 1 A 14 14 GLU CA C 14 56.497 55.280 1.217 1
1 84 . 12 1 1 A 14 14 GLU CB C 14 30.110 33.077 -2.967 1
1 86 . 12 1 1 A 14 14 GLU N N 14 122.160 120.672 1.488 1
1 87 . 12 1 1 A 15 15 ARG H H 15 8.356 8.646 -0.290 1
1 88 . 12 1 1 A 15 15 ARG HA H 15 4.366 4.637 -0.271 1
1 95 . 12 1 1 A 15 15 ARG C C 15 176.844 177.087 -0.243 1
1 96 . 12 1 1 A 15 15 ARG CA C 15 56.010 55.560 0.450 1
1 97 . 12 1 1 A 15 15 ARG CB C 15 30.890 32.667 -1.777 1
1 100 . 12 1 1 A 15 15 ARG N N 15 121.945 127.708 -5.763 1
1 101 . 12 1 1 A 16 16 GLY H H 16 8.414 8.016 0.398 1
1 102 . 12 1 1 A 16 16 GLY HA2 H 16 4.022 3.863 0.159 1
1 103 . 12 1 1 A 16 16 GLY HA3 H 16 4.022 3.867 0.155 1
1 104 . 12 1 1 A 16 16 GLY C C 16 174.326 173.650 0.676 1
1 105 . 12 1 1 A 16 16 GLY CA C 16 45.620 46.362 -0.742 1
1 106 . 12 1 1 A 16 16 GLY N N 16 109.734 107.258 2.476 1
1 107 . 12 1 1 A 17 17 GLN H H 17 8.184 7.550 0.634 1
1 108 . 12 1 1 A 17 17 GLN HA H 17 4.366 4.842 -0.476 1
1 113 . 12 1 1 A 17 17 GLN C C 17 175.544 175.006 0.538 1
1 114 . 12 1 1 A 17 17 GLN CA C 17 55.749 53.931 1.818 1
1 115 . 12 1 1 A 17 17 GLN CB C 17 29.367 32.534 -3.167 1
1 117 . 12 1 1 A 17 17 GLN N N 17 119.546 117.598 1.948 1
1 118 . 12 1 1 A 18 18 ARG H H 18 8.366 8.463 -0.097 1
1 119 . 12 1 1 A 18 18 ARG HA H 18 4.487 4.580 -0.093 1
1 126 . 12 1 1 A 18 18 ARG C C 18 176.042 175.679 0.363 1
1 127 . 12 1 1 A 18 18 ARG CA C 18 55.735 55.878 -0.143 1
1 128 . 12 1 1 A 18 18 ARG CB C 18 31.170 31.110 0.060 1
1 131 . 12 1 1 A 18 18 ARG N N 18 122.330 121.055 1.275 1
1 132 . 12 1 1 A 19 19 GLY H H 19 8.192 8.456 -0.264 1
1 133 . 12 1 1 A 19 19 GLY HA2 H 19 4.852 4.141 0.711 1
1 134 . 12 1 1 A 19 19 GLY HA3 H 19 3.894 4.153 -0.259 1
1 135 . 12 1 1 A 19 19 GLY C C 19 172.361 171.651 0.710 1
1 136 . 12 1 1 A 19 19 GLY CA C 19 45.580 44.200 1.380 1
1 137 . 12 1 1 A 19 19 GLY N N 19 109.658 107.836 1.822 1
1 138 . 12 1 1 A 20 20 CYS H H 20 8.843 7.871 0.972 1
1 139 . 12 1 1 A 20 20 CYS HA H 20 5.147 5.148 -0.001 1
1 142 . 12 1 1 A 20 20 CYS C C 20 175.211 174.911 0.300 1
1 143 . 12 1 1 A 20 20 CYS CA C 20 56.712 58.392 -1.680 1
1 144 . 12 1 1 A 20 20 CYS CB C 20 33.530 31.161 2.369 1
1 145 . 12 1 1 A 20 20 CYS N N 20 120.185 118.503 1.682 1
1 146 . 12 1 1 A 21 21 GLU H H 21 8.981 8.933 0.048 1
1 147 . 12 1 1 A 21 21 GLU HA H 21 4.100 4.051 0.049 1
1 152 . 12 1 1 A 21 21 GLU C C 21 176.014 178.265 -2.251 1
1 153 . 12 1 1 A 21 21 GLU CA C 21 57.134 58.693 -1.559 1
1 154 . 12 1 1 A 21 21 GLU CB C 21 28.890 28.973 -0.083 1
1 156 . 12 1 1 A 21 21 GLU N N 21 116.078 125.241 -9.163 1
1 157 . 12 1 1 A 22 22 HIS H H 22 9.342 7.671 1.671 1
1 158 . 12 1 1 A 22 22 HIS HA H 22 4.210 4.246 -0.036 1
1 161 . 12 1 1 A 22 22 HIS C C 22 175.128 174.804 0.324 1
1 162 . 12 1 1 A 22 22 HIS CA C 22 58.945 58.823 0.122 1
1 163 . 12 1 1 A 22 22 HIS CB C 22 33.160 30.491 2.669 1
1 164 . 12 1 1 A 22 22 HIS N N 22 122.296 117.492 4.804 1
1 165 . 12 1 1 A 23 23 TYR H H 23 7.931 7.600 0.331 1
1 166 . 12 1 1 A 23 23 TYR HA H 23 4.856 5.208 -0.352 1
1 171 . 12 1 1 A 23 23 TYR C C 23 173.108 174.391 -1.283 1
1 172 . 12 1 1 A 23 23 TYR CA C 23 57.852 56.155 1.697 1
1 173 . 12 1 1 A 23 23 TYR CB C 23 45.300 42.005 3.295 1
1 175 . 12 1 1 A 23 23 TYR N N 23 115.205 115.316 -0.111 1
1 176 . 12 1 1 A 24 24 ASP H H 24 8.384 8.549 -0.165 1
1 177 . 12 1 1 A 24 24 ASP HA H 24 5.160 4.810 0.350 1
1 180 . 12 1 1 A 24 24 ASP C C 24 174.437 174.742 -0.305 1
1 181 . 12 1 1 A 24 24 ASP CA C 24 53.343 53.725 -0.382 1
1 182 . 12 1 1 A 24 24 ASP CB C 24 41.470 39.086 2.384 1
1 183 . 12 1 1 A 24 24 ASP N N 24 122.016 124.753 -2.737 1
1 184 . 12 1 1 A 25 25 ARG H H 25 7.313 8.046 -0.733 1
1 185 . 12 1 1 A 25 25 ARG HA H 25 5.331 5.076 0.255 1
1 192 . 12 1 1 A 25 25 ARG C C 25 175.045 175.324 -0.279 1
1 193 . 12 1 1 A 25 25 ARG CA C 25 54.224 54.628 -0.404 1
1 194 . 12 1 1 A 25 25 ARG CB C 25 34.090 33.815 0.275 1
1 197 . 12 1 1 A 25 25 ARG N N 25 115.898 119.198 -3.300 1
1 198 . 12 1 1 A 26 26 GLY H H 26 9.387 9.094 0.293 1
1 199 . 12 1 1 A 26 26 GLY HA2 H 26 4.622 3.738 0.884 1
1 200 . 12 1 1 A 26 26 GLY HA3 H 26 3.788 3.761 0.027 1
1 201 . 12 1 1 A 26 26 GLY C C 26 170.978 173.083 -2.105 1
1 202 . 12 1 1 A 26 26 GLY CA C 26 44.794 46.562 -1.768 1
1 203 . 12 1 1 A 26 26 GLY N N 26 105.653 108.950 -3.297 1
1 204 . 12 1 1 A 27 27 CYS H H 27 6.864 7.443 -0.579 1
1 205 . 12 1 1 A 27 27 CYS HA H 27 5.195 4.850 0.345 1
1 208 . 12 1 1 A 27 27 CYS C C 27 171.144 172.537 -1.393 1
1 209 . 12 1 1 A 27 27 CYS CA C 27 52.349 57.922 -5.573 1
1 210 . 12 1 1 A 27 27 CYS CB C 27 30.997 32.275 -1.278 1
1 211 . 12 1 1 A 27 27 CYS N N 27 110.921 117.071 -6.150 1
1 212 . 12 1 1 A 28 28 LEU H H 28 8.310 8.832 -0.522 1
1 213 . 12 1 1 A 28 28 LEU HA H 28 4.651 4.954 -0.303 1
1 223 . 12 1 1 A 28 28 LEU C C 28 176.827 176.400 0.427 1
1 224 . 12 1 1 A 28 28 LEU CA C 28 53.054 53.184 -0.130 1
1 225 . 12 1 1 A 28 28 LEU CB C 28 44.200 45.175 -0.975 1
1 229 . 12 1 1 A 28 28 LEU N N 28 115.519 122.334 -6.815 1
1 230 . 12 1 1 A 29 29 LEU H H 29 8.800 8.789 0.011 1
1 231 . 12 1 1 A 29 29 LEU HA H 29 4.313 4.396 -0.083 1
1 240 . 12 1 1 A 29 29 LEU C C 29 175.571 176.040 -0.469 1
1 241 . 12 1 1 A 29 29 LEU CA C 29 54.388 54.612 -0.224 1
1 242 . 12 1 1 A 29 29 LEU CB C 29 42.780 41.230 1.550 1
1 245 . 12 1 1 A 29 29 LEU N N 29 118.712 125.482 -6.770 1
1 246 . 12 1 1 A 30 30 LYS H H 30 8.009 8.493 -0.484 1
1 247 . 12 1 1 A 30 30 LYS HA H 30 4.592 4.918 -0.326 1
1 256 . 12 1 1 A 30 30 LYS C C 30 174.990 174.681 0.309 1
1 257 . 12 1 1 A 30 30 LYS CA C 30 54.999 55.945 -0.946 1
1 258 . 12 1 1 A 30 30 LYS CB C 30 32.330 33.405 -1.075 1
1 262 . 12 1 1 A 30 30 LYS N N 30 122.310 125.963 -3.653 1
1 263 . 12 1 1 A 31 31 ALA H H 31 9.238 8.556 0.682 1
1 264 . 12 1 1 A 31 31 ALA HA H 31 4.477 4.521 -0.044 1
1 268 . 12 1 1 A 31 31 ALA CA C 31 50.190 49.235 0.955 1
1 269 . 12 1 1 A 31 31 ALA CB C 31 21.637 20.099 1.538 1
1 270 . 12 1 1 A 31 31 ALA N N 31 133.864 130.071 3.793 1
1 271 . 12 1 1 A 32 32 PRO HA H 32 4.637 4.395 0.242 1
1 278 . 12 1 1 A 32 32 PRO C C 32 175.737 177.417 -1.680 1
1 279 . 12 1 1 A 32 32 PRO CA C 32 64.259 64.248 0.011 1
1 280 . 12 1 1 A 32 32 PRO CB C 32 31.740 31.802 -0.062 1
1 283 . 12 1 1 A 33 33 CYS H H 33 8.779 8.282 0.497 1
1 284 . 12 1 1 A 33 33 CYS HA H 33 4.321 4.203 0.118 1
1 287 . 12 1 1 A 33 33 CYS C C 33 176.733 175.329 1.404 1
1 288 . 12 1 1 A 33 33 CYS CA C 33 54.398 62.013 -7.615 1
1 289 . 12 1 1 A 33 33 CYS CB C 33 30.697 27.298 3.399 1
1 290 . 12 1 1 A 33 33 CYS N N 33 120.005 116.168 3.837 1
1 291 . 12 1 1 A 34 34 CYS H H 34 7.424 7.781 -0.357 1
1 292 . 12 1 1 A 34 34 CYS HA H 34 4.896 4.696 0.200 1
1 295 . 12 1 1 A 34 34 CYS C C 34 174.935 174.358 0.577 1
1 296 . 12 1 1 A 34 34 CYS CA C 34 56.962 58.451 -1.489 1
1 297 . 12 1 1 A 34 34 CYS CB C 34 31.067 29.287 1.780 1
1 298 . 12 1 1 A 34 34 CYS N N 34 115.034 116.580 -1.546 1
1 299 . 12 1 1 A 35 35 ASP H H 35 8.368 8.048 0.320 1
1 300 . 12 1 1 A 35 35 ASP HA H 35 4.454 4.191 0.263 1
1 303 . 12 1 1 A 35 35 ASP C C 35 174.354 174.961 -0.607 1
1 304 . 12 1 1 A 35 35 ASP CA C 35 56.222 55.470 0.752 1
1 305 . 12 1 1 A 35 35 ASP CB C 35 39.730 39.078 0.652 1
1 306 . 12 1 1 A 35 35 ASP N N 35 121.381 117.880 3.501 1
1 307 . 12 1 1 A 36 36 LYS H H 36 7.227 7.566 -0.339 1
1 308 . 12 1 1 A 36 36 LYS HA H 36 4.451 4.625 -0.174 1
1 317 . 12 1 1 A 36 36 LYS C C 36 175.433 175.514 -0.081 1
1 318 . 12 1 1 A 36 36 LYS CA C 36 56.270 55.358 0.912 1
1 319 . 12 1 1 A 36 36 LYS CB C 36 36.620 34.177 2.443 1
1 323 . 12 1 1 A 36 36 LYS N N 36 117.673 118.461 -0.788 1
1 324 . 12 1 1 A 37 37 LEU H H 37 8.053 8.578 -0.525 1
1 325 . 12 1 1 A 37 37 LEU HA H 37 5.292 4.889 0.403 1
1 335 . 12 1 1 A 37 37 LEU C C 37 176.484 175.097 1.387 1
1 336 . 12 1 1 A 37 37 LEU CA C 37 53.348 53.270 0.078 1
1 337 . 12 1 1 A 37 37 LEU CB C 37 42.400 42.531 -0.131 1
1 341 . 12 1 1 A 37 37 LEU N N 37 120.994 123.518 -2.524 1
1 342 . 12 1 1 A 38 38 TYR H H 38 8.741 8.768 -0.027 1
1 343 . 12 1 1 A 38 38 TYR HA H 38 5.002 4.811 0.191 1
1 350 . 12 1 1 A 38 38 TYR C C 38 176.374 175.950 0.424 1
1 351 . 12 1 1 A 38 38 TYR CA C 38 57.081 56.839 0.242 1
1 352 . 12 1 1 A 38 38 TYR CB C 38 45.647 41.837 3.810 1
1 355 . 12 1 1 A 38 38 TYR N N 38 121.128 122.196 -1.068 1
1 356 . 12 1 1 A 39 39 THR H H 39 9.402 8.844 0.558 1
1 357 . 12 1 1 A 39 39 THR HA H 39 4.098 4.155 -0.057 1
1 362 . 12 1 1 A 39 39 THR C C 39 173.496 174.893 -1.397 1
1 363 . 12 1 1 A 39 39 THR CA C 39 67.062 65.589 1.473 1
1 364 . 12 1 1 A 39 39 THR CB C 39 68.047 68.629 -0.582 1
1 366 . 12 1 1 A 39 39 THR N N 39 116.641 117.842 -1.201 1
1 367 . 12 1 1 A 40 40 CYS H H 40 7.317 8.104 -0.787 1
1 368 . 12 1 1 A 40 40 CYS HA H 40 4.771 4.758 0.013 1
1 371 . 12 1 1 A 40 40 CYS C C 40 175.128 174.855 0.273 1
1 372 . 12 1 1 A 40 40 CYS CA C 40 56.577 57.637 -1.060 1
1 373 . 12 1 1 A 40 40 CYS CB C 40 35.087 30.559 4.528 1
1 374 . 12 1 1 A 40 40 CYS N N 40 109.059 118.860 -9.801 1
1 375 . 12 1 1 A 41 41 ARG H H 41 9.201 8.832 0.369 1
1 376 . 12 1 1 A 41 41 ARG HA H 41 3.982 3.829 0.153 1
1 383 . 12 1 1 A 41 41 ARG C C 41 175.101 177.833 -2.732 1
1 384 . 12 1 1 A 41 41 ARG CA C 41 58.591 59.614 -1.023 1
1 385 . 12 1 1 A 41 41 ARG CB C 41 29.640 29.656 -0.016 1
1 388 . 12 1 1 A 41 41 ARG N N 41 121.737 125.220 -3.483 1
1 389 . 12 1 1 A 42 42 LEU H H 42 9.116 7.794 1.322 1
1 390 . 12 1 1 A 42 42 LEU HA H 42 4.029 3.991 0.038 1
1 400 . 12 1 1 A 42 42 LEU C C 42 179.943 179.349 0.594 1
1 401 . 12 1 1 A 42 42 LEU CA C 42 58.005 57.663 0.342 1
1 402 . 12 1 1 A 42 42 LEU CB C 42 38.960 41.112 -2.152 1
1 406 . 12 1 1 A 42 42 LEU N N 42 126.364 118.483 7.881 1
1 407 . 12 1 1 A 43 43 CYS H H 43 8.785 8.240 0.545 1
1 408 . 12 1 1 A 43 43 CYS HA H 43 4.187 4.190 -0.003 1
1 411 . 12 1 1 A 43 43 CYS C C 43 177.785 177.006 0.779 1
1 412 . 12 1 1 A 43 43 CYS CA C 43 66.415 62.847 3.568 1
1 413 . 12 1 1 A 43 43 CYS CB C 43 28.870 27.247 1.623 1
1 414 . 12 1 1 A 43 43 CYS N N 43 124.519 118.106 6.413 1
1 415 . 12 1 1 A 44 44 HIS H H 44 7.604 7.542 0.062 1
1 416 . 12 1 1 A 44 44 HIS HA H 44 1.983 2.983 -1.000 1
1 420 . 12 1 1 A 44 44 HIS C C 44 176.429 176.222 0.207 1
1 421 . 12 1 1 A 44 44 HIS CA C 44 58.760 58.923 -0.163 1
1 422 . 12 1 1 A 44 44 HIS CB C 44 27.990 29.576 -1.586 1
1 423 . 12 1 1 A 44 44 HIS N N 44 117.024 121.043 -4.019 1
1 424 . 12 1 1 A 45 45 ASP H H 45 8.750 8.184 0.566 1
1 425 . 12 1 1 A 45 45 ASP HA H 45 4.116 3.979 0.137 1
1 428 . 12 1 1 A 45 45 ASP C C 45 177.453 177.807 -0.354 1
1 429 . 12 1 1 A 45 45 ASP CA C 45 56.840 57.472 -0.632 1
1 430 . 12 1 1 A 45 45 ASP CB C 45 38.960 42.051 -3.091 1
1 431 . 12 1 1 A 45 45 ASP N N 45 120.440 119.036 1.404 1
1 432 . 12 1 1 A 46 46 ASN H H 46 7.888 8.240 -0.352 1
1 433 . 12 1 1 A 46 46 ASN HA H 46 4.612 4.376 0.236 1
1 438 . 12 1 1 A 46 46 ASN C C 46 175.903 176.737 -0.834 1
1 439 . 12 1 1 A 46 46 ASN CA C 46 54.342 57.032 -2.690 1
1 440 . 12 1 1 A 46 46 ASN CB C 46 38.790 39.881 -1.091 1
1 441 . 12 1 1 A 46 46 ASN N N 46 115.758 117.199 -1.441 1
1 443 . 12 1 1 A 47 47 ASN H H 47 7.384 7.139 0.245 1
1 444 . 12 1 1 A 47 47 ASN HA H 47 4.893 4.707 0.186 1
1 449 . 12 1 1 A 47 47 ASN C C 47 173.579 175.661 -2.082 1
1 450 . 12 1 1 A 47 47 ASN CA C 47 53.937 54.132 -0.195 1
1 451 . 12 1 1 A 47 47 ASN CB C 47 43.130 39.376 3.754 1
1 452 . 12 1 1 A 47 47 ASN N N 47 116.576 114.794 1.782 1
1 454 . 12 1 1 A 48 48 GLU H H 48 7.143 7.562 -0.419 1
1 455 . 12 1 1 A 48 48 GLU HA H 48 4.572 4.531 0.041 1
1 460 . 12 1 1 A 48 48 GLU C C 48 175.627 175.904 -0.277 1
1 461 . 12 1 1 A 48 48 GLU CA C 48 53.727 54.455 -0.728 1
1 462 . 12 1 1 A 48 48 GLU CB C 48 32.480 30.632 1.848 1
1 464 . 12 1 1 A 48 48 GLU N N 48 116.967 117.585 -0.618 1
1 465 . 12 1 1 A 49 49 ASP H H 49 8.748 8.857 -0.109 1
1 466 . 12 1 1 A 49 49 ASP HA H 49 4.576 4.905 -0.329 1
1 469 . 12 1 1 A 49 49 ASP C C 49 174.796 174.996 -0.200 1
1 470 . 12 1 1 A 49 49 ASP CA C 49 53.027 54.080 -1.053 1
1 471 . 12 1 1 A 49 49 ASP CB C 49 40.340 41.814 -1.474 1
1 472 . 12 1 1 A 49 49 ASP N N 49 119.296 119.364 -0.068 1
1 473 . 12 1 1 A 50 50 HIS H H 50 6.919 7.304 -0.385 1
1 474 . 12 1 1 A 50 50 HIS HA H 50 4.880 4.983 -0.103 1
1 477 . 12 1 1 A 50 50 HIS C C 50 172.942 172.513 0.429 1
1 478 . 12 1 1 A 50 50 HIS CA C 50 53.978 54.655 -0.677 1
1 479 . 12 1 1 A 50 50 HIS CB C 50 30.330 31.615 -1.285 1
1 480 . 12 1 1 A 50 50 HIS N N 50 113.709 114.968 -1.259 1
1 481 . 12 1 1 A 51 51 GLN H H 51 8.646 8.585 0.061 1
1 482 . 12 1 1 A 51 51 GLN HA H 51 4.896 4.617 0.279 1
1 487 . 12 1 1 A 51 51 GLN C C 51 176.512 175.026 1.486 1
1 488 . 12 1 1 A 51 51 GLN CA C 51 54.872 56.274 -1.402 1
1 489 . 12 1 1 A 51 51 GLN CB C 51 30.950 30.251 0.699 1
1 491 . 12 1 1 A 51 51 GLN N N 51 119.379 119.646 -0.267 1
1 492 . 12 1 1 A 52 52 LEU H H 52 9.646 8.608 1.038 1
1 493 . 12 1 1 A 52 52 LEU HA H 52 4.206 4.630 -0.424 1
1 503 . 12 1 1 A 52 52 LEU C C 52 175.793 175.094 0.699 1
1 504 . 12 1 1 A 52 52 LEU CA C 52 55.450 53.804 1.646 1
1 505 . 12 1 1 A 52 52 LEU CB C 52 41.407 43.198 -1.791 1
1 509 . 12 1 1 A 52 52 LEU N N 52 128.069 124.914 3.155 1
1 510 . 12 1 1 A 53 53 ASP H H 53 9.281 8.673 0.608 1
1 511 . 12 1 1 A 53 53 ASP HA H 53 4.725 4.684 0.041 1
1 514 . 12 1 1 A 53 53 ASP C C 53 176.401 177.305 -0.904 1
1 515 . 12 1 1 A 53 53 ASP CA C 53 52.590 53.980 -1.390 1
1 516 . 12 1 1 A 53 53 ASP CB C 53 39.990 41.798 -1.808 1
1 517 . 12 1 1 A 53 53 ASP N N 53 128.783 127.324 1.459 1
1 518 . 12 1 1 A 54 54 ARG H H 54 8.496 8.438 0.058 1
1 519 . 12 1 1 A 54 54 ARG HA H 54 3.859 3.845 0.014 1
1 526 . 12 1 1 A 54 54 ARG C C 54 176.346 177.583 -1.237 1
1 527 . 12 1 1 A 54 54 ARG CA C 54 57.357 58.156 -0.799 1
1 528 . 12 1 1 A 54 54 ARG CB C 54 28.890 29.686 -0.796 1
1 531 . 12 1 1 A 54 54 ARG N N 54 125.813 125.737 0.076 1
1 532 . 12 1 1 A 55 55 PHE H H 55 8.005 7.342 0.663 1
1 533 . 12 1 1 A 55 55 PHE HA H 55 4.712 4.121 0.591 1
1 540 . 12 1 1 A 55 55 PHE C C 55 177.481 178.454 -0.973 1
1 541 . 12 1 1 A 55 55 PHE CA C 55 59.080 61.021 -1.941 1
1 542 . 12 1 1 A 55 55 PHE CB C 55 37.447 38.163 -0.716 1
1 545 . 12 1 1 A 55 55 PHE N N 55 120.168 118.137 2.031 1
1 546 . 12 1 1 A 56 56 LYS H H 56 7.681 7.592 0.089 1
1 547 . 12 1 1 A 56 56 LYS HA H 56 4.411 4.226 0.185 1
1 556 . 12 1 1 A 56 56 LYS C C 56 175.959 176.675 -0.716 1
1 557 . 12 1 1 A 56 56 LYS CA C 56 55.459 58.280 -2.821 1
1 558 . 12 1 1 A 56 56 LYS CB C 56 33.590 32.595 0.995 1
1 562 . 12 1 1 A 56 56 LYS N N 56 116.937 118.337 -1.400 1
1 563 . 12 1 1 A 57 57 VAL H H 57 6.553 7.259 -0.706 1
1 564 . 12 1 1 A 57 57 VAL HA H 57 3.408 3.994 -0.586 1
1 572 . 12 1 1 A 57 57 VAL C C 57 173.911 176.091 -2.180 1
1 573 . 12 1 1 A 57 57 VAL CA C 57 65.025 61.875 3.150 1
1 574 . 12 1 1 A 57 57 VAL CB C 57 32.663 31.510 1.153 1
1 577 . 12 1 1 A 57 57 VAL N N 57 119.519 117.090 2.429 1
1 578 . 12 1 1 A 58 58 LYS H H 58 9.182 8.831 0.351 1
1 579 . 12 1 1 A 58 58 LYS HA H 58 4.489 4.286 0.203 1
1 588 . 12 1 1 A 58 58 LYS C C 58 176.927 176.183 0.744 1
1 589 . 12 1 1 A 58 58 LYS CA C 58 55.913 57.800 -1.887 1
1 590 . 12 1 1 A 58 58 LYS CB C 58 36.340 33.296 3.044 1
1 594 . 12 1 1 A 58 58 LYS N N 58 124.985 126.507 -1.522 1
1 595 . 12 1 1 A 59 59 GLU H H 59 8.799 7.790 1.009 1
1 596 . 12 1 1 A 59 59 GLU HA H 59 5.209 4.986 0.223 1
1 601 . 12 1 1 A 59 59 GLU C C 59 173.911 175.447 -1.536 1
1 602 . 12 1 1 A 59 59 GLU CA C 59 54.670 54.867 -0.197 1
1 603 . 12 1 1 A 59 59 GLU CB C 59 35.180 33.308 1.872 1
1 605 . 12 1 1 A 59 59 GLU N N 59 121.493 116.666 4.827 1
1 606 . 12 1 1 A 60 60 VAL H H 60 8.917 8.714 0.203 1
1 607 . 12 1 1 A 60 60 VAL HA H 60 4.983 5.090 -0.107 1
1 615 . 12 1 1 A 60 60 VAL C C 60 173.441 174.085 -0.644 1
1 616 . 12 1 1 A 60 60 VAL CA C 60 57.497 59.072 -1.575 1
1 617 . 12 1 1 A 60 60 VAL CB C 60 35.460 36.295 -0.835 1
1 620 . 12 1 1 A 60 60 VAL N N 60 109.266 117.587 -8.321 1
1 621 . 12 1 1 A 61 61 GLN H H 61 8.970 8.755 0.215 1
1 622 . 12 1 1 A 61 61 GLN HA H 61 5.024 5.320 -0.296 1
1 629 . 12 1 1 A 61 61 GLN C C 61 175.045 173.453 1.592 1
1 630 . 12 1 1 A 61 61 GLN CA C 61 53.128 54.019 -0.891 1
1 631 . 12 1 1 A 61 61 GLN CB C 61 33.980 32.637 1.343 1
1 633 . 12 1 1 A 61 61 GLN N N 61 118.525 118.426 0.099 1
1 635 . 12 1 1 A 62 62 CYS H H 62 7.688 8.514 -0.826 1
1 636 . 12 1 1 A 62 62 CYS HA H 62 4.210 4.406 -0.196 1
1 639 . 12 1 1 A 62 62 CYS C C 62 177.951 175.922 2.029 1
1 640 . 12 1 1 A 62 62 CYS CA C 62 59.845 57.312 2.533 1
1 641 . 12 1 1 A 62 62 CYS CB C 62 33.120 29.145 3.975 1
1 642 . 12 1 1 A 62 62 CYS N N 62 128.772 120.397 8.375 1
1 643 . 12 1 1 A 63 63 ILE H H 63 8.192 8.323 -0.131 1
1 644 . 12 1 1 A 63 63 ILE HA H 63 3.984 3.911 0.073 1
1 654 . 12 1 1 A 63 63 ILE C C 63 175.433 177.292 -1.859 1
1 655 . 12 1 1 A 63 63 ILE CA C 63 63.657 64.274 -0.617 1
1 656 . 12 1 1 A 63 63 ILE CB C 63 38.506 37.748 0.758 1
1 660 . 12 1 1 A 63 63 ILE N N 63 127.455 127.693 -0.238 1
1 661 . 12 1 1 A 64 64 ASN H H 64 9.181 7.926 1.255 1
1 662 . 12 1 1 A 64 64 ASN HA H 64 4.810 4.697 0.113 1
1 667 . 12 1 1 A 64 64 ASN C C 64 175.931 175.074 0.857 1
1 668 . 12 1 1 A 64 64 ASN CA C 64 55.617 52.069 3.548 1
1 669 . 12 1 1 A 64 64 ASN CB C 64 40.640 36.929 3.711 1
1 670 . 12 1 1 A 64 64 ASN N N 64 122.104 118.266 3.838 1
1 672 . 12 1 1 A 65 65 CYS H H 65 9.065 7.829 1.236 1
1 673 . 12 1 1 A 65 65 CYS HA H 65 4.979 4.514 0.465 1
1 676 . 12 1 1 A 65 65 CYS C C 65 176.291 174.860 1.431 1
1 677 . 12 1 1 A 65 65 CYS CA C 65 59.027 59.555 -0.528 1
1 678 . 12 1 1 A 65 65 CYS CB C 65 32.030 28.246 3.784 1
1 679 . 12 1 1 A 65 65 CYS N N 65 120.368 119.980 0.388 1
1 680 . 12 1 1 A 66 66 GLU H H 66 7.281 8.358 -1.077 1
1 681 . 12 1 1 A 66 66 GLU HA H 66 4.046 3.992 0.054 1
1 686 . 12 1 1 A 66 66 GLU C C 66 175.211 175.303 -0.092 1
1 687 . 12 1 1 A 66 66 GLU CA C 66 58.591 57.956 0.635 1
1 688 . 12 1 1 A 66 66 GLU CB C 66 27.067 27.069 -0.002 1
1 690 . 12 1 1 A 66 66 GLU N N 66 115.012 116.228 -1.216 1
1 691 . 12 1 1 A 67 67 LYS H H 67 8.481 7.838 0.643 1
1 692 . 12 1 1 A 67 67 LYS HA H 67 4.326 4.279 0.047 1
1 701 . 12 1 1 A 67 67 LYS C C 67 177.923 175.981 1.942 1
1 702 . 12 1 1 A 67 67 LYS CA C 67 57.628 56.806 0.822 1
1 703 . 12 1 1 A 67 67 LYS CB C 67 33.617 32.706 0.911 1
1 707 . 12 1 1 A 67 67 LYS N N 67 123.514 120.825 2.689 1
1 708 . 12 1 1 A 68 68 ILE H H 68 8.867 8.558 0.309 1
1 709 . 12 1 1 A 68 68 ILE HA H 68 4.976 4.513 0.463 1
1 719 . 12 1 1 A 68 68 ILE C C 68 175.018 175.220 -0.202 1
1 720 . 12 1 1 A 68 68 ILE CA C 68 60.919 60.986 -0.067 1
1 721 . 12 1 1 A 68 68 ILE CB C 68 37.090 37.050 0.040 1
1 725 . 12 1 1 A 68 68 ILE N N 68 133.478 129.124 4.354 1
1 726 . 12 1 1 A 69 69 GLN H H 69 9.269 8.607 0.662 1
1 727 . 12 1 1 A 69 69 GLN HA H 69 5.036 5.018 0.018 1
1 732 . 12 1 1 A 69 69 GLN C C 69 173.607 174.624 -1.017 1
1 733 . 12 1 1 A 69 69 GLN CA C 69 53.419 53.957 -0.538 1
1 734 . 12 1 1 A 69 69 GLN CB C 69 34.997 32.122 2.875 1
1 736 . 12 1 1 A 69 69 GLN N N 69 125.104 124.234 0.870 1
1 737 . 12 1 1 A 70 70 HIS H H 70 8.829 8.729 0.100 1
1 738 . 12 1 1 A 70 70 HIS HA H 70 4.865 4.679 0.186 1
1 741 . 12 1 1 A 70 70 HIS C C 70 174.852 175.026 -0.174 1
1 742 . 12 1 1 A 70 70 HIS CA C 70 56.304 55.520 0.784 1
1 743 . 12 1 1 A 70 70 HIS CB C 70 30.050 31.268 -1.218 1
1 744 . 12 1 1 A 70 70 HIS N N 70 118.576 118.949 -0.373 1
1 745 . 12 1 1 A 71 71 ALA H H 71 7.768 8.049 -0.281 1
1 746 . 12 1 1 A 71 71 ALA HA H 71 3.977 4.503 -0.526 1
1 750 . 12 1 1 A 71 71 ALA C C 71 175.433 177.151 -1.718 1
1 751 . 12 1 1 A 71 71 ALA CA C 71 54.393 52.652 1.741 1
1 752 . 12 1 1 A 71 71 ALA CB C 71 18.000 18.856 -0.856 1
1 753 . 12 1 1 A 71 71 ALA N N 71 121.438 123.027 -1.589 1
1 754 . 12 1 1 A 72 72 GLN H H 72 7.227 7.957 -0.730 1
1 755 . 12 1 1 A 72 72 GLN HA H 72 4.371 4.377 -0.006 1
1 762 . 12 1 1 A 72 72 GLN C C 72 173.053 174.823 -1.770 1
1 763 . 12 1 1 A 72 72 GLN CA C 72 54.290 53.545 0.745 1
1 764 . 12 1 1 A 72 72 GLN CB C 72 28.623 31.665 -3.042 1
1 766 . 12 1 1 A 72 72 GLN N N 72 115.858 122.577 -6.719 1
1 768 . 12 1 1 A 73 73 GLN H H 73 8.481 8.326 0.155 1
1 769 . 12 1 1 A 73 73 GLN HA H 73 3.570 3.583 -0.013 1
1 776 . 12 1 1 A 73 73 GLN C C 73 174.243 174.825 -0.582 1
1 777 . 12 1 1 A 73 73 GLN CA C 73 60.206 57.536 2.670 1
1 778 . 12 1 1 A 73 73 GLN CB C 73 28.850 28.756 0.094 1
1 780 . 12 1 1 A 73 73 GLN N N 73 116.433 122.238 -5.805 1
1 782 . 12 1 1 A 74 74 THR H H 74 7.211 7.156 0.055 1
1 783 . 12 1 1 A 74 74 THR HA H 74 4.160 5.117 -0.957 1
1 788 . 12 1 1 A 74 74 THR C C 74 171.836 172.098 -0.262 1
1 789 . 12 1 1 A 74 74 THR CA C 74 59.072 60.925 -1.853 1
1 790 . 12 1 1 A 74 74 THR CB C 74 71.560 72.513 -0.953 1
1 792 . 12 1 1 A 74 74 THR N N 74 108.717 109.928 -1.211 1
1 793 . 12 1 1 A 75 75 CYS H H 75 7.676 8.386 -0.710 1
1 794 . 12 1 1 A 75 75 CYS HA H 75 4.158 4.811 -0.653 1
1 797 . 12 1 1 A 75 75 CYS C C 75 178.781 175.818 2.963 1
1 798 . 12 1 1 A 75 75 CYS CA C 75 58.661 57.331 1.330 1
1 799 . 12 1 1 A 75 75 CYS CB C 75 30.840 29.090 1.750 1
1 800 . 12 1 1 A 75 75 CYS N N 75 123.108 122.336 0.772 1
1 801 . 12 1 1 A 76 76 GLU H H 76 9.203 8.805 0.398 1
1 802 . 12 1 1 A 76 76 GLU HA H 76 4.187 4.045 0.142 1
1 807 . 12 1 1 A 76 76 GLU C C 76 175.488 178.810 -3.322 1
1 808 . 12 1 1 A 76 76 GLU CA C 76 57.306 58.920 -1.614 1
1 809 . 12 1 1 A 76 76 GLU CB C 76 29.347 29.044 0.303 1
1 811 . 12 1 1 A 76 76 GLU N N 76 129.817 127.005 2.812 1
1 812 . 12 1 1 A 77 77 GLU H H 77 9.496 7.822 1.674 1
1 813 . 12 1 1 A 77 77 GLU HA H 77 4.599 4.086 0.513 1
1 818 . 12 1 1 A 77 77 GLU C C 77 177.148 177.359 -0.211 1
1 819 . 12 1 1 A 77 77 GLU CA C 77 57.554 58.915 -1.361 1
1 820 . 12 1 1 A 77 77 GLU CB C 77 31.980 30.313 1.667 1
1 822 . 12 1 1 A 77 77 GLU N N 77 124.795 120.678 4.117 1
1 823 . 12 1 1 A 78 78 CYS H H 78 8.967 7.389 1.578 1
1 824 . 12 1 1 A 78 78 CYS HA H 78 5.073 4.609 0.464 1
1 827 . 12 1 1 A 78 78 CYS C C 78 176.374 174.853 1.521 1
1 828 . 12 1 1 A 78 78 CYS CA C 78 58.537 58.260 0.277 1
1 829 . 12 1 1 A 78 78 CYS CB C 78 31.597 29.002 2.595 1
1 830 . 12 1 1 A 78 78 CYS N N 78 119.692 115.179 4.513 1
1 831 . 12 1 1 A 79 79 SER H H 79 7.474 8.316 -0.842 1
1 832 . 12 1 1 A 79 79 SER HA H 79 4.113 4.092 0.021 1
1 835 . 12 1 1 A 79 79 SER C C 79 172.915 173.558 -0.643 1
1 836 . 12 1 1 A 79 79 SER CA C 79 60.440 59.350 1.090 1
1 837 . 12 1 1 A 79 79 SER CB C 79 61.421 61.007 0.414 1
1 838 . 12 1 1 A 79 79 SER N N 79 113.385 115.635 -2.250 1
1 839 . 12 1 1 A 80 80 THR H H 80 7.907 7.896 0.011 1
1 840 . 12 1 1 A 80 80 THR HA H 80 3.913 4.204 -0.291 1
1 845 . 12 1 1 A 80 80 THR C C 80 172.306 173.896 -1.590 1
1 846 . 12 1 1 A 80 80 THR CA C 80 65.262 63.466 1.796 1
1 847 . 12 1 1 A 80 80 THR CB C 80 69.910 69.004 0.906 1
1 849 . 12 1 1 A 80 80 THR N N 80 120.005 116.808 3.197 1
1 850 . 12 1 1 A 81 81 LEU H H 81 8.556 8.609 -0.053 1
1 851 . 12 1 1 A 81 81 LEU HA H 81 4.172 4.645 -0.473 1
1 861 . 12 1 1 A 81 81 LEU C C 81 177.121 176.421 0.700 1
1 862 . 12 1 1 A 81 81 LEU CA C 81 54.996 55.012 -0.016 1
1 863 . 12 1 1 A 81 81 LEU CB C 81 42.147 42.390 -0.243 1
1 867 . 12 1 1 A 81 81 LEU N N 81 128.272 128.891 -0.619 1
1 868 . 12 1 1 A 82 82 PHE H H 82 9.251 9.340 -0.089 1
1 869 . 12 1 1 A 82 82 PHE HA H 82 4.576 4.383 0.193 1
1 874 . 12 1 1 A 82 82 PHE C C 82 177.785 176.547 1.238 1
1 875 . 12 1 1 A 82 82 PHE CA C 82 56.470 60.443 -3.973 1
1 876 . 12 1 1 A 82 82 PHE CB C 82 38.210 39.052 -0.842 1
1 878 . 12 1 1 A 82 82 PHE N N 82 129.268 126.456 2.812 1
1 879 . 12 1 1 A 83 83 GLY H H 83 7.047 7.569 -0.522 1
1 880 . 12 1 1 A 83 83 GLY HA2 H 83 4.783 4.189 0.594 1
1 881 . 12 1 1 A 83 83 GLY HA3 H 83 3.876 4.262 -0.386 1
1 882 . 12 1 1 A 83 83 GLY C C 83 171.642 174.852 -3.210 1
1 883 . 12 1 1 A 83 83 GLY CA C 83 45.826 45.908 -0.082 1
1 884 . 12 1 1 A 83 83 GLY N N 83 102.168 103.655 -1.487 1
1 885 . 12 1 1 A 84 84 GLU H H 84 8.444 8.921 -0.477 1
1 886 . 12 1 1 A 84 84 GLU HA H 84 4.111 4.138 -0.027 1
1 891 . 12 1 1 A 84 84 GLU C C 84 177.259 176.503 0.756 1
1 892 . 12 1 1 A 84 84 GLU CA C 84 59.438 59.411 0.027 1
1 893 . 12 1 1 A 84 84 GLU CB C 84 30.670 30.126 0.544 1
1 895 . 12 1 1 A 84 84 GLU N N 84 127.546 122.923 4.623 1
1 896 . 12 1 1 A 85 85 TYR H H 85 9.344 8.067 1.277 1
1 897 . 12 1 1 A 85 85 TYR HA H 85 4.599 5.064 -0.465 1
1 902 . 12 1 1 A 85 85 TYR C C 85 173.302 173.802 -0.500 1
1 903 . 12 1 1 A 85 85 TYR CA C 85 57.261 56.204 1.057 1
1 904 . 12 1 1 A 85 85 TYR CB C 85 40.850 40.472 0.378 1
1 906 . 12 1 1 A 85 85 TYR N N 85 118.936 119.784 -0.848 1
1 907 . 12 1 1 A 86 86 TYR H H 86 7.323 8.881 -1.558 1
1 908 . 12 1 1 A 86 86 TYR HA H 86 5.298 5.975 -0.677 1
1 911 . 12 1 1 A 86 86 TYR C C 86 172.804 173.372 -0.568 1
1 912 . 12 1 1 A 86 86 TYR CA C 86 54.041 55.490 -1.449 1
1 913 . 12 1 1 A 86 86 TYR CB C 86 40.987 41.793 -0.806 1
1 914 . 12 1 1 A 86 86 TYR N N 86 124.965 123.216 1.749 1
1 915 . 12 1 1 A 87 87 CYS H H 87 7.046 8.843 -1.797 1
1 916 . 12 1 1 A 87 87 CYS HA H 87 3.842 4.689 -0.847 1
1 919 . 12 1 1 A 87 87 CYS C C 87 174.243 174.345 -0.102 1
1 920 . 12 1 1 A 87 87 CYS CA C 87 56.377 58.488 -2.111 1
1 921 . 12 1 1 A 87 87 CYS CB C 87 33.230 29.987 3.243 1
1 922 . 12 1 1 A 87 87 CYS N N 87 128.735 118.433 10.302 1
1 923 . 12 1 1 A 88 88 ASP H H 88 8.002 9.196 -1.194 1
1 924 . 12 1 1 A 88 88 ASP HA H 88 3.761 4.530 -0.769 1
1 927 . 12 1 1 A 88 88 ASP C C 88 173.579 178.225 -4.646 1
1 928 . 12 1 1 A 88 88 ASP CA C 88 53.958 56.698 -2.740 1
1 929 . 12 1 1 A 88 88 ASP CB C 88 41.240 39.751 1.489 1
1 930 . 12 1 1 A 88 88 ASP N N 88 127.013 127.167 -0.154 1
1 931 . 12 1 1 A 89 89 ILE H H 89 7.972 7.915 0.057 1
1 932 . 12 1 1 A 89 89 ILE HA H 89 3.660 3.817 -0.157 1
1 942 . 12 1 1 A 89 89 ILE C C 89 177.259 177.423 -0.164 1
1 943 . 12 1 1 A 89 89 ILE CA C 89 63.107 65.281 -2.174 1
1 944 . 12 1 1 A 89 89 ILE CB C 89 39.430 38.133 1.297 1
1 948 . 12 1 1 A 89 89 ILE N N 89 120.357 120.753 -0.396 1
1 949 . 12 1 1 A 90 90 CYS H H 90 8.554 7.849 0.705 1
1 950 . 12 1 1 A 90 90 CYS HA H 90 3.677 4.891 -1.214 1
1 953 . 12 1 1 A 90 90 CYS C C 90 175.128 174.005 1.123 1
1 954 . 12 1 1 A 90 90 CYS CA C 90 60.791 58.900 1.891 1
1 955 . 12 1 1 A 90 90 CYS CB C 90 30.427 28.588 1.839 1
1 956 . 12 1 1 A 90 90 CYS N N 90 119.564 116.696 2.868 1
1 957 . 12 1 1 A 91 91 HIS H H 91 7.364 7.719 -0.355 1
1 958 . 12 1 1 A 91 91 HIS HA H 91 3.512 3.917 -0.405 1
1 963 . 12 1 1 A 91 91 HIS C C 91 170.590 173.017 -2.427 1
1 964 . 12 1 1 A 91 91 HIS CA C 91 58.739 56.669 2.070 1
1 965 . 12 1 1 A 91 91 HIS CB C 91 24.810 26.634 -1.824 1
1 968 . 12 1 1 A 91 91 HIS N N 91 111.440 116.441 -5.001 1
1 969 . 12 1 1 A 92 92 LEU H H 92 6.214 7.158 -0.944 1
1 970 . 12 1 1 A 92 92 LEU HA H 92 4.191 4.385 -0.194 1
1 980 . 12 1 1 A 92 92 LEU C C 92 173.911 175.195 -1.284 1
1 981 . 12 1 1 A 92 92 LEU CA C 92 53.717 53.199 0.518 1
1 982 . 12 1 1 A 92 92 LEU CB C 92 45.360 43.336 2.024 1
1 986 . 12 1 1 A 92 92 LEU N N 92 115.684 116.535 -0.851 1
1 987 . 12 1 1 A 93 93 PHE H H 93 6.669 8.768 -2.099 1
1 988 . 12 1 1 A 93 93 PHE HA H 93 5.622 5.182 0.440 1
1 995 . 12 1 1 A 93 93 PHE C C 93 175.765 174.380 1.385 1
1 996 . 12 1 1 A 93 93 PHE CA C 93 55.387 56.576 -1.189 1
1 997 . 12 1 1 A 93 93 PHE CB C 93 42.700 41.375 1.325 1
1 1000 . 12 1 1 A 93 93 PHE N N 93 121.535 120.617 0.918 1
1 1001 . 12 1 1 A 94 94 ASP H H 94 9.209 8.948 0.261 1
1 1002 . 12 1 1 A 94 94 ASP HA H 94 5.819 5.215 0.604 1
1 1005 . 12 1 1 A 94 94 ASP C C 94 175.654 175.166 0.488 1
1 1006 . 12 1 1 A 94 94 ASP CA C 94 53.330 52.855 0.475 1
1 1007 . 12 1 1 A 94 94 ASP CB C 94 44.720 44.899 -0.179 1
1 1008 . 12 1 1 A 94 94 ASP N N 94 123.504 122.399 1.105 1
1 1009 . 12 1 1 A 95 95 LYS H H 95 9.043 8.163 0.880 1
1 1010 . 12 1 1 A 95 95 LYS HA H 95 4.527 4.401 0.126 1
1 1019 . 12 1 1 A 95 95 LYS C C 95 174.879 176.575 -1.696 1
1 1020 . 12 1 1 A 95 95 LYS CA C 95 56.620 57.019 -0.399 1
1 1021 . 12 1 1 A 95 95 LYS CB C 95 33.720 33.370 0.350 1
1 1025 . 12 1 1 A 95 95 LYS N N 95 120.380 121.520 -1.140 1
1 1026 . 12 1 1 A 96 96 ASP H H 96 8.999 8.594 0.405 1
1 1027 . 12 1 1 A 96 96 ASP HA H 96 4.724 4.796 -0.072 1
1 1030 . 12 1 1 A 96 96 ASP C C 96 176.401 176.022 0.379 1
1 1031 . 12 1 1 A 96 96 ASP CA C 96 56.147 53.624 2.523 1
1 1032 . 12 1 1 A 96 96 ASP CB C 96 40.790 40.898 -0.108 1
1 1033 . 12 1 1 A 96 96 ASP N N 96 120.784 121.890 -1.106 1
1 1034 . 12 1 1 A 97 97 LYS H H 97 9.382 8.481 0.901 1
1 1035 . 12 1 1 A 97 97 LYS HA H 97 4.473 4.561 -0.088 1
1 1044 . 12 1 1 A 97 97 LYS C C 97 175.903 175.477 0.426 1
1 1045 . 12 1 1 A 97 97 LYS CA C 97 54.771 55.049 -0.278 1
1 1046 . 12 1 1 A 97 97 LYS CB C 97 33.270 32.570 0.700 1
1 1050 . 12 1 1 A 97 97 LYS N N 97 131.617 125.956 5.661 1
1 1051 . 12 1 1 A 98 98 LYS H H 98 8.940 7.941 0.999 1
1 1052 . 12 1 1 A 98 98 LYS HA H 98 4.118 3.864 0.254 1
1 1061 . 12 1 1 A 98 98 LYS C C 98 177.065 175.198 1.867 1
1 1062 . 12 1 1 A 98 98 LYS CA C 98 56.297 57.733 -1.436 1
1 1063 . 12 1 1 A 98 98 LYS CB C 98 28.467 29.745 -1.278 1
1 1067 . 12 1 1 A 98 98 LYS N N 98 115.034 115.232 -0.198 1
1 1068 . 12 1 1 A 99 99 GLN H H 99 9.266 7.709 1.557 1
1 1069 . 12 1 1 A 99 99 GLN HA H 99 4.460 4.340 0.120 1
1 1074 . 12 1 1 A 99 99 GLN C C 99 174.990 174.836 0.154 1
1 1075 . 12 1 1 A 99 99 GLN CA C 99 57.563 55.544 2.019 1
1 1076 . 12 1 1 A 99 99 GLN CB C 99 27.280 29.297 -2.017 1
1 1078 . 12 1 1 A 99 99 GLN N N 99 117.717 118.231 -0.514 1
1 1079 . 12 1 1 A 100 100 TYR H H 100 8.402 7.533 0.869 1
1 1080 . 12 1 1 A 100 100 TYR HA H 100 4.935 5.807 -0.872 1
1 1087 . 12 1 1 A 100 100 TYR C C 100 171.504 172.965 -1.461 1
1 1088 . 12 1 1 A 100 100 TYR CA C 100 55.786 55.143 0.643 1
1 1089 . 12 1 1 A 100 100 TYR CB C 100 41.090 41.394 -0.304 1
1 1092 . 12 1 1 A 100 100 TYR N N 100 115.081 117.139 -2.058 1
1 1093 . 12 1 1 A 101 101 HIS H H 101 8.829 9.033 -0.204 1
1 1094 . 12 1 1 A 101 101 HIS HA H 101 4.525 5.054 -0.529 1
1 1099 . 12 1 1 A 101 101 HIS C C 101 174.935 173.968 0.967 1
1 1100 . 12 1 1 A 101 101 HIS CA C 101 56.327 54.743 1.584 1
1 1101 . 12 1 1 A 101 101 HIS CB C 101 31.020 31.249 -0.229 1
1 1104 . 12 1 1 A 101 101 HIS N N 101 120.894 122.475 -1.581 1
1 1105 . 12 1 1 A 102 102 CYS H H 102 7.427 8.342 -0.915 1
1 1106 . 12 1 1 A 102 102 CYS HA H 102 4.561 4.516 0.045 1
1 1109 . 12 1 1 A 102 102 CYS C C 102 175.765 175.442 0.323 1
1 1110 . 12 1 1 A 102 102 CYS CA C 102 57.707 59.611 -1.904 1
1 1111 . 12 1 1 A 102 102 CYS CB C 102 29.130 28.440 0.690 1
1 1112 . 12 1 1 A 102 102 CYS N N 102 131.256 126.683 4.573 1
1 1113 . 12 1 1 A 103 103 GLU H H 103 9.497 8.901 0.596 1
1 1114 . 12 1 1 A 103 103 GLU HA H 103 4.003 4.063 -0.060 1
1 1119 . 12 1 1 A 103 103 GLU C C 103 176.540 178.574 -2.034 1
1 1120 . 12 1 1 A 103 103 GLU CA C 103 58.796 59.321 -0.525 1
1 1121 . 12 1 1 A 103 103 GLU CB C 103 29.280 29.553 -0.273 1
1 1123 . 12 1 1 A 103 103 GLU N N 103 129.829 128.240 1.589 1
1 1124 . 12 1 1 A 104 104 ASN H H 104 7.832 8.509 -0.677 1
1 1125 . 12 1 1 A 104 104 ASN HA H 104 4.457 4.436 0.021 1
1 1130 . 12 1 1 A 104 104 ASN C C 104 176.401 177.112 -0.711 1
1 1131 . 12 1 1 A 104 104 ASN CA C 104 56.053 55.900 0.153 1
1 1132 . 12 1 1 A 104 104 ASN CB C 104 38.400 37.324 1.076 1
1 1133 . 12 1 1 A 104 104 ASN N N 104 117.703 116.517 1.186 1
1 1135 . 12 1 1 A 105 105 CYS H H 105 9.415 7.802 1.613 1
1 1136 . 12 1 1 A 105 105 CYS HA H 105 4.137 4.417 -0.280 1
1 1139 . 12 1 1 A 105 105 CYS C C 105 176.844 175.409 1.435 1
1 1140 . 12 1 1 A 105 105 CYS CA C 105 64.328 59.381 4.947 1
1 1141 . 12 1 1 A 105 105 CYS CB C 105 30.350 28.107 2.243 1
1 1142 . 12 1 1 A 105 105 CYS N N 105 124.939 116.853 8.086 1
1 1143 . 12 1 1 A 106 106 GLY H H 106 8.145 8.781 -0.636 1
1 1144 . 12 1 1 A 106 106 GLY HA2 H 106 3.980 3.872 0.108 1
1 1145 . 12 1 1 A 106 106 GLY HA3 H 106 3.502 3.908 -0.406 1
1 1146 . 12 1 1 A 106 106 GLY C C 106 172.500 173.537 -1.037 1
1 1147 . 12 1 1 A 106 106 GLY CA C 106 44.968 45.987 -1.019 1
1 1148 . 12 1 1 A 106 106 GLY N N 106 106.090 109.640 -3.550 1
1 1149 . 12 1 1 A 107 107 ILE H H 107 6.465 6.989 -0.524 1
1 1150 . 12 1 1 A 107 107 ILE HA H 107 4.878 5.097 -0.219 1
1 1160 . 12 1 1 A 107 107 ILE C C 107 174.824 174.454 0.370 1
1 1161 . 12 1 1 A 107 107 ILE CA C 107 58.226 58.550 -0.324 1
1 1162 . 12 1 1 A 107 107 ILE CB C 107 44.460 42.234 2.226 1
1 1166 . 12 1 1 A 107 107 ILE N N 107 107.914 114.602 -6.688 1
1 1167 . 12 1 1 A 108 108 CYS H H 108 7.041 9.102 -2.061 1
1 1168 . 12 1 1 A 108 108 CYS HA H 108 5.018 5.735 -0.717 1
1 1171 . 12 1 1 A 108 108 CYS C C 108 175.461 172.960 2.501 1
1 1172 . 12 1 1 A 108 108 CYS CA C 108 62.097 56.998 5.099 1
1 1173 . 12 1 1 A 108 108 CYS CB C 108 31.353 31.046 0.307 1
1 1174 . 12 1 1 A 108 108 CYS N N 108 122.441 121.839 0.602 1
1 1175 . 12 1 1 A 109 109 ARG H H 109 8.561 7.862 0.699 1
1 1176 . 12 1 1 A 109 109 ARG HA H 109 4.239 4.629 -0.390 1
1 1183 . 12 1 1 A 109 109 ARG C C 109 174.271 174.158 0.113 1
1 1184 . 12 1 1 A 109 109 ARG CA C 109 52.962 54.492 -1.530 1
1 1185 . 12 1 1 A 109 109 ARG CB C 109 33.903 33.890 0.013 1
1 1188 . 12 1 1 A 109 109 ARG N N 109 121.163 121.696 -0.533 1
1 1189 . 12 1 1 A 110 110 ILE H H 110 7.847 8.265 -0.418 1
1 1190 . 12 1 1 A 110 110 ILE HA H 110 3.531 4.056 -0.525 1
1 1200 . 12 1 1 A 110 110 ILE C C 110 175.405 176.498 -1.093 1
1 1201 . 12 1 1 A 110 110 ILE CA C 110 62.201 62.115 0.086 1
1 1202 . 12 1 1 A 110 110 ILE CB C 110 36.860 37.227 -0.367 1
1 1206 . 12 1 1 A 110 110 ILE N N 110 118.955 125.543 -6.588 1
1 1207 . 12 1 1 A 111 111 GLY H H 111 6.928 8.184 -1.256 1
1 1208 . 12 1 1 A 111 111 GLY HA2 H 111 4.564 4.231 0.333 1
1 1209 . 12 1 1 A 111 111 GLY HA3 H 111 4.135 4.358 -0.223 1
1 1210 . 12 1 1 A 111 111 GLY CA C 111 43.068 45.541 -2.473 1
1 1211 . 12 1 1 A 111 111 GLY N N 111 113.782 113.549 0.233 1
1 1212 . 12 1 1 A 112 112 PRO HA H 112 4.990 4.722 0.268 1
1 1219 . 12 1 1 A 112 112 PRO C C 112 177.342 177.749 -0.407 1
1 1220 . 12 1 1 A 112 112 PRO CA C 112 62.920 62.884 0.036 1
1 1221 . 12 1 1 A 112 112 PRO CB C 112 34.807 31.726 3.081 1
1 1224 . 12 1 1 A 113 113 LYS H H 113 8.989 8.620 0.369 1
1 1225 . 12 1 1 A 113 113 LYS HA H 113 3.144 4.198 -1.054 1
1 1234 . 12 1 1 A 113 113 LYS C C 113 177.536 178.163 -0.627 1
1 1235 . 12 1 1 A 113 113 LYS CA C 113 59.883 59.045 0.838 1
1 1236 . 12 1 1 A 113 113 LYS CB C 113 32.260 32.065 0.195 1
1 1240 . 12 1 1 A 113 113 LYS N N 113 123.545 123.734 -0.189 1
1 1241 . 12 1 1 A 114 114 GLU H H 114 9.080 9.134 -0.054 1
1 1242 . 12 1 1 A 114 114 GLU HA H 114 4.199 4.134 0.065 1
1 1247 . 12 1 1 A 114 114 GLU C C 114 176.374 177.444 -1.070 1
1 1248 . 12 1 1 A 114 114 GLU CA C 114 58.733 59.474 -0.741 1
1 1249 . 12 1 1 A 114 114 GLU CB C 114 28.077 29.127 -1.050 1
1 1251 . 12 1 1 A 114 114 GLU N N 114 114.832 120.431 -5.599 1
1 1252 . 12 1 1 A 115 115 ASP H H 115 7.799 7.700 0.099 1
1 1253 . 12 1 1 A 115 115 ASP HA H 115 4.642 4.799 -0.157 1
1 1256 . 12 1 1 A 115 115 ASP C C 115 176.374 175.926 0.448 1
1 1257 . 12 1 1 A 115 115 ASP CA C 115 54.470 53.619 0.851 1
1 1258 . 12 1 1 A 115 115 ASP CB C 115 40.850 41.008 -0.158 1
1 1259 . 12 1 1 A 115 115 ASP N N 115 118.858 118.813 0.045 1
1 1260 . 12 1 1 A 116 116 PHE H H 116 8.063 7.918 0.145 1
1 1261 . 12 1 1 A 116 116 PHE HA H 116 5.239 4.509 0.730 1
1 1264 . 12 1 1 A 116 116 PHE C C 116 173.413 174.468 -1.055 1
1 1265 . 12 1 1 A 116 116 PHE CA C 116 57.708 58.661 -0.953 1
1 1266 . 12 1 1 A 116 116 PHE CB C 116 44.557 40.021 4.536 1
1 1267 . 12 1 1 A 116 116 PHE N N 116 120.567 121.255 -0.688 1
1 1268 . 12 1 1 A 117 117 PHE H H 117 9.439 8.293 1.146 1
1 1269 . 12 1 1 A 117 117 PHE HA H 117 5.091 4.327 0.764 1
1 1277 . 12 1 1 A 117 117 PHE C C 117 171.614 172.198 -0.584 1
1 1278 . 12 1 1 A 117 117 PHE CA C 117 55.311 55.209 0.102 1
1 1279 . 12 1 1 A 117 117 PHE CB C 117 41.887 41.590 0.297 1
1 1283 . 12 1 1 A 117 117 PHE N N 117 118.040 119.725 -1.685 1
1 1284 . 12 1 1 A 118 118 HIS H H 118 8.779 8.360 0.419 1
1 1285 . 12 1 1 A 118 118 HIS HA H 118 4.836 4.663 0.173 1
1 1289 . 12 1 1 A 118 118 HIS C C 118 174.879 173.619 1.260 1
1 1290 . 12 1 1 A 118 118 HIS CA C 118 55.322 56.234 -0.912 1
1 1291 . 12 1 1 A 118 118 HIS CB C 118 30.950 31.042 -0.092 1
1 1293 . 12 1 1 A 118 118 HIS N N 118 121.208 121.333 -0.125 1
1 1294 . 12 1 1 A 119 119 CYS H H 119 8.123 7.594 0.529 1
1 1295 . 12 1 1 A 119 119 CYS HA H 119 4.529 4.726 -0.197 1
1 1298 . 12 1 1 A 119 119 CYS C C 119 176.567 175.871 0.696 1
1 1299 . 12 1 1 A 119 119 CYS CA C 119 58.957 56.958 1.999 1
1 1300 . 12 1 1 A 119 119 CYS CB C 119 30.090 30.296 -0.206 1
1 1301 . 12 1 1 A 119 119 CYS N N 119 131.659 126.780 4.879 1
1 1302 . 12 1 1 A 120 120 LEU H H 120 8.970 8.785 0.185 1
1 1303 . 12 1 1 A 120 120 LEU N N 120 130.361 124.452 5.909 1
1 1304 . 12 1 1 A 121 121 LYS HA H 121 4.299 4.571 -0.272 1
1 1313 . 12 1 1 A 121 121 LYS CA C 121 58.727 55.337 3.390 1
1 1314 . 12 1 1 A 121 121 LYS CB C 121 33.210 34.093 -0.883 1
1 1318 . 12 1 1 A 123 123 ASN HA H 123 4.438 5.087 -0.649 1
1 1323 . 12 1 1 A 123 123 ASN C C 123 172.444 174.360 -1.916 1
1 1324 . 12 1 1 A 123 123 ASN CA C 123 53.448 53.439 0.009 1
1 1325 . 12 1 1 A 123 123 ASN CB C 123 37.130 38.849 -1.719 1
1 1327 . 12 1 1 A 124 124 LEU H H 124 6.596 7.308 -0.712 1
1 1328 . 12 1 1 A 124 124 LEU HA H 124 4.576 4.754 -0.178 1
1 1338 . 12 1 1 A 124 124 LEU C C 124 175.903 175.353 0.550 1
1 1339 . 12 1 1 A 124 124 LEU CA C 124 54.043 53.862 0.181 1
1 1340 . 12 1 1 A 124 124 LEU CB C 124 45.837 44.333 1.504 1
1 1344 . 12 1 1 A 124 124 LEU N N 124 115.443 121.899 -6.456 1
1 1345 . 12 1 1 A 125 125 CYS H H 125 6.342 8.649 -2.307 1
1 1346 . 12 1 1 A 125 125 CYS HA H 125 5.033 4.995 0.038 1
1 1349 . 12 1 1 A 125 125 CYS C C 125 175.101 174.117 0.984 1
1 1350 . 12 1 1 A 125 125 CYS CA C 125 62.046 57.387 4.659 1
1 1351 . 12 1 1 A 125 125 CYS CB C 125 30.840 29.057 1.783 1
1 1352 . 12 1 1 A 125 125 CYS N N 125 118.685 122.868 -4.183 1
1 1353 . 12 1 1 A 126 126 LEU H H 126 8.894 8.141 0.753 1
1 1354 . 12 1 1 A 126 126 LEU HA H 126 4.565 4.775 -0.210 1
1 1364 . 12 1 1 A 126 126 LEU C C 126 174.879 175.662 -0.783 1
1 1365 . 12 1 1 A 126 126 LEU CA C 126 52.751 52.901 -0.150 1
1 1366 . 12 1 1 A 126 126 LEU CB C 126 46.090 44.559 1.531 1
1 1370 . 12 1 1 A 126 126 LEU N N 126 124.501 126.219 -1.718 1
1 1371 . 12 1 1 A 127 127 ALA H H 127 8.378 8.551 -0.173 1
1 1372 . 12 1 1 A 127 127 ALA HA H 127 3.957 4.693 -0.736 1
1 1376 . 12 1 1 A 127 127 ALA C C 127 179.085 178.162 0.923 1
1 1377 . 12 1 1 A 127 127 ALA CA C 127 52.554 51.540 1.014 1
1 1378 . 12 1 1 A 127 127 ALA CB C 127 18.527 20.135 -1.608 1
1 1379 . 12 1 1 A 127 127 ALA N N 127 123.011 124.177 -1.166 1
1 1380 . 12 1 1 A 128 128 MET H H 128 8.237 9.065 -0.828 1
1 1385 . 12 1 1 A 128 128 MET N N 128 120.642 121.664 -1.022 1
1 1386 . 12 1 1 A 129 129 ASN HA H 129 4.502 4.541 -0.039 1
1 1389 . 12 1 1 A 129 129 ASN C C 129 175.931 177.256 -1.325 1
1 1390 . 12 1 1 A 129 129 ASN CA C 129 55.064 56.105 -1.041 1
1 1391 . 12 1 1 A 129 129 ASN CB C 129 36.920 39.111 -2.191 1
1 1392 . 12 1 1 A 130 130 LEU H H 130 8.211 7.847 0.364 1
1 1393 . 12 1 1 A 130 130 LEU HA H 130 4.489 4.203 0.286 1
1 1403 . 12 1 1 A 130 130 LEU C C 130 178.836 176.524 2.312 1
1 1404 . 12 1 1 A 130 130 LEU CA C 130 54.653 56.714 -2.061 1
1 1405 . 12 1 1 A 130 130 LEU CB C 130 41.887 42.233 -0.346 1
1 1409 . 12 1 1 A 130 130 LEU N N 130 118.563 119.738 -1.175 1
1 1410 . 12 1 1 A 131 131 GLN H H 131 7.953 7.744 0.209 1
1 1411 . 12 1 1 A 131 131 GLN HA H 131 3.729 4.715 -0.986 1
1 1418 . 12 1 1 A 131 131 GLN CA C 131 59.310 56.935 2.375 1
1 1419 . 12 1 1 A 131 131 GLN CB C 131 28.340 28.991 -0.651 1
1 1421 . 12 1 1 A 131 131 GLN N N 131 123.929 116.875 7.054 1
1 1423 . 12 1 1 A 132 132 GLY HA2 H 132 4.034 3.895 0.139 1
1 1424 . 12 1 1 A 132 132 GLY HA3 H 132 3.865 3.979 -0.114 1
1 1425 . 12 1 1 A 132 132 GLY C C 132 174.547 174.906 -0.359 1
1 1426 . 12 1 1 A 132 132 GLY CA C 132 45.902 45.052 0.850 1
1 1427 . 12 1 1 A 133 133 ARG H H 133 7.735 7.652 0.083 1
1 1428 . 12 1 1 A 133 133 ARG HA H 133 4.611 4.108 0.503 1
1 1435 . 12 1 1 A 133 133 ARG C C 133 175.461 176.136 -0.675 1
1 1436 . 12 1 1 A 133 133 ARG CA C 133 54.987 58.275 -3.288 1
1 1437 . 12 1 1 A 133 133 ARG CB C 133 31.470 30.216 1.254 1
1 1440 . 12 1 1 A 133 133 ARG N N 133 118.194 122.081 -3.887 1
1 1441 . 12 1 1 A 134 134 HIS H H 134 7.803 7.940 -0.137 1
1 1444 . 12 1 1 A 134 134 HIS N N 134 118.700 114.104 4.596 1
1 1445 . 12 1 1 A 135 135 LYS HA H 135 4.331 4.079 0.252 1
1 1454 . 12 1 1 A 135 135 LYS C C 135 174.852 176.496 -1.644 1
1 1455 . 12 1 1 A 135 135 LYS CA C 135 55.390 56.562 -1.172 1
1 1456 . 12 1 1 A 135 135 LYS CB C 135 32.970 32.606 0.364 1
1 1460 . 12 1 1 A 136 136 CYS H H 136 7.801 8.661 -0.860 1
1 1461 . 12 1 1 A 136 136 CYS HA H 136 4.113 4.938 -0.825 1
1 1464 . 12 1 1 A 136 136 CYS C C 136 174.879 174.271 0.608 1
1 1465 . 12 1 1 A 136 136 CYS CA C 136 60.028 58.491 1.537 1
1 1466 . 12 1 1 A 136 136 CYS CB C 136 30.350 28.821 1.529 1
1 1467 . 12 1 1 A 136 136 CYS N N 136 126.055 120.914 5.141 1
1 10 . 13 1 1 A 2 2 ALA H H 2 8.220 8.567 -0.347 1
1 11 . 13 1 1 A 2 2 ALA HA H 2 4.321 4.822 -0.501 1
1 15 . 13 1 1 A 2 2 ALA C C 2 177.564 175.962 1.602 1
1 16 . 13 1 1 A 2 2 ALA CA C 2 52.383 51.613 0.770 1
1 17 . 13 1 1 A 2 2 ALA CB C 2 19.290 22.761 -3.471 1
1 18 . 13 1 1 A 2 2 ALA N N 2 125.223 121.445 3.778 1
1 19 . 13 1 1 A 3 3 ALA H H 3 8.246 8.344 -0.098 1
1 20 . 13 1 1 A 3 3 ALA N N 3 123.250 123.524 -0.274 1
1 21 . 13 1 1 A 5 5 ALA HA H 5 4.415 4.728 -0.313 1
1 25 . 13 1 1 A 5 5 ALA C C 5 177.481 177.579 -0.098 1
1 26 . 13 1 1 A 5 5 ALA CA C 5 52.423 51.676 0.747 1
1 27 . 13 1 1 A 5 5 ALA CB C 5 19.420 19.835 -0.415 1
1 28 . 13 1 1 A 6 6 ARG H H 6 8.239 8.959 -0.720 1
1 29 . 13 1 1 A 6 6 ARG HA H 6 4.371 4.789 -0.418 1
1 36 . 13 1 1 A 6 6 ARG C C 6 176.180 175.491 0.689 1
1 37 . 13 1 1 A 6 6 ARG CA C 6 56.353 54.869 1.484 1
1 38 . 13 1 1 A 6 6 ARG CB C 6 31.170 30.168 1.002 1
1 41 . 13 1 1 A 6 6 ARG N N 6 120.436 120.410 0.026 1
1 42 . 13 1 1 A 7 7 GLU H H 7 8.535 8.527 0.008 1
1 43 . 13 1 1 A 7 7 GLU HA H 7 4.335 4.350 -0.015 1
1 48 . 13 1 1 A 7 7 GLU C C 7 176.346 176.518 -0.172 1
1 49 . 13 1 1 A 7 7 GLU CA C 7 56.740 55.938 0.802 1
1 50 . 13 1 1 A 7 7 GLU CB C 7 30.390 29.371 1.019 1
1 52 . 13 1 1 A 7 7 GLU N N 7 122.189 122.982 -0.793 1
1 53 . 13 1 1 A 8 8 ASP H H 8 8.347 8.329 0.018 1
1 54 . 13 1 1 A 8 8 ASP N N 8 121.112 126.176 -5.064 1
1 55 . 13 1 1 A 9 9 GLY HA2 H 9 3.975 3.849 0.126 1
1 56 . 13 1 1 A 9 9 GLY HA3 H 9 3.975 3.850 0.125 1
1 57 . 13 1 1 A 9 9 GLY C C 9 174.243 175.226 -0.983 1
1 58 . 13 1 1 A 9 9 GLY CA C 9 45.933 47.046 -1.113 1
1 59 . 13 1 1 A 10 10 ALA H H 10 8.111 8.462 -0.351 1
1 60 . 13 1 1 A 10 10 ALA N N 10 123.721 125.097 -1.376 1
1 61 . 13 1 1 A 12 12 GLY HA2 H 12 3.992 4.440 -0.448 1
1 62 . 13 1 1 A 12 12 GLY HA3 H 12 3.992 4.441 -0.449 1
1 63 . 13 1 1 A 12 12 GLY C C 12 173.883 171.741 2.142 1
1 64 . 13 1 1 A 12 12 GLY CA C 12 45.381 44.860 0.521 1
1 65 . 13 1 1 A 13 13 GLU H H 13 8.224 8.453 -0.229 1
1 66 . 13 1 1 A 13 13 GLU HA H 13 4.367 4.897 -0.530 1
1 71 . 13 1 1 A 13 13 GLU C C 13 176.125 176.052 0.073 1
1 72 . 13 1 1 A 13 13 GLU CA C 13 56.349 54.969 1.380 1
1 73 . 13 1 1 A 13 13 GLU CB C 13 29.560 33.158 -3.598 1
1 75 . 13 1 1 A 13 13 GLU N N 13 120.148 120.874 -0.726 1
1 76 . 13 1 1 A 14 14 GLU H H 14 8.508 8.611 -0.103 1
1 77 . 13 1 1 A 14 14 GLU HA H 14 4.302 4.493 -0.191 1
1 82 . 13 1 1 A 14 14 GLU C C 14 176.623 175.287 1.336 1
1 83 . 13 1 1 A 14 14 GLU CA C 14 56.497 56.350 0.147 1
1 84 . 13 1 1 A 14 14 GLU CB C 14 30.110 30.035 0.075 1
1 86 . 13 1 1 A 14 14 GLU N N 14 122.160 123.048 -0.888 1
1 87 . 13 1 1 A 15 15 ARG H H 15 8.356 7.524 0.832 1
1 88 . 13 1 1 A 15 15 ARG HA H 15 4.366 5.014 -0.648 1
1 95 . 13 1 1 A 15 15 ARG C C 15 176.844 176.168 0.676 1
1 96 . 13 1 1 A 15 15 ARG CA C 15 56.010 53.989 2.021 1
1 97 . 13 1 1 A 15 15 ARG CB C 15 30.890 33.600 -2.710 1
1 100 . 13 1 1 A 15 15 ARG N N 15 121.945 122.322 -0.377 1
1 101 . 13 1 1 A 16 16 GLY H H 16 8.414 8.792 -0.378 1
1 102 . 13 1 1 A 16 16 GLY HA2 H 16 4.022 3.929 0.093 1
1 103 . 13 1 1 A 16 16 GLY HA3 H 16 4.022 3.931 0.091 1
1 104 . 13 1 1 A 16 16 GLY C C 16 174.326 173.095 1.231 1
1 105 . 13 1 1 A 16 16 GLY CA C 16 45.620 46.499 -0.879 1
1 106 . 13 1 1 A 16 16 GLY N N 16 109.734 112.116 -2.382 1
1 107 . 13 1 1 A 17 17 GLN H H 17 8.184 8.541 -0.357 1
1 108 . 13 1 1 A 17 17 GLN HA H 17 4.366 5.134 -0.768 1
1 113 . 13 1 1 A 17 17 GLN C C 17 175.544 174.906 0.638 1
1 114 . 13 1 1 A 17 17 GLN CA C 17 55.749 53.846 1.903 1
1 115 . 13 1 1 A 17 17 GLN CB C 17 29.367 31.855 -2.488 1
1 117 . 13 1 1 A 17 17 GLN N N 17 119.546 125.397 -5.851 1
1 118 . 13 1 1 A 18 18 ARG H H 18 8.366 8.675 -0.309 1
1 119 . 13 1 1 A 18 18 ARG HA H 18 4.487 4.896 -0.409 1
1 126 . 13 1 1 A 18 18 ARG C C 18 176.042 175.201 0.841 1
1 127 . 13 1 1 A 18 18 ARG CA C 18 55.735 54.470 1.265 1
1 128 . 13 1 1 A 18 18 ARG CB C 18 31.170 33.591 -2.421 1
1 131 . 13 1 1 A 18 18 ARG N N 18 122.330 118.997 3.333 1
1 132 . 13 1 1 A 19 19 GLY H H 19 8.192 8.519 -0.327 1
1 133 . 13 1 1 A 19 19 GLY HA2 H 19 4.852 4.145 0.707 1
1 134 . 13 1 1 A 19 19 GLY HA3 H 19 3.894 4.152 -0.258 1
1 135 . 13 1 1 A 19 19 GLY C C 19 172.361 171.694 0.667 1
1 136 . 13 1 1 A 19 19 GLY CA C 19 45.580 44.374 1.206 1
1 137 . 13 1 1 A 19 19 GLY N N 19 109.658 107.279 2.379 1
1 138 . 13 1 1 A 20 20 CYS H H 20 8.843 8.014 0.829 1
1 139 . 13 1 1 A 20 20 CYS HA H 20 5.147 5.116 0.031 1
1 142 . 13 1 1 A 20 20 CYS C C 20 175.211 174.487 0.724 1
1 143 . 13 1 1 A 20 20 CYS CA C 20 56.712 58.145 -1.433 1
1 144 . 13 1 1 A 20 20 CYS CB C 20 33.530 30.692 2.838 1
1 145 . 13 1 1 A 20 20 CYS N N 20 120.185 118.631 1.554 1
1 146 . 13 1 1 A 21 21 GLU H H 21 8.981 8.828 0.153 1
1 147 . 13 1 1 A 21 21 GLU HA H 21 4.100 4.018 0.082 1
1 152 . 13 1 1 A 21 21 GLU C C 21 176.014 177.758 -1.744 1
1 153 . 13 1 1 A 21 21 GLU CA C 21 57.134 58.547 -1.413 1
1 154 . 13 1 1 A 21 21 GLU CB C 21 28.890 28.935 -0.045 1
1 156 . 13 1 1 A 21 21 GLU N N 21 116.078 124.615 -8.537 1
1 157 . 13 1 1 A 22 22 HIS H H 22 9.342 7.576 1.766 1
1 158 . 13 1 1 A 22 22 HIS HA H 22 4.210 4.190 0.020 1
1 161 . 13 1 1 A 22 22 HIS C C 22 175.128 174.817 0.311 1
1 162 . 13 1 1 A 22 22 HIS CA C 22 58.945 58.663 0.282 1
1 163 . 13 1 1 A 22 22 HIS CB C 22 33.160 30.604 2.556 1
1 164 . 13 1 1 A 22 22 HIS N N 22 122.296 117.398 4.898 1
1 165 . 13 1 1 A 23 23 TYR H H 23 7.931 7.776 0.155 1
1 166 . 13 1 1 A 23 23 TYR HA H 23 4.856 5.240 -0.384 1
1 171 . 13 1 1 A 23 23 TYR C C 23 173.108 174.471 -1.363 1
1 172 . 13 1 1 A 23 23 TYR CA C 23 57.852 56.132 1.720 1
1 173 . 13 1 1 A 23 23 TYR CB C 23 45.300 42.134 3.166 1
1 175 . 13 1 1 A 23 23 TYR N N 23 115.205 115.117 0.088 1
1 176 . 13 1 1 A 24 24 ASP H H 24 8.384 8.789 -0.405 1
1 177 . 13 1 1 A 24 24 ASP HA H 24 5.160 5.060 0.100 1
1 180 . 13 1 1 A 24 24 ASP C C 24 174.437 175.385 -0.948 1
1 181 . 13 1 1 A 24 24 ASP CA C 24 53.343 53.808 -0.465 1
1 182 . 13 1 1 A 24 24 ASP CB C 24 41.470 40.884 0.586 1
1 183 . 13 1 1 A 24 24 ASP N N 24 122.016 124.534 -2.518 1
1 184 . 13 1 1 A 25 25 ARG H H 25 7.313 8.469 -1.156 1
1 185 . 13 1 1 A 25 25 ARG HA H 25 5.331 5.060 0.271 1
1 192 . 13 1 1 A 25 25 ARG C C 25 175.045 175.917 -0.872 1
1 193 . 13 1 1 A 25 25 ARG CA C 25 54.224 54.646 -0.422 1
1 194 . 13 1 1 A 25 25 ARG CB C 25 34.090 33.907 0.183 1
1 197 . 13 1 1 A 25 25 ARG N N 25 115.898 121.953 -6.055 1
1 198 . 13 1 1 A 26 26 GLY H H 26 9.387 9.010 0.377 1
1 199 . 13 1 1 A 26 26 GLY HA2 H 26 4.622 3.839 0.783 1
1 200 . 13 1 1 A 26 26 GLY HA3 H 26 3.788 3.873 -0.085 1
1 201 . 13 1 1 A 26 26 GLY C C 26 170.978 172.950 -1.972 1
1 202 . 13 1 1 A 26 26 GLY CA C 26 44.794 45.648 -0.854 1
1 203 . 13 1 1 A 26 26 GLY N N 26 105.653 108.195 -2.542 1
1 204 . 13 1 1 A 27 27 CYS H H 27 6.864 7.554 -0.690 1
1 205 . 13 1 1 A 27 27 CYS HA H 27 5.195 5.190 0.005 1
1 208 . 13 1 1 A 27 27 CYS C C 27 171.144 172.856 -1.712 1
1 209 . 13 1 1 A 27 27 CYS CA C 27 52.349 57.987 -5.638 1
1 210 . 13 1 1 A 27 27 CYS CB C 27 30.997 32.202 -1.205 1
1 211 . 13 1 1 A 27 27 CYS N N 27 110.921 117.608 -6.687 1
1 212 . 13 1 1 A 28 28 LEU H H 28 8.310 8.709 -0.399 1
1 213 . 13 1 1 A 28 28 LEU HA H 28 4.651 4.980 -0.329 1
1 223 . 13 1 1 A 28 28 LEU C C 28 176.827 176.916 -0.089 1
1 224 . 13 1 1 A 28 28 LEU CA C 28 53.054 53.388 -0.334 1
1 225 . 13 1 1 A 28 28 LEU CB C 28 44.200 43.356 0.844 1
1 229 . 13 1 1 A 28 28 LEU N N 28 115.519 123.004 -7.485 1
1 230 . 13 1 1 A 29 29 LEU H H 29 8.800 8.763 0.037 1
1 231 . 13 1 1 A 29 29 LEU HA H 29 4.313 4.221 0.092 1
1 240 . 13 1 1 A 29 29 LEU C C 29 175.571 176.768 -1.197 1
1 241 . 13 1 1 A 29 29 LEU CA C 29 54.388 55.201 -0.813 1
1 242 . 13 1 1 A 29 29 LEU CB C 29 42.780 41.386 1.394 1
1 245 . 13 1 1 A 29 29 LEU N N 29 118.712 125.307 -6.595 1
1 246 . 13 1 1 A 30 30 LYS H H 30 8.009 8.368 -0.359 1
1 247 . 13 1 1 A 30 30 LYS HA H 30 4.592 4.556 0.036 1
1 256 . 13 1 1 A 30 30 LYS C C 30 174.990 175.311 -0.321 1
1 257 . 13 1 1 A 30 30 LYS CA C 30 54.999 56.378 -1.379 1
1 258 . 13 1 1 A 30 30 LYS CB C 30 32.330 32.776 -0.446 1
1 262 . 13 1 1 A 30 30 LYS N N 30 122.310 125.629 -3.319 1
1 263 . 13 1 1 A 31 31 ALA H H 31 9.238 8.472 0.766 1
1 264 . 13 1 1 A 31 31 ALA HA H 31 4.477 4.379 0.098 1
1 268 . 13 1 1 A 31 31 ALA CA C 31 50.190 50.146 0.044 1
1 269 . 13 1 1 A 31 31 ALA CB C 31 21.637 19.765 1.872 1
1 270 . 13 1 1 A 31 31 ALA N N 31 133.864 130.112 3.752 1
1 271 . 13 1 1 A 32 32 PRO HA H 32 4.637 4.481 0.156 1
1 278 . 13 1 1 A 32 32 PRO C C 32 175.737 177.374 -1.637 1
1 279 . 13 1 1 A 32 32 PRO CA C 32 64.259 64.100 0.159 1
1 280 . 13 1 1 A 32 32 PRO CB C 32 31.740 31.828 -0.088 1
1 283 . 13 1 1 A 33 33 CYS H H 33 8.779 8.268 0.511 1
1 284 . 13 1 1 A 33 33 CYS HA H 33 4.321 4.325 -0.004 1
1 287 . 13 1 1 A 33 33 CYS C C 33 176.733 175.745 0.988 1
1 288 . 13 1 1 A 33 33 CYS CA C 33 54.398 61.586 -7.188 1
1 289 . 13 1 1 A 33 33 CYS CB C 33 30.697 27.585 3.112 1
1 290 . 13 1 1 A 33 33 CYS N N 33 120.005 116.559 3.446 1
1 291 . 13 1 1 A 34 34 CYS H H 34 7.424 7.825 -0.401 1
1 292 . 13 1 1 A 34 34 CYS HA H 34 4.896 4.707 0.189 1
1 295 . 13 1 1 A 34 34 CYS C C 34 174.935 174.569 0.366 1
1 296 . 13 1 1 A 34 34 CYS CA C 34 56.962 58.480 -1.518 1
1 297 . 13 1 1 A 34 34 CYS CB C 34 31.067 29.135 1.932 1
1 298 . 13 1 1 A 34 34 CYS N N 34 115.034 119.277 -4.243 1
1 299 . 13 1 1 A 35 35 ASP H H 35 8.368 8.165 0.203 1
1 300 . 13 1 1 A 35 35 ASP HA H 35 4.454 4.231 0.223 1
1 303 . 13 1 1 A 35 35 ASP C C 35 174.354 174.720 -0.366 1
1 304 . 13 1 1 A 35 35 ASP CA C 35 56.222 55.601 0.621 1
1 305 . 13 1 1 A 35 35 ASP CB C 35 39.730 40.459 -0.729 1
1 306 . 13 1 1 A 35 35 ASP N N 35 121.381 120.049 1.332 1
1 307 . 13 1 1 A 36 36 LYS H H 36 7.227 7.884 -0.657 1
1 308 . 13 1 1 A 36 36 LYS HA H 36 4.451 4.560 -0.109 1
1 317 . 13 1 1 A 36 36 LYS C C 36 175.433 175.701 -0.268 1
1 318 . 13 1 1 A 36 36 LYS CA C 36 56.270 54.924 1.346 1
1 319 . 13 1 1 A 36 36 LYS CB C 36 36.620 33.859 2.761 1
1 323 . 13 1 1 A 36 36 LYS N N 36 117.673 120.342 -2.669 1
1 324 . 13 1 1 A 37 37 LEU H H 37 8.053 8.182 -0.129 1
1 325 . 13 1 1 A 37 37 LEU HA H 37 5.292 5.001 0.291 1
1 335 . 13 1 1 A 37 37 LEU C C 37 176.484 175.198 1.286 1
1 336 . 13 1 1 A 37 37 LEU CA C 37 53.348 52.883 0.465 1
1 337 . 13 1 1 A 37 37 LEU CB C 37 42.400 42.976 -0.576 1
1 341 . 13 1 1 A 37 37 LEU N N 37 120.994 121.344 -0.350 1
1 342 . 13 1 1 A 38 38 TYR H H 38 8.741 8.748 -0.007 1
1 343 . 13 1 1 A 38 38 TYR HA H 38 5.002 4.884 0.118 1
1 350 . 13 1 1 A 38 38 TYR C C 38 176.374 176.074 0.300 1
1 351 . 13 1 1 A 38 38 TYR CA C 38 57.081 56.826 0.255 1
1 352 . 13 1 1 A 38 38 TYR CB C 38 45.647 41.475 4.172 1
1 355 . 13 1 1 A 38 38 TYR N N 38 121.128 122.540 -1.412 1
1 356 . 13 1 1 A 39 39 THR H H 39 9.402 8.778 0.624 1
1 357 . 13 1 1 A 39 39 THR HA H 39 4.098 4.074 0.024 1
1 362 . 13 1 1 A 39 39 THR C C 39 173.496 175.158 -1.662 1
1 363 . 13 1 1 A 39 39 THR CA C 39 67.062 65.904 1.158 1
1 364 . 13 1 1 A 39 39 THR CB C 39 68.047 68.778 -0.731 1
1 366 . 13 1 1 A 39 39 THR N N 39 116.641 118.056 -1.415 1
1 367 . 13 1 1 A 40 40 CYS H H 40 7.317 8.113 -0.796 1
1 368 . 13 1 1 A 40 40 CYS HA H 40 4.771 4.885 -0.114 1
1 371 . 13 1 1 A 40 40 CYS C C 40 175.128 175.131 -0.003 1
1 372 . 13 1 1 A 40 40 CYS CA C 40 56.577 57.731 -1.154 1
1 373 . 13 1 1 A 40 40 CYS CB C 40 35.087 30.134 4.953 1
1 374 . 13 1 1 A 40 40 CYS N N 40 109.059 118.628 -9.569 1
1 375 . 13 1 1 A 41 41 ARG H H 41 9.201 8.799 0.402 1
1 376 . 13 1 1 A 41 41 ARG HA H 41 3.982 3.983 -0.001 1
1 383 . 13 1 1 A 41 41 ARG C C 41 175.101 177.885 -2.784 1
1 384 . 13 1 1 A 41 41 ARG CA C 41 58.591 58.803 -0.212 1
1 385 . 13 1 1 A 41 41 ARG CB C 41 29.640 29.716 -0.076 1
1 388 . 13 1 1 A 41 41 ARG N N 41 121.737 124.465 -2.728 1
1 389 . 13 1 1 A 42 42 LEU H H 42 9.116 7.664 1.452 1
1 390 . 13 1 1 A 42 42 LEU HA H 42 4.029 4.040 -0.011 1
1 400 . 13 1 1 A 42 42 LEU C C 42 179.943 179.005 0.938 1
1 401 . 13 1 1 A 42 42 LEU CA C 42 58.005 57.713 0.292 1
1 402 . 13 1 1 A 42 42 LEU CB C 42 38.960 41.066 -2.106 1
1 406 . 13 1 1 A 42 42 LEU N N 42 126.364 116.493 9.871 1
1 407 . 13 1 1 A 43 43 CYS H H 43 8.785 8.278 0.507 1
1 408 . 13 1 1 A 43 43 CYS HA H 43 4.187 4.286 -0.099 1
1 411 . 13 1 1 A 43 43 CYS C C 43 177.785 177.224 0.561 1
1 412 . 13 1 1 A 43 43 CYS CA C 43 66.415 62.336 4.079 1
1 413 . 13 1 1 A 43 43 CYS CB C 43 28.870 26.818 2.052 1
1 414 . 13 1 1 A 43 43 CYS N N 43 124.519 117.078 7.441 1
1 415 . 13 1 1 A 44 44 HIS H H 44 7.604 7.174 0.430 1
1 416 . 13 1 1 A 44 44 HIS HA H 44 1.983 3.051 -1.068 1
1 420 . 13 1 1 A 44 44 HIS C C 44 176.429 176.637 -0.208 1
1 421 . 13 1 1 A 44 44 HIS CA C 44 58.760 58.655 0.105 1
1 422 . 13 1 1 A 44 44 HIS CB C 44 27.990 29.284 -1.294 1
1 423 . 13 1 1 A 44 44 HIS N N 44 117.024 121.121 -4.097 1
1 424 . 13 1 1 A 45 45 ASP H H 45 8.750 8.052 0.698 1
1 425 . 13 1 1 A 45 45 ASP HA H 45 4.116 4.547 -0.431 1
1 428 . 13 1 1 A 45 45 ASP C C 45 177.453 178.663 -1.210 1
1 429 . 13 1 1 A 45 45 ASP CA C 45 56.840 56.987 -0.147 1
1 430 . 13 1 1 A 45 45 ASP CB C 45 38.960 41.559 -2.599 1
1 431 . 13 1 1 A 45 45 ASP N N 45 120.440 119.143 1.297 1
1 432 . 13 1 1 A 46 46 ASN H H 46 7.888 8.018 -0.130 1
1 433 . 13 1 1 A 46 46 ASN HA H 46 4.612 4.414 0.198 1
1 438 . 13 1 1 A 46 46 ASN C C 46 175.903 176.700 -0.797 1
1 439 . 13 1 1 A 46 46 ASN CA C 46 54.342 56.383 -2.041 1
1 440 . 13 1 1 A 46 46 ASN CB C 46 38.790 38.679 0.111 1
1 441 . 13 1 1 A 46 46 ASN N N 46 115.758 117.353 -1.595 1
1 443 . 13 1 1 A 47 47 ASN H H 47 7.384 7.627 -0.243 1
1 444 . 13 1 1 A 47 47 ASN HA H 47 4.893 4.724 0.169 1
1 449 . 13 1 1 A 47 47 ASN C C 47 173.579 175.322 -1.743 1
1 450 . 13 1 1 A 47 47 ASN CA C 47 53.937 54.590 -0.653 1
1 451 . 13 1 1 A 47 47 ASN CB C 47 43.130 39.687 3.443 1
1 452 . 13 1 1 A 47 47 ASN N N 47 116.576 115.124 1.452 1
1 454 . 13 1 1 A 48 48 GLU H H 48 7.143 7.731 -0.588 1
1 455 . 13 1 1 A 48 48 GLU HA H 48 4.572 4.589 -0.017 1
1 460 . 13 1 1 A 48 48 GLU C C 48 175.627 176.903 -1.276 1
1 461 . 13 1 1 A 48 48 GLU CA C 48 53.727 54.705 -0.978 1
1 462 . 13 1 1 A 48 48 GLU CB C 48 32.480 30.974 1.506 1
1 464 . 13 1 1 A 48 48 GLU N N 48 116.967 117.368 -0.401 1
1 465 . 13 1 1 A 49 49 ASP H H 49 8.748 8.968 -0.220 1
1 466 . 13 1 1 A 49 49 ASP HA H 49 4.576 4.497 0.079 1
1 469 . 13 1 1 A 49 49 ASP C C 49 174.796 176.231 -1.435 1
1 470 . 13 1 1 A 49 49 ASP CA C 49 53.027 56.221 -3.194 1
1 471 . 13 1 1 A 49 49 ASP CB C 49 40.340 40.620 -0.280 1
1 472 . 13 1 1 A 49 49 ASP N N 49 119.296 120.917 -1.621 1
1 473 . 13 1 1 A 50 50 HIS H H 50 6.919 7.867 -0.948 1
1 474 . 13 1 1 A 50 50 HIS HA H 50 4.880 5.254 -0.374 1
1 477 . 13 1 1 A 50 50 HIS C C 50 172.942 174.407 -1.465 1
1 478 . 13 1 1 A 50 50 HIS CA C 50 53.978 53.227 0.751 1
1 479 . 13 1 1 A 50 50 HIS CB C 50 30.330 32.482 -2.152 1
1 480 . 13 1 1 A 50 50 HIS N N 50 113.709 114.023 -0.314 1
1 481 . 13 1 1 A 51 51 GLN H H 51 8.646 8.145 0.501 1
1 482 . 13 1 1 A 51 51 GLN HA H 51 4.896 4.104 0.792 1
1 487 . 13 1 1 A 51 51 GLN C C 51 176.512 174.504 2.008 1
1 488 . 13 1 1 A 51 51 GLN CA C 51 54.872 55.314 -0.442 1
1 489 . 13 1 1 A 51 51 GLN CB C 51 30.950 29.203 1.747 1
1 491 . 13 1 1 A 51 51 GLN N N 51 119.379 118.311 1.068 1
1 492 . 13 1 1 A 52 52 LEU H H 52 9.646 7.960 1.686 1
1 493 . 13 1 1 A 52 52 LEU HA H 52 4.206 4.140 0.066 1
1 503 . 13 1 1 A 52 52 LEU C C 52 175.793 174.958 0.835 1
1 504 . 13 1 1 A 52 52 LEU CA C 52 55.450 53.992 1.458 1
1 505 . 13 1 1 A 52 52 LEU CB C 52 41.407 43.031 -1.624 1
1 509 . 13 1 1 A 52 52 LEU N N 52 128.069 124.537 3.532 1
1 510 . 13 1 1 A 53 53 ASP H H 53 9.281 8.829 0.452 1
1 511 . 13 1 1 A 53 53 ASP HA H 53 4.725 4.577 0.148 1
1 514 . 13 1 1 A 53 53 ASP C C 53 176.401 176.894 -0.493 1
1 515 . 13 1 1 A 53 53 ASP CA C 53 52.590 53.649 -1.059 1
1 516 . 13 1 1 A 53 53 ASP CB C 53 39.990 39.315 0.675 1
1 517 . 13 1 1 A 53 53 ASP N N 53 128.783 126.635 2.148 1
1 518 . 13 1 1 A 54 54 ARG H H 54 8.496 7.984 0.512 1
1 519 . 13 1 1 A 54 54 ARG HA H 54 3.859 3.839 0.020 1
1 526 . 13 1 1 A 54 54 ARG C C 54 176.346 177.890 -1.544 1
1 527 . 13 1 1 A 54 54 ARG CA C 54 57.357 58.414 -1.057 1
1 528 . 13 1 1 A 54 54 ARG CB C 54 28.890 29.630 -0.740 1
1 531 . 13 1 1 A 54 54 ARG N N 54 125.813 122.899 2.914 1
1 532 . 13 1 1 A 55 55 PHE H H 55 8.005 7.398 0.607 1
1 533 . 13 1 1 A 55 55 PHE HA H 55 4.712 4.299 0.413 1
1 540 . 13 1 1 A 55 55 PHE C C 55 177.481 176.797 0.684 1
1 541 . 13 1 1 A 55 55 PHE CA C 55 59.080 60.349 -1.269 1
1 542 . 13 1 1 A 55 55 PHE CB C 55 37.447 39.073 -1.626 1
1 545 . 13 1 1 A 55 55 PHE N N 55 120.168 118.222 1.946 1
1 546 . 13 1 1 A 56 56 LYS H H 56 7.681 7.286 0.395 1
1 547 . 13 1 1 A 56 56 LYS HA H 56 4.411 4.241 0.170 1
1 556 . 13 1 1 A 56 56 LYS C C 56 175.959 176.126 -0.167 1
1 557 . 13 1 1 A 56 56 LYS CA C 56 55.459 55.607 -0.148 1
1 558 . 13 1 1 A 56 56 LYS CB C 56 33.590 32.993 0.597 1
1 562 . 13 1 1 A 56 56 LYS N N 56 116.937 115.693 1.244 1
1 563 . 13 1 1 A 57 57 VAL H H 57 6.553 7.157 -0.604 1
1 564 . 13 1 1 A 57 57 VAL HA H 57 3.408 3.912 -0.504 1
1 572 . 13 1 1 A 57 57 VAL C C 57 173.911 175.859 -1.948 1
1 573 . 13 1 1 A 57 57 VAL CA C 57 65.025 61.861 3.164 1
1 574 . 13 1 1 A 57 57 VAL CB C 57 32.663 31.771 0.892 1
1 577 . 13 1 1 A 57 57 VAL N N 57 119.519 118.502 1.017 1
1 578 . 13 1 1 A 58 58 LYS H H 58 9.182 8.807 0.375 1
1 579 . 13 1 1 A 58 58 LYS HA H 58 4.489 4.332 0.157 1
1 588 . 13 1 1 A 58 58 LYS C C 58 176.927 176.012 0.915 1
1 589 . 13 1 1 A 58 58 LYS CA C 58 55.913 57.711 -1.798 1
1 590 . 13 1 1 A 58 58 LYS CB C 58 36.340 33.705 2.635 1
1 594 . 13 1 1 A 58 58 LYS N N 58 124.985 126.549 -1.564 1
1 595 . 13 1 1 A 59 59 GLU H H 59 8.799 7.681 1.118 1
1 596 . 13 1 1 A 59 59 GLU HA H 59 5.209 4.789 0.420 1
1 601 . 13 1 1 A 59 59 GLU C C 59 173.911 175.143 -1.232 1
1 602 . 13 1 1 A 59 59 GLU CA C 59 54.670 54.744 -0.074 1
1 603 . 13 1 1 A 59 59 GLU CB C 59 35.180 32.937 2.243 1
1 605 . 13 1 1 A 59 59 GLU N N 59 121.493 116.381 5.112 1
1 606 . 13 1 1 A 60 60 VAL H H 60 8.917 8.735 0.182 1
1 607 . 13 1 1 A 60 60 VAL HA H 60 4.983 4.931 0.052 1
1 615 . 13 1 1 A 60 60 VAL C C 60 173.441 173.673 -0.232 1
1 616 . 13 1 1 A 60 60 VAL CA C 60 57.497 59.295 -1.798 1
1 617 . 13 1 1 A 60 60 VAL CB C 60 35.460 36.237 -0.777 1
1 620 . 13 1 1 A 60 60 VAL N N 60 109.266 117.233 -7.967 1
1 621 . 13 1 1 A 61 61 GLN H H 61 8.970 8.433 0.537 1
1 622 . 13 1 1 A 61 61 GLN HA H 61 5.024 5.290 -0.266 1
1 629 . 13 1 1 A 61 61 GLN C C 61 175.045 174.230 0.815 1
1 630 . 13 1 1 A 61 61 GLN CA C 61 53.128 54.254 -1.126 1
1 631 . 13 1 1 A 61 61 GLN CB C 61 33.980 31.433 2.547 1
1 633 . 13 1 1 A 61 61 GLN N N 61 118.525 119.989 -1.464 1
1 635 . 13 1 1 A 62 62 CYS H H 62 7.688 8.813 -1.125 1
1 636 . 13 1 1 A 62 62 CYS HA H 62 4.210 4.548 -0.338 1
1 639 . 13 1 1 A 62 62 CYS C C 62 177.951 174.962 2.989 1
1 640 . 13 1 1 A 62 62 CYS CA C 62 59.845 58.332 1.513 1
1 641 . 13 1 1 A 62 62 CYS CB C 62 33.120 28.567 4.553 1
1 642 . 13 1 1 A 62 62 CYS N N 62 128.772 121.770 7.002 1
1 643 . 13 1 1 A 63 63 ILE H H 63 8.192 8.647 -0.455 1
1 644 . 13 1 1 A 63 63 ILE HA H 63 3.984 4.303 -0.319 1
1 654 . 13 1 1 A 63 63 ILE C C 63 175.433 175.892 -0.459 1
1 655 . 13 1 1 A 63 63 ILE CA C 63 63.657 61.030 2.627 1
1 656 . 13 1 1 A 63 63 ILE CB C 63 38.506 35.565 2.941 1
1 660 . 13 1 1 A 63 63 ILE N N 63 127.455 128.439 -0.984 1
1 661 . 13 1 1 A 64 64 ASN H H 64 9.181 8.441 0.740 1
1 662 . 13 1 1 A 64 64 ASN HA H 64 4.810 5.045 -0.235 1
1 667 . 13 1 1 A 64 64 ASN C C 64 175.931 176.026 -0.095 1
1 668 . 13 1 1 A 64 64 ASN CA C 64 55.617 54.330 1.287 1
1 669 . 13 1 1 A 64 64 ASN CB C 64 40.640 41.789 -1.149 1
1 670 . 13 1 1 A 64 64 ASN N N 64 122.104 122.705 -0.601 1
1 672 . 13 1 1 A 65 65 CYS H H 65 9.065 7.752 1.313 1
1 673 . 13 1 1 A 65 65 CYS HA H 65 4.979 4.601 0.378 1
1 676 . 13 1 1 A 65 65 CYS C C 65 176.291 175.027 1.264 1
1 677 . 13 1 1 A 65 65 CYS CA C 65 59.027 58.371 0.656 1
1 678 . 13 1 1 A 65 65 CYS CB C 65 32.030 29.280 2.750 1
1 679 . 13 1 1 A 65 65 CYS N N 65 120.368 115.749 4.619 1
1 680 . 13 1 1 A 66 66 GLU H H 66 7.281 8.044 -0.763 1
1 681 . 13 1 1 A 66 66 GLU HA H 66 4.046 3.978 0.068 1
1 686 . 13 1 1 A 66 66 GLU C C 66 175.211 175.185 0.026 1
1 687 . 13 1 1 A 66 66 GLU CA C 66 58.591 57.557 1.034 1
1 688 . 13 1 1 A 66 66 GLU CB C 66 27.067 27.280 -0.213 1
1 690 . 13 1 1 A 66 66 GLU N N 66 115.012 115.523 -0.511 1
1 691 . 13 1 1 A 67 67 LYS H H 67 8.481 7.813 0.668 1
1 692 . 13 1 1 A 67 67 LYS HA H 67 4.326 4.289 0.037 1
1 701 . 13 1 1 A 67 67 LYS C C 67 177.923 176.015 1.908 1
1 702 . 13 1 1 A 67 67 LYS CA C 67 57.628 56.617 1.011 1
1 703 . 13 1 1 A 67 67 LYS CB C 67 33.617 32.892 0.725 1
1 707 . 13 1 1 A 67 67 LYS N N 67 123.514 120.768 2.746 1
1 708 . 13 1 1 A 68 68 ILE H H 68 8.867 8.586 0.281 1
1 709 . 13 1 1 A 68 68 ILE HA H 68 4.976 4.614 0.362 1
1 719 . 13 1 1 A 68 68 ILE C C 68 175.018 175.512 -0.494 1
1 720 . 13 1 1 A 68 68 ILE CA C 68 60.919 60.855 0.064 1
1 721 . 13 1 1 A 68 68 ILE CB C 68 37.090 36.664 0.426 1
1 725 . 13 1 1 A 68 68 ILE N N 68 133.478 128.263 5.215 1
1 726 . 13 1 1 A 69 69 GLN H H 69 9.269 8.550 0.719 1
1 727 . 13 1 1 A 69 69 GLN HA H 69 5.036 5.069 -0.033 1
1 732 . 13 1 1 A 69 69 GLN C C 69 173.607 174.688 -1.081 1
1 733 . 13 1 1 A 69 69 GLN CA C 69 53.419 53.889 -0.470 1
1 734 . 13 1 1 A 69 69 GLN CB C 69 34.997 32.423 2.574 1
1 736 . 13 1 1 A 69 69 GLN N N 69 125.104 123.477 1.627 1
1 737 . 13 1 1 A 70 70 HIS H H 70 8.829 8.975 -0.146 1
1 738 . 13 1 1 A 70 70 HIS HA H 70 4.865 4.801 0.064 1
1 741 . 13 1 1 A 70 70 HIS C C 70 174.852 175.150 -0.298 1
1 742 . 13 1 1 A 70 70 HIS CA C 70 56.304 57.064 -0.760 1
1 743 . 13 1 1 A 70 70 HIS CB C 70 30.050 30.476 -0.426 1
1 744 . 13 1 1 A 70 70 HIS N N 70 118.576 120.331 -1.755 1
1 745 . 13 1 1 A 71 71 ALA H H 71 7.768 8.608 -0.840 1
1 746 . 13 1 1 A 71 71 ALA HA H 71 3.977 4.588 -0.611 1
1 750 . 13 1 1 A 71 71 ALA C C 71 175.433 176.992 -1.559 1
1 751 . 13 1 1 A 71 71 ALA CA C 71 54.393 52.535 1.858 1
1 752 . 13 1 1 A 71 71 ALA CB C 71 18.000 18.814 -0.814 1
1 753 . 13 1 1 A 71 71 ALA N N 71 121.438 124.659 -3.221 1
1 754 . 13 1 1 A 72 72 GLN H H 72 7.227 8.298 -1.071 1
1 755 . 13 1 1 A 72 72 GLN HA H 72 4.371 4.501 -0.130 1
1 762 . 13 1 1 A 72 72 GLN C C 72 173.053 175.282 -2.229 1
1 763 . 13 1 1 A 72 72 GLN CA C 72 54.290 53.610 0.680 1
1 764 . 13 1 1 A 72 72 GLN CB C 72 28.623 29.752 -1.129 1
1 766 . 13 1 1 A 72 72 GLN N N 72 115.858 124.474 -8.616 1
1 768 . 13 1 1 A 73 73 GLN H H 73 8.481 8.410 0.071 1
1 769 . 13 1 1 A 73 73 GLN HA H 73 3.570 3.549 0.021 1
1 776 . 13 1 1 A 73 73 GLN C C 73 174.243 174.047 0.196 1
1 777 . 13 1 1 A 73 73 GLN CA C 73 60.206 56.309 3.897 1
1 778 . 13 1 1 A 73 73 GLN CB C 73 28.850 29.551 -0.701 1
1 780 . 13 1 1 A 73 73 GLN N N 73 116.433 117.358 -0.925 1
1 782 . 13 1 1 A 74 74 THR H H 74 7.211 7.253 -0.042 1
1 783 . 13 1 1 A 74 74 THR HA H 74 4.160 4.541 -0.381 1
1 788 . 13 1 1 A 74 74 THR C C 74 171.836 172.922 -1.086 1
1 789 . 13 1 1 A 74 74 THR CA C 74 59.072 60.267 -1.195 1
1 790 . 13 1 1 A 74 74 THR CB C 74 71.560 72.318 -0.758 1
1 792 . 13 1 1 A 74 74 THR N N 74 108.717 110.448 -1.731 1
1 793 . 13 1 1 A 75 75 CYS H H 75 7.676 8.901 -1.225 1
1 794 . 13 1 1 A 75 75 CYS HA H 75 4.158 4.547 -0.389 1
1 797 . 13 1 1 A 75 75 CYS C C 75 178.781 176.304 2.477 1
1 798 . 13 1 1 A 75 75 CYS CA C 75 58.661 59.473 -0.812 1
1 799 . 13 1 1 A 75 75 CYS CB C 75 30.840 28.350 2.490 1
1 800 . 13 1 1 A 75 75 CYS N N 75 123.108 125.321 -2.213 1
1 801 . 13 1 1 A 76 76 GLU H H 76 9.203 8.788 0.415 1
1 802 . 13 1 1 A 76 76 GLU HA H 76 4.187 4.137 0.050 1
1 807 . 13 1 1 A 76 76 GLU C C 76 175.488 178.795 -3.307 1
1 808 . 13 1 1 A 76 76 GLU CA C 76 57.306 58.117 -0.811 1
1 809 . 13 1 1 A 76 76 GLU CB C 76 29.347 28.495 0.852 1
1 811 . 13 1 1 A 76 76 GLU N N 76 129.817 126.904 2.913 1
1 812 . 13 1 1 A 77 77 GLU H H 77 9.496 8.072 1.424 1
1 813 . 13 1 1 A 77 77 GLU HA H 77 4.599 4.197 0.402 1
1 818 . 13 1 1 A 77 77 GLU C C 77 177.148 177.230 -0.082 1
1 819 . 13 1 1 A 77 77 GLU CA C 77 57.554 58.547 -0.993 1
1 820 . 13 1 1 A 77 77 GLU CB C 77 31.980 30.579 1.401 1
1 822 . 13 1 1 A 77 77 GLU N N 77 124.795 120.341 4.454 1
1 823 . 13 1 1 A 78 78 CYS H H 78 8.967 7.331 1.636 1
1 824 . 13 1 1 A 78 78 CYS HA H 78 5.073 4.625 0.448 1
1 827 . 13 1 1 A 78 78 CYS C C 78 176.374 175.186 1.188 1
1 828 . 13 1 1 A 78 78 CYS CA C 78 58.537 58.227 0.310 1
1 829 . 13 1 1 A 78 78 CYS CB C 78 31.597 28.889 2.708 1
1 830 . 13 1 1 A 78 78 CYS N N 78 119.692 115.852 3.840 1
1 831 . 13 1 1 A 79 79 SER H H 79 7.474 8.260 -0.786 1
1 832 . 13 1 1 A 79 79 SER HA H 79 4.113 4.135 -0.022 1
1 835 . 13 1 1 A 79 79 SER C C 79 172.915 173.456 -0.541 1
1 836 . 13 1 1 A 79 79 SER CA C 79 60.440 59.630 0.810 1
1 837 . 13 1 1 A 79 79 SER CB C 79 61.421 61.248 0.173 1
1 838 . 13 1 1 A 79 79 SER N N 79 113.385 112.613 0.772 1
1 839 . 13 1 1 A 80 80 THR H H 80 7.907 7.888 0.019 1
1 840 . 13 1 1 A 80 80 THR HA H 80 3.913 4.226 -0.313 1
1 845 . 13 1 1 A 80 80 THR C C 80 172.306 173.933 -1.627 1
1 846 . 13 1 1 A 80 80 THR CA C 80 65.262 63.290 1.972 1
1 847 . 13 1 1 A 80 80 THR CB C 80 69.910 68.842 1.068 1
1 849 . 13 1 1 A 80 80 THR N N 80 120.005 115.978 4.027 1
1 850 . 13 1 1 A 81 81 LEU H H 81 8.556 8.681 -0.125 1
1 851 . 13 1 1 A 81 81 LEU HA H 81 4.172 4.492 -0.320 1
1 861 . 13 1 1 A 81 81 LEU C C 81 177.121 177.395 -0.274 1
1 862 . 13 1 1 A 81 81 LEU CA C 81 54.996 55.241 -0.245 1
1 863 . 13 1 1 A 81 81 LEU CB C 81 42.147 42.758 -0.611 1
1 867 . 13 1 1 A 81 81 LEU N N 81 128.272 128.856 -0.584 1
1 868 . 13 1 1 A 82 82 PHE H H 82 9.251 9.132 0.119 1
1 869 . 13 1 1 A 82 82 PHE HA H 82 4.576 4.461 0.115 1
1 874 . 13 1 1 A 82 82 PHE C C 82 177.785 175.736 2.049 1
1 875 . 13 1 1 A 82 82 PHE CA C 82 56.470 59.854 -3.384 1
1 876 . 13 1 1 A 82 82 PHE CB C 82 38.210 38.729 -0.519 1
1 878 . 13 1 1 A 82 82 PHE N N 82 129.268 126.278 2.990 1
1 879 . 13 1 1 A 83 83 GLY H H 83 7.047 7.345 -0.298 1
1 880 . 13 1 1 A 83 83 GLY HA2 H 83 4.783 4.173 0.610 1
1 881 . 13 1 1 A 83 83 GLY HA3 H 83 3.876 4.223 -0.347 1
1 882 . 13 1 1 A 83 83 GLY C C 83 171.642 174.642 -3.000 1
1 883 . 13 1 1 A 83 83 GLY CA C 83 45.826 45.967 -0.141 1
1 884 . 13 1 1 A 83 83 GLY N N 83 102.168 105.566 -3.398 1
1 885 . 13 1 1 A 84 84 GLU H H 84 8.444 8.924 -0.480 1
1 886 . 13 1 1 A 84 84 GLU HA H 84 4.111 4.133 -0.022 1
1 891 . 13 1 1 A 84 84 GLU C C 84 177.259 176.605 0.654 1
1 892 . 13 1 1 A 84 84 GLU CA C 84 59.438 59.146 0.292 1
1 893 . 13 1 1 A 84 84 GLU CB C 84 30.670 30.250 0.420 1
1 895 . 13 1 1 A 84 84 GLU N N 84 127.546 121.478 6.068 1
1 896 . 13 1 1 A 85 85 TYR H H 85 9.344 8.091 1.253 1
1 897 . 13 1 1 A 85 85 TYR HA H 85 4.599 5.060 -0.461 1
1 902 . 13 1 1 A 85 85 TYR C C 85 173.302 173.813 -0.511 1
1 903 . 13 1 1 A 85 85 TYR CA C 85 57.261 56.215 1.046 1
1 904 . 13 1 1 A 85 85 TYR CB C 85 40.850 40.466 0.384 1
1 906 . 13 1 1 A 85 85 TYR N N 85 118.936 120.284 -1.348 1
1 907 . 13 1 1 A 86 86 TYR H H 86 7.323 8.888 -1.565 1
1 908 . 13 1 1 A 86 86 TYR HA H 86 5.298 5.817 -0.519 1
1 911 . 13 1 1 A 86 86 TYR C C 86 172.804 173.024 -0.220 1
1 912 . 13 1 1 A 86 86 TYR CA C 86 54.041 55.260 -1.219 1
1 913 . 13 1 1 A 86 86 TYR CB C 86 40.987 41.695 -0.708 1
1 914 . 13 1 1 A 86 86 TYR N N 86 124.965 123.008 1.957 1
1 915 . 13 1 1 A 87 87 CYS H H 87 7.046 8.569 -1.523 1
1 916 . 13 1 1 A 87 87 CYS HA H 87 3.842 4.442 -0.600 1
1 919 . 13 1 1 A 87 87 CYS C C 87 174.243 174.267 -0.024 1
1 920 . 13 1 1 A 87 87 CYS CA C 87 56.377 57.682 -1.305 1
1 921 . 13 1 1 A 87 87 CYS CB C 87 33.230 30.019 3.211 1
1 922 . 13 1 1 A 87 87 CYS N N 87 128.735 118.697 10.038 1
1 923 . 13 1 1 A 88 88 ASP H H 88 8.002 9.044 -1.042 1
1 924 . 13 1 1 A 88 88 ASP HA H 88 3.761 4.453 -0.692 1
1 927 . 13 1 1 A 88 88 ASP C C 88 173.579 178.341 -4.762 1
1 928 . 13 1 1 A 88 88 ASP CA C 88 53.958 56.886 -2.928 1
1 929 . 13 1 1 A 88 88 ASP CB C 88 41.240 39.682 1.558 1
1 930 . 13 1 1 A 88 88 ASP N N 88 127.013 127.049 -0.036 1
1 931 . 13 1 1 A 89 89 ILE H H 89 7.972 7.908 0.064 1
1 932 . 13 1 1 A 89 89 ILE HA H 89 3.660 3.890 -0.230 1
1 942 . 13 1 1 A 89 89 ILE C C 89 177.259 177.385 -0.126 1
1 943 . 13 1 1 A 89 89 ILE CA C 89 63.107 64.201 -1.094 1
1 944 . 13 1 1 A 89 89 ILE CB C 89 39.430 37.448 1.982 1
1 948 . 13 1 1 A 89 89 ILE N N 89 120.357 120.634 -0.277 1
1 949 . 13 1 1 A 90 90 CYS H H 90 8.554 7.976 0.578 1
1 950 . 13 1 1 A 90 90 CYS HA H 90 3.677 4.922 -1.245 1
1 953 . 13 1 1 A 90 90 CYS C C 90 175.128 174.783 0.345 1
1 954 . 13 1 1 A 90 90 CYS CA C 90 60.791 59.662 1.129 1
1 955 . 13 1 1 A 90 90 CYS CB C 90 30.427 28.640 1.787 1
1 956 . 13 1 1 A 90 90 CYS N N 90 119.564 117.025 2.539 1
1 957 . 13 1 1 A 91 91 HIS H H 91 7.364 7.832 -0.468 1
1 958 . 13 1 1 A 91 91 HIS HA H 91 3.512 4.009 -0.497 1
1 963 . 13 1 1 A 91 91 HIS C C 91 170.590 173.170 -2.580 1
1 964 . 13 1 1 A 91 91 HIS CA C 91 58.739 56.785 1.954 1
1 965 . 13 1 1 A 91 91 HIS CB C 91 24.810 26.489 -1.679 1
1 968 . 13 1 1 A 91 91 HIS N N 91 111.440 116.595 -5.155 1
1 969 . 13 1 1 A 92 92 LEU H H 92 6.214 7.702 -1.488 1
1 970 . 13 1 1 A 92 92 LEU HA H 92 4.191 4.017 0.174 1
1 980 . 13 1 1 A 92 92 LEU C C 92 173.911 175.554 -1.643 1
1 981 . 13 1 1 A 92 92 LEU CA C 92 53.717 53.224 0.493 1
1 982 . 13 1 1 A 92 92 LEU CB C 92 45.360 42.636 2.724 1
1 986 . 13 1 1 A 92 92 LEU N N 92 115.684 118.427 -2.743 1
1 987 . 13 1 1 A 93 93 PHE H H 93 6.669 8.696 -2.027 1
1 988 . 13 1 1 A 93 93 PHE HA H 93 5.622 5.266 0.356 1
1 995 . 13 1 1 A 93 93 PHE C C 93 175.765 174.241 1.524 1
1 996 . 13 1 1 A 93 93 PHE CA C 93 55.387 56.265 -0.878 1
1 997 . 13 1 1 A 93 93 PHE CB C 93 42.700 42.249 0.451 1
1 1000 . 13 1 1 A 93 93 PHE N N 93 121.535 120.288 1.247 1
1 1001 . 13 1 1 A 94 94 ASP H H 94 9.209 8.934 0.275 1
1 1002 . 13 1 1 A 94 94 ASP HA H 94 5.819 5.254 0.565 1
1 1005 . 13 1 1 A 94 94 ASP C C 94 175.654 175.261 0.393 1
1 1006 . 13 1 1 A 94 94 ASP CA C 94 53.330 53.258 0.072 1
1 1007 . 13 1 1 A 94 94 ASP CB C 94 44.720 44.988 -0.268 1
1 1008 . 13 1 1 A 94 94 ASP N N 94 123.504 121.206 2.298 1
1 1009 . 13 1 1 A 95 95 LYS H H 95 9.043 8.275 0.768 1
1 1010 . 13 1 1 A 95 95 LYS HA H 95 4.527 4.409 0.118 1
1 1019 . 13 1 1 A 95 95 LYS C C 95 174.879 176.470 -1.591 1
1 1020 . 13 1 1 A 95 95 LYS CA C 95 56.620 56.563 0.057 1
1 1021 . 13 1 1 A 95 95 LYS CB C 95 33.720 33.551 0.169 1
1 1025 . 13 1 1 A 95 95 LYS N N 95 120.380 122.258 -1.878 1
1 1026 . 13 1 1 A 96 96 ASP H H 96 8.999 8.500 0.499 1
1 1027 . 13 1 1 A 96 96 ASP HA H 96 4.724 4.758 -0.034 1
1 1030 . 13 1 1 A 96 96 ASP C C 96 176.401 176.080 0.321 1
1 1031 . 13 1 1 A 96 96 ASP CA C 96 56.147 53.617 2.530 1
1 1032 . 13 1 1 A 96 96 ASP CB C 96 40.790 40.973 -0.183 1
1 1033 . 13 1 1 A 96 96 ASP N N 96 120.784 121.431 -0.647 1
1 1034 . 13 1 1 A 97 97 LYS H H 97 9.382 8.594 0.788 1
1 1035 . 13 1 1 A 97 97 LYS HA H 97 4.473 4.615 -0.142 1
1 1044 . 13 1 1 A 97 97 LYS C C 97 175.903 175.859 0.044 1
1 1045 . 13 1 1 A 97 97 LYS CA C 97 54.771 55.016 -0.245 1
1 1046 . 13 1 1 A 97 97 LYS CB C 97 33.270 33.043 0.227 1
1 1050 . 13 1 1 A 97 97 LYS N N 97 131.617 126.426 5.191 1
1 1051 . 13 1 1 A 98 98 LYS H H 98 8.940 8.026 0.914 1
1 1052 . 13 1 1 A 98 98 LYS HA H 98 4.118 3.848 0.270 1
1 1061 . 13 1 1 A 98 98 LYS C C 98 177.065 175.290 1.775 1
1 1062 . 13 1 1 A 98 98 LYS CA C 98 56.297 57.888 -1.591 1
1 1063 . 13 1 1 A 98 98 LYS CB C 98 28.467 29.849 -1.382 1
1 1067 . 13 1 1 A 98 98 LYS N N 98 115.034 115.247 -0.213 1
1 1068 . 13 1 1 A 99 99 GLN H H 99 9.266 7.876 1.390 1
1 1069 . 13 1 1 A 99 99 GLN HA H 99 4.460 4.555 -0.095 1
1 1074 . 13 1 1 A 99 99 GLN C C 99 174.990 175.091 -0.101 1
1 1075 . 13 1 1 A 99 99 GLN CA C 99 57.563 55.832 1.731 1
1 1076 . 13 1 1 A 99 99 GLN CB C 99 27.280 29.244 -1.964 1
1 1078 . 13 1 1 A 99 99 GLN N N 99 117.717 118.694 -0.977 1
1 1079 . 13 1 1 A 100 100 TYR H H 100 8.402 8.873 -0.471 1
1 1080 . 13 1 1 A 100 100 TYR HA H 100 4.935 5.621 -0.686 1
1 1087 . 13 1 1 A 100 100 TYR C C 100 171.504 172.899 -1.395 1
1 1088 . 13 1 1 A 100 100 TYR CA C 100 55.786 55.023 0.763 1
1 1089 . 13 1 1 A 100 100 TYR CB C 100 41.090 41.711 -0.621 1
1 1092 . 13 1 1 A 100 100 TYR N N 100 115.081 117.797 -2.716 1
1 1093 . 13 1 1 A 101 101 HIS H H 101 8.829 8.919 -0.090 1
1 1094 . 13 1 1 A 101 101 HIS HA H 101 4.525 4.677 -0.152 1
1 1099 . 13 1 1 A 101 101 HIS C C 101 174.935 173.764 1.171 1
1 1100 . 13 1 1 A 101 101 HIS CA C 101 56.327 55.228 1.099 1
1 1101 . 13 1 1 A 101 101 HIS CB C 101 31.020 30.965 0.055 1
1 1104 . 13 1 1 A 101 101 HIS N N 101 120.894 121.489 -0.595 1
1 1105 . 13 1 1 A 102 102 CYS H H 102 7.427 7.984 -0.557 1
1 1106 . 13 1 1 A 102 102 CYS HA H 102 4.561 4.317 0.244 1
1 1109 . 13 1 1 A 102 102 CYS C C 102 175.765 175.300 0.465 1
1 1110 . 13 1 1 A 102 102 CYS CA C 102 57.707 58.482 -0.775 1
1 1111 . 13 1 1 A 102 102 CYS CB C 102 29.130 27.129 2.001 1
1 1112 . 13 1 1 A 102 102 CYS N N 102 131.256 126.952 4.304 1
1 1113 . 13 1 1 A 103 103 GLU H H 103 9.497 8.780 0.717 1
1 1114 . 13 1 1 A 103 103 GLU HA H 103 4.003 4.145 -0.142 1
1 1119 . 13 1 1 A 103 103 GLU C C 103 176.540 178.343 -1.803 1
1 1120 . 13 1 1 A 103 103 GLU CA C 103 58.796 59.001 -0.205 1
1 1121 . 13 1 1 A 103 103 GLU CB C 103 29.280 29.062 0.218 1
1 1123 . 13 1 1 A 103 103 GLU N N 103 129.829 127.378 2.451 1
1 1124 . 13 1 1 A 104 104 ASN H H 104 7.832 7.993 -0.161 1
1 1125 . 13 1 1 A 104 104 ASN HA H 104 4.457 4.532 -0.075 1
1 1130 . 13 1 1 A 104 104 ASN C C 104 176.401 176.842 -0.441 1
1 1131 . 13 1 1 A 104 104 ASN CA C 104 56.053 56.100 -0.047 1
1 1132 . 13 1 1 A 104 104 ASN CB C 104 38.400 38.486 -0.086 1
1 1133 . 13 1 1 A 104 104 ASN N N 104 117.703 117.890 -0.187 1
1 1135 . 13 1 1 A 105 105 CYS H H 105 9.415 7.747 1.668 1
1 1136 . 13 1 1 A 105 105 CYS HA H 105 4.137 4.442 -0.305 1
1 1139 . 13 1 1 A 105 105 CYS C C 105 176.844 175.351 1.493 1
1 1140 . 13 1 1 A 105 105 CYS CA C 105 64.328 59.386 4.942 1
1 1141 . 13 1 1 A 105 105 CYS CB C 105 30.350 28.119 2.231 1
1 1142 . 13 1 1 A 105 105 CYS N N 105 124.939 115.593 9.346 1
1 1143 . 13 1 1 A 106 106 GLY H H 106 8.145 8.821 -0.676 1
1 1144 . 13 1 1 A 106 106 GLY HA2 H 106 3.980 3.892 0.088 1
1 1145 . 13 1 1 A 106 106 GLY HA3 H 106 3.502 3.961 -0.459 1
1 1146 . 13 1 1 A 106 106 GLY C C 106 172.500 173.550 -1.050 1
1 1147 . 13 1 1 A 106 106 GLY CA C 106 44.968 45.975 -1.007 1
1 1148 . 13 1 1 A 106 106 GLY N N 106 106.090 109.565 -3.475 1
1 1149 . 13 1 1 A 107 107 ILE H H 107 6.465 6.852 -0.387 1
1 1150 . 13 1 1 A 107 107 ILE HA H 107 4.878 5.232 -0.354 1
1 1160 . 13 1 1 A 107 107 ILE C C 107 174.824 174.219 0.605 1
1 1161 . 13 1 1 A 107 107 ILE CA C 107 58.226 58.517 -0.291 1
1 1162 . 13 1 1 A 107 107 ILE CB C 107 44.460 42.339 2.121 1
1 1166 . 13 1 1 A 107 107 ILE N N 107 107.914 114.927 -7.013 1
1 1167 . 13 1 1 A 108 108 CYS H H 108 7.041 9.207 -2.166 1
1 1168 . 13 1 1 A 108 108 CYS HA H 108 5.018 5.311 -0.293 1
1 1171 . 13 1 1 A 108 108 CYS C C 108 175.461 172.795 2.666 1
1 1172 . 13 1 1 A 108 108 CYS CA C 108 62.097 56.609 5.488 1
1 1173 . 13 1 1 A 108 108 CYS CB C 108 31.353 31.213 0.140 1
1 1174 . 13 1 1 A 108 108 CYS N N 108 122.441 121.198 1.243 1
1 1175 . 13 1 1 A 109 109 ARG H H 109 8.561 7.996 0.565 1
1 1176 . 13 1 1 A 109 109 ARG HA H 109 4.239 4.748 -0.509 1
1 1183 . 13 1 1 A 109 109 ARG C C 109 174.271 174.202 0.069 1
1 1184 . 13 1 1 A 109 109 ARG CA C 109 52.962 54.703 -1.741 1
1 1185 . 13 1 1 A 109 109 ARG CB C 109 33.903 34.125 -0.222 1
1 1188 . 13 1 1 A 109 109 ARG N N 109 121.163 121.016 0.147 1
1 1189 . 13 1 1 A 110 110 ILE H H 110 7.847 8.387 -0.540 1
1 1190 . 13 1 1 A 110 110 ILE HA H 110 3.531 4.101 -0.570 1
1 1200 . 13 1 1 A 110 110 ILE C C 110 175.405 175.681 -0.276 1
1 1201 . 13 1 1 A 110 110 ILE CA C 110 62.201 61.681 0.520 1
1 1202 . 13 1 1 A 110 110 ILE CB C 110 36.860 36.804 0.056 1
1 1206 . 13 1 1 A 110 110 ILE N N 110 118.955 125.431 -6.476 1
1 1207 . 13 1 1 A 111 111 GLY H H 111 6.928 8.100 -1.172 1
1 1208 . 13 1 1 A 111 111 GLY HA2 H 111 4.564 3.242 1.322 1
1 1209 . 13 1 1 A 111 111 GLY HA3 H 111 4.135 3.872 0.263 1
1 1210 . 13 1 1 A 111 111 GLY CA C 111 43.068 45.187 -2.119 1
1 1211 . 13 1 1 A 111 111 GLY N N 111 113.782 113.700 0.082 1
1 1212 . 13 1 1 A 112 112 PRO HA H 112 4.990 4.870 0.120 1
1 1219 . 13 1 1 A 112 112 PRO C C 112 177.342 177.692 -0.350 1
1 1220 . 13 1 1 A 112 112 PRO CA C 112 62.920 62.815 0.105 1
1 1221 . 13 1 1 A 112 112 PRO CB C 112 34.807 31.733 3.074 1
1 1224 . 13 1 1 A 113 113 LYS H H 113 8.989 8.271 0.718 1
1 1225 . 13 1 1 A 113 113 LYS HA H 113 3.144 3.681 -0.537 1
1 1234 . 13 1 1 A 113 113 LYS C C 113 177.536 178.110 -0.574 1
1 1235 . 13 1 1 A 113 113 LYS CA C 113 59.883 58.830 1.053 1
1 1236 . 13 1 1 A 113 113 LYS CB C 113 32.260 31.798 0.462 1
1 1240 . 13 1 1 A 113 113 LYS N N 113 123.545 123.589 -0.044 1
1 1241 . 13 1 1 A 114 114 GLU H H 114 9.080 9.046 0.034 1
1 1242 . 13 1 1 A 114 114 GLU HA H 114 4.199 4.062 0.137 1
1 1247 . 13 1 1 A 114 114 GLU C C 114 176.374 177.053 -0.679 1
1 1248 . 13 1 1 A 114 114 GLU CA C 114 58.733 59.404 -0.671 1
1 1249 . 13 1 1 A 114 114 GLU CB C 114 28.077 29.002 -0.925 1
1 1251 . 13 1 1 A 114 114 GLU N N 114 114.832 120.092 -5.260 1
1 1252 . 13 1 1 A 115 115 ASP H H 115 7.799 7.970 -0.171 1
1 1253 . 13 1 1 A 115 115 ASP HA H 115 4.642 4.806 -0.164 1
1 1256 . 13 1 1 A 115 115 ASP C C 115 176.374 174.495 1.879 1
1 1257 . 13 1 1 A 115 115 ASP CA C 115 54.470 53.935 0.535 1
1 1258 . 13 1 1 A 115 115 ASP CB C 115 40.850 41.769 -0.919 1
1 1259 . 13 1 1 A 115 115 ASP N N 115 118.858 117.919 0.939 1
1 1260 . 13 1 1 A 116 116 PHE H H 116 8.063 7.681 0.382 1
1 1261 . 13 1 1 A 116 116 PHE HA H 116 5.239 4.955 0.284 1
1 1264 . 13 1 1 A 116 116 PHE C C 116 173.413 173.805 -0.392 1
1 1265 . 13 1 1 A 116 116 PHE CA C 116 57.708 57.683 0.025 1
1 1266 . 13 1 1 A 116 116 PHE CB C 116 44.557 42.961 1.596 1
1 1267 . 13 1 1 A 116 116 PHE N N 116 120.567 120.635 -0.068 1
1 1268 . 13 1 1 A 117 117 PHE H H 117 9.439 8.974 0.465 1
1 1269 . 13 1 1 A 117 117 PHE HA H 117 5.091 5.394 -0.303 1
1 1277 . 13 1 1 A 117 117 PHE C C 117 171.614 172.311 -0.697 1
1 1278 . 13 1 1 A 117 117 PHE CA C 117 55.311 55.440 -0.129 1
1 1279 . 13 1 1 A 117 117 PHE CB C 117 41.887 42.409 -0.522 1
1 1283 . 13 1 1 A 117 117 PHE N N 117 118.040 119.424 -1.384 1
1 1284 . 13 1 1 A 118 118 HIS H H 118 8.779 8.978 -0.199 1
1 1285 . 13 1 1 A 118 118 HIS HA H 118 4.836 4.962 -0.126 1
1 1289 . 13 1 1 A 118 118 HIS C C 118 174.879 174.028 0.851 1
1 1290 . 13 1 1 A 118 118 HIS CA C 118 55.322 55.209 0.113 1
1 1291 . 13 1 1 A 118 118 HIS CB C 118 30.950 32.131 -1.181 1
1 1293 . 13 1 1 A 118 118 HIS N N 118 121.208 121.453 -0.245 1
1 1294 . 13 1 1 A 119 119 CYS H H 119 8.123 8.094 0.029 1
1 1295 . 13 1 1 A 119 119 CYS HA H 119 4.529 4.486 0.043 1
1 1298 . 13 1 1 A 119 119 CYS C C 119 176.567 174.305 2.262 1
1 1299 . 13 1 1 A 119 119 CYS CA C 119 58.957 57.536 1.421 1
1 1300 . 13 1 1 A 119 119 CYS CB C 119 30.090 27.249 2.841 1
1 1301 . 13 1 1 A 119 119 CYS N N 119 131.659 124.978 6.681 1
1 1302 . 13 1 1 A 120 120 LEU H H 120 8.970 8.691 0.279 1
1 1303 . 13 1 1 A 120 120 LEU N N 120 130.361 128.114 2.247 1
1 1304 . 13 1 1 A 121 121 LYS HA H 121 4.299 4.498 -0.199 1
1 1313 . 13 1 1 A 121 121 LYS CA C 121 58.727 55.990 2.737 1
1 1314 . 13 1 1 A 121 121 LYS CB C 121 33.210 34.081 -0.871 1
1 1318 . 13 1 1 A 123 123 ASN HA H 123 4.438 4.301 0.137 1
1 1323 . 13 1 1 A 123 123 ASN C C 123 172.444 175.032 -2.588 1
1 1324 . 13 1 1 A 123 123 ASN CA C 123 53.448 55.463 -2.015 1
1 1325 . 13 1 1 A 123 123 ASN CB C 123 37.130 37.088 0.042 1
1 1327 . 13 1 1 A 124 124 LEU H H 124 6.596 7.765 -1.169 1
1 1328 . 13 1 1 A 124 124 LEU HA H 124 4.576 4.158 0.418 1
1 1338 . 13 1 1 A 124 124 LEU C C 124 175.903 176.201 -0.298 1
1 1339 . 13 1 1 A 124 124 LEU CA C 124 54.043 55.627 -1.584 1
1 1340 . 13 1 1 A 124 124 LEU CB C 124 45.837 43.131 2.706 1
1 1344 . 13 1 1 A 124 124 LEU N N 124 115.443 120.126 -4.683 1
1 1345 . 13 1 1 A 125 125 CYS H H 125 6.342 8.644 -2.302 1
1 1346 . 13 1 1 A 125 125 CYS HA H 125 5.033 5.128 -0.095 1
1 1349 . 13 1 1 A 125 125 CYS C C 125 175.101 173.788 1.313 1
1 1350 . 13 1 1 A 125 125 CYS CA C 125 62.046 57.266 4.780 1
1 1351 . 13 1 1 A 125 125 CYS CB C 125 30.840 28.909 1.931 1
1 1352 . 13 1 1 A 125 125 CYS N N 125 118.685 124.728 -6.043 1
1 1353 . 13 1 1 A 126 126 LEU H H 126 8.894 7.647 1.247 1
1 1354 . 13 1 1 A 126 126 LEU HA H 126 4.565 4.457 0.108 1
1 1364 . 13 1 1 A 126 126 LEU C C 126 174.879 175.159 -0.280 1
1 1365 . 13 1 1 A 126 126 LEU CA C 126 52.751 52.652 0.099 1
1 1366 . 13 1 1 A 126 126 LEU CB C 126 46.090 44.522 1.568 1
1 1370 . 13 1 1 A 126 126 LEU N N 126 124.501 125.949 -1.448 1
1 1371 . 13 1 1 A 127 127 ALA H H 127 8.378 8.432 -0.054 1
1 1372 . 13 1 1 A 127 127 ALA HA H 127 3.957 4.450 -0.493 1
1 1376 . 13 1 1 A 127 127 ALA C C 127 179.085 178.398 0.687 1
1 1377 . 13 1 1 A 127 127 ALA CA C 127 52.554 51.090 1.464 1
1 1378 . 13 1 1 A 127 127 ALA CB C 127 18.527 20.754 -2.227 1
1 1379 . 13 1 1 A 127 127 ALA N N 127 123.011 122.236 0.775 1
1 1380 . 13 1 1 A 128 128 MET H H 128 8.237 8.841 -0.604 1
1 1385 . 13 1 1 A 128 128 MET N N 128 120.642 120.561 0.081 1
1 1386 . 13 1 1 A 129 129 ASN HA H 129 4.502 4.624 -0.122 1
1 1389 . 13 1 1 A 129 129 ASN C C 129 175.931 176.147 -0.216 1
1 1390 . 13 1 1 A 129 129 ASN CA C 129 55.064 55.772 -0.708 1
1 1391 . 13 1 1 A 129 129 ASN CB C 129 36.920 38.302 -1.382 1
1 1392 . 13 1 1 A 130 130 LEU H H 130 8.211 7.551 0.660 1
1 1393 . 13 1 1 A 130 130 LEU HA H 130 4.489 4.554 -0.065 1
1 1403 . 13 1 1 A 130 130 LEU C C 130 178.836 178.122 0.714 1
1 1404 . 13 1 1 A 130 130 LEU CA C 130 54.653 53.830 0.823 1
1 1405 . 13 1 1 A 130 130 LEU CB C 130 41.887 42.882 -0.995 1
1 1409 . 13 1 1 A 130 130 LEU N N 130 118.563 120.009 -1.446 1
1 1410 . 13 1 1 A 131 131 GLN H H 131 7.953 7.729 0.224 1
1 1411 . 13 1 1 A 131 131 GLN HA H 131 3.729 3.939 -0.210 1
1 1418 . 13 1 1 A 131 131 GLN CA C 131 59.310 58.788 0.522 1
1 1419 . 13 1 1 A 131 131 GLN CB C 131 28.340 27.956 0.384 1
1 1421 . 13 1 1 A 131 131 GLN N N 131 123.929 118.943 4.986 1
1 1423 . 13 1 1 A 132 132 GLY HA2 H 132 4.034 3.947 0.087 1
1 1424 . 13 1 1 A 132 132 GLY HA3 H 132 3.865 3.951 -0.086 1
1 1425 . 13 1 1 A 132 132 GLY C C 132 174.547 174.486 0.061 1
1 1426 . 13 1 1 A 132 132 GLY CA C 132 45.902 45.751 0.151 1
1 1427 . 13 1 1 A 133 133 ARG H H 133 7.735 7.644 0.091 1
1 1428 . 13 1 1 A 133 133 ARG HA H 133 4.611 4.583 0.028 1
1 1435 . 13 1 1 A 133 133 ARG C C 133 175.461 175.590 -0.129 1
1 1436 . 13 1 1 A 133 133 ARG CA C 133 54.987 55.088 -0.101 1
1 1437 . 13 1 1 A 133 133 ARG CB C 133 31.470 30.541 0.929 1
1 1440 . 13 1 1 A 133 133 ARG N N 133 118.194 118.244 -0.050 1
1 1441 . 13 1 1 A 134 134 HIS H H 134 7.803 8.251 -0.448 1
1 1444 . 13 1 1 A 134 134 HIS N N 134 118.700 118.451 0.249 1
1 1445 . 13 1 1 A 135 135 LYS HA H 135 4.331 4.315 0.016 1
1 1454 . 13 1 1 A 135 135 LYS C C 135 174.852 174.819 0.033 1
1 1455 . 13 1 1 A 135 135 LYS CA C 135 55.390 55.647 -0.257 1
1 1456 . 13 1 1 A 135 135 LYS CB C 135 32.970 31.915 1.055 1
1 1460 . 13 1 1 A 136 136 CYS H H 136 7.801 8.347 -0.546 1
1 1461 . 13 1 1 A 136 136 CYS HA H 136 4.113 5.051 -0.938 1
1 1464 . 13 1 1 A 136 136 CYS C C 136 174.879 173.443 1.436 1
1 1465 . 13 1 1 A 136 136 CYS CA C 136 60.028 57.312 2.716 1
1 1466 . 13 1 1 A 136 136 CYS CB C 136 30.350 27.811 2.539 1
1 1467 . 13 1 1 A 136 136 CYS N N 136 126.055 125.491 0.564 1
1 10 . 14 1 1 A 2 2 ALA H H 2 8.220 8.896 -0.676 1
1 11 . 14 1 1 A 2 2 ALA HA H 2 4.321 5.374 -1.053 1
1 15 . 14 1 1 A 2 2 ALA C C 2 177.564 175.837 1.727 1
1 16 . 14 1 1 A 2 2 ALA CA C 2 52.383 50.334 2.049 1
1 17 . 14 1 1 A 2 2 ALA CB C 2 19.290 21.093 -1.803 1
1 18 . 14 1 1 A 2 2 ALA N N 2 125.223 128.050 -2.827 1
1 19 . 14 1 1 A 3 3 ALA H H 3 8.246 8.847 -0.601 1
1 20 . 14 1 1 A 3 3 ALA N N 3 123.250 125.162 -1.912 1
1 21 . 14 1 1 A 5 5 ALA HA H 5 4.415 4.884 -0.469 1
1 25 . 14 1 1 A 5 5 ALA C C 5 177.481 175.676 1.805 1
1 26 . 14 1 1 A 5 5 ALA CA C 5 52.423 51.543 0.880 1
1 27 . 14 1 1 A 5 5 ALA CB C 5 19.420 19.811 -0.391 1
1 28 . 14 1 1 A 6 6 ARG H H 6 8.239 8.986 -0.747 1
1 29 . 14 1 1 A 6 6 ARG HA H 6 4.371 4.678 -0.307 1
1 36 . 14 1 1 A 6 6 ARG C C 6 176.180 175.611 0.569 1
1 37 . 14 1 1 A 6 6 ARG CA C 6 56.353 56.371 -0.018 1
1 38 . 14 1 1 A 6 6 ARG CB C 6 31.170 30.701 0.469 1
1 41 . 14 1 1 A 6 6 ARG N N 6 120.436 126.199 -5.763 1
1 42 . 14 1 1 A 7 7 GLU H H 7 8.535 8.670 -0.135 1
1 43 . 14 1 1 A 7 7 GLU HA H 7 4.335 5.220 -0.885 1
1 48 . 14 1 1 A 7 7 GLU C C 7 176.346 174.107 2.239 1
1 49 . 14 1 1 A 7 7 GLU CA C 7 56.740 55.000 1.740 1
1 50 . 14 1 1 A 7 7 GLU CB C 7 30.390 33.810 -3.420 1
1 52 . 14 1 1 A 7 7 GLU N N 7 122.189 123.302 -1.113 1
1 53 . 14 1 1 A 8 8 ASP H H 8 8.347 8.718 -0.371 1
1 54 . 14 1 1 A 8 8 ASP N N 8 121.112 119.669 1.443 1
1 55 . 14 1 1 A 9 9 GLY HA2 H 9 3.975 3.966 0.009 1
1 56 . 14 1 1 A 9 9 GLY HA3 H 9 3.975 3.966 0.009 1
1 57 . 14 1 1 A 9 9 GLY C C 9 174.243 173.812 0.431 1
1 58 . 14 1 1 A 9 9 GLY CA C 9 45.933 45.556 0.377 1
1 59 . 14 1 1 A 10 10 ALA H H 10 8.111 7.613 0.498 1
1 60 . 14 1 1 A 10 10 ALA N N 10 123.721 123.234 0.487 1
1 61 . 14 1 1 A 12 12 GLY HA2 H 12 3.992 4.048 -0.056 1
1 62 . 14 1 1 A 12 12 GLY HA3 H 12 3.992 4.049 -0.057 1
1 63 . 14 1 1 A 12 12 GLY C C 12 173.883 173.912 -0.029 1
1 64 . 14 1 1 A 12 12 GLY CA C 12 45.381 44.187 1.194 1
1 65 . 14 1 1 A 13 13 GLU H H 13 8.224 8.884 -0.660 1
1 66 . 14 1 1 A 13 13 GLU HA H 13 4.367 3.936 0.431 1
1 71 . 14 1 1 A 13 13 GLU C C 13 176.125 176.325 -0.200 1
1 72 . 14 1 1 A 13 13 GLU CA C 13 56.349 58.156 -1.807 1
1 73 . 14 1 1 A 13 13 GLU CB C 13 29.560 27.810 1.750 1
1 75 . 14 1 1 A 13 13 GLU N N 13 120.148 118.063 2.085 1
1 76 . 14 1 1 A 14 14 GLU H H 14 8.508 7.975 0.533 1
1 77 . 14 1 1 A 14 14 GLU HA H 14 4.302 4.036 0.266 1
1 82 . 14 1 1 A 14 14 GLU C C 14 176.623 177.882 -1.259 1
1 83 . 14 1 1 A 14 14 GLU CA C 14 56.497 58.962 -2.465 1
1 84 . 14 1 1 A 14 14 GLU CB C 14 30.110 30.178 -0.068 1
1 86 . 14 1 1 A 14 14 GLU N N 14 122.160 118.962 3.198 1
1 87 . 14 1 1 A 15 15 ARG H H 15 8.356 8.081 0.275 1
1 88 . 14 1 1 A 15 15 ARG HA H 15 4.366 4.692 -0.326 1
1 95 . 14 1 1 A 15 15 ARG C C 15 176.844 176.957 -0.113 1
1 96 . 14 1 1 A 15 15 ARG CA C 15 56.010 55.435 0.575 1
1 97 . 14 1 1 A 15 15 ARG CB C 15 30.890 30.553 0.337 1
1 100 . 14 1 1 A 15 15 ARG N N 15 121.945 117.930 4.015 1
1 101 . 14 1 1 A 16 16 GLY H H 16 8.414 8.340 0.074 1
1 102 . 14 1 1 A 16 16 GLY HA2 H 16 4.022 3.844 0.178 1
1 103 . 14 1 1 A 16 16 GLY HA3 H 16 4.022 3.845 0.177 1
1 104 . 14 1 1 A 16 16 GLY C C 16 174.326 174.180 0.146 1
1 105 . 14 1 1 A 16 16 GLY CA C 16 45.620 47.266 -1.646 1
1 106 . 14 1 1 A 16 16 GLY N N 16 109.734 109.047 0.687 1
1 107 . 14 1 1 A 17 17 GLN H H 17 8.184 7.637 0.547 1
1 108 . 14 1 1 A 17 17 GLN HA H 17 4.366 4.880 -0.514 1
1 113 . 14 1 1 A 17 17 GLN C C 17 175.544 174.868 0.676 1
1 114 . 14 1 1 A 17 17 GLN CA C 17 55.749 54.408 1.341 1
1 115 . 14 1 1 A 17 17 GLN CB C 17 29.367 30.782 -1.415 1
1 117 . 14 1 1 A 17 17 GLN N N 17 119.546 117.210 2.336 1
1 118 . 14 1 1 A 18 18 ARG H H 18 8.366 8.599 -0.233 1
1 119 . 14 1 1 A 18 18 ARG HA H 18 4.487 5.029 -0.542 1
1 126 . 14 1 1 A 18 18 ARG C C 18 176.042 174.766 1.276 1
1 127 . 14 1 1 A 18 18 ARG CA C 18 55.735 54.855 0.880 1
1 128 . 14 1 1 A 18 18 ARG CB C 18 31.170 31.671 -0.501 1
1 131 . 14 1 1 A 18 18 ARG N N 18 122.330 119.600 2.730 1
1 132 . 14 1 1 A 19 19 GLY H H 19 8.192 8.291 -0.099 1
1 133 . 14 1 1 A 19 19 GLY HA2 H 19 4.852 4.153 0.699 1
1 134 . 14 1 1 A 19 19 GLY HA3 H 19 3.894 4.160 -0.266 1
1 135 . 14 1 1 A 19 19 GLY C C 19 172.361 171.247 1.114 1
1 136 . 14 1 1 A 19 19 GLY CA C 19 45.580 45.289 0.291 1
1 137 . 14 1 1 A 19 19 GLY N N 19 109.658 107.866 1.792 1
1 138 . 14 1 1 A 20 20 CYS H H 20 8.843 8.589 0.254 1
1 139 . 14 1 1 A 20 20 CYS HA H 20 5.147 5.183 -0.036 1
1 142 . 14 1 1 A 20 20 CYS C C 20 175.211 175.489 -0.278 1
1 143 . 14 1 1 A 20 20 CYS CA C 20 56.712 57.965 -1.253 1
1 144 . 14 1 1 A 20 20 CYS CB C 20 33.530 31.229 2.301 1
1 145 . 14 1 1 A 20 20 CYS N N 20 120.185 118.675 1.510 1
1 146 . 14 1 1 A 21 21 GLU H H 21 8.981 8.900 0.081 1
1 147 . 14 1 1 A 21 21 GLU HA H 21 4.100 4.045 0.055 1
1 152 . 14 1 1 A 21 21 GLU C C 21 176.014 177.773 -1.759 1
1 153 . 14 1 1 A 21 21 GLU CA C 21 57.134 58.562 -1.428 1
1 154 . 14 1 1 A 21 21 GLU CB C 21 28.890 28.961 -0.071 1
1 156 . 14 1 1 A 21 21 GLU N N 21 116.078 124.742 -8.664 1
1 157 . 14 1 1 A 22 22 HIS H H 22 9.342 7.625 1.717 1
1 158 . 14 1 1 A 22 22 HIS HA H 22 4.210 4.258 -0.048 1
1 161 . 14 1 1 A 22 22 HIS C C 22 175.128 174.758 0.370 1
1 162 . 14 1 1 A 22 22 HIS CA C 22 58.945 59.083 -0.138 1
1 163 . 14 1 1 A 22 22 HIS CB C 22 33.160 30.747 2.413 1
1 164 . 14 1 1 A 22 22 HIS N N 22 122.296 117.419 4.877 1
1 165 . 14 1 1 A 23 23 TYR H H 23 7.931 8.035 -0.104 1
1 166 . 14 1 1 A 23 23 TYR HA H 23 4.856 5.167 -0.311 1
1 171 . 14 1 1 A 23 23 TYR C C 23 173.108 174.522 -1.414 1
1 172 . 14 1 1 A 23 23 TYR CA C 23 57.852 56.213 1.639 1
1 173 . 14 1 1 A 23 23 TYR CB C 23 45.300 40.843 4.457 1
1 175 . 14 1 1 A 23 23 TYR N N 23 115.205 115.514 -0.309 1
1 176 . 14 1 1 A 24 24 ASP H H 24 8.384 8.942 -0.558 1
1 177 . 14 1 1 A 24 24 ASP HA H 24 5.160 4.915 0.245 1
1 180 . 14 1 1 A 24 24 ASP C C 24 174.437 175.264 -0.827 1
1 181 . 14 1 1 A 24 24 ASP CA C 24 53.343 53.728 -0.385 1
1 182 . 14 1 1 A 24 24 ASP CB C 24 41.470 39.657 1.813 1
1 183 . 14 1 1 A 24 24 ASP N N 24 122.016 124.876 -2.860 1
1 184 . 14 1 1 A 25 25 ARG H H 25 7.313 7.907 -0.594 1
1 185 . 14 1 1 A 25 25 ARG HA H 25 5.331 4.972 0.359 1
1 192 . 14 1 1 A 25 25 ARG C C 25 175.045 175.832 -0.787 1
1 193 . 14 1 1 A 25 25 ARG CA C 25 54.224 54.597 -0.373 1
1 194 . 14 1 1 A 25 25 ARG CB C 25 34.090 33.748 0.342 1
1 197 . 14 1 1 A 25 25 ARG N N 25 115.898 121.415 -5.517 1
1 198 . 14 1 1 A 26 26 GLY H H 26 9.387 8.696 0.691 1
1 199 . 14 1 1 A 26 26 GLY HA2 H 26 4.622 3.779 0.843 1
1 200 . 14 1 1 A 26 26 GLY HA3 H 26 3.788 3.796 -0.008 1
1 201 . 14 1 1 A 26 26 GLY C C 26 170.978 172.896 -1.918 1
1 202 . 14 1 1 A 26 26 GLY CA C 26 44.794 45.383 -0.589 1
1 203 . 14 1 1 A 26 26 GLY N N 26 105.653 107.884 -2.231 1
1 204 . 14 1 1 A 27 27 CYS H H 27 6.864 7.464 -0.600 1
1 205 . 14 1 1 A 27 27 CYS HA H 27 5.195 4.760 0.435 1
1 208 . 14 1 1 A 27 27 CYS C C 27 171.144 173.001 -1.857 1
1 209 . 14 1 1 A 27 27 CYS CA C 27 52.349 57.809 -5.460 1
1 210 . 14 1 1 A 27 27 CYS CB C 27 30.997 32.055 -1.058 1
1 211 . 14 1 1 A 27 27 CYS N N 27 110.921 117.464 -6.543 1
1 212 . 14 1 1 A 28 28 LEU H H 28 8.310 8.588 -0.278 1
1 213 . 14 1 1 A 28 28 LEU HA H 28 4.651 4.938 -0.287 1
1 223 . 14 1 1 A 28 28 LEU C C 28 176.827 176.066 0.761 1
1 224 . 14 1 1 A 28 28 LEU CA C 28 53.054 53.349 -0.295 1
1 225 . 14 1 1 A 28 28 LEU CB C 28 44.200 43.053 1.147 1
1 229 . 14 1 1 A 28 28 LEU N N 28 115.519 122.968 -7.449 1
1 230 . 14 1 1 A 29 29 LEU H H 29 8.800 8.572 0.228 1
1 231 . 14 1 1 A 29 29 LEU HA H 29 4.313 4.929 -0.616 1
1 240 . 14 1 1 A 29 29 LEU C C 29 175.571 175.762 -0.191 1
1 241 . 14 1 1 A 29 29 LEU CA C 29 54.388 53.440 0.948 1
1 242 . 14 1 1 A 29 29 LEU CB C 29 42.780 44.048 -1.268 1
1 245 . 14 1 1 A 29 29 LEU N N 29 118.712 122.006 -3.294 1
1 246 . 14 1 1 A 30 30 LYS H H 30 8.009 8.579 -0.570 1
1 247 . 14 1 1 A 30 30 LYS HA H 30 4.592 5.053 -0.461 1
1 256 . 14 1 1 A 30 30 LYS C C 30 174.990 175.142 -0.152 1
1 257 . 14 1 1 A 30 30 LYS CA C 30 54.999 55.143 -0.144 1
1 258 . 14 1 1 A 30 30 LYS CB C 30 32.330 33.993 -1.663 1
1 262 . 14 1 1 A 30 30 LYS N N 30 122.310 124.658 -2.348 1
1 263 . 14 1 1 A 31 31 ALA H H 31 9.238 8.649 0.589 1
1 264 . 14 1 1 A 31 31 ALA HA H 31 4.477 4.436 0.041 1
1 268 . 14 1 1 A 31 31 ALA CA C 31 50.190 49.511 0.679 1
1 269 . 14 1 1 A 31 31 ALA CB C 31 21.637 19.810 1.827 1
1 270 . 14 1 1 A 31 31 ALA N N 31 133.864 130.073 3.791 1
1 271 . 14 1 1 A 32 32 PRO HA H 32 4.637 4.389 0.248 1
1 278 . 14 1 1 A 32 32 PRO C C 32 175.737 177.354 -1.617 1
1 279 . 14 1 1 A 32 32 PRO CA C 32 64.259 64.128 0.131 1
1 280 . 14 1 1 A 32 32 PRO CB C 32 31.740 31.704 0.036 1
1 283 . 14 1 1 A 33 33 CYS H H 33 8.779 8.289 0.490 1
1 284 . 14 1 1 A 33 33 CYS HA H 33 4.321 4.220 0.101 1
1 287 . 14 1 1 A 33 33 CYS C C 33 176.733 175.320 1.413 1
1 288 . 14 1 1 A 33 33 CYS CA C 33 54.398 61.805 -7.407 1
1 289 . 14 1 1 A 33 33 CYS CB C 33 30.697 27.148 3.549 1
1 290 . 14 1 1 A 33 33 CYS N N 33 120.005 116.183 3.822 1
1 291 . 14 1 1 A 34 34 CYS H H 34 7.424 7.629 -0.205 1
1 292 . 14 1 1 A 34 34 CYS HA H 34 4.896 4.637 0.259 1
1 295 . 14 1 1 A 34 34 CYS C C 34 174.935 174.756 0.179 1
1 296 . 14 1 1 A 34 34 CYS CA C 34 56.962 58.346 -1.384 1
1 297 . 14 1 1 A 34 34 CYS CB C 34 31.067 29.371 1.696 1
1 298 . 14 1 1 A 34 34 CYS N N 34 115.034 117.398 -2.364 1
1 299 . 14 1 1 A 35 35 ASP H H 35 8.368 8.014 0.354 1
1 300 . 14 1 1 A 35 35 ASP HA H 35 4.454 4.223 0.231 1
1 303 . 14 1 1 A 35 35 ASP C C 35 174.354 175.028 -0.674 1
1 304 . 14 1 1 A 35 35 ASP CA C 35 56.222 55.512 0.710 1
1 305 . 14 1 1 A 35 35 ASP CB C 35 39.730 39.648 0.082 1
1 306 . 14 1 1 A 35 35 ASP N N 35 121.381 117.064 4.317 1
1 307 . 14 1 1 A 36 36 LYS H H 36 7.227 7.543 -0.316 1
1 308 . 14 1 1 A 36 36 LYS HA H 36 4.451 4.480 -0.029 1
1 317 . 14 1 1 A 36 36 LYS C C 36 175.433 175.947 -0.514 1
1 318 . 14 1 1 A 36 36 LYS CA C 36 56.270 55.711 0.559 1
1 319 . 14 1 1 A 36 36 LYS CB C 36 36.620 33.848 2.772 1
1 323 . 14 1 1 A 36 36 LYS N N 36 117.673 118.294 -0.621 1
1 324 . 14 1 1 A 37 37 LEU H H 37 8.053 8.309 -0.256 1
1 325 . 14 1 1 A 37 37 LEU HA H 37 5.292 5.249 0.043 1
1 335 . 14 1 1 A 37 37 LEU C C 37 176.484 174.993 1.491 1
1 336 . 14 1 1 A 37 37 LEU CA C 37 53.348 52.891 0.457 1
1 337 . 14 1 1 A 37 37 LEU CB C 37 42.400 43.705 -1.305 1
1 341 . 14 1 1 A 37 37 LEU N N 37 120.994 121.261 -0.267 1
1 342 . 14 1 1 A 38 38 TYR H H 38 8.741 8.781 -0.040 1
1 343 . 14 1 1 A 38 38 TYR HA H 38 5.002 4.842 0.160 1
1 350 . 14 1 1 A 38 38 TYR C C 38 176.374 175.908 0.466 1
1 351 . 14 1 1 A 38 38 TYR CA C 38 57.081 57.072 0.009 1
1 352 . 14 1 1 A 38 38 TYR CB C 38 45.647 42.380 3.267 1
1 355 . 14 1 1 A 38 38 TYR N N 38 121.128 122.042 -0.914 1
1 356 . 14 1 1 A 39 39 THR H H 39 9.402 8.752 0.650 1
1 357 . 14 1 1 A 39 39 THR HA H 39 4.098 4.234 -0.136 1
1 362 . 14 1 1 A 39 39 THR C C 39 173.496 174.893 -1.397 1
1 363 . 14 1 1 A 39 39 THR CA C 39 67.062 64.740 2.322 1
1 364 . 14 1 1 A 39 39 THR CB C 39 68.047 68.890 -0.843 1
1 366 . 14 1 1 A 39 39 THR N N 39 116.641 116.649 -0.008 1
1 367 . 14 1 1 A 40 40 CYS H H 40 7.317 7.854 -0.537 1
1 368 . 14 1 1 A 40 40 CYS HA H 40 4.771 4.884 -0.113 1
1 371 . 14 1 1 A 40 40 CYS C C 40 175.128 174.800 0.328 1
1 372 . 14 1 1 A 40 40 CYS CA C 40 56.577 58.086 -1.509 1
1 373 . 14 1 1 A 40 40 CYS CB C 40 35.087 31.795 3.292 1
1 374 . 14 1 1 A 40 40 CYS N N 40 109.059 118.197 -9.138 1
1 375 . 14 1 1 A 41 41 ARG H H 41 9.201 8.785 0.416 1
1 376 . 14 1 1 A 41 41 ARG HA H 41 3.982 3.801 0.181 1
1 383 . 14 1 1 A 41 41 ARG C C 41 175.101 177.797 -2.696 1
1 384 . 14 1 1 A 41 41 ARG CA C 41 58.591 59.504 -0.913 1
1 385 . 14 1 1 A 41 41 ARG CB C 41 29.640 29.924 -0.284 1
1 388 . 14 1 1 A 41 41 ARG N N 41 121.737 124.815 -3.078 1
1 389 . 14 1 1 A 42 42 LEU H H 42 9.116 7.885 1.231 1
1 390 . 14 1 1 A 42 42 LEU HA H 42 4.029 3.959 0.070 1
1 400 . 14 1 1 A 42 42 LEU C C 42 179.943 179.082 0.861 1
1 401 . 14 1 1 A 42 42 LEU CA C 42 58.005 57.891 0.114 1
1 402 . 14 1 1 A 42 42 LEU CB C 42 38.960 41.184 -2.224 1
1 406 . 14 1 1 A 42 42 LEU N N 42 126.364 118.711 7.653 1
1 407 . 14 1 1 A 43 43 CYS H H 43 8.785 8.143 0.642 1
1 408 . 14 1 1 A 43 43 CYS HA H 43 4.187 4.212 -0.025 1
1 411 . 14 1 1 A 43 43 CYS C C 43 177.785 177.173 0.612 1
1 412 . 14 1 1 A 43 43 CYS CA C 43 66.415 62.412 4.003 1
1 413 . 14 1 1 A 43 43 CYS CB C 43 28.870 26.939 1.931 1
1 414 . 14 1 1 A 43 43 CYS N N 43 124.519 118.240 6.279 1
1 415 . 14 1 1 A 44 44 HIS H H 44 7.604 7.362 0.242 1
1 416 . 14 1 1 A 44 44 HIS HA H 44 1.983 2.649 -0.666 1
1 420 . 14 1 1 A 44 44 HIS C C 44 176.429 176.095 0.334 1
1 421 . 14 1 1 A 44 44 HIS CA C 44 58.760 58.617 0.143 1
1 422 . 14 1 1 A 44 44 HIS CB C 44 27.990 29.560 -1.570 1
1 423 . 14 1 1 A 44 44 HIS N N 44 117.024 121.149 -4.125 1
1 424 . 14 1 1 A 45 45 ASP H H 45 8.750 8.237 0.513 1
1 425 . 14 1 1 A 45 45 ASP HA H 45 4.116 4.113 0.003 1
1 428 . 14 1 1 A 45 45 ASP C C 45 177.453 177.873 -0.420 1
1 429 . 14 1 1 A 45 45 ASP CA C 45 56.840 57.096 -0.256 1
1 430 . 14 1 1 A 45 45 ASP CB C 45 38.960 41.375 -2.415 1
1 431 . 14 1 1 A 45 45 ASP N N 45 120.440 119.185 1.255 1
1 432 . 14 1 1 A 46 46 ASN H H 46 7.888 7.937 -0.049 1
1 433 . 14 1 1 A 46 46 ASN HA H 46 4.612 4.512 0.100 1
1 438 . 14 1 1 A 46 46 ASN C C 46 175.903 176.242 -0.339 1
1 439 . 14 1 1 A 46 46 ASN CA C 46 54.342 54.914 -0.572 1
1 440 . 14 1 1 A 46 46 ASN CB C 46 38.790 38.119 0.671 1
1 441 . 14 1 1 A 46 46 ASN N N 46 115.758 116.458 -0.700 1
1 443 . 14 1 1 A 47 47 ASN H H 47 7.384 7.641 -0.257 1
1 444 . 14 1 1 A 47 47 ASN HA H 47 4.893 4.780 0.113 1
1 449 . 14 1 1 A 47 47 ASN C C 47 173.579 175.076 -1.497 1
1 450 . 14 1 1 A 47 47 ASN CA C 47 53.937 53.066 0.871 1
1 451 . 14 1 1 A 47 47 ASN CB C 47 43.130 40.053 3.077 1
1 452 . 14 1 1 A 47 47 ASN N N 47 116.576 115.613 0.963 1
1 454 . 14 1 1 A 48 48 GLU H H 48 7.143 7.536 -0.393 1
1 455 . 14 1 1 A 48 48 GLU HA H 48 4.572 4.581 -0.009 1
1 460 . 14 1 1 A 48 48 GLU C C 48 175.627 176.000 -0.373 1
1 461 . 14 1 1 A 48 48 GLU CA C 48 53.727 54.728 -1.001 1
1 462 . 14 1 1 A 48 48 GLU CB C 48 32.480 31.308 1.172 1
1 464 . 14 1 1 A 48 48 GLU N N 48 116.967 117.195 -0.228 1
1 465 . 14 1 1 A 49 49 ASP H H 49 8.748 8.975 -0.227 1
1 466 . 14 1 1 A 49 49 ASP HA H 49 4.576 4.780 -0.204 1
1 469 . 14 1 1 A 49 49 ASP C C 49 174.796 175.316 -0.520 1
1 470 . 14 1 1 A 49 49 ASP CA C 49 53.027 54.777 -1.750 1
1 471 . 14 1 1 A 49 49 ASP CB C 49 40.340 41.771 -1.431 1
1 472 . 14 1 1 A 49 49 ASP N N 49 119.296 120.322 -1.026 1
1 473 . 14 1 1 A 50 50 HIS H H 50 6.919 7.301 -0.382 1
1 474 . 14 1 1 A 50 50 HIS HA H 50 4.880 5.008 -0.128 1
1 477 . 14 1 1 A 50 50 HIS C C 50 172.942 172.812 0.130 1
1 478 . 14 1 1 A 50 50 HIS CA C 50 53.978 54.444 -0.466 1
1 479 . 14 1 1 A 50 50 HIS CB C 50 30.330 31.274 -0.944 1
1 480 . 14 1 1 A 50 50 HIS N N 50 113.709 115.568 -1.859 1
1 481 . 14 1 1 A 51 51 GLN H H 51 8.646 8.550 0.096 1
1 482 . 14 1 1 A 51 51 GLN HA H 51 4.896 4.637 0.259 1
1 487 . 14 1 1 A 51 51 GLN C C 51 176.512 174.638 1.874 1
1 488 . 14 1 1 A 51 51 GLN CA C 51 54.872 55.325 -0.453 1
1 489 . 14 1 1 A 51 51 GLN CB C 51 30.950 29.909 1.041 1
1 491 . 14 1 1 A 51 51 GLN N N 51 119.379 119.265 0.114 1
1 492 . 14 1 1 A 52 52 LEU H H 52 9.646 8.722 0.924 1
1 493 . 14 1 1 A 52 52 LEU HA H 52 4.206 4.535 -0.329 1
1 503 . 14 1 1 A 52 52 LEU C C 52 175.793 174.454 1.339 1
1 504 . 14 1 1 A 52 52 LEU CA C 52 55.450 53.691 1.759 1
1 505 . 14 1 1 A 52 52 LEU CB C 52 41.407 43.009 -1.602 1
1 509 . 14 1 1 A 52 52 LEU N N 52 128.069 125.371 2.698 1
1 510 . 14 1 1 A 53 53 ASP H H 53 9.281 8.895 0.386 1
1 511 . 14 1 1 A 53 53 ASP HA H 53 4.725 4.618 0.107 1
1 514 . 14 1 1 A 53 53 ASP C C 53 176.401 177.463 -1.062 1
1 515 . 14 1 1 A 53 53 ASP CA C 53 52.590 54.460 -1.870 1
1 516 . 14 1 1 A 53 53 ASP CB C 53 39.990 41.111 -1.121 1
1 517 . 14 1 1 A 53 53 ASP N N 53 128.783 127.534 1.249 1
1 518 . 14 1 1 A 54 54 ARG H H 54 8.496 8.503 -0.007 1
1 519 . 14 1 1 A 54 54 ARG HA H 54 3.859 3.838 0.021 1
1 526 . 14 1 1 A 54 54 ARG C C 54 176.346 176.809 -0.463 1
1 527 . 14 1 1 A 54 54 ARG CA C 54 57.357 57.948 -0.591 1
1 528 . 14 1 1 A 54 54 ARG CB C 54 28.890 29.441 -0.551 1
1 531 . 14 1 1 A 54 54 ARG N N 54 125.813 124.989 0.824 1
1 532 . 14 1 1 A 55 55 PHE H H 55 8.005 7.410 0.595 1
1 533 . 14 1 1 A 55 55 PHE HA H 55 4.712 4.516 0.196 1
1 540 . 14 1 1 A 55 55 PHE C C 55 177.481 176.789 0.692 1
1 541 . 14 1 1 A 55 55 PHE CA C 55 59.080 59.393 -0.313 1
1 542 . 14 1 1 A 55 55 PHE CB C 55 37.447 38.123 -0.676 1
1 545 . 14 1 1 A 55 55 PHE N N 55 120.168 117.245 2.923 1
1 546 . 14 1 1 A 56 56 LYS H H 56 7.681 7.485 0.196 1
1 547 . 14 1 1 A 56 56 LYS HA H 56 4.411 4.379 0.032 1
1 556 . 14 1 1 A 56 56 LYS C C 56 175.959 176.311 -0.352 1
1 557 . 14 1 1 A 56 56 LYS CA C 56 55.459 56.716 -1.257 1
1 558 . 14 1 1 A 56 56 LYS CB C 56 33.590 33.919 -0.329 1
1 562 . 14 1 1 A 56 56 LYS N N 56 116.937 116.339 0.598 1
1 563 . 14 1 1 A 57 57 VAL H H 57 6.553 7.098 -0.545 1
1 564 . 14 1 1 A 57 57 VAL HA H 57 3.408 3.930 -0.522 1
1 572 . 14 1 1 A 57 57 VAL C C 57 173.911 175.770 -1.859 1
1 573 . 14 1 1 A 57 57 VAL CA C 57 65.025 61.885 3.140 1
1 574 . 14 1 1 A 57 57 VAL CB C 57 32.663 31.383 1.280 1
1 577 . 14 1 1 A 57 57 VAL N N 57 119.519 117.611 1.908 1
1 578 . 14 1 1 A 58 58 LYS H H 58 9.182 8.769 0.413 1
1 579 . 14 1 1 A 58 58 LYS HA H 58 4.489 4.385 0.104 1
1 588 . 14 1 1 A 58 58 LYS C C 58 176.927 176.634 0.293 1
1 589 . 14 1 1 A 58 58 LYS CA C 58 55.913 57.917 -2.004 1
1 590 . 14 1 1 A 58 58 LYS CB C 58 36.340 33.674 2.666 1
1 594 . 14 1 1 A 58 58 LYS N N 58 124.985 126.689 -1.704 1
1 595 . 14 1 1 A 59 59 GLU H H 59 8.799 7.808 0.991 1
1 596 . 14 1 1 A 59 59 GLU HA H 59 5.209 4.611 0.598 1
1 601 . 14 1 1 A 59 59 GLU C C 59 173.911 175.799 -1.888 1
1 602 . 14 1 1 A 59 59 GLU CA C 59 54.670 55.330 -0.660 1
1 603 . 14 1 1 A 59 59 GLU CB C 59 35.180 31.296 3.884 1
1 605 . 14 1 1 A 59 59 GLU N N 59 121.493 117.437 4.056 1
1 606 . 14 1 1 A 60 60 VAL H H 60 8.917 8.678 0.239 1
1 607 . 14 1 1 A 60 60 VAL HA H 60 4.983 4.778 0.205 1
1 615 . 14 1 1 A 60 60 VAL C C 60 173.441 174.493 -1.052 1
1 616 . 14 1 1 A 60 60 VAL CA C 60 57.497 59.300 -1.803 1
1 617 . 14 1 1 A 60 60 VAL CB C 60 35.460 36.413 -0.953 1
1 620 . 14 1 1 A 60 60 VAL N N 60 109.266 117.475 -8.209 1
1 621 . 14 1 1 A 61 61 GLN H H 61 8.970 8.553 0.417 1
1 622 . 14 1 1 A 61 61 GLN HA H 61 5.024 4.787 0.237 1
1 629 . 14 1 1 A 61 61 GLN C C 61 175.045 174.233 0.812 1
1 630 . 14 1 1 A 61 61 GLN CA C 61 53.128 54.212 -1.084 1
1 631 . 14 1 1 A 61 61 GLN CB C 61 33.980 30.020 3.960 1
1 633 . 14 1 1 A 61 61 GLN N N 61 118.525 120.763 -2.238 1
1 635 . 14 1 1 A 62 62 CYS H H 62 7.688 8.321 -0.633 1
1 636 . 14 1 1 A 62 62 CYS HA H 62 4.210 4.748 -0.538 1
1 639 . 14 1 1 A 62 62 CYS C C 62 177.951 174.946 3.005 1
1 640 . 14 1 1 A 62 62 CYS CA C 62 59.845 57.395 2.450 1
1 641 . 14 1 1 A 62 62 CYS CB C 62 33.120 29.622 3.498 1
1 642 . 14 1 1 A 62 62 CYS N N 62 128.772 120.775 7.997 1
1 643 . 14 1 1 A 63 63 ILE H H 63 8.192 8.621 -0.429 1
1 644 . 14 1 1 A 63 63 ILE HA H 63 3.984 4.100 -0.116 1
1 654 . 14 1 1 A 63 63 ILE C C 63 175.433 177.033 -1.600 1
1 655 . 14 1 1 A 63 63 ILE CA C 63 63.657 63.484 0.173 1
1 656 . 14 1 1 A 63 63 ILE CB C 63 38.506 38.583 -0.077 1
1 660 . 14 1 1 A 63 63 ILE N N 63 127.455 126.577 0.878 1
1 661 . 14 1 1 A 64 64 ASN H H 64 9.181 7.594 1.587 1
1 662 . 14 1 1 A 64 64 ASN HA H 64 4.810 4.700 0.110 1
1 667 . 14 1 1 A 64 64 ASN C C 64 175.931 175.263 0.668 1
1 668 . 14 1 1 A 64 64 ASN CA C 64 55.617 52.131 3.486 1
1 669 . 14 1 1 A 64 64 ASN CB C 64 40.640 37.566 3.074 1
1 670 . 14 1 1 A 64 64 ASN N N 64 122.104 118.063 4.041 1
1 672 . 14 1 1 A 65 65 CYS H H 65 9.065 7.965 1.100 1
1 673 . 14 1 1 A 65 65 CYS HA H 65 4.979 4.502 0.477 1
1 676 . 14 1 1 A 65 65 CYS C C 65 176.291 174.797 1.494 1
1 677 . 14 1 1 A 65 65 CYS CA C 65 59.027 60.032 -1.005 1
1 678 . 14 1 1 A 65 65 CYS CB C 65 32.030 26.516 5.514 1
1 679 . 14 1 1 A 65 65 CYS N N 65 120.368 122.007 -1.639 1
1 680 . 14 1 1 A 66 66 GLU H H 66 7.281 8.409 -1.128 1
1 681 . 14 1 1 A 66 66 GLU HA H 66 4.046 4.355 -0.309 1
1 686 . 14 1 1 A 66 66 GLU C C 66 175.211 174.713 0.498 1
1 687 . 14 1 1 A 66 66 GLU CA C 66 58.591 58.060 0.531 1
1 688 . 14 1 1 A 66 66 GLU CB C 66 27.067 27.448 -0.381 1
1 690 . 14 1 1 A 66 66 GLU N N 66 115.012 116.545 -1.533 1
1 691 . 14 1 1 A 67 67 LYS H H 67 8.481 7.778 0.703 1
1 692 . 14 1 1 A 67 67 LYS HA H 67 4.326 4.595 -0.269 1
1 701 . 14 1 1 A 67 67 LYS C C 67 177.923 175.910 2.013 1
1 702 . 14 1 1 A 67 67 LYS CA C 67 57.628 55.644 1.984 1
1 703 . 14 1 1 A 67 67 LYS CB C 67 33.617 34.143 -0.526 1
1 707 . 14 1 1 A 67 67 LYS N N 67 123.514 120.533 2.981 1
1 708 . 14 1 1 A 68 68 ILE H H 68 8.867 8.422 0.445 1
1 709 . 14 1 1 A 68 68 ILE HA H 68 4.976 4.539 0.437 1
1 719 . 14 1 1 A 68 68 ILE C C 68 175.018 175.461 -0.443 1
1 720 . 14 1 1 A 68 68 ILE CA C 68 60.919 60.237 0.682 1
1 721 . 14 1 1 A 68 68 ILE CB C 68 37.090 37.941 -0.851 1
1 725 . 14 1 1 A 68 68 ILE N N 68 133.478 125.505 7.973 1
1 726 . 14 1 1 A 69 69 GLN H H 69 9.269 8.802 0.467 1
1 727 . 14 1 1 A 69 69 GLN HA H 69 5.036 5.059 -0.023 1
1 732 . 14 1 1 A 69 69 GLN C C 69 173.607 174.817 -1.210 1
1 733 . 14 1 1 A 69 69 GLN CA C 69 53.419 53.764 -0.345 1
1 734 . 14 1 1 A 69 69 GLN CB C 69 34.997 32.382 2.615 1
1 736 . 14 1 1 A 69 69 GLN N N 69 125.104 123.911 1.193 1
1 737 . 14 1 1 A 70 70 HIS H H 70 8.829 8.996 -0.167 1
1 738 . 14 1 1 A 70 70 HIS HA H 70 4.865 4.849 0.016 1
1 741 . 14 1 1 A 70 70 HIS C C 70 174.852 175.335 -0.483 1
1 742 . 14 1 1 A 70 70 HIS CA C 70 56.304 56.600 -0.296 1
1 743 . 14 1 1 A 70 70 HIS CB C 70 30.050 30.871 -0.821 1
1 744 . 14 1 1 A 70 70 HIS N N 70 118.576 118.993 -0.417 1
1 745 . 14 1 1 A 71 71 ALA H H 71 7.768 8.268 -0.500 1
1 746 . 14 1 1 A 71 71 ALA HA H 71 3.977 4.440 -0.463 1
1 750 . 14 1 1 A 71 71 ALA C C 71 175.433 176.864 -1.431 1
1 751 . 14 1 1 A 71 71 ALA CA C 71 54.393 52.485 1.908 1
1 752 . 14 1 1 A 71 71 ALA CB C 71 18.000 18.579 -0.579 1
1 753 . 14 1 1 A 71 71 ALA N N 71 121.438 124.762 -3.324 1
1 754 . 14 1 1 A 72 72 GLN H H 72 7.227 7.847 -0.620 1
1 755 . 14 1 1 A 72 72 GLN HA H 72 4.371 4.424 -0.053 1
1 762 . 14 1 1 A 72 72 GLN C C 72 173.053 175.037 -1.984 1
1 763 . 14 1 1 A 72 72 GLN CA C 72 54.290 53.261 1.029 1
1 764 . 14 1 1 A 72 72 GLN CB C 72 28.623 30.187 -1.564 1
1 766 . 14 1 1 A 72 72 GLN N N 72 115.858 123.565 -7.707 1
1 768 . 14 1 1 A 73 73 GLN H H 73 8.481 8.588 -0.107 1
1 769 . 14 1 1 A 73 73 GLN HA H 73 3.570 3.661 -0.091 1
1 776 . 14 1 1 A 73 73 GLN C C 73 174.243 174.941 -0.698 1
1 777 . 14 1 1 A 73 73 GLN CA C 73 60.206 56.675 3.531 1
1 778 . 14 1 1 A 73 73 GLN CB C 73 28.850 29.876 -1.026 1
1 780 . 14 1 1 A 73 73 GLN N N 73 116.433 118.195 -1.762 1
1 782 . 14 1 1 A 74 74 THR H H 74 7.211 7.497 -0.286 1
1 783 . 14 1 1 A 74 74 THR HA H 74 4.160 5.160 -1.000 1
1 788 . 14 1 1 A 74 74 THR C C 74 171.836 173.388 -1.552 1
1 789 . 14 1 1 A 74 74 THR CA C 74 59.072 60.702 -1.630 1
1 790 . 14 1 1 A 74 74 THR CB C 74 71.560 72.268 -0.708 1
1 792 . 14 1 1 A 74 74 THR N N 74 108.717 110.799 -2.082 1
1 793 . 14 1 1 A 75 75 CYS H H 75 7.676 8.882 -1.206 1
1 794 . 14 1 1 A 75 75 CYS HA H 75 4.158 4.607 -0.449 1
1 797 . 14 1 1 A 75 75 CYS C C 75 178.781 176.057 2.724 1
1 798 . 14 1 1 A 75 75 CYS CA C 75 58.661 60.062 -1.401 1
1 799 . 14 1 1 A 75 75 CYS CB C 75 30.840 28.763 2.077 1
1 800 . 14 1 1 A 75 75 CYS N N 75 123.108 126.030 -2.922 1
1 801 . 14 1 1 A 76 76 GLU H H 76 9.203 8.866 0.337 1
1 802 . 14 1 1 A 76 76 GLU HA H 76 4.187 4.071 0.116 1
1 807 . 14 1 1 A 76 76 GLU C C 76 175.488 178.896 -3.408 1
1 808 . 14 1 1 A 76 76 GLU CA C 76 57.306 58.955 -1.649 1
1 809 . 14 1 1 A 76 76 GLU CB C 76 29.347 29.075 0.272 1
1 811 . 14 1 1 A 76 76 GLU N N 76 129.817 127.406 2.411 1
1 812 . 14 1 1 A 77 77 GLU H H 77 9.496 7.350 2.146 1
1 813 . 14 1 1 A 77 77 GLU HA H 77 4.599 4.110 0.489 1
1 818 . 14 1 1 A 77 77 GLU C C 77 177.148 177.286 -0.138 1
1 819 . 14 1 1 A 77 77 GLU CA C 77 57.554 58.738 -1.184 1
1 820 . 14 1 1 A 77 77 GLU CB C 77 31.980 30.442 1.538 1
1 822 . 14 1 1 A 77 77 GLU N N 77 124.795 120.506 4.289 1
1 823 . 14 1 1 A 78 78 CYS H H 78 8.967 7.756 1.211 1
1 824 . 14 1 1 A 78 78 CYS HA H 78 5.073 4.607 0.466 1
1 827 . 14 1 1 A 78 78 CYS C C 78 176.374 174.910 1.464 1
1 828 . 14 1 1 A 78 78 CYS CA C 78 58.537 58.240 0.297 1
1 829 . 14 1 1 A 78 78 CYS CB C 78 31.597 29.280 2.317 1
1 830 . 14 1 1 A 78 78 CYS N N 78 119.692 115.334 4.358 1
1 831 . 14 1 1 A 79 79 SER H H 79 7.474 8.215 -0.741 1
1 832 . 14 1 1 A 79 79 SER HA H 79 4.113 4.159 -0.046 1
1 835 . 14 1 1 A 79 79 SER C C 79 172.915 172.783 0.132 1
1 836 . 14 1 1 A 79 79 SER CA C 79 60.440 59.385 1.055 1
1 837 . 14 1 1 A 79 79 SER CB C 79 61.421 61.209 0.212 1
1 838 . 14 1 1 A 79 79 SER N N 79 113.385 112.935 0.450 1
1 839 . 14 1 1 A 80 80 THR H H 80 7.907 7.786 0.121 1
1 840 . 14 1 1 A 80 80 THR HA H 80 3.913 4.570 -0.657 1
1 845 . 14 1 1 A 80 80 THR C C 80 172.306 173.107 -0.801 1
1 846 . 14 1 1 A 80 80 THR CA C 80 65.262 61.423 3.839 1
1 847 . 14 1 1 A 80 80 THR CB C 80 69.910 69.863 0.047 1
1 849 . 14 1 1 A 80 80 THR N N 80 120.005 114.033 5.972 1
1 850 . 14 1 1 A 81 81 LEU H H 81 8.556 8.614 -0.058 1
1 851 . 14 1 1 A 81 81 LEU HA H 81 4.172 4.699 -0.527 1
1 861 . 14 1 1 A 81 81 LEU C C 81 177.121 176.463 0.658 1
1 862 . 14 1 1 A 81 81 LEU CA C 81 54.996 54.174 0.822 1
1 863 . 14 1 1 A 81 81 LEU CB C 81 42.147 42.925 -0.778 1
1 867 . 14 1 1 A 81 81 LEU N N 81 128.272 130.099 -1.827 1
1 868 . 14 1 1 A 82 82 PHE H H 82 9.251 9.424 -0.173 1
1 869 . 14 1 1 A 82 82 PHE HA H 82 4.576 4.470 0.106 1
1 874 . 14 1 1 A 82 82 PHE C C 82 177.785 175.780 2.005 1
1 875 . 14 1 1 A 82 82 PHE CA C 82 56.470 59.860 -3.390 1
1 876 . 14 1 1 A 82 82 PHE CB C 82 38.210 38.974 -0.764 1
1 878 . 14 1 1 A 82 82 PHE N N 82 129.268 126.221 3.047 1
1 879 . 14 1 1 A 83 83 GLY H H 83 7.047 7.368 -0.321 1
1 880 . 14 1 1 A 83 83 GLY HA2 H 83 4.783 4.203 0.580 1
1 881 . 14 1 1 A 83 83 GLY HA3 H 83 3.876 4.269 -0.393 1
1 882 . 14 1 1 A 83 83 GLY C C 83 171.642 174.727 -3.085 1
1 883 . 14 1 1 A 83 83 GLY CA C 83 45.826 45.719 0.107 1
1 884 . 14 1 1 A 83 83 GLY N N 83 102.168 106.001 -3.833 1
1 885 . 14 1 1 A 84 84 GLU H H 84 8.444 9.035 -0.591 1
1 886 . 14 1 1 A 84 84 GLU HA H 84 4.111 4.138 -0.027 1
1 891 . 14 1 1 A 84 84 GLU C C 84 177.259 176.498 0.761 1
1 892 . 14 1 1 A 84 84 GLU CA C 84 59.438 59.169 0.269 1
1 893 . 14 1 1 A 84 84 GLU CB C 84 30.670 30.175 0.495 1
1 895 . 14 1 1 A 84 84 GLU N N 84 127.546 121.142 6.404 1
1 896 . 14 1 1 A 85 85 TYR H H 85 9.344 8.032 1.312 1
1 897 . 14 1 1 A 85 85 TYR HA H 85 4.599 4.959 -0.360 1
1 902 . 14 1 1 A 85 85 TYR C C 85 173.302 174.301 -0.999 1
1 903 . 14 1 1 A 85 85 TYR CA C 85 57.261 58.337 -1.076 1
1 904 . 14 1 1 A 85 85 TYR CB C 85 40.850 40.210 0.640 1
1 906 . 14 1 1 A 85 85 TYR N N 85 118.936 121.692 -2.756 1
1 907 . 14 1 1 A 86 86 TYR H H 86 7.323 8.637 -1.314 1
1 908 . 14 1 1 A 86 86 TYR HA H 86 5.298 5.781 -0.483 1
1 911 . 14 1 1 A 86 86 TYR C C 86 172.804 172.671 0.133 1
1 912 . 14 1 1 A 86 86 TYR CA C 86 54.041 55.313 -1.272 1
1 913 . 14 1 1 A 86 86 TYR CB C 86 40.987 41.867 -0.880 1
1 914 . 14 1 1 A 86 86 TYR N N 86 124.965 121.007 3.958 1
1 915 . 14 1 1 A 87 87 CYS H H 87 7.046 9.039 -1.993 1
1 916 . 14 1 1 A 87 87 CYS HA H 87 3.842 4.531 -0.689 1
1 919 . 14 1 1 A 87 87 CYS C C 87 174.243 174.431 -0.188 1
1 920 . 14 1 1 A 87 87 CYS CA C 87 56.377 58.060 -1.683 1
1 921 . 14 1 1 A 87 87 CYS CB C 87 33.230 29.855 3.375 1
1 922 . 14 1 1 A 87 87 CYS N N 87 128.735 118.702 10.033 1
1 923 . 14 1 1 A 88 88 ASP H H 88 8.002 8.858 -0.856 1
1 924 . 14 1 1 A 88 88 ASP HA H 88 3.761 4.268 -0.507 1
1 927 . 14 1 1 A 88 88 ASP C C 88 173.579 177.314 -3.735 1
1 928 . 14 1 1 A 88 88 ASP CA C 88 53.958 57.797 -3.839 1
1 929 . 14 1 1 A 88 88 ASP CB C 88 41.240 40.994 0.246 1
1 930 . 14 1 1 A 88 88 ASP N N 88 127.013 127.486 -0.473 1
1 931 . 14 1 1 A 89 89 ILE H H 89 7.972 7.753 0.219 1
1 932 . 14 1 1 A 89 89 ILE HA H 89 3.660 3.530 0.130 1
1 942 . 14 1 1 A 89 89 ILE C C 89 177.259 178.127 -0.868 1
1 943 . 14 1 1 A 89 89 ILE CA C 89 63.107 65.286 -2.179 1
1 944 . 14 1 1 A 89 89 ILE CB C 89 39.430 38.381 1.049 1
1 948 . 14 1 1 A 89 89 ILE N N 89 120.357 118.670 1.687 1
1 949 . 14 1 1 A 90 90 CYS H H 90 8.554 7.752 0.802 1
1 950 . 14 1 1 A 90 90 CYS HA H 90 3.677 4.241 -0.564 1
1 953 . 14 1 1 A 90 90 CYS C C 90 175.128 174.633 0.495 1
1 954 . 14 1 1 A 90 90 CYS CA C 90 60.791 61.139 -0.348 1
1 955 . 14 1 1 A 90 90 CYS CB C 90 30.427 27.905 2.522 1
1 956 . 14 1 1 A 90 90 CYS N N 90 119.564 117.759 1.805 1
1 957 . 14 1 1 A 91 91 HIS H H 91 7.364 7.616 -0.252 1
1 958 . 14 1 1 A 91 91 HIS HA H 91 3.512 3.674 -0.162 1
1 963 . 14 1 1 A 91 91 HIS C C 91 170.590 173.113 -2.523 1
1 964 . 14 1 1 A 91 91 HIS CA C 91 58.739 56.572 2.167 1
1 965 . 14 1 1 A 91 91 HIS CB C 91 24.810 26.439 -1.629 1
1 968 . 14 1 1 A 91 91 HIS N N 91 111.440 115.825 -4.385 1
1 969 . 14 1 1 A 92 92 LEU H H 92 6.214 7.635 -1.421 1
1 970 . 14 1 1 A 92 92 LEU HA H 92 4.191 4.019 0.172 1
1 980 . 14 1 1 A 92 92 LEU C C 92 173.911 175.955 -2.044 1
1 981 . 14 1 1 A 92 92 LEU CA C 92 53.717 53.711 0.006 1
1 982 . 14 1 1 A 92 92 LEU CB C 92 45.360 42.300 3.060 1
1 986 . 14 1 1 A 92 92 LEU N N 92 115.684 119.812 -4.128 1
1 987 . 14 1 1 A 93 93 PHE H H 93 6.669 8.890 -2.221 1
1 988 . 14 1 1 A 93 93 PHE HA H 93 5.622 5.310 0.312 1
1 995 . 14 1 1 A 93 93 PHE C C 93 175.765 174.651 1.114 1
1 996 . 14 1 1 A 93 93 PHE CA C 93 55.387 56.499 -1.112 1
1 997 . 14 1 1 A 93 93 PHE CB C 93 42.700 41.584 1.116 1
1 1000 . 14 1 1 A 93 93 PHE N N 93 121.535 122.096 -0.561 1
1 1001 . 14 1 1 A 94 94 ASP H H 94 9.209 8.997 0.212 1
1 1002 . 14 1 1 A 94 94 ASP HA H 94 5.819 5.337 0.482 1
1 1005 . 14 1 1 A 94 94 ASP C C 94 175.654 175.400 0.254 1
1 1006 . 14 1 1 A 94 94 ASP CA C 94 53.330 53.325 0.005 1
1 1007 . 14 1 1 A 94 94 ASP CB C 94 44.720 44.283 0.437 1
1 1008 . 14 1 1 A 94 94 ASP N N 94 123.504 120.614 2.890 1
1 1009 . 14 1 1 A 95 95 LYS H H 95 9.043 8.607 0.436 1
1 1010 . 14 1 1 A 95 95 LYS HA H 95 4.527 4.440 0.087 1
1 1019 . 14 1 1 A 95 95 LYS C C 95 174.879 176.370 -1.491 1
1 1020 . 14 1 1 A 95 95 LYS CA C 95 56.620 57.092 -0.472 1
1 1021 . 14 1 1 A 95 95 LYS CB C 95 33.720 33.123 0.597 1
1 1025 . 14 1 1 A 95 95 LYS N N 95 120.380 119.882 0.498 1
1 1026 . 14 1 1 A 96 96 ASP H H 96 8.999 8.742 0.257 1
1 1027 . 14 1 1 A 96 96 ASP HA H 96 4.724 4.870 -0.146 1
1 1030 . 14 1 1 A 96 96 ASP C C 96 176.401 175.044 1.357 1
1 1031 . 14 1 1 A 96 96 ASP CA C 96 56.147 53.478 2.669 1
1 1032 . 14 1 1 A 96 96 ASP CB C 96 40.790 41.550 -0.760 1
1 1033 . 14 1 1 A 96 96 ASP N N 96 120.784 123.513 -2.729 1
1 1034 . 14 1 1 A 97 97 LYS H H 97 9.382 8.641 0.741 1
1 1035 . 14 1 1 A 97 97 LYS HA H 97 4.473 4.593 -0.120 1
1 1044 . 14 1 1 A 97 97 LYS C C 97 175.903 176.344 -0.441 1
1 1045 . 14 1 1 A 97 97 LYS CA C 97 54.771 54.980 -0.209 1
1 1046 . 14 1 1 A 97 97 LYS CB C 97 33.270 33.622 -0.352 1
1 1050 . 14 1 1 A 97 97 LYS N N 97 131.617 126.672 4.945 1
1 1051 . 14 1 1 A 98 98 LYS H H 98 8.940 8.255 0.685 1
1 1052 . 14 1 1 A 98 98 LYS HA H 98 4.118 3.881 0.237 1
1 1061 . 14 1 1 A 98 98 LYS C C 98 177.065 175.339 1.726 1
1 1062 . 14 1 1 A 98 98 LYS CA C 98 56.297 57.902 -1.605 1
1 1063 . 14 1 1 A 98 98 LYS CB C 98 28.467 30.004 -1.537 1
1 1067 . 14 1 1 A 98 98 LYS N N 98 115.034 119.333 -4.299 1
1 1068 . 14 1 1 A 99 99 GLN H H 99 9.266 7.978 1.288 1
1 1069 . 14 1 1 A 99 99 GLN HA H 99 4.460 4.716 -0.256 1
1 1074 . 14 1 1 A 99 99 GLN C C 99 174.990 174.888 0.102 1
1 1075 . 14 1 1 A 99 99 GLN CA C 99 57.563 55.099 2.464 1
1 1076 . 14 1 1 A 99 99 GLN CB C 99 27.280 30.006 -2.726 1
1 1078 . 14 1 1 A 99 99 GLN N N 99 117.717 118.466 -0.749 1
1 1079 . 14 1 1 A 100 100 TYR H H 100 8.402 8.623 -0.221 1
1 1080 . 14 1 1 A 100 100 TYR HA H 100 4.935 5.222 -0.287 1
1 1087 . 14 1 1 A 100 100 TYR C C 100 171.504 172.648 -1.144 1
1 1088 . 14 1 1 A 100 100 TYR CA C 100 55.786 55.781 0.005 1
1 1089 . 14 1 1 A 100 100 TYR CB C 100 41.090 41.531 -0.441 1
1 1092 . 14 1 1 A 100 100 TYR N N 100 115.081 115.996 -0.915 1
1 1093 . 14 1 1 A 101 101 HIS H H 101 8.829 9.101 -0.272 1
1 1094 . 14 1 1 A 101 101 HIS HA H 101 4.525 4.809 -0.284 1
1 1099 . 14 1 1 A 101 101 HIS C C 101 174.935 173.763 1.172 1
1 1100 . 14 1 1 A 101 101 HIS CA C 101 56.327 55.035 1.292 1
1 1101 . 14 1 1 A 101 101 HIS CB C 101 31.020 30.416 0.604 1
1 1104 . 14 1 1 A 101 101 HIS N N 101 120.894 122.439 -1.545 1
1 1105 . 14 1 1 A 102 102 CYS H H 102 7.427 8.250 -0.823 1
1 1106 . 14 1 1 A 102 102 CYS HA H 102 4.561 4.491 0.070 1
1 1109 . 14 1 1 A 102 102 CYS C C 102 175.765 175.503 0.262 1
1 1110 . 14 1 1 A 102 102 CYS CA C 102 57.707 57.973 -0.266 1
1 1111 . 14 1 1 A 102 102 CYS CB C 102 29.130 28.442 0.688 1
1 1112 . 14 1 1 A 102 102 CYS N N 102 131.256 127.054 4.202 1
1 1113 . 14 1 1 A 103 103 GLU H H 103 9.497 9.000 0.497 1
1 1114 . 14 1 1 A 103 103 GLU HA H 103 4.003 4.169 -0.166 1
1 1119 . 14 1 1 A 103 103 GLU C C 103 176.540 178.700 -2.160 1
1 1120 . 14 1 1 A 103 103 GLU CA C 103 58.796 59.447 -0.651 1
1 1121 . 14 1 1 A 103 103 GLU CB C 103 29.280 29.589 -0.309 1
1 1123 . 14 1 1 A 103 103 GLU N N 103 129.829 127.521 2.308 1
1 1124 . 14 1 1 A 104 104 ASN H H 104 7.832 7.939 -0.107 1
1 1125 . 14 1 1 A 104 104 ASN HA H 104 4.457 4.433 0.024 1
1 1130 . 14 1 1 A 104 104 ASN C C 104 176.401 177.986 -1.585 1
1 1131 . 14 1 1 A 104 104 ASN CA C 104 56.053 56.179 -0.126 1
1 1132 . 14 1 1 A 104 104 ASN CB C 104 38.400 38.115 0.285 1
1 1133 . 14 1 1 A 104 104 ASN N N 104 117.703 118.538 -0.835 1
1 1135 . 14 1 1 A 105 105 CYS H H 105 9.415 7.335 2.080 1
1 1136 . 14 1 1 A 105 105 CYS HA H 105 4.137 4.444 -0.307 1
1 1139 . 14 1 1 A 105 105 CYS C C 105 176.844 175.162 1.682 1
1 1140 . 14 1 1 A 105 105 CYS CA C 105 64.328 59.082 5.246 1
1 1141 . 14 1 1 A 105 105 CYS CB C 105 30.350 27.668 2.682 1
1 1142 . 14 1 1 A 105 105 CYS N N 105 124.939 115.404 9.535 1
1 1143 . 14 1 1 A 106 106 GLY H H 106 8.145 8.868 -0.723 1
1 1144 . 14 1 1 A 106 106 GLY HA2 H 106 3.980 3.915 0.065 1
1 1145 . 14 1 1 A 106 106 GLY HA3 H 106 3.502 3.919 -0.417 1
1 1146 . 14 1 1 A 106 106 GLY C C 106 172.500 173.525 -1.025 1
1 1147 . 14 1 1 A 106 106 GLY CA C 106 44.968 45.565 -0.597 1
1 1148 . 14 1 1 A 106 106 GLY N N 106 106.090 109.345 -3.255 1
1 1149 . 14 1 1 A 107 107 ILE H H 107 6.465 6.795 -0.330 1
1 1150 . 14 1 1 A 107 107 ILE HA H 107 4.878 4.913 -0.035 1
1 1160 . 14 1 1 A 107 107 ILE C C 107 174.824 174.147 0.677 1
1 1161 . 14 1 1 A 107 107 ILE CA C 107 58.226 58.425 -0.199 1
1 1162 . 14 1 1 A 107 107 ILE CB C 107 44.460 42.339 2.121 1
1 1166 . 14 1 1 A 107 107 ILE N N 107 107.914 114.647 -6.733 1
1 1167 . 14 1 1 A 108 108 CYS H H 108 7.041 8.787 -1.746 1
1 1168 . 14 1 1 A 108 108 CYS HA H 108 5.018 5.175 -0.157 1
1 1171 . 14 1 1 A 108 108 CYS C C 108 175.461 173.173 2.288 1
1 1172 . 14 1 1 A 108 108 CYS CA C 108 62.097 58.124 3.973 1
1 1173 . 14 1 1 A 108 108 CYS CB C 108 31.353 30.746 0.607 1
1 1174 . 14 1 1 A 108 108 CYS N N 108 122.441 118.992 3.449 1
1 1175 . 14 1 1 A 109 109 ARG H H 109 8.561 8.312 0.249 1
1 1176 . 14 1 1 A 109 109 ARG HA H 109 4.239 4.806 -0.567 1
1 1183 . 14 1 1 A 109 109 ARG C C 109 174.271 175.865 -1.594 1
1 1184 . 14 1 1 A 109 109 ARG CA C 109 52.962 53.950 -0.988 1
1 1185 . 14 1 1 A 109 109 ARG CB C 109 33.903 34.522 -0.619 1
1 1188 . 14 1 1 A 109 109 ARG N N 109 121.163 123.804 -2.641 1
1 1189 . 14 1 1 A 110 110 ILE H H 110 7.847 8.418 -0.571 1
1 1190 . 14 1 1 A 110 110 ILE HA H 110 3.531 4.091 -0.560 1
1 1200 . 14 1 1 A 110 110 ILE C C 110 175.405 175.591 -0.186 1
1 1201 . 14 1 1 A 110 110 ILE CA C 110 62.201 61.886 0.315 1
1 1202 . 14 1 1 A 110 110 ILE CB C 110 36.860 36.658 0.202 1
1 1206 . 14 1 1 A 110 110 ILE N N 110 118.955 121.304 -2.349 1
1 1207 . 14 1 1 A 111 111 GLY H H 111 6.928 8.483 -1.555 1
1 1208 . 14 1 1 A 111 111 GLY HA2 H 111 4.564 4.430 0.134 1
1 1209 . 14 1 1 A 111 111 GLY HA3 H 111 4.135 4.501 -0.366 1
1 1210 . 14 1 1 A 111 111 GLY CA C 111 43.068 45.322 -2.254 1
1 1211 . 14 1 1 A 111 111 GLY N N 111 113.782 114.863 -1.081 1
1 1212 . 14 1 1 A 112 112 PRO HA H 112 4.990 4.732 0.258 1
1 1219 . 14 1 1 A 112 112 PRO C C 112 177.342 177.678 -0.336 1
1 1220 . 14 1 1 A 112 112 PRO CA C 112 62.920 62.947 -0.027 1
1 1221 . 14 1 1 A 112 112 PRO CB C 112 34.807 31.766 3.041 1
1 1224 . 14 1 1 A 113 113 LYS H H 113 8.989 8.310 0.679 1
1 1225 . 14 1 1 A 113 113 LYS HA H 113 3.144 3.650 -0.506 1
1 1234 . 14 1 1 A 113 113 LYS C C 113 177.536 178.030 -0.494 1
1 1235 . 14 1 1 A 113 113 LYS CA C 113 59.883 58.768 1.115 1
1 1236 . 14 1 1 A 113 113 LYS CB C 113 32.260 31.784 0.476 1
1 1240 . 14 1 1 A 113 113 LYS N N 113 123.545 123.566 -0.021 1
1 1241 . 14 1 1 A 114 114 GLU H H 114 9.080 9.086 -0.006 1
1 1242 . 14 1 1 A 114 114 GLU HA H 114 4.199 4.061 0.138 1
1 1247 . 14 1 1 A 114 114 GLU C C 114 176.374 177.384 -1.010 1
1 1248 . 14 1 1 A 114 114 GLU CA C 114 58.733 59.145 -0.412 1
1 1249 . 14 1 1 A 114 114 GLU CB C 114 28.077 28.981 -0.904 1
1 1251 . 14 1 1 A 114 114 GLU N N 114 114.832 120.413 -5.581 1
1 1252 . 14 1 1 A 115 115 ASP H H 115 7.799 7.675 0.124 1
1 1253 . 14 1 1 A 115 115 ASP HA H 115 4.642 4.661 -0.019 1
1 1256 . 14 1 1 A 115 115 ASP C C 115 176.374 175.544 0.830 1
1 1257 . 14 1 1 A 115 115 ASP CA C 115 54.470 54.599 -0.129 1
1 1258 . 14 1 1 A 115 115 ASP CB C 115 40.850 41.503 -0.653 1
1 1259 . 14 1 1 A 115 115 ASP N N 115 118.858 117.963 0.895 1
1 1260 . 14 1 1 A 116 116 PHE H H 116 8.063 7.251 0.812 1
1 1261 . 14 1 1 A 116 116 PHE HA H 116 5.239 5.350 -0.111 1
1 1264 . 14 1 1 A 116 116 PHE C C 116 173.413 174.865 -1.452 1
1 1265 . 14 1 1 A 116 116 PHE CA C 116 57.708 55.959 1.749 1
1 1266 . 14 1 1 A 116 116 PHE CB C 116 44.557 42.036 2.521 1
1 1267 . 14 1 1 A 116 116 PHE N N 116 120.567 118.099 2.468 1
1 1268 . 14 1 1 A 117 117 PHE H H 117 9.439 8.909 0.530 1
1 1269 . 14 1 1 A 117 117 PHE HA H 117 5.091 5.179 -0.088 1
1 1277 . 14 1 1 A 117 117 PHE C C 117 171.614 172.308 -0.694 1
1 1278 . 14 1 1 A 117 117 PHE CA C 117 55.311 55.998 -0.687 1
1 1279 . 14 1 1 A 117 117 PHE CB C 117 41.887 41.992 -0.105 1
1 1283 . 14 1 1 A 117 117 PHE N N 117 118.040 117.797 0.243 1
1 1284 . 14 1 1 A 118 118 HIS H H 118 8.779 8.963 -0.184 1
1 1285 . 14 1 1 A 118 118 HIS HA H 118 4.836 4.927 -0.091 1
1 1289 . 14 1 1 A 118 118 HIS C C 118 174.879 174.046 0.833 1
1 1290 . 14 1 1 A 118 118 HIS CA C 118 55.322 56.013 -0.691 1
1 1291 . 14 1 1 A 118 118 HIS CB C 118 30.950 31.383 -0.433 1
1 1293 . 14 1 1 A 118 118 HIS N N 118 121.208 121.842 -0.634 1
1 1294 . 14 1 1 A 119 119 CYS H H 119 8.123 7.208 0.915 1
1 1295 . 14 1 1 A 119 119 CYS HA H 119 4.529 4.850 -0.321 1
1 1298 . 14 1 1 A 119 119 CYS C C 119 176.567 175.024 1.543 1
1 1299 . 14 1 1 A 119 119 CYS CA C 119 58.957 57.337 1.620 1
1 1300 . 14 1 1 A 119 119 CYS CB C 119 30.090 29.881 0.209 1
1 1301 . 14 1 1 A 119 119 CYS N N 119 131.659 126.337 5.322 1
1 1302 . 14 1 1 A 120 120 LEU H H 120 8.970 8.830 0.140 1
1 1303 . 14 1 1 A 120 120 LEU N N 120 130.361 129.044 1.317 1
1 1304 . 14 1 1 A 121 121 LYS HA H 121 4.299 4.495 -0.196 1
1 1313 . 14 1 1 A 121 121 LYS CA C 121 58.727 55.388 3.339 1
1 1314 . 14 1 1 A 121 121 LYS CB C 121 33.210 32.763 0.447 1
1 1318 . 14 1 1 A 123 123 ASN HA H 123 4.438 4.925 -0.487 1
1 1323 . 14 1 1 A 123 123 ASN C C 123 172.444 174.412 -1.968 1
1 1324 . 14 1 1 A 123 123 ASN CA C 123 53.448 53.011 0.437 1
1 1325 . 14 1 1 A 123 123 ASN CB C 123 37.130 36.592 0.538 1
1 1327 . 14 1 1 A 124 124 LEU H H 124 6.596 7.792 -1.196 1
1 1328 . 14 1 1 A 124 124 LEU HA H 124 4.576 4.668 -0.092 1
1 1338 . 14 1 1 A 124 124 LEU C C 124 175.903 174.392 1.511 1
1 1339 . 14 1 1 A 124 124 LEU CA C 124 54.043 54.060 -0.017 1
1 1340 . 14 1 1 A 124 124 LEU CB C 124 45.837 44.810 1.027 1
1 1344 . 14 1 1 A 124 124 LEU N N 124 115.443 124.217 -8.774 1
1 1345 . 14 1 1 A 125 125 CYS H H 125 6.342 8.555 -2.213 1
1 1346 . 14 1 1 A 125 125 CYS HA H 125 5.033 5.075 -0.042 1
1 1349 . 14 1 1 A 125 125 CYS C C 125 175.101 174.715 0.386 1
1 1350 . 14 1 1 A 125 125 CYS CA C 125 62.046 57.114 4.932 1
1 1351 . 14 1 1 A 125 125 CYS CB C 125 30.840 28.525 2.315 1
1 1352 . 14 1 1 A 125 125 CYS N N 125 118.685 124.276 -5.591 1
1 1353 . 14 1 1 A 126 126 LEU H H 126 8.894 8.276 0.618 1
1 1354 . 14 1 1 A 126 126 LEU HA H 126 4.565 4.282 0.283 1
1 1364 . 14 1 1 A 126 126 LEU C C 126 174.879 177.281 -2.402 1
1 1365 . 14 1 1 A 126 126 LEU CA C 126 52.751 54.232 -1.481 1
1 1366 . 14 1 1 A 126 126 LEU CB C 126 46.090 41.804 4.286 1
1 1370 . 14 1 1 A 126 126 LEU N N 126 124.501 125.554 -1.053 1
1 1371 . 14 1 1 A 127 127 ALA H H 127 8.378 8.695 -0.317 1
1 1372 . 14 1 1 A 127 127 ALA HA H 127 3.957 4.289 -0.332 1
1 1376 . 14 1 1 A 127 127 ALA C C 127 179.085 178.158 0.927 1
1 1377 . 14 1 1 A 127 127 ALA CA C 127 52.554 51.571 0.983 1
1 1378 . 14 1 1 A 127 127 ALA CB C 127 18.527 19.576 -1.049 1
1 1379 . 14 1 1 A 127 127 ALA N N 127 123.011 124.259 -1.248 1
1 1380 . 14 1 1 A 128 128 MET H H 128 8.237 8.690 -0.453 1
1 1385 . 14 1 1 A 128 128 MET N N 128 120.642 121.330 -0.688 1
1 1386 . 14 1 1 A 129 129 ASN HA H 129 4.502 4.502 0.000 1
1 1389 . 14 1 1 A 129 129 ASN C C 129 175.931 177.930 -1.999 1
1 1390 . 14 1 1 A 129 129 ASN CA C 129 55.064 55.739 -0.675 1
1 1391 . 14 1 1 A 129 129 ASN CB C 129 36.920 38.600 -1.680 1
1 1392 . 14 1 1 A 130 130 LEU H H 130 8.211 7.515 0.696 1
1 1393 . 14 1 1 A 130 130 LEU HA H 130 4.489 4.036 0.453 1
1 1403 . 14 1 1 A 130 130 LEU C C 130 178.836 177.172 1.664 1
1 1404 . 14 1 1 A 130 130 LEU CA C 130 54.653 58.014 -3.361 1
1 1405 . 14 1 1 A 130 130 LEU CB C 130 41.887 42.072 -0.185 1
1 1409 . 14 1 1 A 130 130 LEU N N 130 118.563 120.027 -1.464 1
1 1410 . 14 1 1 A 131 131 GLN H H 131 7.953 7.632 0.321 1
1 1411 . 14 1 1 A 131 131 GLN HA H 131 3.729 4.105 -0.376 1
1 1418 . 14 1 1 A 131 131 GLN CA C 131 59.310 58.542 0.768 1
1 1419 . 14 1 1 A 131 131 GLN CB C 131 28.340 27.329 1.011 1
1 1421 . 14 1 1 A 131 131 GLN N N 131 123.929 116.444 7.485 1
1 1423 . 14 1 1 A 132 132 GLY HA2 H 132 4.034 3.854 0.180 1
1 1424 . 14 1 1 A 132 132 GLY HA3 H 132 3.865 3.965 -0.100 1
1 1425 . 14 1 1 A 132 132 GLY C C 132 174.547 173.842 0.705 1
1 1426 . 14 1 1 A 132 132 GLY CA C 132 45.902 45.170 0.732 1
1 1427 . 14 1 1 A 133 133 ARG H H 133 7.735 7.660 0.075 1
1 1428 . 14 1 1 A 133 133 ARG HA H 133 4.611 4.436 0.175 1
1 1435 . 14 1 1 A 133 133 ARG C C 133 175.461 174.910 0.551 1
1 1436 . 14 1 1 A 133 133 ARG CA C 133 54.987 55.268 -0.281 1
1 1437 . 14 1 1 A 133 133 ARG CB C 133 31.470 28.851 2.619 1
1 1440 . 14 1 1 A 133 133 ARG N N 133 118.194 122.203 -4.009 1
1 1441 . 14 1 1 A 134 134 HIS H H 134 7.803 7.970 -0.167 1
1 1444 . 14 1 1 A 134 134 HIS N N 134 118.700 120.720 -2.020 1
1 1445 . 14 1 1 A 135 135 LYS HA H 135 4.331 4.158 0.173 1
1 1454 . 14 1 1 A 135 135 LYS C C 135 174.852 176.632 -1.780 1
1 1455 . 14 1 1 A 135 135 LYS CA C 135 55.390 56.625 -1.235 1
1 1456 . 14 1 1 A 135 135 LYS CB C 135 32.970 32.334 0.636 1
1 1460 . 14 1 1 A 136 136 CYS H H 136 7.801 8.619 -0.818 1
1 1461 . 14 1 1 A 136 136 CYS HA H 136 4.113 4.877 -0.764 1
1 1464 . 14 1 1 A 136 136 CYS C C 136 174.879 174.591 0.288 1
1 1465 . 14 1 1 A 136 136 CYS CA C 136 60.028 58.152 1.876 1
1 1466 . 14 1 1 A 136 136 CYS CB C 136 30.350 27.918 2.432 1
1 1467 . 14 1 1 A 136 136 CYS N N 136 126.055 123.148 2.907 1
1 10 . 15 1 1 A 2 2 ALA H H 2 8.220 8.513 -0.293 1
1 11 . 15 1 1 A 2 2 ALA HA H 2 4.321 4.370 -0.049 1
1 15 . 15 1 1 A 2 2 ALA C C 2 177.564 176.478 1.086 1
1 16 . 15 1 1 A 2 2 ALA CA C 2 52.383 52.092 0.291 1
1 17 . 15 1 1 A 2 2 ALA CB C 2 19.290 18.807 0.483 1
1 18 . 15 1 1 A 2 2 ALA N N 2 125.223 129.255 -4.032 1
1 19 . 15 1 1 A 3 3 ALA H H 3 8.246 8.476 -0.230 1
1 20 . 15 1 1 A 3 3 ALA N N 3 123.250 126.179 -2.929 1
1 21 . 15 1 1 A 5 5 ALA HA H 5 4.415 4.377 0.038 1
1 25 . 15 1 1 A 5 5 ALA C C 5 177.481 177.433 0.048 1
1 26 . 15 1 1 A 5 5 ALA CA C 5 52.423 52.126 0.297 1
1 27 . 15 1 1 A 5 5 ALA CB C 5 19.420 19.308 0.112 1
1 28 . 15 1 1 A 6 6 ARG H H 6 8.239 8.908 -0.669 1
1 29 . 15 1 1 A 6 6 ARG HA H 6 4.371 4.307 0.064 1
1 36 . 15 1 1 A 6 6 ARG C C 6 176.180 176.059 0.121 1
1 37 . 15 1 1 A 6 6 ARG CA C 6 56.353 57.403 -1.050 1
1 38 . 15 1 1 A 6 6 ARG CB C 6 31.170 31.418 -0.248 1
1 41 . 15 1 1 A 6 6 ARG N N 6 120.436 122.482 -2.046 1
1 42 . 15 1 1 A 7 7 GLU H H 7 8.535 7.800 0.735 1
1 43 . 15 1 1 A 7 7 GLU HA H 7 4.335 4.746 -0.411 1
1 48 . 15 1 1 A 7 7 GLU C C 7 176.346 174.242 2.104 1
1 49 . 15 1 1 A 7 7 GLU CA C 7 56.740 55.028 1.712 1
1 50 . 15 1 1 A 7 7 GLU CB C 7 30.390 32.489 -2.099 1
1 52 . 15 1 1 A 7 7 GLU N N 7 122.189 114.469 7.720 1
1 53 . 15 1 1 A 8 8 ASP H H 8 8.347 8.632 -0.285 1
1 54 . 15 1 1 A 8 8 ASP N N 8 121.112 120.817 0.295 1
1 55 . 15 1 1 A 9 9 GLY HA2 H 9 3.975 4.088 -0.113 1
1 56 . 15 1 1 A 9 9 GLY HA3 H 9 3.975 4.088 -0.113 1
1 57 . 15 1 1 A 9 9 GLY C C 9 174.243 173.769 0.474 1
1 58 . 15 1 1 A 9 9 GLY CA C 9 45.933 44.610 1.323 1
1 59 . 15 1 1 A 10 10 ALA H H 10 8.111 8.701 -0.590 1
1 60 . 15 1 1 A 10 10 ALA N N 10 123.721 123.145 0.576 1
1 61 . 15 1 1 A 12 12 GLY HA2 H 12 3.992 4.153 -0.161 1
1 62 . 15 1 1 A 12 12 GLY HA3 H 12 3.992 4.153 -0.161 1
1 63 . 15 1 1 A 12 12 GLY C C 12 173.883 172.960 0.923 1
1 64 . 15 1 1 A 12 12 GLY CA C 12 45.381 45.053 0.328 1
1 65 . 15 1 1 A 13 13 GLU H H 13 8.224 8.611 -0.387 1
1 66 . 15 1 1 A 13 13 GLU HA H 13 4.367 5.118 -0.751 1
1 71 . 15 1 1 A 13 13 GLU C C 13 176.125 174.410 1.715 1
1 72 . 15 1 1 A 13 13 GLU CA C 13 56.349 54.543 1.806 1
1 73 . 15 1 1 A 13 13 GLU CB C 13 29.560 33.654 -4.094 1
1 75 . 15 1 1 A 13 13 GLU N N 13 120.148 120.366 -0.218 1
1 76 . 15 1 1 A 14 14 GLU H H 14 8.508 8.737 -0.229 1
1 77 . 15 1 1 A 14 14 GLU HA H 14 4.302 4.949 -0.647 1
1 82 . 15 1 1 A 14 14 GLU C C 14 176.623 176.555 0.068 1
1 83 . 15 1 1 A 14 14 GLU CA C 14 56.497 54.622 1.875 1
1 84 . 15 1 1 A 14 14 GLU CB C 14 30.110 33.669 -3.559 1
1 86 . 15 1 1 A 14 14 GLU N N 14 122.160 119.909 2.251 1
1 87 . 15 1 1 A 15 15 ARG H H 15 8.356 9.015 -0.659 1
1 88 . 15 1 1 A 15 15 ARG HA H 15 4.366 4.105 0.261 1
1 95 . 15 1 1 A 15 15 ARG C C 15 176.844 176.348 0.496 1
1 96 . 15 1 1 A 15 15 ARG CA C 15 56.010 57.312 -1.302 1
1 97 . 15 1 1 A 15 15 ARG CB C 15 30.890 31.544 -0.654 1
1 100 . 15 1 1 A 15 15 ARG N N 15 121.945 120.939 1.006 1
1 101 . 15 1 1 A 16 16 GLY H H 16 8.414 7.985 0.429 1
1 102 . 15 1 1 A 16 16 GLY HA2 H 16 4.022 3.926 0.096 1
1 103 . 15 1 1 A 16 16 GLY HA3 H 16 4.022 3.927 0.095 1
1 104 . 15 1 1 A 16 16 GLY C C 16 174.326 174.601 -0.275 1
1 105 . 15 1 1 A 16 16 GLY CA C 16 45.620 46.777 -1.157 1
1 106 . 15 1 1 A 16 16 GLY N N 16 109.734 108.141 1.593 1
1 107 . 15 1 1 A 17 17 GLN H H 17 8.184 8.048 0.136 1
1 108 . 15 1 1 A 17 17 GLN HA H 17 4.366 4.645 -0.279 1
1 113 . 15 1 1 A 17 17 GLN C C 17 175.544 175.248 0.296 1
1 114 . 15 1 1 A 17 17 GLN CA C 17 55.749 55.092 0.657 1
1 115 . 15 1 1 A 17 17 GLN CB C 17 29.367 29.959 -0.592 1
1 117 . 15 1 1 A 17 17 GLN N N 17 119.546 120.365 -0.819 1
1 118 . 15 1 1 A 18 18 ARG H H 18 8.366 8.538 -0.172 1
1 119 . 15 1 1 A 18 18 ARG HA H 18 4.487 4.885 -0.398 1
1 126 . 15 1 1 A 18 18 ARG C C 18 176.042 175.415 0.627 1
1 127 . 15 1 1 A 18 18 ARG CA C 18 55.735 54.269 1.466 1
1 128 . 15 1 1 A 18 18 ARG CB C 18 31.170 33.435 -2.265 1
1 131 . 15 1 1 A 18 18 ARG N N 18 122.330 122.446 -0.116 1
1 132 . 15 1 1 A 19 19 GLY H H 19 8.192 8.391 -0.199 1
1 133 . 15 1 1 A 19 19 GLY HA2 H 19 4.852 4.108 0.744 1
1 134 . 15 1 1 A 19 19 GLY HA3 H 19 3.894 4.119 -0.225 1
1 135 . 15 1 1 A 19 19 GLY C C 19 172.361 171.927 0.434 1
1 136 . 15 1 1 A 19 19 GLY CA C 19 45.580 44.559 1.021 1
1 137 . 15 1 1 A 19 19 GLY N N 19 109.658 108.141 1.517 1
1 138 . 15 1 1 A 20 20 CYS H H 20 8.843 7.870 0.973 1
1 139 . 15 1 1 A 20 20 CYS HA H 20 5.147 5.139 0.008 1
1 142 . 15 1 1 A 20 20 CYS C C 20 175.211 175.087 0.124 1
1 143 . 15 1 1 A 20 20 CYS CA C 20 56.712 58.271 -1.559 1
1 144 . 15 1 1 A 20 20 CYS CB C 20 33.530 31.119 2.411 1
1 145 . 15 1 1 A 20 20 CYS N N 20 120.185 118.482 1.703 1
1 146 . 15 1 1 A 21 21 GLU H H 21 8.981 8.912 0.069 1
1 147 . 15 1 1 A 21 21 GLU HA H 21 4.100 4.044 0.056 1
1 152 . 15 1 1 A 21 21 GLU C C 21 176.014 178.076 -2.062 1
1 153 . 15 1 1 A 21 21 GLU CA C 21 57.134 58.881 -1.747 1
1 154 . 15 1 1 A 21 21 GLU CB C 21 28.890 28.805 0.085 1
1 156 . 15 1 1 A 21 21 GLU N N 21 116.078 125.299 -9.221 1
1 157 . 15 1 1 A 22 22 HIS H H 22 9.342 7.747 1.595 1
1 158 . 15 1 1 A 22 22 HIS HA H 22 4.210 4.194 0.016 1
1 161 . 15 1 1 A 22 22 HIS C C 22 175.128 174.692 0.436 1
1 162 . 15 1 1 A 22 22 HIS CA C 22 58.945 59.147 -0.202 1
1 163 . 15 1 1 A 22 22 HIS CB C 22 33.160 30.560 2.600 1
1 164 . 15 1 1 A 22 22 HIS N N 22 122.296 117.813 4.483 1
1 165 . 15 1 1 A 23 23 TYR H H 23 7.931 7.603 0.328 1
1 166 . 15 1 1 A 23 23 TYR HA H 23 4.856 5.332 -0.476 1
1 171 . 15 1 1 A 23 23 TYR C C 23 173.108 174.356 -1.248 1
1 172 . 15 1 1 A 23 23 TYR CA C 23 57.852 56.228 1.624 1
1 173 . 15 1 1 A 23 23 TYR CB C 23 45.300 40.901 4.399 1
1 175 . 15 1 1 A 23 23 TYR N N 23 115.205 115.435 -0.230 1
1 176 . 15 1 1 A 24 24 ASP H H 24 8.384 8.787 -0.403 1
1 177 . 15 1 1 A 24 24 ASP HA H 24 5.160 5.101 0.059 1
1 180 . 15 1 1 A 24 24 ASP C C 24 174.437 175.244 -0.807 1
1 181 . 15 1 1 A 24 24 ASP CA C 24 53.343 53.701 -0.358 1
1 182 . 15 1 1 A 24 24 ASP CB C 24 41.470 39.804 1.666 1
1 183 . 15 1 1 A 24 24 ASP N N 24 122.016 125.260 -3.244 1
1 184 . 15 1 1 A 25 25 ARG H H 25 7.313 8.123 -0.810 1
1 185 . 15 1 1 A 25 25 ARG HA H 25 5.331 4.994 0.337 1
1 192 . 15 1 1 A 25 25 ARG C C 25 175.045 175.768 -0.723 1
1 193 . 15 1 1 A 25 25 ARG CA C 25 54.224 54.498 -0.274 1
1 194 . 15 1 1 A 25 25 ARG CB C 25 34.090 33.844 0.246 1
1 197 . 15 1 1 A 25 25 ARG N N 25 115.898 121.401 -5.503 1
1 198 . 15 1 1 A 26 26 GLY H H 26 9.387 8.356 1.031 1
1 199 . 15 1 1 A 26 26 GLY HA2 H 26 4.622 3.745 0.877 1
1 200 . 15 1 1 A 26 26 GLY HA3 H 26 3.788 3.765 0.023 1
1 201 . 15 1 1 A 26 26 GLY C C 26 170.978 173.063 -2.085 1
1 202 . 15 1 1 A 26 26 GLY CA C 26 44.794 46.475 -1.681 1
1 203 . 15 1 1 A 26 26 GLY N N 26 105.653 107.546 -1.893 1
1 204 . 15 1 1 A 27 27 CYS H H 27 6.864 7.537 -0.673 1
1 205 . 15 1 1 A 27 27 CYS HA H 27 5.195 4.847 0.348 1
1 208 . 15 1 1 A 27 27 CYS C C 27 171.144 172.711 -1.567 1
1 209 . 15 1 1 A 27 27 CYS CA C 27 52.349 57.920 -5.571 1
1 210 . 15 1 1 A 27 27 CYS CB C 27 30.997 32.801 -1.804 1
1 211 . 15 1 1 A 27 27 CYS N N 27 110.921 116.838 -5.917 1
1 212 . 15 1 1 A 28 28 LEU H H 28 8.310 8.663 -0.353 1
1 213 . 15 1 1 A 28 28 LEU HA H 28 4.651 5.127 -0.476 1
1 223 . 15 1 1 A 28 28 LEU C C 28 176.827 176.009 0.818 1
1 224 . 15 1 1 A 28 28 LEU CA C 28 53.054 53.453 -0.399 1
1 225 . 15 1 1 A 28 28 LEU CB C 28 44.200 45.655 -1.455 1
1 229 . 15 1 1 A 28 28 LEU N N 28 115.519 122.239 -6.720 1
1 230 . 15 1 1 A 29 29 LEU H H 29 8.800 8.679 0.121 1
1 231 . 15 1 1 A 29 29 LEU HA H 29 4.313 4.899 -0.586 1
1 240 . 15 1 1 A 29 29 LEU C C 29 175.571 175.484 0.087 1
1 241 . 15 1 1 A 29 29 LEU CA C 29 54.388 53.376 1.012 1
1 242 . 15 1 1 A 29 29 LEU CB C 29 42.780 44.278 -1.498 1
1 245 . 15 1 1 A 29 29 LEU N N 29 118.712 121.159 -2.447 1
1 246 . 15 1 1 A 30 30 LYS H H 30 8.009 8.741 -0.732 1
1 247 . 15 1 1 A 30 30 LYS HA H 30 4.592 4.771 -0.179 1
1 256 . 15 1 1 A 30 30 LYS C C 30 174.990 174.828 0.162 1
1 257 . 15 1 1 A 30 30 LYS CA C 30 54.999 55.909 -0.910 1
1 258 . 15 1 1 A 30 30 LYS CB C 30 32.330 33.332 -1.002 1
1 262 . 15 1 1 A 30 30 LYS N N 30 122.310 125.685 -3.375 1
1 263 . 15 1 1 A 31 31 ALA H H 31 9.238 8.680 0.558 1
1 264 . 15 1 1 A 31 31 ALA HA H 31 4.477 4.468 0.009 1
1 268 . 15 1 1 A 31 31 ALA CA C 31 50.190 49.431 0.759 1
1 269 . 15 1 1 A 31 31 ALA CB C 31 21.637 20.031 1.606 1
1 270 . 15 1 1 A 31 31 ALA N N 31 133.864 130.352 3.512 1
1 271 . 15 1 1 A 32 32 PRO HA H 32 4.637 4.419 0.218 1
1 278 . 15 1 1 A 32 32 PRO C C 32 175.737 177.311 -1.574 1
1 279 . 15 1 1 A 32 32 PRO CA C 32 64.259 64.242 0.017 1
1 280 . 15 1 1 A 32 32 PRO CB C 32 31.740 31.739 0.001 1
1 283 . 15 1 1 A 33 33 CYS H H 33 8.779 8.326 0.453 1
1 284 . 15 1 1 A 33 33 CYS HA H 33 4.321 4.265 0.056 1
1 287 . 15 1 1 A 33 33 CYS C C 33 176.733 175.226 1.507 1
1 288 . 15 1 1 A 33 33 CYS CA C 33 54.398 61.346 -6.948 1
1 289 . 15 1 1 A 33 33 CYS CB C 33 30.697 27.318 3.379 1
1 290 . 15 1 1 A 33 33 CYS N N 33 120.005 116.239 3.766 1
1 291 . 15 1 1 A 34 34 CYS H H 34 7.424 7.596 -0.172 1
1 292 . 15 1 1 A 34 34 CYS HA H 34 4.896 4.691 0.205 1
1 295 . 15 1 1 A 34 34 CYS C C 34 174.935 174.936 -0.001 1
1 296 . 15 1 1 A 34 34 CYS CA C 34 56.962 58.514 -1.552 1
1 297 . 15 1 1 A 34 34 CYS CB C 34 31.067 29.562 1.505 1
1 298 . 15 1 1 A 34 34 CYS N N 34 115.034 118.043 -3.009 1
1 299 . 15 1 1 A 35 35 ASP H H 35 8.368 8.098 0.270 1
1 300 . 15 1 1 A 35 35 ASP HA H 35 4.454 4.238 0.216 1
1 303 . 15 1 1 A 35 35 ASP C C 35 174.354 174.870 -0.516 1
1 304 . 15 1 1 A 35 35 ASP CA C 35 56.222 55.530 0.692 1
1 305 . 15 1 1 A 35 35 ASP CB C 35 39.730 39.282 0.448 1
1 306 . 15 1 1 A 35 35 ASP N N 35 121.381 117.240 4.141 1
1 307 . 15 1 1 A 36 36 LYS H H 36 7.227 7.463 -0.236 1
1 308 . 15 1 1 A 36 36 LYS HA H 36 4.451 4.700 -0.249 1
1 317 . 15 1 1 A 36 36 LYS C C 36 175.433 175.755 -0.322 1
1 318 . 15 1 1 A 36 36 LYS CA C 36 56.270 54.968 1.302 1
1 319 . 15 1 1 A 36 36 LYS CB C 36 36.620 34.586 2.034 1
1 323 . 15 1 1 A 36 36 LYS N N 36 117.673 118.166 -0.493 1
1 324 . 15 1 1 A 37 37 LEU H H 37 8.053 8.712 -0.659 1
1 325 . 15 1 1 A 37 37 LEU HA H 37 5.292 5.047 0.245 1
1 335 . 15 1 1 A 37 37 LEU C C 37 176.484 175.014 1.470 1
1 336 . 15 1 1 A 37 37 LEU CA C 37 53.348 53.367 -0.019 1
1 337 . 15 1 1 A 37 37 LEU CB C 37 42.400 42.733 -0.333 1
1 341 . 15 1 1 A 37 37 LEU N N 37 120.994 123.023 -2.029 1
1 342 . 15 1 1 A 38 38 TYR H H 38 8.741 8.923 -0.182 1
1 343 . 15 1 1 A 38 38 TYR HA H 38 5.002 4.827 0.175 1
1 350 . 15 1 1 A 38 38 TYR C C 38 176.374 176.145 0.229 1
1 351 . 15 1 1 A 38 38 TYR CA C 38 57.081 56.895 0.186 1
1 352 . 15 1 1 A 38 38 TYR CB C 38 45.647 41.941 3.706 1
1 355 . 15 1 1 A 38 38 TYR N N 38 121.128 122.980 -1.852 1
1 356 . 15 1 1 A 39 39 THR H H 39 9.402 8.681 0.721 1
1 357 . 15 1 1 A 39 39 THR HA H 39 4.098 4.121 -0.023 1
1 362 . 15 1 1 A 39 39 THR C C 39 173.496 175.083 -1.587 1
1 363 . 15 1 1 A 39 39 THR CA C 39 67.062 65.867 1.195 1
1 364 . 15 1 1 A 39 39 THR CB C 39 68.047 68.513 -0.466 1
1 366 . 15 1 1 A 39 39 THR N N 39 116.641 116.674 -0.033 1
1 367 . 15 1 1 A 40 40 CYS H H 40 7.317 8.047 -0.730 1
1 368 . 15 1 1 A 40 40 CYS HA H 40 4.771 4.898 -0.127 1
1 371 . 15 1 1 A 40 40 CYS C C 40 175.128 175.459 -0.331 1
1 372 . 15 1 1 A 40 40 CYS CA C 40 56.577 57.947 -1.370 1
1 373 . 15 1 1 A 40 40 CYS CB C 40 35.087 30.598 4.489 1
1 374 . 15 1 1 A 40 40 CYS N N 40 109.059 118.170 -9.111 1
1 375 . 15 1 1 A 41 41 ARG H H 41 9.201 8.969 0.232 1
1 376 . 15 1 1 A 41 41 ARG HA H 41 3.982 3.969 0.013 1
1 383 . 15 1 1 A 41 41 ARG C C 41 175.101 177.777 -2.676 1
1 384 . 15 1 1 A 41 41 ARG CA C 41 58.591 58.788 -0.197 1
1 385 . 15 1 1 A 41 41 ARG CB C 41 29.640 29.869 -0.229 1
1 388 . 15 1 1 A 41 41 ARG N N 41 121.737 123.251 -1.514 1
1 389 . 15 1 1 A 42 42 LEU H H 42 9.116 7.724 1.392 1
1 390 . 15 1 1 A 42 42 LEU HA H 42 4.029 4.073 -0.044 1
1 400 . 15 1 1 A 42 42 LEU C C 42 179.943 179.379 0.564 1
1 401 . 15 1 1 A 42 42 LEU CA C 42 58.005 57.576 0.429 1
1 402 . 15 1 1 A 42 42 LEU CB C 42 38.960 41.081 -2.121 1
1 406 . 15 1 1 A 42 42 LEU N N 42 126.364 116.793 9.571 1
1 407 . 15 1 1 A 43 43 CYS H H 43 8.785 8.187 0.598 1
1 408 . 15 1 1 A 43 43 CYS HA H 43 4.187 4.162 0.025 1
1 411 . 15 1 1 A 43 43 CYS C C 43 177.785 177.245 0.540 1
1 412 . 15 1 1 A 43 43 CYS CA C 43 66.415 62.917 3.498 1
1 413 . 15 1 1 A 43 43 CYS CB C 43 28.870 27.263 1.607 1
1 414 . 15 1 1 A 43 43 CYS N N 43 124.519 117.794 6.725 1
1 415 . 15 1 1 A 44 44 HIS H H 44 7.604 7.825 -0.221 1
1 416 . 15 1 1 A 44 44 HIS HA H 44 1.983 2.767 -0.784 1
1 420 . 15 1 1 A 44 44 HIS C C 44 176.429 176.486 -0.057 1
1 421 . 15 1 1 A 44 44 HIS CA C 44 58.760 58.823 -0.063 1
1 422 . 15 1 1 A 44 44 HIS CB C 44 27.990 29.357 -1.367 1
1 423 . 15 1 1 A 44 44 HIS N N 44 117.024 120.882 -3.858 1
1 424 . 15 1 1 A 45 45 ASP H H 45 8.750 8.067 0.683 1
1 425 . 15 1 1 A 45 45 ASP HA H 45 4.116 4.134 -0.018 1
1 428 . 15 1 1 A 45 45 ASP C C 45 177.453 178.061 -0.608 1
1 429 . 15 1 1 A 45 45 ASP CA C 45 56.840 57.358 -0.518 1
1 430 . 15 1 1 A 45 45 ASP CB C 45 38.960 41.701 -2.741 1
1 431 . 15 1 1 A 45 45 ASP N N 45 120.440 118.904 1.536 1
1 432 . 15 1 1 A 46 46 ASN H H 46 7.888 8.192 -0.304 1
1 433 . 15 1 1 A 46 46 ASN HA H 46 4.612 4.414 0.198 1
1 438 . 15 1 1 A 46 46 ASN C C 46 175.903 176.749 -0.846 1
1 439 . 15 1 1 A 46 46 ASN CA C 46 54.342 57.068 -2.726 1
1 440 . 15 1 1 A 46 46 ASN CB C 46 38.790 39.539 -0.749 1
1 441 . 15 1 1 A 46 46 ASN N N 46 115.758 116.970 -1.212 1
1 443 . 15 1 1 A 47 47 ASN H H 47 7.384 7.319 0.065 1
1 444 . 15 1 1 A 47 47 ASN HA H 47 4.893 4.686 0.207 1
1 449 . 15 1 1 A 47 47 ASN C C 47 173.579 175.292 -1.713 1
1 450 . 15 1 1 A 47 47 ASN CA C 47 53.937 54.437 -0.500 1
1 451 . 15 1 1 A 47 47 ASN CB C 47 43.130 39.452 3.678 1
1 452 . 15 1 1 A 47 47 ASN N N 47 116.576 114.935 1.641 1
1 454 . 15 1 1 A 48 48 GLU H H 48 7.143 7.344 -0.201 1
1 455 . 15 1 1 A 48 48 GLU HA H 48 4.572 4.641 -0.069 1
1 460 . 15 1 1 A 48 48 GLU C C 48 175.627 176.006 -0.379 1
1 461 . 15 1 1 A 48 48 GLU CA C 48 53.727 54.671 -0.944 1
1 462 . 15 1 1 A 48 48 GLU CB C 48 32.480 31.139 1.341 1
1 464 . 15 1 1 A 48 48 GLU N N 48 116.967 117.416 -0.449 1
1 465 . 15 1 1 A 49 49 ASP H H 49 8.748 8.890 -0.142 1
1 466 . 15 1 1 A 49 49 ASP HA H 49 4.576 4.773 -0.197 1
1 469 . 15 1 1 A 49 49 ASP C C 49 174.796 175.508 -0.712 1
1 470 . 15 1 1 A 49 49 ASP CA C 49 53.027 55.055 -2.028 1
1 471 . 15 1 1 A 49 49 ASP CB C 49 40.340 41.533 -1.193 1
1 472 . 15 1 1 A 49 49 ASP N N 49 119.296 120.745 -1.449 1
1 473 . 15 1 1 A 50 50 HIS H H 50 6.919 7.326 -0.407 1
1 474 . 15 1 1 A 50 50 HIS HA H 50 4.880 5.327 -0.447 1
1 477 . 15 1 1 A 50 50 HIS C C 50 172.942 172.939 0.003 1
1 478 . 15 1 1 A 50 50 HIS CA C 50 53.978 53.586 0.392 1
1 479 . 15 1 1 A 50 50 HIS CB C 50 30.330 32.789 -2.459 1
1 480 . 15 1 1 A 50 50 HIS N N 50 113.709 115.791 -2.082 1
1 481 . 15 1 1 A 51 51 GLN H H 51 8.646 8.640 0.006 1
1 482 . 15 1 1 A 51 51 GLN HA H 51 4.896 4.583 0.313 1
1 487 . 15 1 1 A 51 51 GLN C C 51 176.512 175.280 1.232 1
1 488 . 15 1 1 A 51 51 GLN CA C 51 54.872 55.728 -0.856 1
1 489 . 15 1 1 A 51 51 GLN CB C 51 30.950 30.299 0.651 1
1 491 . 15 1 1 A 51 51 GLN N N 51 119.379 119.256 0.123 1
1 492 . 15 1 1 A 52 52 LEU H H 52 9.646 8.375 1.271 1
1 493 . 15 1 1 A 52 52 LEU HA H 52 4.206 4.331 -0.125 1
1 503 . 15 1 1 A 52 52 LEU C C 52 175.793 174.435 1.358 1
1 504 . 15 1 1 A 52 52 LEU CA C 52 55.450 53.930 1.520 1
1 505 . 15 1 1 A 52 52 LEU CB C 52 41.407 42.342 -0.935 1
1 509 . 15 1 1 A 52 52 LEU N N 52 128.069 124.974 3.095 1
1 510 . 15 1 1 A 53 53 ASP H H 53 9.281 8.811 0.470 1
1 511 . 15 1 1 A 53 53 ASP HA H 53 4.725 4.562 0.163 1
1 514 . 15 1 1 A 53 53 ASP C C 53 176.401 177.441 -1.040 1
1 515 . 15 1 1 A 53 53 ASP CA C 53 52.590 54.494 -1.904 1
1 516 . 15 1 1 A 53 53 ASP CB C 53 39.990 40.734 -0.744 1
1 517 . 15 1 1 A 53 53 ASP N N 53 128.783 127.307 1.476 1
1 518 . 15 1 1 A 54 54 ARG H H 54 8.496 8.423 0.073 1
1 519 . 15 1 1 A 54 54 ARG HA H 54 3.859 3.789 0.070 1
1 526 . 15 1 1 A 54 54 ARG C C 54 176.346 177.214 -0.868 1
1 527 . 15 1 1 A 54 54 ARG CA C 54 57.357 57.961 -0.604 1
1 528 . 15 1 1 A 54 54 ARG CB C 54 28.890 29.381 -0.491 1
1 531 . 15 1 1 A 54 54 ARG N N 54 125.813 125.069 0.744 1
1 532 . 15 1 1 A 55 55 PHE H H 55 8.005 7.319 0.686 1
1 533 . 15 1 1 A 55 55 PHE HA H 55 4.712 4.432 0.280 1
1 540 . 15 1 1 A 55 55 PHE C C 55 177.481 177.604 -0.123 1
1 541 . 15 1 1 A 55 55 PHE CA C 55 59.080 61.288 -2.208 1
1 542 . 15 1 1 A 55 55 PHE CB C 55 37.447 38.641 -1.194 1
1 545 . 15 1 1 A 55 55 PHE N N 55 120.168 117.694 2.474 1
1 546 . 15 1 1 A 56 56 LYS H H 56 7.681 7.441 0.240 1
1 547 . 15 1 1 A 56 56 LYS HA H 56 4.411 4.364 0.047 1
1 556 . 15 1 1 A 56 56 LYS C C 56 175.959 176.382 -0.423 1
1 557 . 15 1 1 A 56 56 LYS CA C 56 55.459 57.052 -1.593 1
1 558 . 15 1 1 A 56 56 LYS CB C 56 33.590 33.354 0.236 1
1 562 . 15 1 1 A 56 56 LYS N N 56 116.937 117.924 -0.987 1
1 563 . 15 1 1 A 57 57 VAL H H 57 6.553 7.192 -0.639 1
1 564 . 15 1 1 A 57 57 VAL HA H 57 3.408 3.903 -0.495 1
1 572 . 15 1 1 A 57 57 VAL C C 57 173.911 175.737 -1.826 1
1 573 . 15 1 1 A 57 57 VAL CA C 57 65.025 61.701 3.324 1
1 574 . 15 1 1 A 57 57 VAL CB C 57 32.663 31.389 1.274 1
1 577 . 15 1 1 A 57 57 VAL N N 57 119.519 117.717 1.802 1
1 578 . 15 1 1 A 58 58 LYS H H 58 9.182 8.806 0.376 1
1 579 . 15 1 1 A 58 58 LYS HA H 58 4.489 4.263 0.226 1
1 588 . 15 1 1 A 58 58 LYS C C 58 176.927 176.118 0.809 1
1 589 . 15 1 1 A 58 58 LYS CA C 58 55.913 57.617 -1.704 1
1 590 . 15 1 1 A 58 58 LYS CB C 58 36.340 33.641 2.699 1
1 594 . 15 1 1 A 58 58 LYS N N 58 124.985 126.466 -1.481 1
1 595 . 15 1 1 A 59 59 GLU H H 59 8.799 7.648 1.151 1
1 596 . 15 1 1 A 59 59 GLU HA H 59 5.209 4.684 0.525 1
1 601 . 15 1 1 A 59 59 GLU C C 59 173.911 175.552 -1.641 1
1 602 . 15 1 1 A 59 59 GLU CA C 59 54.670 54.706 -0.036 1
1 603 . 15 1 1 A 59 59 GLU CB C 59 35.180 32.649 2.531 1
1 605 . 15 1 1 A 59 59 GLU N N 59 121.493 116.955 4.538 1
1 606 . 15 1 1 A 60 60 VAL H H 60 8.917 8.954 -0.037 1
1 607 . 15 1 1 A 60 60 VAL HA H 60 4.983 5.038 -0.055 1
1 615 . 15 1 1 A 60 60 VAL C C 60 173.441 174.165 -0.724 1
1 616 . 15 1 1 A 60 60 VAL CA C 60 57.497 59.070 -1.573 1
1 617 . 15 1 1 A 60 60 VAL CB C 60 35.460 36.542 -1.082 1
1 620 . 15 1 1 A 60 60 VAL N N 60 109.266 117.487 -8.221 1
1 621 . 15 1 1 A 61 61 GLN H H 61 8.970 8.297 0.673 1
1 622 . 15 1 1 A 61 61 GLN HA H 61 5.024 5.494 -0.470 1
1 629 . 15 1 1 A 61 61 GLN C C 61 175.045 173.584 1.461 1
1 630 . 15 1 1 A 61 61 GLN CA C 61 53.128 53.972 -0.844 1
1 631 . 15 1 1 A 61 61 GLN CB C 61 33.980 33.074 0.906 1
1 633 . 15 1 1 A 61 61 GLN N N 61 118.525 119.282 -0.757 1
1 635 . 15 1 1 A 62 62 CYS H H 62 7.688 8.823 -1.135 1
1 636 . 15 1 1 A 62 62 CYS HA H 62 4.210 5.000 -0.790 1
1 639 . 15 1 1 A 62 62 CYS C C 62 177.951 173.539 4.412 1
1 640 . 15 1 1 A 62 62 CYS CA C 62 59.845 56.862 2.983 1
1 641 . 15 1 1 A 62 62 CYS CB C 62 33.120 30.122 2.998 1
1 642 . 15 1 1 A 62 62 CYS N N 62 128.772 119.751 9.021 1
1 643 . 15 1 1 A 63 63 ILE H H 63 8.192 8.688 -0.496 1
1 644 . 15 1 1 A 63 63 ILE HA H 63 3.984 4.219 -0.235 1
1 654 . 15 1 1 A 63 63 ILE C C 63 175.433 175.635 -0.202 1
1 655 . 15 1 1 A 63 63 ILE CA C 63 63.657 60.984 2.673 1
1 656 . 15 1 1 A 63 63 ILE CB C 63 38.506 35.746 2.760 1
1 660 . 15 1 1 A 63 63 ILE N N 63 127.455 128.686 -1.231 1
1 661 . 15 1 1 A 64 64 ASN H H 64 9.181 8.307 0.874 1
1 662 . 15 1 1 A 64 64 ASN HA H 64 4.810 4.994 -0.184 1
1 667 . 15 1 1 A 64 64 ASN C C 64 175.931 174.711 1.220 1
1 668 . 15 1 1 A 64 64 ASN CA C 64 55.617 54.719 0.898 1
1 669 . 15 1 1 A 64 64 ASN CB C 64 40.640 40.845 -0.205 1
1 670 . 15 1 1 A 64 64 ASN N N 64 122.104 121.667 0.437 1
1 672 . 15 1 1 A 65 65 CYS H H 65 9.065 7.833 1.232 1
1 673 . 15 1 1 A 65 65 CYS HA H 65 4.979 4.774 0.205 1
1 676 . 15 1 1 A 65 65 CYS C C 65 176.291 174.067 2.224 1
1 677 . 15 1 1 A 65 65 CYS CA C 65 59.027 57.398 1.629 1
1 678 . 15 1 1 A 65 65 CYS CB C 65 32.030 27.668 4.362 1
1 679 . 15 1 1 A 65 65 CYS N N 65 120.368 115.741 4.627 1
1 680 . 15 1 1 A 66 66 GLU H H 66 7.281 8.535 -1.254 1
1 681 . 15 1 1 A 66 66 GLU HA H 66 4.046 4.539 -0.493 1
1 686 . 15 1 1 A 66 66 GLU C C 66 175.211 176.303 -1.092 1
1 687 . 15 1 1 A 66 66 GLU CA C 66 58.591 56.804 1.787 1
1 688 . 15 1 1 A 66 66 GLU CB C 66 27.067 28.748 -1.681 1
1 690 . 15 1 1 A 66 66 GLU N N 66 115.012 125.705 -10.693 1
1 691 . 15 1 1 A 67 67 LYS H H 67 8.481 8.534 -0.053 1
1 692 . 15 1 1 A 67 67 LYS HA H 67 4.326 4.826 -0.500 1
1 701 . 15 1 1 A 67 67 LYS C C 67 177.923 175.215 2.708 1
1 702 . 15 1 1 A 67 67 LYS CA C 67 57.628 54.912 2.716 1
1 703 . 15 1 1 A 67 67 LYS CB C 67 33.617 34.204 -0.587 1
1 707 . 15 1 1 A 67 67 LYS N N 67 123.514 125.175 -1.661 1
1 708 . 15 1 1 A 68 68 ILE H H 68 8.867 8.672 0.195 1
1 709 . 15 1 1 A 68 68 ILE HA H 68 4.976 4.623 0.353 1
1 719 . 15 1 1 A 68 68 ILE C C 68 175.018 175.407 -0.389 1
1 720 . 15 1 1 A 68 68 ILE CA C 68 60.919 61.108 -0.189 1
1 721 . 15 1 1 A 68 68 ILE CB C 68 37.090 36.713 0.377 1
1 725 . 15 1 1 A 68 68 ILE N N 68 133.478 128.671 4.807 1
1 726 . 15 1 1 A 69 69 GLN H H 69 9.269 8.548 0.721 1
1 727 . 15 1 1 A 69 69 GLN HA H 69 5.036 5.110 -0.074 1
1 732 . 15 1 1 A 69 69 GLN C C 69 173.607 174.968 -1.361 1
1 733 . 15 1 1 A 69 69 GLN CA C 69 53.419 53.722 -0.303 1
1 734 . 15 1 1 A 69 69 GLN CB C 69 34.997 32.325 2.672 1
1 736 . 15 1 1 A 69 69 GLN N N 69 125.104 124.173 0.931 1
1 737 . 15 1 1 A 70 70 HIS H H 70 8.829 8.918 -0.089 1
1 738 . 15 1 1 A 70 70 HIS HA H 70 4.865 4.826 0.039 1
1 741 . 15 1 1 A 70 70 HIS C C 70 174.852 175.239 -0.387 1
1 742 . 15 1 1 A 70 70 HIS CA C 70 56.304 56.519 -0.215 1
1 743 . 15 1 1 A 70 70 HIS CB C 70 30.050 30.941 -0.891 1
1 744 . 15 1 1 A 70 70 HIS N N 70 118.576 118.748 -0.172 1
1 745 . 15 1 1 A 71 71 ALA H H 71 7.768 8.254 -0.486 1
1 746 . 15 1 1 A 71 71 ALA HA H 71 3.977 4.362 -0.385 1
1 750 . 15 1 1 A 71 71 ALA C C 71 175.433 177.185 -1.752 1
1 751 . 15 1 1 A 71 71 ALA CA C 71 54.393 52.957 1.436 1
1 752 . 15 1 1 A 71 71 ALA CB C 71 18.000 19.075 -1.075 1
1 753 . 15 1 1 A 71 71 ALA N N 71 121.438 124.851 -3.413 1
1 754 . 15 1 1 A 72 72 GLN H H 72 7.227 8.038 -0.811 1
1 755 . 15 1 1 A 72 72 GLN HA H 72 4.371 4.654 -0.283 1
1 762 . 15 1 1 A 72 72 GLN C C 72 173.053 174.969 -1.916 1
1 763 . 15 1 1 A 72 72 GLN CA C 72 54.290 53.727 0.563 1
1 764 . 15 1 1 A 72 72 GLN CB C 72 28.623 31.843 -3.220 1
1 766 . 15 1 1 A 72 72 GLN N N 72 115.858 122.965 -7.107 1
1 768 . 15 1 1 A 73 73 GLN H H 73 8.481 8.306 0.175 1
1 769 . 15 1 1 A 73 73 GLN HA H 73 3.570 3.869 -0.299 1
1 776 . 15 1 1 A 73 73 GLN C C 73 174.243 175.773 -1.530 1
1 777 . 15 1 1 A 73 73 GLN CA C 73 60.206 57.390 2.816 1
1 778 . 15 1 1 A 73 73 GLN CB C 73 28.850 29.081 -0.231 1
1 780 . 15 1 1 A 73 73 GLN N N 73 116.433 122.670 -6.237 1
1 782 . 15 1 1 A 74 74 THR H H 74 7.211 7.309 -0.098 1
1 783 . 15 1 1 A 74 74 THR HA H 74 4.160 5.363 -1.203 1
1 788 . 15 1 1 A 74 74 THR C C 74 171.836 172.574 -0.738 1
1 789 . 15 1 1 A 74 74 THR CA C 74 59.072 59.257 -0.185 1
1 790 . 15 1 1 A 74 74 THR CB C 74 71.560 72.012 -0.452 1
1 792 . 15 1 1 A 74 74 THR N N 74 108.717 108.309 0.408 1
1 793 . 15 1 1 A 75 75 CYS H H 75 7.676 8.698 -1.022 1
1 794 . 15 1 1 A 75 75 CYS HA H 75 4.158 4.839 -0.681 1
1 797 . 15 1 1 A 75 75 CYS C C 75 178.781 175.712 3.069 1
1 798 . 15 1 1 A 75 75 CYS CA C 75 58.661 58.362 0.299 1
1 799 . 15 1 1 A 75 75 CYS CB C 75 30.840 27.374 3.466 1
1 800 . 15 1 1 A 75 75 CYS N N 75 123.108 122.720 0.388 1
1 801 . 15 1 1 A 76 76 GLU H H 76 9.203 8.850 0.353 1
1 802 . 15 1 1 A 76 76 GLU HA H 76 4.187 4.068 0.119 1
1 807 . 15 1 1 A 76 76 GLU C C 76 175.488 178.788 -3.300 1
1 808 . 15 1 1 A 76 76 GLU CA C 76 57.306 58.971 -1.665 1
1 809 . 15 1 1 A 76 76 GLU CB C 76 29.347 29.007 0.340 1
1 811 . 15 1 1 A 76 76 GLU N N 76 129.817 127.219 2.598 1
1 812 . 15 1 1 A 77 77 GLU H H 77 9.496 7.836 1.660 1
1 813 . 15 1 1 A 77 77 GLU HA H 77 4.599 4.087 0.512 1
1 818 . 15 1 1 A 77 77 GLU C C 77 177.148 177.274 -0.126 1
1 819 . 15 1 1 A 77 77 GLU CA C 77 57.554 59.098 -1.544 1
1 820 . 15 1 1 A 77 77 GLU CB C 77 31.980 30.292 1.688 1
1 822 . 15 1 1 A 77 77 GLU N N 77 124.795 120.409 4.386 1
1 823 . 15 1 1 A 78 78 CYS H H 78 8.967 7.581 1.386 1
1 824 . 15 1 1 A 78 78 CYS HA H 78 5.073 4.632 0.441 1
1 827 . 15 1 1 A 78 78 CYS C C 78 176.374 175.043 1.331 1
1 828 . 15 1 1 A 78 78 CYS CA C 78 58.537 58.256 0.281 1
1 829 . 15 1 1 A 78 78 CYS CB C 78 31.597 28.803 2.794 1
1 830 . 15 1 1 A 78 78 CYS N N 78 119.692 114.825 4.867 1
1 831 . 15 1 1 A 79 79 SER H H 79 7.474 8.396 -0.922 1
1 832 . 15 1 1 A 79 79 SER HA H 79 4.113 4.118 -0.005 1
1 835 . 15 1 1 A 79 79 SER C C 79 172.915 173.601 -0.686 1
1 836 . 15 1 1 A 79 79 SER CA C 79 60.440 59.248 1.192 1
1 837 . 15 1 1 A 79 79 SER CB C 79 61.421 61.066 0.355 1
1 838 . 15 1 1 A 79 79 SER N N 79 113.385 115.499 -2.114 1
1 839 . 15 1 1 A 80 80 THR H H 80 7.907 7.910 -0.003 1
1 840 . 15 1 1 A 80 80 THR HA H 80 3.913 4.165 -0.252 1
1 845 . 15 1 1 A 80 80 THR C C 80 172.306 174.067 -1.761 1
1 846 . 15 1 1 A 80 80 THR CA C 80 65.262 64.052 1.210 1
1 847 . 15 1 1 A 80 80 THR CB C 80 69.910 69.445 0.465 1
1 849 . 15 1 1 A 80 80 THR N N 80 120.005 116.471 3.534 1
1 850 . 15 1 1 A 81 81 LEU H H 81 8.556 8.444 0.112 1
1 851 . 15 1 1 A 81 81 LEU HA H 81 4.172 4.636 -0.464 1
1 861 . 15 1 1 A 81 81 LEU C C 81 177.121 176.614 0.507 1
1 862 . 15 1 1 A 81 81 LEU CA C 81 54.996 54.816 0.180 1
1 863 . 15 1 1 A 81 81 LEU CB C 81 42.147 42.272 -0.125 1
1 867 . 15 1 1 A 81 81 LEU N N 81 128.272 128.183 0.089 1
1 868 . 15 1 1 A 82 82 PHE H H 82 9.251 9.452 -0.201 1
1 869 . 15 1 1 A 82 82 PHE HA H 82 4.576 4.573 0.003 1
1 874 . 15 1 1 A 82 82 PHE C C 82 177.785 175.843 1.942 1
1 875 . 15 1 1 A 82 82 PHE CA C 82 56.470 58.941 -2.471 1
1 876 . 15 1 1 A 82 82 PHE CB C 82 38.210 39.504 -1.294 1
1 878 . 15 1 1 A 82 82 PHE N N 82 129.268 126.160 3.108 1
1 879 . 15 1 1 A 83 83 GLY H H 83 7.047 7.393 -0.346 1
1 880 . 15 1 1 A 83 83 GLY HA2 H 83 4.783 4.188 0.595 1
1 881 . 15 1 1 A 83 83 GLY HA3 H 83 3.876 4.258 -0.382 1
1 882 . 15 1 1 A 83 83 GLY C C 83 171.642 174.687 -3.045 1
1 883 . 15 1 1 A 83 83 GLY CA C 83 45.826 46.000 -0.174 1
1 884 . 15 1 1 A 83 83 GLY N N 83 102.168 105.784 -3.616 1
1 885 . 15 1 1 A 84 84 GLU H H 84 8.444 8.959 -0.515 1
1 886 . 15 1 1 A 84 84 GLU HA H 84 4.111 4.151 -0.040 1
1 891 . 15 1 1 A 84 84 GLU C C 84 177.259 176.541 0.718 1
1 892 . 15 1 1 A 84 84 GLU CA C 84 59.438 58.692 0.746 1
1 893 . 15 1 1 A 84 84 GLU CB C 84 30.670 30.328 0.342 1
1 895 . 15 1 1 A 84 84 GLU N N 84 127.546 121.612 5.934 1
1 896 . 15 1 1 A 85 85 TYR H H 85 9.344 8.173 1.171 1
1 897 . 15 1 1 A 85 85 TYR HA H 85 4.599 5.041 -0.442 1
1 902 . 15 1 1 A 85 85 TYR C C 85 173.302 173.525 -0.223 1
1 903 . 15 1 1 A 85 85 TYR CA C 85 57.261 56.763 0.498 1
1 904 . 15 1 1 A 85 85 TYR CB C 85 40.850 40.424 0.426 1
1 906 . 15 1 1 A 85 85 TYR N N 85 118.936 121.489 -2.553 1
1 907 . 15 1 1 A 86 86 TYR H H 86 7.323 8.710 -1.387 1
1 908 . 15 1 1 A 86 86 TYR HA H 86 5.298 5.357 -0.059 1
1 911 . 15 1 1 A 86 86 TYR C C 86 172.804 174.513 -1.709 1
1 912 . 15 1 1 A 86 86 TYR CA C 86 54.041 56.341 -2.300 1
1 913 . 15 1 1 A 86 86 TYR CB C 86 40.987 41.948 -0.961 1
1 914 . 15 1 1 A 86 86 TYR N N 86 124.965 129.591 -4.626 1
1 915 . 15 1 1 A 87 87 CYS H H 87 7.046 8.457 -1.411 1
1 916 . 15 1 1 A 87 87 CYS HA H 87 3.842 4.638 -0.796 1
1 919 . 15 1 1 A 87 87 CYS C C 87 174.243 174.026 0.217 1
1 920 . 15 1 1 A 87 87 CYS CA C 87 56.377 58.332 -1.955 1
1 921 . 15 1 1 A 87 87 CYS CB C 87 33.230 29.986 3.244 1
1 922 . 15 1 1 A 87 87 CYS N N 87 128.735 125.752 2.983 1
1 923 . 15 1 1 A 88 88 ASP H H 88 8.002 8.880 -0.878 1
1 924 . 15 1 1 A 88 88 ASP HA H 88 3.761 4.232 -0.471 1
1 927 . 15 1 1 A 88 88 ASP C C 88 173.579 178.098 -4.519 1
1 928 . 15 1 1 A 88 88 ASP CA C 88 53.958 56.537 -2.579 1
1 929 . 15 1 1 A 88 88 ASP CB C 88 41.240 39.542 1.698 1
1 930 . 15 1 1 A 88 88 ASP N N 88 127.013 126.749 0.264 1
1 931 . 15 1 1 A 89 89 ILE H H 89 7.972 7.799 0.173 1
1 932 . 15 1 1 A 89 89 ILE HA H 89 3.660 3.669 -0.009 1
1 942 . 15 1 1 A 89 89 ILE C C 89 177.259 177.484 -0.225 1
1 943 . 15 1 1 A 89 89 ILE CA C 89 63.107 64.949 -1.842 1
1 944 . 15 1 1 A 89 89 ILE CB C 89 39.430 37.740 1.690 1
1 948 . 15 1 1 A 89 89 ILE N N 89 120.357 120.752 -0.395 1
1 949 . 15 1 1 A 90 90 CYS H H 90 8.554 7.736 0.818 1
1 950 . 15 1 1 A 90 90 CYS HA H 90 3.677 4.415 -0.738 1
1 953 . 15 1 1 A 90 90 CYS C C 90 175.128 174.607 0.521 1
1 954 . 15 1 1 A 90 90 CYS CA C 90 60.791 59.467 1.324 1
1 955 . 15 1 1 A 90 90 CYS CB C 90 30.427 28.183 2.244 1
1 956 . 15 1 1 A 90 90 CYS N N 90 119.564 116.871 2.693 1
1 957 . 15 1 1 A 91 91 HIS H H 91 7.364 7.501 -0.137 1
1 958 . 15 1 1 A 91 91 HIS HA H 91 3.512 3.702 -0.190 1
1 963 . 15 1 1 A 91 91 HIS C C 91 170.590 173.019 -2.429 1
1 964 . 15 1 1 A 91 91 HIS CA C 91 58.739 56.585 2.154 1
1 965 . 15 1 1 A 91 91 HIS CB C 91 24.810 26.396 -1.586 1
1 968 . 15 1 1 A 91 91 HIS N N 91 111.440 115.891 -4.451 1
1 969 . 15 1 1 A 92 92 LEU H H 92 6.214 7.634 -1.420 1
1 970 . 15 1 1 A 92 92 LEU HA H 92 4.191 3.985 0.206 1
1 980 . 15 1 1 A 92 92 LEU C C 92 173.911 175.796 -1.885 1
1 981 . 15 1 1 A 92 92 LEU CA C 92 53.717 53.605 0.112 1
1 982 . 15 1 1 A 92 92 LEU CB C 92 45.360 42.280 3.080 1
1 986 . 15 1 1 A 92 92 LEU N N 92 115.684 119.406 -3.722 1
1 987 . 15 1 1 A 93 93 PHE H H 93 6.669 8.799 -2.130 1
1 988 . 15 1 1 A 93 93 PHE HA H 93 5.622 5.304 0.318 1
1 995 . 15 1 1 A 93 93 PHE C C 93 175.765 174.647 1.118 1
1 996 . 15 1 1 A 93 93 PHE CA C 93 55.387 56.535 -1.148 1
1 997 . 15 1 1 A 93 93 PHE CB C 93 42.700 41.315 1.385 1
1 1000 . 15 1 1 A 93 93 PHE N N 93 121.535 122.953 -1.418 1
1 1001 . 15 1 1 A 94 94 ASP H H 94 9.209 8.702 0.507 1
1 1002 . 15 1 1 A 94 94 ASP HA H 94 5.819 5.210 0.609 1
1 1005 . 15 1 1 A 94 94 ASP C C 94 175.654 175.202 0.452 1
1 1006 . 15 1 1 A 94 94 ASP CA C 94 53.330 53.348 -0.018 1
1 1007 . 15 1 1 A 94 94 ASP CB C 94 44.720 45.031 -0.311 1
1 1008 . 15 1 1 A 94 94 ASP N N 94 123.504 121.822 1.682 1
1 1009 . 15 1 1 A 95 95 LYS H H 95 9.043 8.608 0.435 1
1 1010 . 15 1 1 A 95 95 LYS HA H 95 4.527 4.404 0.123 1
1 1019 . 15 1 1 A 95 95 LYS C C 95 174.879 176.447 -1.568 1
1 1020 . 15 1 1 A 95 95 LYS CA C 95 56.620 57.149 -0.529 1
1 1021 . 15 1 1 A 95 95 LYS CB C 95 33.720 33.245 0.475 1
1 1025 . 15 1 1 A 95 95 LYS N N 95 120.380 122.643 -2.263 1
1 1026 . 15 1 1 A 96 96 ASP H H 96 8.999 8.627 0.372 1
1 1027 . 15 1 1 A 96 96 ASP HA H 96 4.724 4.785 -0.061 1
1 1030 . 15 1 1 A 96 96 ASP C C 96 176.401 175.658 0.743 1
1 1031 . 15 1 1 A 96 96 ASP CA C 96 56.147 53.514 2.633 1
1 1032 . 15 1 1 A 96 96 ASP CB C 96 40.790 40.937 -0.147 1
1 1033 . 15 1 1 A 96 96 ASP N N 96 120.784 122.328 -1.544 1
1 1034 . 15 1 1 A 97 97 LYS H H 97 9.382 8.679 0.703 1
1 1035 . 15 1 1 A 97 97 LYS HA H 97 4.473 4.621 -0.148 1
1 1044 . 15 1 1 A 97 97 LYS C C 97 175.903 175.611 0.292 1
1 1045 . 15 1 1 A 97 97 LYS CA C 97 54.771 55.508 -0.737 1
1 1046 . 15 1 1 A 97 97 LYS CB C 97 33.270 32.052 1.218 1
1 1050 . 15 1 1 A 97 97 LYS N N 97 131.617 126.299 5.318 1
1 1051 . 15 1 1 A 98 98 LYS H H 98 8.940 8.038 0.902 1
1 1052 . 15 1 1 A 98 98 LYS HA H 98 4.118 3.888 0.230 1
1 1061 . 15 1 1 A 98 98 LYS C C 98 177.065 175.193 1.872 1
1 1062 . 15 1 1 A 98 98 LYS CA C 98 56.297 57.544 -1.247 1
1 1063 . 15 1 1 A 98 98 LYS CB C 98 28.467 29.656 -1.189 1
1 1067 . 15 1 1 A 98 98 LYS N N 98 115.034 113.644 1.390 1
1 1068 . 15 1 1 A 99 99 GLN H H 99 9.266 7.901 1.365 1
1 1069 . 15 1 1 A 99 99 GLN HA H 99 4.460 4.438 0.022 1
1 1074 . 15 1 1 A 99 99 GLN C C 99 174.990 174.811 0.179 1
1 1075 . 15 1 1 A 99 99 GLN CA C 99 57.563 55.439 2.124 1
1 1076 . 15 1 1 A 99 99 GLN CB C 99 27.280 29.810 -2.530 1
1 1078 . 15 1 1 A 99 99 GLN N N 99 117.717 118.274 -0.557 1
1 1079 . 15 1 1 A 100 100 TYR H H 100 8.402 8.382 0.020 1
1 1080 . 15 1 1 A 100 100 TYR HA H 100 4.935 5.358 -0.423 1
1 1087 . 15 1 1 A 100 100 TYR C C 100 171.504 172.525 -1.021 1
1 1088 . 15 1 1 A 100 100 TYR CA C 100 55.786 55.602 0.184 1
1 1089 . 15 1 1 A 100 100 TYR CB C 100 41.090 41.900 -0.810 1
1 1092 . 15 1 1 A 100 100 TYR N N 100 115.081 116.403 -1.322 1
1 1093 . 15 1 1 A 101 101 HIS H H 101 8.829 9.022 -0.193 1
1 1094 . 15 1 1 A 101 101 HIS HA H 101 4.525 5.033 -0.508 1
1 1099 . 15 1 1 A 101 101 HIS C C 101 174.935 173.661 1.274 1
1 1100 . 15 1 1 A 101 101 HIS CA C 101 56.327 55.152 1.175 1
1 1101 . 15 1 1 A 101 101 HIS CB C 101 31.020 31.531 -0.511 1
1 1104 . 15 1 1 A 101 101 HIS N N 101 120.894 122.669 -1.775 1
1 1105 . 15 1 1 A 102 102 CYS H H 102 7.427 8.319 -0.892 1
1 1106 . 15 1 1 A 102 102 CYS HA H 102 4.561 4.610 -0.049 1
1 1109 . 15 1 1 A 102 102 CYS C C 102 175.765 175.772 -0.007 1
1 1110 . 15 1 1 A 102 102 CYS CA C 102 57.707 57.563 0.144 1
1 1111 . 15 1 1 A 102 102 CYS CB C 102 29.130 30.233 -1.103 1
1 1112 . 15 1 1 A 102 102 CYS N N 102 131.256 127.580 3.676 1
1 1113 . 15 1 1 A 103 103 GLU H H 103 9.497 9.119 0.378 1
1 1114 . 15 1 1 A 103 103 GLU HA H 103 4.003 4.193 -0.190 1
1 1119 . 15 1 1 A 103 103 GLU C C 103 176.540 178.741 -2.201 1
1 1120 . 15 1 1 A 103 103 GLU CA C 103 58.796 59.364 -0.568 1
1 1121 . 15 1 1 A 103 103 GLU CB C 103 29.280 29.734 -0.454 1
1 1123 . 15 1 1 A 103 103 GLU N N 103 129.829 127.570 2.259 1
1 1124 . 15 1 1 A 104 104 ASN H H 104 7.832 7.909 -0.077 1
1 1125 . 15 1 1 A 104 104 ASN HA H 104 4.457 4.418 0.039 1
1 1130 . 15 1 1 A 104 104 ASN C C 104 176.401 177.679 -1.278 1
1 1131 . 15 1 1 A 104 104 ASN CA C 104 56.053 56.199 -0.146 1
1 1132 . 15 1 1 A 104 104 ASN CB C 104 38.400 37.602 0.798 1
1 1133 . 15 1 1 A 104 104 ASN N N 104 117.703 118.678 -0.975 1
1 1135 . 15 1 1 A 105 105 CYS H H 105 9.415 7.352 2.063 1
1 1136 . 15 1 1 A 105 105 CYS HA H 105 4.137 4.484 -0.347 1
1 1139 . 15 1 1 A 105 105 CYS C C 105 176.844 175.269 1.575 1
1 1140 . 15 1 1 A 105 105 CYS CA C 105 64.328 59.433 4.895 1
1 1141 . 15 1 1 A 105 105 CYS CB C 105 30.350 28.099 2.251 1
1 1142 . 15 1 1 A 105 105 CYS N N 105 124.939 115.312 9.627 1
1 1143 . 15 1 1 A 106 106 GLY H H 106 8.145 8.876 -0.731 1
1 1144 . 15 1 1 A 106 106 GLY HA2 H 106 3.980 3.901 0.079 1
1 1145 . 15 1 1 A 106 106 GLY HA3 H 106 3.502 3.913 -0.411 1
1 1146 . 15 1 1 A 106 106 GLY C C 106 172.500 173.482 -0.982 1
1 1147 . 15 1 1 A 106 106 GLY CA C 106 44.968 45.649 -0.681 1
1 1148 . 15 1 1 A 106 106 GLY N N 106 106.090 109.623 -3.533 1
1 1149 . 15 1 1 A 107 107 ILE H H 107 6.465 6.840 -0.375 1
1 1150 . 15 1 1 A 107 107 ILE HA H 107 4.878 4.933 -0.055 1
1 1160 . 15 1 1 A 107 107 ILE C C 107 174.824 174.125 0.699 1
1 1161 . 15 1 1 A 107 107 ILE CA C 107 58.226 58.517 -0.291 1
1 1162 . 15 1 1 A 107 107 ILE CB C 107 44.460 42.270 2.190 1
1 1166 . 15 1 1 A 107 107 ILE N N 107 107.914 114.696 -6.782 1
1 1167 . 15 1 1 A 108 108 CYS H H 108 7.041 9.228 -2.187 1
1 1168 . 15 1 1 A 108 108 CYS HA H 108 5.018 5.421 -0.403 1
1 1171 . 15 1 1 A 108 108 CYS C C 108 175.461 172.615 2.846 1
1 1172 . 15 1 1 A 108 108 CYS CA C 108 62.097 57.176 4.921 1
1 1173 . 15 1 1 A 108 108 CYS CB C 108 31.353 30.272 1.081 1
1 1174 . 15 1 1 A 108 108 CYS N N 108 122.441 120.658 1.783 1
1 1175 . 15 1 1 A 109 109 ARG H H 109 8.561 8.244 0.317 1
1 1176 . 15 1 1 A 109 109 ARG HA H 109 4.239 4.759 -0.520 1
1 1183 . 15 1 1 A 109 109 ARG C C 109 174.271 174.332 -0.061 1
1 1184 . 15 1 1 A 109 109 ARG CA C 109 52.962 54.187 -1.225 1
1 1185 . 15 1 1 A 109 109 ARG CB C 109 33.903 34.017 -0.114 1
1 1188 . 15 1 1 A 109 109 ARG N N 109 121.163 123.068 -1.905 1
1 1189 . 15 1 1 A 110 110 ILE H H 110 7.847 8.312 -0.465 1
1 1190 . 15 1 1 A 110 110 ILE HA H 110 3.531 4.011 -0.480 1
1 1200 . 15 1 1 A 110 110 ILE C C 110 175.405 176.524 -1.119 1
1 1201 . 15 1 1 A 110 110 ILE CA C 110 62.201 62.664 -0.463 1
1 1202 . 15 1 1 A 110 110 ILE CB C 110 36.860 37.040 -0.180 1
1 1206 . 15 1 1 A 110 110 ILE N N 110 118.955 124.860 -5.905 1
1 1207 . 15 1 1 A 111 111 GLY H H 111 6.928 8.147 -1.219 1
1 1208 . 15 1 1 A 111 111 GLY HA2 H 111 4.564 3.874 0.690 1
1 1209 . 15 1 1 A 111 111 GLY HA3 H 111 4.135 4.200 -0.065 1
1 1210 . 15 1 1 A 111 111 GLY CA C 111 43.068 45.763 -2.695 1
1 1211 . 15 1 1 A 111 111 GLY N N 111 113.782 113.798 -0.016 1
1 1212 . 15 1 1 A 112 112 PRO HA H 112 4.990 4.728 0.262 1
1 1219 . 15 1 1 A 112 112 PRO C C 112 177.342 177.802 -0.460 1
1 1220 . 15 1 1 A 112 112 PRO CA C 112 62.920 62.933 -0.013 1
1 1221 . 15 1 1 A 112 112 PRO CB C 112 34.807 31.809 2.998 1
1 1224 . 15 1 1 A 113 113 LYS H H 113 8.989 8.329 0.660 1
1 1225 . 15 1 1 A 113 113 LYS HA H 113 3.144 3.624 -0.480 1
1 1234 . 15 1 1 A 113 113 LYS C C 113 177.536 178.225 -0.689 1
1 1235 . 15 1 1 A 113 113 LYS CA C 113 59.883 58.906 0.977 1
1 1236 . 15 1 1 A 113 113 LYS CB C 113 32.260 31.858 0.402 1
1 1240 . 15 1 1 A 113 113 LYS N N 113 123.545 123.726 -0.181 1
1 1241 . 15 1 1 A 114 114 GLU H H 114 9.080 9.063 0.017 1
1 1242 . 15 1 1 A 114 114 GLU HA H 114 4.199 4.063 0.136 1
1 1247 . 15 1 1 A 114 114 GLU C C 114 176.374 177.710 -1.336 1
1 1248 . 15 1 1 A 114 114 GLU CA C 114 58.733 59.561 -0.828 1
1 1249 . 15 1 1 A 114 114 GLU CB C 114 28.077 29.024 -0.947 1
1 1251 . 15 1 1 A 114 114 GLU N N 114 114.832 120.231 -5.399 1
1 1252 . 15 1 1 A 115 115 ASP H H 115 7.799 7.528 0.271 1
1 1253 . 15 1 1 A 115 115 ASP HA H 115 4.642 4.677 -0.035 1
1 1256 . 15 1 1 A 115 115 ASP C C 115 176.374 175.709 0.665 1
1 1257 . 15 1 1 A 115 115 ASP CA C 115 54.470 53.917 0.553 1
1 1258 . 15 1 1 A 115 115 ASP CB C 115 40.850 41.254 -0.404 1
1 1259 . 15 1 1 A 115 115 ASP N N 115 118.858 119.300 -0.442 1
1 1260 . 15 1 1 A 116 116 PHE H H 116 8.063 7.295 0.768 1
1 1261 . 15 1 1 A 116 116 PHE HA H 116 5.239 5.282 -0.043 1
1 1264 . 15 1 1 A 116 116 PHE C C 116 173.413 175.130 -1.717 1
1 1265 . 15 1 1 A 116 116 PHE CA C 116 57.708 55.914 1.794 1
1 1266 . 15 1 1 A 116 116 PHE CB C 116 44.557 41.661 2.896 1
1 1267 . 15 1 1 A 116 116 PHE N N 116 120.567 117.757 2.810 1
1 1268 . 15 1 1 A 117 117 PHE H H 117 9.439 8.758 0.681 1
1 1269 . 15 1 1 A 117 117 PHE HA H 117 5.091 5.592 -0.501 1
1 1277 . 15 1 1 A 117 117 PHE C C 117 171.614 172.663 -1.049 1
1 1278 . 15 1 1 A 117 117 PHE CA C 117 55.311 55.270 0.041 1
1 1279 . 15 1 1 A 117 117 PHE CB C 117 41.887 42.373 -0.486 1
1 1283 . 15 1 1 A 117 117 PHE N N 117 118.040 119.113 -1.073 1
1 1284 . 15 1 1 A 118 118 HIS H H 118 8.779 8.997 -0.218 1
1 1285 . 15 1 1 A 118 118 HIS HA H 118 4.836 4.914 -0.078 1
1 1289 . 15 1 1 A 118 118 HIS C C 118 174.879 173.871 1.008 1
1 1290 . 15 1 1 A 118 118 HIS CA C 118 55.322 55.684 -0.362 1
1 1291 . 15 1 1 A 118 118 HIS CB C 118 30.950 31.567 -0.617 1
1 1293 . 15 1 1 A 118 118 HIS N N 118 121.208 121.223 -0.015 1
1 1294 . 15 1 1 A 119 119 CYS H H 119 8.123 7.674 0.449 1
1 1295 . 15 1 1 A 119 119 CYS HA H 119 4.529 4.917 -0.388 1
1 1298 . 15 1 1 A 119 119 CYS C C 119 176.567 175.401 1.166 1
1 1299 . 15 1 1 A 119 119 CYS CA C 119 58.957 57.286 1.671 1
1 1300 . 15 1 1 A 119 119 CYS CB C 119 30.090 29.688 0.402 1
1 1301 . 15 1 1 A 119 119 CYS N N 119 131.659 126.451 5.208 1
1 1302 . 15 1 1 A 120 120 LEU H H 120 8.970 8.416 0.554 1
1 1303 . 15 1 1 A 120 120 LEU N N 120 130.361 128.063 2.298 1
1 1304 . 15 1 1 A 121 121 LYS HA H 121 4.299 4.229 0.070 1
1 1313 . 15 1 1 A 121 121 LYS CA C 121 58.727 56.322 2.405 1
1 1314 . 15 1 1 A 121 121 LYS CB C 121 33.210 33.495 -0.285 1
1 1318 . 15 1 1 A 123 123 ASN HA H 123 4.438 4.852 -0.414 1
1 1323 . 15 1 1 A 123 123 ASN C C 123 172.444 174.725 -2.281 1
1 1324 . 15 1 1 A 123 123 ASN CA C 123 53.448 55.004 -1.556 1
1 1325 . 15 1 1 A 123 123 ASN CB C 123 37.130 38.609 -1.479 1
1 1327 . 15 1 1 A 124 124 LEU H H 124 6.596 7.326 -0.730 1
1 1328 . 15 1 1 A 124 124 LEU HA H 124 4.576 4.648 -0.072 1
1 1338 . 15 1 1 A 124 124 LEU C C 124 175.903 175.716 0.187 1
1 1339 . 15 1 1 A 124 124 LEU CA C 124 54.043 53.725 0.318 1
1 1340 . 15 1 1 A 124 124 LEU CB C 124 45.837 44.303 1.534 1
1 1344 . 15 1 1 A 124 124 LEU N N 124 115.443 122.206 -6.763 1
1 1345 . 15 1 1 A 125 125 CYS H H 125 6.342 8.669 -2.327 1
1 1346 . 15 1 1 A 125 125 CYS HA H 125 5.033 5.120 -0.087 1
1 1349 . 15 1 1 A 125 125 CYS C C 125 175.101 174.356 0.745 1
1 1350 . 15 1 1 A 125 125 CYS CA C 125 62.046 57.630 4.416 1
1 1351 . 15 1 1 A 125 125 CYS CB C 125 30.840 28.724 2.116 1
1 1352 . 15 1 1 A 125 125 CYS N N 125 118.685 122.658 -3.973 1
1 1353 . 15 1 1 A 126 126 LEU H H 126 8.894 8.223 0.671 1
1 1354 . 15 1 1 A 126 126 LEU HA H 126 4.565 4.896 -0.331 1
1 1364 . 15 1 1 A 126 126 LEU C C 126 174.879 176.107 -1.228 1
1 1365 . 15 1 1 A 126 126 LEU CA C 126 52.751 52.959 -0.208 1
1 1366 . 15 1 1 A 126 126 LEU CB C 126 46.090 44.350 1.740 1
1 1370 . 15 1 1 A 126 126 LEU N N 126 124.501 126.195 -1.694 1
1 1371 . 15 1 1 A 127 127 ALA H H 127 8.378 8.414 -0.036 1
1 1372 . 15 1 1 A 127 127 ALA HA H 127 3.957 4.437 -0.480 1
1 1376 . 15 1 1 A 127 127 ALA C C 127 179.085 178.350 0.735 1
1 1377 . 15 1 1 A 127 127 ALA CA C 127 52.554 51.170 1.384 1
1 1378 . 15 1 1 A 127 127 ALA CB C 127 18.527 20.034 -1.507 1
1 1379 . 15 1 1 A 127 127 ALA N N 127 123.011 124.034 -1.023 1
1 1380 . 15 1 1 A 128 128 MET H H 128 8.237 8.665 -0.428 1
1 1385 . 15 1 1 A 128 128 MET N N 128 120.642 119.546 1.096 1
1 1386 . 15 1 1 A 129 129 ASN HA H 129 4.502 4.480 0.022 1
1 1389 . 15 1 1 A 129 129 ASN C C 129 175.931 176.970 -1.039 1
1 1390 . 15 1 1 A 129 129 ASN CA C 129 55.064 55.282 -0.218 1
1 1391 . 15 1 1 A 129 129 ASN CB C 129 36.920 38.536 -1.616 1
1 1392 . 15 1 1 A 130 130 LEU H H 130 8.211 7.741 0.470 1
1 1393 . 15 1 1 A 130 130 LEU HA H 130 4.489 4.555 -0.066 1
1 1403 . 15 1 1 A 130 130 LEU C C 130 178.836 176.352 2.484 1
1 1404 . 15 1 1 A 130 130 LEU CA C 130 54.653 55.283 -0.630 1
1 1405 . 15 1 1 A 130 130 LEU CB C 130 41.887 43.053 -1.166 1
1 1409 . 15 1 1 A 130 130 LEU N N 130 118.563 118.815 -0.252 1
1 1410 . 15 1 1 A 131 131 GLN H H 131 7.953 7.352 0.601 1
1 1411 . 15 1 1 A 131 131 GLN HA H 131 3.729 5.018 -1.289 1
1 1418 . 15 1 1 A 131 131 GLN CA C 131 59.310 57.101 2.209 1
1 1419 . 15 1 1 A 131 131 GLN CB C 131 28.340 28.686 -0.346 1
1 1421 . 15 1 1 A 131 131 GLN N N 131 123.929 116.871 7.058 1
1 1423 . 15 1 1 A 132 132 GLY HA2 H 132 4.034 3.815 0.219 1
1 1424 . 15 1 1 A 132 132 GLY HA3 H 132 3.865 3.902 -0.037 1
1 1425 . 15 1 1 A 132 132 GLY C C 132 174.547 175.838 -1.291 1
1 1426 . 15 1 1 A 132 132 GLY CA C 132 45.902 45.070 0.832 1
1 1427 . 15 1 1 A 133 133 ARG H H 133 7.735 7.980 -0.245 1
1 1428 . 15 1 1 A 133 133 ARG HA H 133 4.611 4.362 0.249 1
1 1435 . 15 1 1 A 133 133 ARG C C 133 175.461 176.143 -0.682 1
1 1436 . 15 1 1 A 133 133 ARG CA C 133 54.987 56.740 -1.753 1
1 1437 . 15 1 1 A 133 133 ARG CB C 133 31.470 30.751 0.719 1
1 1440 . 15 1 1 A 133 133 ARG N N 133 118.194 118.531 -0.337 1
1 1441 . 15 1 1 A 134 134 HIS H H 134 7.803 7.614 0.189 1
1 1444 . 15 1 1 A 134 134 HIS N N 134 118.700 115.820 2.880 1
1 1445 . 15 1 1 A 135 135 LYS HA H 135 4.331 4.329 0.002 1
1 1454 . 15 1 1 A 135 135 LYS C C 135 174.852 176.678 -1.826 1
1 1455 . 15 1 1 A 135 135 LYS CA C 135 55.390 56.686 -1.296 1
1 1456 . 15 1 1 A 135 135 LYS CB C 135 32.970 32.728 0.242 1
1 1460 . 15 1 1 A 136 136 CYS H H 136 7.801 8.694 -0.893 1
1 1461 . 15 1 1 A 136 136 CYS HA H 136 4.113 4.775 -0.662 1
1 1464 . 15 1 1 A 136 136 CYS C C 136 174.879 174.146 0.733 1
1 1465 . 15 1 1 A 136 136 CYS CA C 136 60.028 58.656 1.372 1
1 1466 . 15 1 1 A 136 136 CYS CB C 136 30.350 28.191 2.159 1
1 1467 . 15 1 1 A 136 136 CYS N N 136 126.055 125.630 0.425 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 122 1.387 1
2 1 1 1 "RMS(OBS, PRED)" CA 126 1.755 1
3 1 1 1 "RMS(OBS, PRED)" CB 117 1.815 1
4 1 1 1 "RMS(OBS, PRED)" H 122 0.744 1
5 1 1 1 "RMS(OBS, PRED)" HA 135 0.330 1
6 1 1 1 "RMS(OBS, PRED)" N 122 3.887 1
7 1 2 1 "RMS(OBS, PRED)" C 122 1.329 1
8 1 2 1 "RMS(OBS, PRED)" CA 126 1.800 1
9 1 2 1 "RMS(OBS, PRED)" CB 117 1.793 1
10 1 2 1 "RMS(OBS, PRED)" H 122 0.765 1
11 1 2 1 "RMS(OBS, PRED)" HA 135 0.341 1
12 1 2 1 "RMS(OBS, PRED)" N 122 3.819 1
13 1 3 1 "RMS(OBS, PRED)" C 122 1.399 1
14 1 3 1 "RMS(OBS, PRED)" CA 126 1.725 1
15 1 3 1 "RMS(OBS, PRED)" CB 117 1.725 1
16 1 3 1 "RMS(OBS, PRED)" H 122 0.757 1
17 1 3 1 "RMS(OBS, PRED)" HA 135 0.340 1
18 1 3 1 "RMS(OBS, PRED)" N 122 3.958 1
19 1 4 1 "RMS(OBS, PRED)" C 122 1.412 1
20 1 4 1 "RMS(OBS, PRED)" CA 126 1.663 1
21 1 4 1 "RMS(OBS, PRED)" CB 117 1.976 1
22 1 4 1 "RMS(OBS, PRED)" H 122 0.762 1
23 1 4 1 "RMS(OBS, PRED)" HA 135 0.339 1
24 1 4 1 "RMS(OBS, PRED)" N 122 3.832 1
25 1 5 1 "RMS(OBS, PRED)" C 122 1.378 1
26 1 5 1 "RMS(OBS, PRED)" CA 126 1.771 1
27 1 5 1 "RMS(OBS, PRED)" CB 117 1.880 1
28 1 5 1 "RMS(OBS, PRED)" H 122 0.788 1
29 1 5 1 "RMS(OBS, PRED)" HA 135 0.322 1
30 1 5 1 "RMS(OBS, PRED)" N 122 3.832 1
31 1 6 1 "RMS(OBS, PRED)" C 122 1.446 1
32 1 6 1 "RMS(OBS, PRED)" CA 126 1.778 1
33 1 6 1 "RMS(OBS, PRED)" CB 117 1.826 1
34 1 6 1 "RMS(OBS, PRED)" H 122 0.754 1
35 1 6 1 "RMS(OBS, PRED)" HA 135 0.360 1
36 1 6 1 "RMS(OBS, PRED)" N 122 4.041 1
37 1 7 1 "RMS(OBS, PRED)" C 122 1.480 1
38 1 7 1 "RMS(OBS, PRED)" CA 126 1.677 1
39 1 7 1 "RMS(OBS, PRED)" CB 117 1.936 1
40 1 7 1 "RMS(OBS, PRED)" H 122 0.764 1
41 1 7 1 "RMS(OBS, PRED)" HA 135 0.375 1
42 1 7 1 "RMS(OBS, PRED)" N 122 3.943 1
43 1 8 1 "RMS(OBS, PRED)" C 122 1.402 1
44 1 8 1 "RMS(OBS, PRED)" CA 126 1.738 1
45 1 8 1 "RMS(OBS, PRED)" CB 117 1.772 1
46 1 8 1 "RMS(OBS, PRED)" H 122 0.771 1
47 1 8 1 "RMS(OBS, PRED)" HA 135 0.333 1
48 1 8 1 "RMS(OBS, PRED)" N 122 3.916 1
49 1 9 1 "RMS(OBS, PRED)" C 122 1.378 1
50 1 9 1 "RMS(OBS, PRED)" CA 126 1.788 1
51 1 9 1 "RMS(OBS, PRED)" CB 117 1.930 1
52 1 9 1 "RMS(OBS, PRED)" H 122 0.771 1
53 1 9 1 "RMS(OBS, PRED)" HA 135 0.369 1
54 1 9 1 "RMS(OBS, PRED)" N 122 3.983 1
55 1 10 1 "RMS(OBS, PRED)" C 122 1.305 1
56 1 10 1 "RMS(OBS, PRED)" CA 126 1.817 1
57 1 10 1 "RMS(OBS, PRED)" CB 117 1.911 1
58 1 10 1 "RMS(OBS, PRED)" H 122 0.760 1
59 1 10 1 "RMS(OBS, PRED)" HA 135 0.335 1
60 1 10 1 "RMS(OBS, PRED)" N 122 3.754 1
61 1 11 1 "RMS(OBS, PRED)" C 122 1.363 1
62 1 11 1 "RMS(OBS, PRED)" CA 126 1.698 1
63 1 11 1 "RMS(OBS, PRED)" CB 117 1.771 1
64 1 11 1 "RMS(OBS, PRED)" H 122 0.751 1
65 1 11 1 "RMS(OBS, PRED)" HA 135 0.319 1
66 1 11 1 "RMS(OBS, PRED)" N 122 3.971 1
67 1 12 1 "RMS(OBS, PRED)" C 122 1.333 1
68 1 12 1 "RMS(OBS, PRED)" CA 126 1.854 1
69 1 12 1 "RMS(OBS, PRED)" CB 117 1.838 1
70 1 12 1 "RMS(OBS, PRED)" H 122 0.779 1
71 1 12 1 "RMS(OBS, PRED)" HA 135 0.410 1
72 1 12 1 "RMS(OBS, PRED)" N 122 3.811 1
73 1 13 1 "RMS(OBS, PRED)" C 122 1.329 1
74 1 13 1 "RMS(OBS, PRED)" CA 126 1.746 1
75 1 13 1 "RMS(OBS, PRED)" CB 117 1.814 1
76 1 13 1 "RMS(OBS, PRED)" H 122 0.795 1
77 1 13 1 "RMS(OBS, PRED)" HA 135 0.366 1
78 1 13 1 "RMS(OBS, PRED)" N 122 3.824 1
79 1 14 1 "RMS(OBS, PRED)" C 122 1.357 1
80 1 14 1 "RMS(OBS, PRED)" CA 126 1.834 1
81 1 14 1 "RMS(OBS, PRED)" CB 117 1.827 1
82 1 14 1 "RMS(OBS, PRED)" H 122 0.775 1
83 1 14 1 "RMS(OBS, PRED)" HA 135 0.350 1
84 1 14 1 "RMS(OBS, PRED)" N 122 3.884 1
85 1 15 1 "RMS(OBS, PRED)" C 122 1.415 1
86 1 15 1 "RMS(OBS, PRED)" CA 126 1.753 1
87 1 15 1 "RMS(OBS, PRED)" CB 117 1.824 1
88 1 15 1 "RMS(OBS, PRED)" H 122 0.776 1
89 1 15 1 "RMS(OBS, PRED)" HA 135 0.369 1
90 1 15 1 "RMS(OBS, PRED)" N 122 3.836 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 10 . 1 1 A 2 2 ALA H H 2 8.220 8.339 -0.119 2
1 11 . 1 1 A 2 2 ALA HA H 2 4.321 4.661 -0.340 2
1 15 . 1 1 A 2 2 ALA C C 2 177.564 176.322 1.242 2
1 16 . 1 1 A 2 2 ALA CA C 2 52.383 51.548 0.835 2
1 17 . 1 1 A 2 2 ALA CB C 2 19.290 20.497 -1.207 2
1 18 . 1 1 A 2 2 ALA N N 2 125.223 124.297 0.926 2
1 19 . 1 1 A 3 3 ALA H H 3 8.246 8.487 -0.241 2
1 20 . 1 1 A 3 3 ALA N N 3 123.250 124.282 -1.032 2
1 21 . 1 1 A 5 5 ALA HA H 5 4.415 4.679 -0.264 2
1 25 . 1 1 A 5 5 ALA C C 5 177.481 176.608 0.873 2
1 26 . 1 1 A 5 5 ALA CA C 5 52.423 51.817 0.606 2
1 27 . 1 1 A 5 5 ALA CB C 5 19.420 20.530 -1.110 2
1 28 . 1 1 A 6 6 ARG H H 6 8.239 8.626 -0.387 2
1 29 . 1 1 A 6 6 ARG HA H 6 4.371 4.682 -0.311 2
1 36 . 1 1 A 6 6 ARG C C 6 176.180 175.513 0.667 2
1 37 . 1 1 A 6 6 ARG CA C 6 56.353 55.334 1.019 2
1 38 . 1 1 A 6 6 ARG CB C 6 31.170 31.110 0.060 2
1 41 . 1 1 A 6 6 ARG N N 6 120.436 120.978 -0.542 2
1 42 . 1 1 A 7 7 GLU H H 7 8.535 8.606 -0.071 2
1 43 . 1 1 A 7 7 GLU HA H 7 4.335 4.597 -0.262 2
1 48 . 1 1 A 7 7 GLU C C 7 176.346 175.691 0.655 2
1 49 . 1 1 A 7 7 GLU CA C 7 56.740 56.169 0.571 2
1 50 . 1 1 A 7 7 GLU CB C 7 30.390 30.886 -0.496 2
1 52 . 1 1 A 7 7 GLU N N 7 122.189 121.653 0.536 2
1 53 . 1 1 A 8 8 ASP H H 8 8.347 8.350 -0.003 2
1 54 . 1 1 A 8 8 ASP N N 8 121.112 122.020 -0.908 2
1 55 . 1 1 A 9 9 GLY HA2 H 9 3.975 4.103 -0.128 2
1 56 . 1 1 A 9 9 GLY HA3 H 9 3.975 4.104 -0.129 2
1 57 . 1 1 A 9 9 GLY C C 9 174.243 173.203 1.040 2
1 58 . 1 1 A 9 9 GLY CA C 9 45.933 45.857 0.076 2
1 59 . 1 1 A 10 10 ALA H H 10 8.111 8.281 -0.170 2
1 60 . 1 1 A 10 10 ALA N N 10 123.721 124.410 -0.689 2
1 61 . 1 1 A 12 12 GLY HA2 H 12 3.992 4.151 -0.159 2
1 62 . 1 1 A 12 12 GLY HA3 H 12 3.992 4.152 -0.160 2
1 63 . 1 1 A 12 12 GLY C C 12 173.883 172.825 1.058 2
1 64 . 1 1 A 12 12 GLY CA C 12 45.381 45.325 0.056 2
1 65 . 1 1 A 13 13 GLU H H 13 8.224 8.628 -0.404 2
1 66 . 1 1 A 13 13 GLU HA H 13 4.367 4.755 -0.388 2
1 71 . 1 1 A 13 13 GLU C C 13 176.125 175.348 0.777 2
1 72 . 1 1 A 13 13 GLU CA C 13 56.349 55.703 0.646 2
1 73 . 1 1 A 13 13 GLU CB C 13 29.560 31.573 -2.013 2
1 75 . 1 1 A 13 13 GLU N N 13 120.148 120.649 -0.501 2
1 76 . 1 1 A 14 14 GLU H H 14 8.508 8.492 0.016 2
1 77 . 1 1 A 14 14 GLU HA H 14 4.302 4.678 -0.376 2
1 82 . 1 1 A 14 14 GLU C C 14 176.623 175.567 1.056 2
1 83 . 1 1 A 14 14 GLU CA C 14 56.497 56.067 0.430 2
1 84 . 1 1 A 14 14 GLU CB C 14 30.110 31.441 -1.331 2
1 86 . 1 1 A 14 14 GLU N N 14 122.160 121.923 0.237 2
1 87 . 1 1 A 15 15 ARG H H 15 8.356 8.542 -0.186 2
1 88 . 1 1 A 15 15 ARG HA H 15 4.366 4.641 -0.275 2
1 95 . 1 1 A 15 15 ARG C C 15 176.844 176.090 0.754 2
1 96 . 1 1 A 15 15 ARG CA C 15 56.010 55.684 0.326 2
1 97 . 1 1 A 15 15 ARG CB C 15 30.890 31.810 -0.920 2
1 100 . 1 1 A 15 15 ARG N N 15 121.945 123.819 -1.874 2
1 101 . 1 1 A 16 16 GLY H H 16 8.414 8.338 0.076 2
1 102 . 1 1 A 16 16 GLY HA2 H 16 4.022 4.039 -0.017 2
1 103 . 1 1 A 16 16 GLY HA3 H 16 4.022 4.042 -0.020 2
1 104 . 1 1 A 16 16 GLY C C 16 174.326 173.904 0.422 2
1 105 . 1 1 A 16 16 GLY CA C 16 45.620 45.942 -0.322 2
1 106 . 1 1 A 16 16 GLY N N 16 109.734 110.380 -0.646 2
1 107 . 1 1 A 17 17 GLN H H 17 8.184 8.214 -0.030 2
1 108 . 1 1 A 17 17 GLN HA H 17 4.366 4.545 -0.179 2
1 113 . 1 1 A 17 17 GLN C C 17 175.544 175.379 0.165 2
1 114 . 1 1 A 17 17 GLN CA C 17 55.749 55.724 0.025 2
1 115 . 1 1 A 17 17 GLN CB C 17 29.367 29.917 -0.550 2
1 117 . 1 1 A 17 17 GLN N N 17 119.546 121.067 -1.521 2
1 118 . 1 1 A 18 18 ARG H H 18 8.366 8.358 0.008 2
1 119 . 1 1 A 18 18 ARG HA H 18 4.487 4.775 -0.288 2
1 126 . 1 1 A 18 18 ARG C C 18 176.042 175.508 0.534 2
1 127 . 1 1 A 18 18 ARG CA C 18 55.735 54.930 0.805 2
1 128 . 1 1 A 18 18 ARG CB C 18 31.170 32.508 -1.338 2
1 131 . 1 1 A 18 18 ARG N N 18 122.330 120.215 2.115 2
1 132 . 1 1 A 19 19 GLY H H 19 8.192 8.397 -0.205 2
1 133 . 1 1 A 19 19 GLY HA2 H 19 4.852 4.111 0.741 2
1 134 . 1 1 A 19 19 GLY HA3 H 19 3.894 4.124 -0.230 2
1 135 . 1 1 A 19 19 GLY C C 19 172.361 171.805 0.556 2
1 136 . 1 1 A 19 19 GLY CA C 19 45.580 44.798 0.782 2
1 137 . 1 1 A 19 19 GLY N N 19 109.658 108.183 1.475 2
1 138 . 1 1 A 20 20 CYS H H 20 8.843 8.136 0.707 2
1 139 . 1 1 A 20 20 CYS HA H 20 5.147 5.095 0.052 2
1 142 . 1 1 A 20 20 CYS C C 20 175.211 174.731 0.480 2
1 143 . 1 1 A 20 20 CYS CA C 20 56.712 58.192 -1.480 2
1 144 . 1 1 A 20 20 CYS CB C 20 33.530 30.932 2.598 2
1 145 . 1 1 A 20 20 CYS N N 20 120.185 118.774 1.411 2
1 146 . 1 1 A 21 21 GLU H H 21 8.981 8.923 0.058 2
1 147 . 1 1 A 21 21 GLU HA H 21 4.100 4.028 0.072 2
1 152 . 1 1 A 21 21 GLU C C 21 176.014 177.950 -1.936 2
1 153 . 1 1 A 21 21 GLU CA C 21 57.134 58.741 -1.607 2
1 154 . 1 1 A 21 21 GLU CB C 21 28.890 28.913 -0.023 2
1 156 . 1 1 A 21 21 GLU N N 21 116.078 124.632 -8.554 2
1 157 . 1 1 A 22 22 HIS H H 22 9.342 7.676 1.666 2
1 158 . 1 1 A 22 22 HIS HA H 22 4.210 4.237 -0.027 2
1 161 . 1 1 A 22 22 HIS C C 22 175.128 174.737 0.391 2
1 162 . 1 1 A 22 22 HIS CA C 22 58.945 58.439 0.506 2
1 163 . 1 1 A 22 22 HIS CB C 22 33.160 30.653 2.507 2
1 164 . 1 1 A 22 22 HIS N N 22 122.296 117.556 4.740 2
1 165 . 1 1 A 23 23 TYR H H 23 7.931 7.785 0.146 2
1 166 . 1 1 A 23 23 TYR HA H 23 4.856 5.193 -0.337 2
1 171 . 1 1 A 23 23 TYR C C 23 173.108 174.458 -1.350 2
1 172 . 1 1 A 23 23 TYR CA C 23 57.852 56.225 1.627 2
1 173 . 1 1 A 23 23 TYR CB C 23 45.300 41.690 3.610 2
1 175 . 1 1 A 23 23 TYR N N 23 115.205 115.396 -0.191 2
1 176 . 1 1 A 24 24 ASP H H 24 8.384 8.817 -0.433 2
1 177 . 1 1 A 24 24 ASP HA H 24 5.160 5.012 0.148 2
1 180 . 1 1 A 24 24 ASP C C 24 174.437 175.247 -0.810 2
1 181 . 1 1 A 24 24 ASP CA C 24 53.343 53.784 -0.441 2
1 182 . 1 1 A 24 24 ASP CB C 24 41.470 40.217 1.253 2
1 183 . 1 1 A 24 24 ASP N N 24 122.016 124.742 -2.726 2
1 184 . 1 1 A 25 25 ARG H H 25 7.313 8.286 -0.973 2
1 185 . 1 1 A 25 25 ARG HA H 25 5.331 5.200 0.131 2
1 192 . 1 1 A 25 25 ARG C C 25 175.045 175.848 -0.803 2
1 193 . 1 1 A 25 25 ARG CA C 25 54.224 54.604 -0.380 2
1 194 . 1 1 A 25 25 ARG CB C 25 34.090 33.933 0.157 2
1 197 . 1 1 A 25 25 ARG N N 25 115.898 121.959 -6.061 2
1 198 . 1 1 A 26 26 GLY H H 26 9.387 8.856 0.531 2
1 199 . 1 1 A 26 26 GLY HA2 H 26 4.622 3.855 0.767 2
1 200 . 1 1 A 26 26 GLY HA3 H 26 3.788 3.920 -0.132 2
1 201 . 1 1 A 26 26 GLY C C 26 170.978 173.772 -2.794 2
1 202 . 1 1 A 26 26 GLY CA C 26 44.794 45.848 -1.054 2
1 203 . 1 1 A 26 26 GLY N N 26 105.653 108.451 -2.798 2
1 204 . 1 1 A 27 27 CYS H H 27 6.864 7.587 -0.723 2
1 205 . 1 1 A 27 27 CYS HA H 27 5.195 5.079 0.116 2
1 208 . 1 1 A 27 27 CYS C C 27 171.144 172.698 -1.554 2
1 209 . 1 1 A 27 27 CYS CA C 27 52.349 57.455 -5.106 2
1 210 . 1 1 A 27 27 CYS CB C 27 30.997 31.502 -0.505 2
1 211 . 1 1 A 27 27 CYS N N 27 110.921 117.254 -6.333 2
1 212 . 1 1 A 28 28 LEU H H 28 8.310 8.685 -0.375 2
1 213 . 1 1 A 28 28 LEU HA H 28 4.651 4.968 -0.317 2
1 223 . 1 1 A 28 28 LEU C C 28 176.827 176.541 0.286 2
1 224 . 1 1 A 28 28 LEU CA C 28 53.054 53.373 -0.319 2
1 225 . 1 1 A 28 28 LEU CB C 28 44.200 44.263 -0.063 2
1 229 . 1 1 A 28 28 LEU N N 28 115.519 122.463 -6.944 2
1 230 . 1 1 A 29 29 LEU H H 29 8.800 8.734 0.066 2
1 231 . 1 1 A 29 29 LEU HA H 29 4.313 4.462 -0.149 2
1 240 . 1 1 A 29 29 LEU C C 29 175.571 176.134 -0.563 2
1 241 . 1 1 A 29 29 LEU CA C 29 54.388 54.506 -0.118 2
1 242 . 1 1 A 29 29 LEU CB C 29 42.780 41.894 0.886 2
1 245 . 1 1 A 29 29 LEU N N 29 118.712 124.605 -5.893 2
1 246 . 1 1 A 30 30 LYS H H 30 8.009 8.526 -0.517 2
1 247 . 1 1 A 30 30 LYS HA H 30 4.592 4.746 -0.154 2
1 256 . 1 1 A 30 30 LYS C C 30 174.990 175.142 -0.152 2
1 257 . 1 1 A 30 30 LYS CA C 30 54.999 56.164 -1.165 2
1 258 . 1 1 A 30 30 LYS CB C 30 32.330 32.964 -0.634 2
1 262 . 1 1 A 30 30 LYS N N 30 122.310 125.865 -3.555 2
1 263 . 1 1 A 31 31 ALA H H 31 9.238 8.545 0.693 2
1 264 . 1 1 A 31 31 ALA HA H 31 4.477 4.432 0.045 2
1 268 . 1 1 A 31 31 ALA CA C 31 50.190 49.750 0.440 2
1 269 . 1 1 A 31 31 ALA CB C 31 21.637 19.887 1.750 2
1 270 . 1 1 A 31 31 ALA N N 31 133.864 130.126 3.738 2
1 271 . 1 1 A 32 32 PRO HA H 32 4.637 4.439 0.198 2
1 278 . 1 1 A 32 32 PRO C C 32 175.737 177.322 -1.585 2
1 279 . 1 1 A 32 32 PRO CA C 32 64.259 64.246 0.013 2
1 280 . 1 1 A 32 32 PRO CB C 32 31.740 31.853 -0.113 2
1 283 . 1 1 A 33 33 CYS H H 33 8.779 8.295 0.484 2
1 284 . 1 1 A 33 33 CYS HA H 33 4.321 4.273 0.048 2
1 287 . 1 1 A 33 33 CYS C C 33 176.733 175.349 1.384 2
1 288 . 1 1 A 33 33 CYS CA C 33 54.398 61.331 -6.933 2
1 289 . 1 1 A 33 33 CYS CB C 33 30.697 27.317 3.380 2
1 290 . 1 1 A 33 33 CYS N N 33 120.005 116.265 3.740 2
1 291 . 1 1 A 34 34 CYS H H 34 7.424 7.610 -0.186 2
1 292 . 1 1 A 34 34 CYS HA H 34 4.896 4.688 0.208 2
1 295 . 1 1 A 34 34 CYS C C 34 174.935 174.579 0.356 2
1 296 . 1 1 A 34 34 CYS CA C 34 56.962 58.612 -1.650 2
1 297 . 1 1 A 34 34 CYS CB C 34 31.067 29.628 1.439 2
1 298 . 1 1 A 34 34 CYS N N 34 115.034 118.152 -3.118 2
1 299 . 1 1 A 35 35 ASP H H 35 8.368 8.096 0.272 2
1 300 . 1 1 A 35 35 ASP HA H 35 4.454 4.236 0.218 2
1 303 . 1 1 A 35 35 ASP C C 35 174.354 174.877 -0.523 2
1 304 . 1 1 A 35 35 ASP CA C 35 56.222 55.530 0.692 2
1 305 . 1 1 A 35 35 ASP CB C 35 39.730 39.657 0.073 2
1 306 . 1 1 A 35 35 ASP N N 35 121.381 117.923 3.458 2
1 307 . 1 1 A 36 36 LYS H H 36 7.227 7.673 -0.446 2
1 308 . 1 1 A 36 36 LYS HA H 36 4.451 4.607 -0.156 2
1 317 . 1 1 A 36 36 LYS C C 36 175.433 175.681 -0.248 2
1 318 . 1 1 A 36 36 LYS CA C 36 56.270 55.073 1.197 2
1 319 . 1 1 A 36 36 LYS CB C 36 36.620 34.186 2.434 2
1 323 . 1 1 A 36 36 LYS N N 36 117.673 118.507 -0.834 2
1 324 . 1 1 A 37 37 LEU H H 37 8.053 8.384 -0.331 2
1 325 . 1 1 A 37 37 LEU HA H 37 5.292 4.977 0.315 2
1 335 . 1 1 A 37 37 LEU C C 37 176.484 175.055 1.429 2
1 336 . 1 1 A 37 37 LEU CA C 37 53.348 53.002 0.346 2
1 337 . 1 1 A 37 37 LEU CB C 37 42.400 43.051 -0.651 2
1 341 . 1 1 A 37 37 LEU N N 37 120.994 122.219 -1.225 2
1 342 . 1 1 A 38 38 TYR H H 38 8.741 8.729 0.012 2
1 343 . 1 1 A 38 38 TYR HA H 38 5.002 4.873 0.129 2
1 350 . 1 1 A 38 38 TYR C C 38 176.374 176.014 0.360 2
1 351 . 1 1 A 38 38 TYR CA C 38 57.081 56.840 0.241 2
1 352 . 1 1 A 38 38 TYR CB C 38 45.647 41.788 3.859 2
1 355 . 1 1 A 38 38 TYR N N 38 121.128 122.269 -1.141 2
1 356 . 1 1 A 39 39 THR H H 39 9.402 8.767 0.635 2
1 357 . 1 1 A 39 39 THR HA H 39 4.098 4.108 -0.010 2
1 362 . 1 1 A 39 39 THR C C 39 173.496 175.021 -1.525 2
1 363 . 1 1 A 39 39 THR CA C 39 67.062 65.672 1.390 2
1 364 . 1 1 A 39 39 THR CB C 39 68.047 68.584 -0.537 2
1 366 . 1 1 A 39 39 THR N N 39 116.641 117.694 -1.053 2
1 367 . 1 1 A 40 40 CYS H H 40 7.317 8.002 -0.685 2
1 368 . 1 1 A 40 40 CYS HA H 40 4.771 4.863 -0.092 2
1 371 . 1 1 A 40 40 CYS C C 40 175.128 175.231 -0.103 2
1 372 . 1 1 A 40 40 CYS CA C 40 56.577 57.896 -1.319 2
1 373 . 1 1 A 40 40 CYS CB C 40 35.087 30.738 4.349 2
1 374 . 1 1 A 40 40 CYS N N 40 109.059 118.480 -9.421 2
1 375 . 1 1 A 41 41 ARG H H 41 9.201 8.865 0.336 2
1 376 . 1 1 A 41 41 ARG HA H 41 3.982 3.971 0.011 2
1 383 . 1 1 A 41 41 ARG C C 41 175.101 177.816 -2.715 2
1 384 . 1 1 A 41 41 ARG CA C 41 58.591 58.921 -0.330 2
1 385 . 1 1 A 41 41 ARG CB C 41 29.640 29.783 -0.143 2
1 388 . 1 1 A 41 41 ARG N N 41 121.737 124.252 -2.515 2
1 389 . 1 1 A 42 42 LEU H H 42 9.116 7.752 1.364 2
1 390 . 1 1 A 42 42 LEU HA H 42 4.029 4.043 -0.014 2
1 400 . 1 1 A 42 42 LEU C C 42 179.943 179.279 0.664 2
1 401 . 1 1 A 42 42 LEU CA C 42 58.005 57.654 0.351 2
1 402 . 1 1 A 42 42 LEU CB C 42 38.960 41.110 -2.150 2
1 406 . 1 1 A 42 42 LEU N N 42 126.364 116.956 9.408 2
1 407 . 1 1 A 43 43 CYS H H 43 8.785 8.228 0.557 2
1 408 . 1 1 A 43 43 CYS HA H 43 4.187 4.198 -0.011 2
1 411 . 1 1 A 43 43 CYS C C 43 177.785 177.153 0.632 2
1 412 . 1 1 A 43 43 CYS CA C 43 66.415 62.693 3.722 2
1 413 . 1 1 A 43 43 CYS CB C 43 28.870 27.100 1.770 2
1 414 . 1 1 A 43 43 CYS N N 43 124.519 117.725 6.794 2
1 415 . 1 1 A 44 44 HIS H H 44 7.604 7.437 0.167 2
1 416 . 1 1 A 44 44 HIS HA H 44 1.983 2.845 -0.862 2
1 420 . 1 1 A 44 44 HIS C C 44 176.429 176.268 0.161 2
1 421 . 1 1 A 44 44 HIS CA C 44 58.760 58.813 -0.053 2
1 422 . 1 1 A 44 44 HIS CB C 44 27.990 29.400 -1.410 2
1 423 . 1 1 A 44 44 HIS N N 44 117.024 121.061 -4.037 2
1 424 . 1 1 A 45 45 ASP H H 45 8.750 8.099 0.651 2
1 425 . 1 1 A 45 45 ASP HA H 45 4.116 4.161 -0.045 2
1 428 . 1 1 A 45 45 ASP C C 45 177.453 178.162 -0.709 2
1 429 . 1 1 A 45 45 ASP CA C 45 56.840 57.379 -0.539 2
1 430 . 1 1 A 45 45 ASP CB C 45 38.960 41.616 -2.656 2
1 431 . 1 1 A 45 45 ASP N N 45 120.440 118.938 1.502 2
1 432 . 1 1 A 46 46 ASN H H 46 7.888 8.124 -0.236 2
1 433 . 1 1 A 46 46 ASN HA H 46 4.612 4.420 0.192 2
1 438 . 1 1 A 46 46 ASN C C 46 175.903 176.733 -0.830 2
1 439 . 1 1 A 46 46 ASN CA C 46 54.342 56.549 -2.207 2
1 440 . 1 1 A 46 46 ASN CB C 46 38.790 39.200 -0.410 2
1 441 . 1 1 A 46 46 ASN N N 46 115.758 117.119 -1.361 2
1 443 . 1 1 A 47 47 ASN H H 47 7.384 7.431 -0.047 2
1 444 . 1 1 A 47 47 ASN HA H 47 4.893 4.693 0.200 2
1 449 . 1 1 A 47 47 ASN C C 47 173.579 175.369 -1.790 2
1 450 . 1 1 A 47 47 ASN CA C 47 53.937 54.334 -0.397 2
1 451 . 1 1 A 47 47 ASN CB C 47 43.130 39.469 3.661 2
1 452 . 1 1 A 47 47 ASN N N 47 116.576 115.000 1.576 2
1 454 . 1 1 A 48 48 GLU H H 48 7.143 7.453 -0.310 2
1 455 . 1 1 A 48 48 GLU HA H 48 4.572 4.515 0.057 2
1 460 . 1 1 A 48 48 GLU C C 48 175.627 176.264 -0.637 2
1 461 . 1 1 A 48 48 GLU CA C 48 53.727 54.590 -0.863 2
1 462 . 1 1 A 48 48 GLU CB C 48 32.480 31.010 1.470 2
1 464 . 1 1 A 48 48 GLU N N 48 116.967 117.522 -0.555 2
1 465 . 1 1 A 49 49 ASP H H 49 8.748 8.764 -0.016 2
1 466 . 1 1 A 49 49 ASP HA H 49 4.576 4.578 -0.002 2
1 469 . 1 1 A 49 49 ASP C C 49 174.796 175.861 -1.065 2
1 470 . 1 1 A 49 49 ASP CA C 49 53.027 55.691 -2.664 2
1 471 . 1 1 A 49 49 ASP CB C 49 40.340 41.614 -1.274 2
1 472 . 1 1 A 49 49 ASP N N 49 119.296 121.016 -1.720 2
1 473 . 1 1 A 50 50 HIS H H 50 6.919 7.339 -0.420 2
1 474 . 1 1 A 50 50 HIS HA H 50 4.880 5.171 -0.291 2
1 477 . 1 1 A 50 50 HIS C C 50 172.942 173.834 -0.892 2
1 478 . 1 1 A 50 50 HIS CA C 50 53.978 53.515 0.463 2
1 479 . 1 1 A 50 50 HIS CB C 50 30.330 32.569 -2.239 2
1 480 . 1 1 A 50 50 HIS N N 50 113.709 114.619 -0.910 2
1 481 . 1 1 A 51 51 GLN H H 51 8.646 8.570 0.076 2
1 482 . 1 1 A 51 51 GLN HA H 51 4.896 4.732 0.164 2
1 487 . 1 1 A 51 51 GLN C C 51 176.512 174.774 1.738 2
1 488 . 1 1 A 51 51 GLN CA C 51 54.872 55.208 -0.336 2
1 489 . 1 1 A 51 51 GLN CB C 51 30.950 30.194 0.756 2
1 491 . 1 1 A 51 51 GLN N N 51 119.379 118.760 0.619 2
1 492 . 1 1 A 52 52 LEU H H 52 9.646 8.518 1.128 2
1 493 . 1 1 A 52 52 LEU HA H 52 4.206 4.599 -0.393 2
1 503 . 1 1 A 52 52 LEU C C 52 175.793 174.634 1.159 2
1 504 . 1 1 A 52 52 LEU CA C 52 55.450 53.857 1.593 2
1 505 . 1 1 A 52 52 LEU CB C 52 41.407 43.407 -2.000 2
1 509 . 1 1 A 52 52 LEU N N 52 128.069 125.049 3.020 2
1 510 . 1 1 A 53 53 ASP H H 53 9.281 8.664 0.617 2
1 511 . 1 1 A 53 53 ASP HA H 53 4.725 4.788 -0.063 2
1 514 . 1 1 A 53 53 ASP C C 53 176.401 177.290 -0.889 2
1 515 . 1 1 A 53 53 ASP CA C 53 52.590 53.637 -1.047 2
1 516 . 1 1 A 53 53 ASP CB C 53 39.990 42.018 -2.028 2
1 517 . 1 1 A 53 53 ASP N N 53 128.783 127.070 1.713 2
1 518 . 1 1 A 54 54 ARG H H 54 8.496 8.566 -0.070 2
1 519 . 1 1 A 54 54 ARG HA H 54 3.859 3.882 -0.023 2
1 526 . 1 1 A 54 54 ARG C C 54 176.346 176.789 -0.443 2
1 527 . 1 1 A 54 54 ARG CA C 54 57.357 58.034 -0.677 2
1 528 . 1 1 A 54 54 ARG CB C 54 28.890 29.393 -0.503 2
1 531 . 1 1 A 54 54 ARG N N 54 125.813 124.784 1.029 2
1 532 . 1 1 A 55 55 PHE H H 55 8.005 7.432 0.573 2
1 533 . 1 1 A 55 55 PHE HA H 55 4.712 4.423 0.289 2
1 540 . 1 1 A 55 55 PHE C C 55 177.481 177.644 -0.163 2
1 541 . 1 1 A 55 55 PHE CA C 55 59.080 60.285 -1.205 2
1 542 . 1 1 A 55 55 PHE CB C 55 37.447 39.313 -1.866 2
1 545 . 1 1 A 55 55 PHE N N 55 120.168 117.779 2.389 2
1 546 . 1 1 A 56 56 LYS H H 56 7.681 7.461 0.220 2
1 547 . 1 1 A 56 56 LYS HA H 56 4.411 4.309 0.102 2
1 556 . 1 1 A 56 56 LYS C C 56 175.959 176.527 -0.568 2
1 557 . 1 1 A 56 56 LYS CA C 56 55.459 57.554 -2.095 2
1 558 . 1 1 A 56 56 LYS CB C 56 33.590 33.079 0.511 2
1 562 . 1 1 A 56 56 LYS N N 56 116.937 117.565 -0.628 2
1 563 . 1 1 A 57 57 VAL H H 57 6.553 7.094 -0.541 2
1 564 . 1 1 A 57 57 VAL HA H 57 3.408 3.915 -0.507 2
1 572 . 1 1 A 57 57 VAL C C 57 173.911 175.458 -1.547 2
1 573 . 1 1 A 57 57 VAL CA C 57 65.025 61.956 3.069 2
1 574 . 1 1 A 57 57 VAL CB C 57 32.663 31.966 0.697 2
1 577 . 1 1 A 57 57 VAL N N 57 119.519 117.600 1.919 2
1 578 . 1 1 A 58 58 LYS H H 58 9.182 8.890 0.292 2
1 579 . 1 1 A 58 58 LYS HA H 58 4.489 4.443 0.046 2
1 588 . 1 1 A 58 58 LYS C C 58 176.927 176.133 0.794 2
1 589 . 1 1 A 58 58 LYS CA C 58 55.913 57.531 -1.618 2
1 590 . 1 1 A 58 58 LYS CB C 58 36.340 34.693 1.647 2
1 594 . 1 1 A 58 58 LYS N N 58 124.985 125.972 -0.987 2
1 595 . 1 1 A 59 59 GLU H H 59 8.799 7.849 0.950 2
1 596 . 1 1 A 59 59 GLU HA H 59 5.209 4.821 0.388 2
1 601 . 1 1 A 59 59 GLU C C 59 173.911 175.546 -1.635 2
1 602 . 1 1 A 59 59 GLU CA C 59 54.670 54.982 -0.312 2
1 603 . 1 1 A 59 59 GLU CB C 59 35.180 32.180 3.000 2
1 605 . 1 1 A 59 59 GLU N N 59 121.493 117.581 3.912 2
1 606 . 1 1 A 60 60 VAL H H 60 8.917 8.825 0.092 2
1 607 . 1 1 A 60 60 VAL HA H 60 4.983 5.040 -0.057 2
1 615 . 1 1 A 60 60 VAL C C 60 173.441 174.056 -0.615 2
1 616 . 1 1 A 60 60 VAL CA C 60 57.497 59.058 -1.561 2
1 617 . 1 1 A 60 60 VAL CB C 60 35.460 36.247 -0.787 2
1 620 . 1 1 A 60 60 VAL N N 60 109.266 117.542 -8.276 2
1 621 . 1 1 A 61 61 GLN H H 61 8.970 8.497 0.473 2
1 622 . 1 1 A 61 61 GLN HA H 61 5.024 5.134 -0.110 2
1 629 . 1 1 A 61 61 GLN C C 61 175.045 173.940 1.105 2
1 630 . 1 1 A 61 61 GLN CA C 61 53.128 54.077 -0.949 2
1 631 . 1 1 A 61 61 GLN CB C 61 33.980 31.783 2.197 2
1 633 . 1 1 A 61 61 GLN N N 61 118.525 119.579 -1.054 2
1 635 . 1 1 A 62 62 CYS H H 62 7.688 8.560 -0.872 2
1 636 . 1 1 A 62 62 CYS HA H 62 4.210 4.681 -0.471 2
1 639 . 1 1 A 62 62 CYS C C 62 177.951 174.902 3.049 2
1 640 . 1 1 A 62 62 CYS CA C 62 59.845 57.809 2.036 2
1 641 . 1 1 A 62 62 CYS CB C 62 33.120 29.302 3.818 2
1 642 . 1 1 A 62 62 CYS N N 62 128.772 121.054 7.718 2
1 643 . 1 1 A 63 63 ILE H H 63 8.192 8.574 -0.382 2
1 644 . 1 1 A 63 63 ILE HA H 63 3.984 4.142 -0.158 2
1 654 . 1 1 A 63 63 ILE C C 63 175.433 176.550 -1.117 2
1 655 . 1 1 A 63 63 ILE CA C 63 63.657 62.563 1.094 2
1 656 . 1 1 A 63 63 ILE CB C 63 38.506 36.781 1.725 2
1 660 . 1 1 A 63 63 ILE N N 63 127.455 128.146 -0.691 2
1 661 . 1 1 A 64 64 ASN H H 64 9.181 8.244 0.937 2
1 662 . 1 1 A 64 64 ASN HA H 64 4.810 4.850 -0.040 2
1 667 . 1 1 A 64 64 ASN C C 64 175.931 175.620 0.311 2
1 668 . 1 1 A 64 64 ASN CA C 64 55.617 53.668 1.949 2
1 669 . 1 1 A 64 64 ASN CB C 64 40.640 39.105 1.535 2
1 670 . 1 1 A 64 64 ASN N N 64 122.104 120.657 1.447 2
1 672 . 1 1 A 65 65 CYS H H 65 9.065 7.872 1.193 2
1 673 . 1 1 A 65 65 CYS HA H 65 4.979 4.552 0.427 2
1 676 . 1 1 A 65 65 CYS C C 65 176.291 174.839 1.452 2
1 677 . 1 1 A 65 65 CYS CA C 65 59.027 58.886 0.141 2
1 678 . 1 1 A 65 65 CYS CB C 65 32.030 28.680 3.350 2
1 679 . 1 1 A 65 65 CYS N N 65 120.368 117.664 2.704 2
1 680 . 1 1 A 66 66 GLU H H 66 7.281 8.219 -0.938 2
1 681 . 1 1 A 66 66 GLU HA H 66 4.046 4.110 -0.064 2
1 686 . 1 1 A 66 66 GLU C C 66 175.211 175.197 0.014 2
1 687 . 1 1 A 66 66 GLU CA C 66 58.591 57.700 0.891 2
1 688 . 1 1 A 66 66 GLU CB C 66 27.067 27.389 -0.322 2
1 690 . 1 1 A 66 66 GLU N N 66 115.012 116.897 -1.885 2
1 691 . 1 1 A 67 67 LYS H H 67 8.481 7.817 0.664 2
1 692 . 1 1 A 67 67 LYS HA H 67 4.326 4.397 -0.071 2
1 701 . 1 1 A 67 67 LYS C C 67 177.923 175.982 1.941 2
1 702 . 1 1 A 67 67 LYS CA C 67 57.628 56.267 1.361 2
1 703 . 1 1 A 67 67 LYS CB C 67 33.617 33.396 0.221 2
1 707 . 1 1 A 67 67 LYS N N 67 123.514 120.789 2.725 2
1 708 . 1 1 A 68 68 ILE H H 68 8.867 8.491 0.376 2
1 709 . 1 1 A 68 68 ILE HA H 68 4.976 4.529 0.447 2
1 719 . 1 1 A 68 68 ILE C C 68 175.018 175.374 -0.356 2
1 720 . 1 1 A 68 68 ILE CA C 68 60.919 60.725 0.194 2
1 721 . 1 1 A 68 68 ILE CB C 68 37.090 37.349 -0.259 2
1 725 . 1 1 A 68 68 ILE N N 68 133.478 127.009 6.469 2
1 726 . 1 1 A 69 69 GLN H H 69 9.269 8.640 0.629 2
1 727 . 1 1 A 69 69 GLN HA H 69 5.036 5.003 0.033 2
1 732 . 1 1 A 69 69 GLN C C 69 173.607 174.743 -1.136 2
1 733 . 1 1 A 69 69 GLN CA C 69 53.419 53.886 -0.467 2
1 734 . 1 1 A 69 69 GLN CB C 69 34.997 32.327 2.670 2
1 736 . 1 1 A 69 69 GLN N N 69 125.104 124.125 0.979 2
1 737 . 1 1 A 70 70 HIS H H 70 8.829 8.834 -0.005 2
1 738 . 1 1 A 70 70 HIS HA H 70 4.865 4.760 0.105 2
1 741 . 1 1 A 70 70 HIS C C 70 174.852 175.135 -0.283 2
1 742 . 1 1 A 70 70 HIS CA C 70 56.304 56.287 0.017 2
1 743 . 1 1 A 70 70 HIS CB C 70 30.050 30.847 -0.797 2
1 744 . 1 1 A 70 70 HIS N N 70 118.576 119.188 -0.612 2
1 745 . 1 1 A 71 71 ALA H H 71 7.768 8.363 -0.595 2
1 746 . 1 1 A 71 71 ALA HA H 71 3.977 4.521 -0.544 2
1 750 . 1 1 A 71 71 ALA C C 71 175.433 177.114 -1.681 2
1 751 . 1 1 A 71 71 ALA CA C 71 54.393 52.579 1.814 2
1 752 . 1 1 A 71 71 ALA CB C 71 18.000 18.903 -0.903 2
1 753 . 1 1 A 71 71 ALA N N 71 121.438 124.063 -2.625 2
1 754 . 1 1 A 72 72 GLN H H 72 7.227 8.210 -0.983 2
1 755 . 1 1 A 72 72 GLN HA H 72 4.371 4.541 -0.170 2
1 762 . 1 1 A 72 72 GLN C C 72 173.053 175.233 -2.180 2
1 763 . 1 1 A 72 72 GLN CA C 72 54.290 53.974 0.316 2
1 764 . 1 1 A 72 72 GLN CB C 72 28.623 31.143 -2.520 2
1 766 . 1 1 A 72 72 GLN N N 72 115.858 123.108 -7.250 2
1 768 . 1 1 A 73 73 GLN H H 73 8.481 8.499 -0.018 2
1 769 . 1 1 A 73 73 GLN HA H 73 3.570 3.767 -0.197 2
1 776 . 1 1 A 73 73 GLN C C 73 174.243 174.934 -0.691 2
1 777 . 1 1 A 73 73 GLN CA C 73 60.206 57.167 3.039 2
1 778 . 1 1 A 73 73 GLN CB C 73 28.850 29.340 -0.490 2
1 780 . 1 1 A 73 73 GLN N N 73 116.433 120.760 -4.327 2
1 782 . 1 1 A 74 74 THR H H 74 7.211 7.399 -0.188 2
1 783 . 1 1 A 74 74 THR HA H 74 4.160 4.741 -0.581 2
1 788 . 1 1 A 74 74 THR C C 74 171.836 172.695 -0.859 2
1 789 . 1 1 A 74 74 THR CA C 74 59.072 60.476 -1.404 2
1 790 . 1 1 A 74 74 THR CB C 74 71.560 71.847 -0.287 2
1 792 . 1 1 A 74 74 THR N N 74 108.717 110.217 -1.500 2
1 793 . 1 1 A 75 75 CYS H H 75 7.676 8.326 -0.650 2
1 794 . 1 1 A 75 75 CYS HA H 75 4.158 4.596 -0.438 2
1 797 . 1 1 A 75 75 CYS C C 75 178.781 175.869 2.912 2
1 798 . 1 1 A 75 75 CYS CA C 75 58.661 58.608 0.053 2
1 799 . 1 1 A 75 75 CYS CB C 75 30.840 28.360 2.480 2
1 800 . 1 1 A 75 75 CYS N N 75 123.108 124.124 -1.016 2
1 801 . 1 1 A 76 76 GLU H H 76 9.203 8.809 0.394 2
1 802 . 1 1 A 76 76 GLU HA H 76 4.187 4.049 0.138 2
1 807 . 1 1 A 76 76 GLU C C 76 175.488 178.527 -3.039 2
1 808 . 1 1 A 76 76 GLU CA C 76 57.306 58.874 -1.568 2
1 809 . 1 1 A 76 76 GLU CB C 76 29.347 28.966 0.381 2
1 811 . 1 1 A 76 76 GLU N N 76 129.817 127.066 2.751 2
1 812 . 1 1 A 77 77 GLU H H 77 9.496 7.854 1.642 2
1 813 . 1 1 A 77 77 GLU HA H 77 4.599 4.156 0.443 2
1 818 . 1 1 A 77 77 GLU C C 77 177.148 177.289 -0.141 2
1 819 . 1 1 A 77 77 GLU CA C 77 57.554 58.607 -1.053 2
1 820 . 1 1 A 77 77 GLU CB C 77 31.980 30.271 1.709 2
1 822 . 1 1 A 77 77 GLU N N 77 124.795 120.004 4.791 2
1 823 . 1 1 A 78 78 CYS H H 78 8.967 7.498 1.469 2
1 824 . 1 1 A 78 78 CYS HA H 78 5.073 4.611 0.462 2
1 827 . 1 1 A 78 78 CYS C C 78 176.374 174.914 1.460 2
1 828 . 1 1 A 78 78 CYS CA C 78 58.537 58.212 0.325 2
1 829 . 1 1 A 78 78 CYS CB C 78 31.597 28.956 2.641 2
1 830 . 1 1 A 78 78 CYS N N 78 119.692 115.703 3.989 2
1 831 . 1 1 A 79 79 SER H H 79 7.474 8.226 -0.752 2
1 832 . 1 1 A 79 79 SER HA H 79 4.113 4.108 0.005 2
1 835 . 1 1 A 79 79 SER C C 79 172.915 173.367 -0.452 2
1 836 . 1 1 A 79 79 SER CA C 79 60.440 59.401 1.039 2
1 837 . 1 1 A 79 79 SER CB C 79 61.421 61.190 0.231 2
1 838 . 1 1 A 79 79 SER N N 79 113.385 113.202 0.183 2
1 839 . 1 1 A 80 80 THR H H 80 7.907 7.813 0.094 2
1 840 . 1 1 A 80 80 THR HA H 80 3.913 4.214 -0.301 2
1 845 . 1 1 A 80 80 THR C C 80 172.306 173.775 -1.469 2
1 846 . 1 1 A 80 80 THR CA C 80 65.262 63.184 2.078 2
1 847 . 1 1 A 80 80 THR CB C 80 69.910 69.082 0.828 2
1 849 . 1 1 A 80 80 THR N N 80 120.005 115.794 4.211 2
1 850 . 1 1 A 81 81 LEU H H 81 8.556 8.511 0.045 2
1 851 . 1 1 A 81 81 LEU HA H 81 4.172 4.429 -0.257 2
1 861 . 1 1 A 81 81 LEU C C 81 177.121 176.724 0.397 2
1 862 . 1 1 A 81 81 LEU CA C 81 54.996 54.981 0.015 2
1 863 . 1 1 A 81 81 LEU CB C 81 42.147 42.505 -0.358 2
1 867 . 1 1 A 81 81 LEU N N 81 128.272 128.642 -0.370 2
1 868 . 1 1 A 82 82 PHE H H 82 9.251 9.027 0.224 2
1 869 . 1 1 A 82 82 PHE HA H 82 4.576 4.450 0.126 2
1 874 . 1 1 A 82 82 PHE C C 82 177.785 176.008 1.777 2
1 875 . 1 1 A 82 82 PHE CA C 82 56.470 59.990 -3.520 2
1 876 . 1 1 A 82 82 PHE CB C 82 38.210 39.026 -0.816 2
1 878 . 1 1 A 82 82 PHE N N 82 129.268 126.151 3.117 2
1 879 . 1 1 A 83 83 GLY H H 83 7.047 7.437 -0.390 2
1 880 . 1 1 A 83 83 GLY HA2 H 83 4.783 4.181 0.602 2
1 881 . 1 1 A 83 83 GLY HA3 H 83 3.876 4.243 -0.367 2
1 882 . 1 1 A 83 83 GLY C C 83 171.642 174.723 -3.081 2
1 883 . 1 1 A 83 83 GLY CA C 83 45.826 45.895 -0.069 2
1 884 . 1 1 A 83 83 GLY N N 83 102.168 104.625 -2.457 2
1 885 . 1 1 A 84 84 GLU H H 84 8.444 8.910 -0.466 2
1 886 . 1 1 A 84 84 GLU HA H 84 4.111 4.175 -0.064 2
1 891 . 1 1 A 84 84 GLU C C 84 177.259 176.538 0.721 2
1 892 . 1 1 A 84 84 GLU CA C 84 59.438 58.989 0.449 2
1 893 . 1 1 A 84 84 GLU CB C 84 30.670 30.373 0.297 2
1 895 . 1 1 A 84 84 GLU N N 84 127.546 120.982 6.564 2
1 896 . 1 1 A 85 85 TYR H H 85 9.344 8.142 1.202 2
1 897 . 1 1 A 85 85 TYR HA H 85 4.599 4.930 -0.331 2
1 902 . 1 1 A 85 85 TYR C C 85 173.302 174.104 -0.802 2
1 903 . 1 1 A 85 85 TYR CA C 85 57.261 57.740 -0.479 2
1 904 . 1 1 A 85 85 TYR CB C 85 40.850 40.208 0.642 2
1 906 . 1 1 A 85 85 TYR N N 85 118.936 120.770 -1.834 2
1 907 . 1 1 A 86 86 TYR H H 86 7.323 8.603 -1.280 2
1 908 . 1 1 A 86 86 TYR HA H 86 5.298 5.791 -0.493 2
1 911 . 1 1 A 86 86 TYR C C 86 172.804 173.505 -0.701 2
1 912 . 1 1 A 86 86 TYR CA C 86 54.041 55.733 -1.692 2
1 913 . 1 1 A 86 86 TYR CB C 86 40.987 42.008 -1.021 2
1 914 . 1 1 A 86 86 TYR N N 86 124.965 123.680 1.285 2
1 915 . 1 1 A 87 87 CYS H H 87 7.046 8.696 -1.650 2
1 916 . 1 1 A 87 87 CYS HA H 87 3.842 4.634 -0.792 2
1 919 . 1 1 A 87 87 CYS C C 87 174.243 174.230 0.013 2
1 920 . 1 1 A 87 87 CYS CA C 87 56.377 58.341 -1.964 2
1 921 . 1 1 A 87 87 CYS CB C 87 33.230 29.996 3.234 2
1 922 . 1 1 A 87 87 CYS N N 87 128.735 120.505 8.230 2
1 923 . 1 1 A 88 88 ASP H H 88 8.002 8.971 -0.969 2
1 924 . 1 1 A 88 88 ASP HA H 88 3.761 4.357 -0.596 2
1 927 . 1 1 A 88 88 ASP C C 88 173.579 177.915 -4.336 2
1 928 . 1 1 A 88 88 ASP CA C 88 53.958 56.715 -2.757 2
1 929 . 1 1 A 88 88 ASP CB C 88 41.240 40.188 1.052 2
1 930 . 1 1 A 88 88 ASP N N 88 127.013 127.080 -0.067 2
1 931 . 1 1 A 89 89 ILE H H 89 7.972 7.831 0.141 2
1 932 . 1 1 A 89 89 ILE HA H 89 3.660 3.652 0.008 2
1 942 . 1 1 A 89 89 ILE C C 89 177.259 177.418 -0.159 2
1 943 . 1 1 A 89 89 ILE CA C 89 63.107 65.031 -1.924 2
1 944 . 1 1 A 89 89 ILE CB C 89 39.430 38.021 1.409 2
1 948 . 1 1 A 89 89 ILE N N 89 120.357 120.027 0.330 2
1 949 . 1 1 A 90 90 CYS H H 90 8.554 7.755 0.799 2
1 950 . 1 1 A 90 90 CYS HA H 90 3.677 4.337 -0.660 2
1 953 . 1 1 A 90 90 CYS C C 90 175.128 174.378 0.750 2
1 954 . 1 1 A 90 90 CYS CA C 90 60.791 59.523 1.268 2
1 955 . 1 1 A 90 90 CYS CB C 90 30.427 28.111 2.316 2
1 956 . 1 1 A 90 90 CYS N N 90 119.564 117.157 2.407 2
1 957 . 1 1 A 91 91 HIS H H 91 7.364 7.679 -0.315 2
1 958 . 1 1 A 91 91 HIS HA H 91 3.512 3.831 -0.319 2
1 963 . 1 1 A 91 91 HIS C C 91 170.590 173.157 -2.567 2
1 964 . 1 1 A 91 91 HIS CA C 91 58.739 56.589 2.150 2
1 965 . 1 1 A 91 91 HIS CB C 91 24.810 26.791 -1.981 2
1 968 . 1 1 A 91 91 HIS N N 91 111.440 116.322 -4.882 2
1 969 . 1 1 A 92 92 LEU H H 92 6.214 7.331 -1.117 2
1 970 . 1 1 A 92 92 LEU HA H 92 4.191 4.215 -0.024 2
1 980 . 1 1 A 92 92 LEU C C 92 173.911 175.417 -1.506 2
1 981 . 1 1 A 92 92 LEU CA C 92 53.717 53.215 0.502 2
1 982 . 1 1 A 92 92 LEU CB C 92 45.360 43.213 2.147 2
1 986 . 1 1 A 92 92 LEU N N 92 115.684 117.323 -1.639 2
1 987 . 1 1 A 93 93 PHE H H 93 6.669 8.723 -2.054 2
1 988 . 1 1 A 93 93 PHE HA H 93 5.622 5.257 0.365 2
1 995 . 1 1 A 93 93 PHE C C 93 175.765 174.439 1.326 2
1 996 . 1 1 A 93 93 PHE CA C 93 55.387 56.542 -1.155 2
1 997 . 1 1 A 93 93 PHE CB C 93 42.700 41.507 1.193 2
1 1000 . 1 1 A 93 93 PHE N N 93 121.535 120.846 0.689 2
1 1001 . 1 1 A 94 94 ASP H H 94 9.209 8.852 0.357 2
1 1002 . 1 1 A 94 94 ASP HA H 94 5.819 5.297 0.522 2
1 1005 . 1 1 A 94 94 ASP C C 94 175.654 175.297 0.357 2
1 1006 . 1 1 A 94 94 ASP CA C 94 53.330 53.129 0.201 2
1 1007 . 1 1 A 94 94 ASP CB C 94 44.720 44.620 0.100 2
1 1008 . 1 1 A 94 94 ASP N N 94 123.504 121.328 2.176 2
1 1009 . 1 1 A 95 95 LYS H H 95 9.043 8.450 0.593 2
1 1010 . 1 1 A 95 95 LYS HA H 95 4.527 4.388 0.139 2
1 1019 . 1 1 A 95 95 LYS C C 95 174.879 176.449 -1.570 2
1 1020 . 1 1 A 95 95 LYS CA C 95 56.620 57.158 -0.538 2
1 1021 . 1 1 A 95 95 LYS CB C 95 33.720 33.151 0.569 2
1 1025 . 1 1 A 95 95 LYS N N 95 120.380 121.050 -0.670 2
1 1026 . 1 1 A 96 96 ASP H H 96 8.999 8.629 0.370 2
1 1027 . 1 1 A 96 96 ASP HA H 96 4.724 4.787 -0.063 2
1 1030 . 1 1 A 96 96 ASP C C 96 176.401 175.625 0.776 2
1 1031 . 1 1 A 96 96 ASP CA C 96 56.147 53.697 2.450 2
1 1032 . 1 1 A 96 96 ASP CB C 96 40.790 41.125 -0.335 2
1 1033 . 1 1 A 96 96 ASP N N 96 120.784 123.235 -2.451 2
1 1034 . 1 1 A 97 97 LYS H H 97 9.382 8.592 0.790 2
1 1035 . 1 1 A 97 97 LYS HA H 97 4.473 4.604 -0.131 2
1 1044 . 1 1 A 97 97 LYS C C 97 175.903 175.996 -0.093 2
1 1045 . 1 1 A 97 97 LYS CA C 97 54.771 55.319 -0.548 2
1 1046 . 1 1 A 97 97 LYS CB C 97 33.270 32.910 0.360 2
1 1050 . 1 1 A 97 97 LYS N N 97 131.617 126.322 5.295 2
1 1051 . 1 1 A 98 98 LYS H H 98 8.940 8.075 0.865 2
1 1052 . 1 1 A 98 98 LYS HA H 98 4.118 3.926 0.192 2
1 1061 . 1 1 A 98 98 LYS C C 98 177.065 175.303 1.762 2
1 1062 . 1 1 A 98 98 LYS CA C 98 56.297 57.554 -1.257 2
1 1063 . 1 1 A 98 98 LYS CB C 98 28.467 29.910 -1.443 2
1 1067 . 1 1 A 98 98 LYS N N 98 115.034 115.770 -0.736 2
1 1068 . 1 1 A 99 99 GLN H H 99 9.266 7.726 1.540 2
1 1069 . 1 1 A 99 99 GLN HA H 99 4.460 4.431 0.029 2
1 1074 . 1 1 A 99 99 GLN C C 99 174.990 175.026 -0.036 2
1 1075 . 1 1 A 99 99 GLN CA C 99 57.563 55.661 1.902 2
1 1076 . 1 1 A 99 99 GLN CB C 99 27.280 29.443 -2.163 2
1 1078 . 1 1 A 99 99 GLN N N 99 117.717 118.552 -0.835 2
1 1079 . 1 1 A 100 100 TYR H H 100 8.402 8.572 -0.170 2
1 1080 . 1 1 A 100 100 TYR HA H 100 4.935 5.503 -0.568 2
1 1087 . 1 1 A 100 100 TYR C C 100 171.504 172.945 -1.441 2
1 1088 . 1 1 A 100 100 TYR CA C 100 55.786 55.559 0.227 2
1 1089 . 1 1 A 100 100 TYR CB C 100 41.090 41.461 -0.371 2
1 1092 . 1 1 A 100 100 TYR N N 100 115.081 118.277 -3.196 2
1 1093 . 1 1 A 101 101 HIS H H 101 8.829 8.970 -0.141 2
1 1094 . 1 1 A 101 101 HIS HA H 101 4.525 4.862 -0.337 2
1 1099 . 1 1 A 101 101 HIS C C 101 174.935 173.861 1.074 2
1 1100 . 1 1 A 101 101 HIS CA C 101 56.327 55.063 1.264 2
1 1101 . 1 1 A 101 101 HIS CB C 101 31.020 30.628 0.392 2
1 1104 . 1 1 A 101 101 HIS N N 101 120.894 122.652 -1.758 2
1 1105 . 1 1 A 102 102 CYS H H 102 7.427 8.235 -0.808 2
1 1106 . 1 1 A 102 102 CYS HA H 102 4.561 4.437 0.124 2
1 1109 . 1 1 A 102 102 CYS C C 102 175.765 175.508 0.257 2
1 1110 . 1 1 A 102 102 CYS CA C 102 57.707 58.659 -0.952 2
1 1111 . 1 1 A 102 102 CYS CB C 102 29.130 28.411 0.719 2
1 1112 . 1 1 A 102 102 CYS N N 102 131.256 126.801 4.455 2
1 1113 . 1 1 A 103 103 GLU H H 103 9.497 8.892 0.605 2
1 1114 . 1 1 A 103 103 GLU HA H 103 4.003 4.094 -0.091 2
1 1119 . 1 1 A 103 103 GLU C C 103 176.540 178.695 -2.155 2
1 1120 . 1 1 A 103 103 GLU CA C 103 58.796 59.400 -0.604 2
1 1121 . 1 1 A 103 103 GLU CB C 103 29.280 29.550 -0.270 2
1 1123 . 1 1 A 103 103 GLU N N 103 129.829 127.428 2.401 2
1 1124 . 1 1 A 104 104 ASN H H 104 7.832 8.127 -0.295 2
1 1125 . 1 1 A 104 104 ASN HA H 104 4.457 4.417 0.040 2
1 1130 . 1 1 A 104 104 ASN C C 104 176.401 177.561 -1.160 2
1 1131 . 1 1 A 104 104 ASN CA C 104 56.053 56.205 -0.152 2
1 1132 . 1 1 A 104 104 ASN CB C 104 38.400 38.071 0.329 2
1 1133 . 1 1 A 104 104 ASN N N 104 117.703 117.738 -0.035 2
1 1135 . 1 1 A 105 105 CYS H H 105 9.415 7.526 1.889 2
1 1136 . 1 1 A 105 105 CYS HA H 105 4.137 4.445 -0.308 2
1 1139 . 1 1 A 105 105 CYS C C 105 176.844 175.292 1.552 2
1 1140 . 1 1 A 105 105 CYS CA C 105 64.328 59.338 4.990 2
1 1141 . 1 1 A 105 105 CYS CB C 105 30.350 28.011 2.339 2
1 1142 . 1 1 A 105 105 CYS N N 105 124.939 115.586 9.353 2
1 1143 . 1 1 A 106 106 GLY H H 106 8.145 8.755 -0.610 2
1 1144 . 1 1 A 106 106 GLY HA2 H 106 3.980 3.899 0.081 2
1 1145 . 1 1 A 106 106 GLY HA3 H 106 3.502 3.926 -0.424 2
1 1146 . 1 1 A 106 106 GLY C C 106 172.500 173.560 -1.060 2
1 1147 . 1 1 A 106 106 GLY CA C 106 44.968 45.875 -0.907 2
1 1148 . 1 1 A 106 106 GLY N N 106 106.090 109.571 -3.481 2
1 1149 . 1 1 A 107 107 ILE H H 107 6.465 6.946 -0.481 2
1 1150 . 1 1 A 107 107 ILE HA H 107 4.878 5.049 -0.171 2
1 1160 . 1 1 A 107 107 ILE C C 107 174.824 174.213 0.611 2
1 1161 . 1 1 A 107 107 ILE CA C 107 58.226 58.518 -0.292 2
1 1162 . 1 1 A 107 107 ILE CB C 107 44.460 42.317 2.143 2
1 1166 . 1 1 A 107 107 ILE N N 107 107.914 114.687 -6.773 2
1 1167 . 1 1 A 108 108 CYS H H 108 7.041 9.036 -1.995 2
1 1168 . 1 1 A 108 108 CYS HA H 108 5.018 5.366 -0.348 2
1 1171 . 1 1 A 108 108 CYS C C 108 175.461 173.047 2.414 2
1 1172 . 1 1 A 108 108 CYS CA C 108 62.097 57.250 4.847 2
1 1173 . 1 1 A 108 108 CYS CB C 108 31.353 30.807 0.546 2
1 1174 . 1 1 A 108 108 CYS N N 108 122.441 120.716 1.725 2
1 1175 . 1 1 A 109 109 ARG H H 109 8.561 8.311 0.250 2
1 1176 . 1 1 A 109 109 ARG HA H 109 4.239 4.753 -0.514 2
1 1183 . 1 1 A 109 109 ARG C C 109 174.271 175.051 -0.780 2
1 1184 . 1 1 A 109 109 ARG CA C 109 52.962 54.247 -1.285 2
1 1185 . 1 1 A 109 109 ARG CB C 109 33.903 34.033 -0.130 2
1 1188 . 1 1 A 109 109 ARG N N 109 121.163 122.277 -1.114 2
1 1189 . 1 1 A 110 110 ILE H H 110 7.847 8.391 -0.544 2
1 1190 . 1 1 A 110 110 ILE HA H 110 3.531 4.030 -0.499 2
1 1200 . 1 1 A 110 110 ILE C C 110 175.405 175.999 -0.594 2
1 1201 . 1 1 A 110 110 ILE CA C 110 62.201 62.077 0.124 2
1 1202 . 1 1 A 110 110 ILE CB C 110 36.860 36.900 -0.040 2
1 1206 . 1 1 A 110 110 ILE N N 110 118.955 122.914 -3.959 2
1 1207 . 1 1 A 111 111 GLY H H 111 6.928 8.224 -1.296 2
1 1208 . 1 1 A 111 111 GLY HA2 H 111 4.564 3.995 0.569 2
1 1209 . 1 1 A 111 111 GLY HA3 H 111 4.135 4.206 -0.071 2
1 1210 . 1 1 A 111 111 GLY CA C 111 43.068 45.401 -2.333 2
1 1211 . 1 1 A 111 111 GLY N N 111 113.782 114.030 -0.248 2
1 1212 . 1 1 A 112 112 PRO HA H 112 4.990 4.753 0.237 2
1 1219 . 1 1 A 112 112 PRO C C 112 177.342 177.680 -0.338 2
1 1220 . 1 1 A 112 112 PRO CA C 112 62.920 62.903 0.017 2
1 1221 . 1 1 A 112 112 PRO CB C 112 34.807 31.790 3.017 2
1 1224 . 1 1 A 113 113 LYS H H 113 8.989 8.359 0.630 2
1 1225 . 1 1 A 113 113 LYS HA H 113 3.144 3.796 -0.652 2
1 1234 . 1 1 A 113 113 LYS C C 113 177.536 178.060 -0.524 2
1 1235 . 1 1 A 113 113 LYS CA C 113 59.883 58.833 1.050 2
1 1236 . 1 1 A 113 113 LYS CB C 113 32.260 31.801 0.459 2
1 1240 . 1 1 A 113 113 LYS N N 113 123.545 123.380 0.165 2
1 1241 . 1 1 A 114 114 GLU H H 114 9.080 9.073 0.007 2
1 1242 . 1 1 A 114 114 GLU HA H 114 4.199 4.078 0.121 2
1 1247 . 1 1 A 114 114 GLU C C 114 176.374 177.494 -1.120 2
1 1248 . 1 1 A 114 114 GLU CA C 114 58.733 59.209 -0.476 2
1 1249 . 1 1 A 114 114 GLU CB C 114 28.077 28.787 -0.710 2
1 1251 . 1 1 A 114 114 GLU N N 114 114.832 120.431 -5.599 2
1 1252 . 1 1 A 115 115 ASP H H 115 7.799 7.850 -0.051 2
1 1253 . 1 1 A 115 115 ASP HA H 115 4.642 4.717 -0.075 2
1 1256 . 1 1 A 115 115 ASP C C 115 176.374 175.611 0.763 2
1 1257 . 1 1 A 115 115 ASP CA C 115 54.470 54.564 -0.094 2
1 1258 . 1 1 A 115 115 ASP CB C 115 40.850 41.716 -0.866 2
1 1259 . 1 1 A 115 115 ASP N N 115 118.858 118.856 0.002 2
1 1260 . 1 1 A 116 116 PHE H H 116 8.063 7.817 0.246 2
1 1261 . 1 1 A 116 116 PHE HA H 116 5.239 5.103 0.136 2
1 1264 . 1 1 A 116 116 PHE C C 116 173.413 174.624 -1.211 2
1 1265 . 1 1 A 116 116 PHE CA C 116 57.708 56.573 1.135 2
1 1266 . 1 1 A 116 116 PHE CB C 116 44.557 41.586 2.971 2
1 1267 . 1 1 A 116 116 PHE N N 116 120.567 118.255 2.312 2
1 1268 . 1 1 A 117 117 PHE H H 117 9.439 8.789 0.650 2
1 1269 . 1 1 A 117 117 PHE HA H 117 5.091 5.191 -0.100 2
1 1277 . 1 1 A 117 117 PHE C C 117 171.614 172.478 -0.864 2
1 1278 . 1 1 A 117 117 PHE CA C 117 55.311 55.463 -0.152 2
1 1279 . 1 1 A 117 117 PHE CB C 117 41.887 41.918 -0.031 2
1 1283 . 1 1 A 117 117 PHE N N 117 118.040 118.686 -0.646 2
1 1284 . 1 1 A 118 118 HIS H H 118 8.779 8.879 -0.100 2
1 1285 . 1 1 A 118 118 HIS HA H 118 4.836 4.930 -0.094 2
1 1289 . 1 1 A 118 118 HIS C C 118 174.879 173.948 0.931 2
1 1290 . 1 1 A 118 118 HIS CA C 118 55.322 55.305 0.017 2
1 1291 . 1 1 A 118 118 HIS CB C 118 30.950 31.591 -0.641 2
1 1293 . 1 1 A 118 118 HIS N N 118 121.208 120.723 0.485 2
1 1294 . 1 1 A 119 119 CYS H H 119 8.123 7.965 0.158 2
1 1295 . 1 1 A 119 119 CYS HA H 119 4.529 4.674 -0.145 2
1 1298 . 1 1 A 119 119 CYS C C 119 176.567 175.236 1.331 2
1 1299 . 1 1 A 119 119 CYS CA C 119 58.957 58.118 0.839 2
1 1300 . 1 1 A 119 119 CYS CB C 119 30.090 28.688 1.402 2
1 1301 . 1 1 A 119 119 CYS N N 119 131.659 126.056 5.603 2
1 1302 . 1 1 A 120 120 LEU H H 120 8.970 8.667 0.303 2
1 1303 . 1 1 A 120 120 LEU N N 120 130.361 127.912 2.449 2
1 1304 . 1 1 A 121 121 LYS HA H 121 4.299 4.387 -0.088 2
1 1313 . 1 1 A 121 121 LYS CA C 121 58.727 56.141 2.586 2
1 1314 . 1 1 A 121 121 LYS CB C 121 33.210 32.793 0.417 2
1 1318 . 1 1 A 123 123 ASN HA H 123 4.438 4.767 -0.329 2
1 1323 . 1 1 A 123 123 ASN C C 123 172.444 174.446 -2.002 2
1 1324 . 1 1 A 123 123 ASN CA C 123 53.448 54.019 -0.571 2
1 1325 . 1 1 A 123 123 ASN CB C 123 37.130 37.607 -0.477 2
1 1327 . 1 1 A 124 124 LEU H H 124 6.596 7.606 -1.010 2
1 1328 . 1 1 A 124 124 LEU HA H 124 4.576 4.610 -0.034 2
1 1338 . 1 1 A 124 124 LEU C C 124 175.903 175.194 0.709 2
1 1339 . 1 1 A 124 124 LEU CA C 124 54.043 54.176 -0.133 2
1 1340 . 1 1 A 124 124 LEU CB C 124 45.837 44.340 1.497 2
1 1344 . 1 1 A 124 124 LEU N N 124 115.443 121.016 -5.573 2
1 1345 . 1 1 A 125 125 CYS H H 125 6.342 8.649 -2.307 2
1 1346 . 1 1 A 125 125 CYS HA H 125 5.033 5.021 0.012 2
1 1349 . 1 1 A 125 125 CYS C C 125 175.101 174.158 0.943 2
1 1350 . 1 1 A 125 125 CYS CA C 125 62.046 57.457 4.589 2
1 1351 . 1 1 A 125 125 CYS CB C 125 30.840 28.719 2.121 2
1 1352 . 1 1 A 125 125 CYS N N 125 118.685 122.990 -4.305 2
1 1353 . 1 1 A 126 126 LEU H H 126 8.894 8.068 0.826 2
1 1354 . 1 1 A 126 126 LEU HA H 126 4.565 4.680 -0.115 2
1 1364 . 1 1 A 126 126 LEU C C 126 174.879 175.932 -1.053 2
1 1365 . 1 1 A 126 126 LEU CA C 126 52.751 53.222 -0.471 2
1 1366 . 1 1 A 126 126 LEU CB C 126 46.090 43.779 2.311 2
1 1370 . 1 1 A 126 126 LEU N N 126 124.501 125.645 -1.144 2
1 1371 . 1 1 A 127 127 ALA H H 127 8.378 8.589 -0.211 2
1 1372 . 1 1 A 127 127 ALA HA H 127 3.957 4.505 -0.548 2
1 1376 . 1 1 A 127 127 ALA C C 127 179.085 178.317 0.768 2
1 1377 . 1 1 A 127 127 ALA CA C 127 52.554 51.316 1.238 2
1 1378 . 1 1 A 127 127 ALA CB C 127 18.527 20.225 -1.698 2
1 1379 . 1 1 A 127 127 ALA N N 127 123.011 123.654 -0.643 2
1 1380 . 1 1 A 128 128 MET H H 128 8.237 8.708 -0.471 2
1 1385 . 1 1 A 128 128 MET N N 128 120.642 120.670 -0.028 2
1 1386 . 1 1 A 129 129 ASN HA H 129 4.502 4.556 -0.054 2
1 1389 . 1 1 A 129 129 ASN C C 129 175.931 177.081 -1.150 2
1 1390 . 1 1 A 129 129 ASN CA C 129 55.064 55.628 -0.564 2
1 1391 . 1 1 A 129 129 ASN CB C 129 36.920 38.496 -1.576 2
1 1392 . 1 1 A 130 130 LEU H H 130 8.211 7.724 0.487 2
1 1393 . 1 1 A 130 130 LEU HA H 130 4.489 4.302 0.187 2
1 1403 . 1 1 A 130 130 LEU C C 130 178.836 177.032 1.804 2
1 1404 . 1 1 A 130 130 LEU CA C 130 54.653 55.986 -1.333 2
1 1405 . 1 1 A 130 130 LEU CB C 130 41.887 42.224 -0.337 2
1 1409 . 1 1 A 130 130 LEU N N 130 118.563 119.655 -1.092 2
1 1410 . 1 1 A 131 131 GLN H H 131 7.953 7.679 0.274 2
1 1411 . 1 1 A 131 131 GLN HA H 131 3.729 4.321 -0.592 2
1 1418 . 1 1 A 131 131 GLN CA C 131 59.310 57.772 1.538 2
1 1419 . 1 1 A 131 131 GLN CB C 131 28.340 28.209 0.131 2
1 1421 . 1 1 A 131 131 GLN N N 131 123.929 117.832 6.097 2
1 1423 . 1 1 A 132 132 GLY HA2 H 132 4.034 3.925 0.109 2
1 1424 . 1 1 A 132 132 GLY HA3 H 132 3.865 3.982 -0.117 2
1 1425 . 1 1 A 132 132 GLY C C 132 174.547 174.904 -0.357 2
1 1426 . 1 1 A 132 132 GLY CA C 132 45.902 45.505 0.397 2
1 1427 . 1 1 A 133 133 ARG H H 133 7.735 7.718 0.017 2
1 1428 . 1 1 A 133 133 ARG HA H 133 4.611 4.313 0.298 2
1 1435 . 1 1 A 133 133 ARG C C 133 175.461 175.808 -0.347 2
1 1436 . 1 1 A 133 133 ARG CA C 133 54.987 56.874 -1.887 2
1 1437 . 1 1 A 133 133 ARG CB C 133 31.470 30.276 1.194 2
1 1440 . 1 1 A 133 133 ARG N N 133 118.194 120.156 -1.962 2
1 1441 . 1 1 A 134 134 HIS H H 134 7.803 7.897 -0.094 2
1 1444 . 1 1 A 134 134 HIS N N 134 118.700 117.051 1.649 2
1 1445 . 1 1 A 135 135 LYS HA H 135 4.331 4.320 0.011 2
1 1454 . 1 1 A 135 135 LYS C C 135 174.852 176.393 -1.541 2
1 1455 . 1 1 A 135 135 LYS CA C 135 55.390 56.097 -0.707 2
1 1456 . 1 1 A 135 135 LYS CB C 135 32.970 32.161 0.809 2
1 1460 . 1 1 A 136 136 CYS H H 136 7.801 8.484 -0.683 2
1 1461 . 1 1 A 136 136 CYS HA H 136 4.113 4.767 -0.654 2
1 1464 . 1 1 A 136 136 CYS C C 136 174.879 174.389 0.490 2
1 1465 . 1 1 A 136 136 CYS CA C 136 60.028 58.654 1.374 2
1 1466 . 1 1 A 136 136 CYS CB C 136 30.350 28.067 2.283 2
1 1467 . 1 1 A 136 136 CYS N N 136 126.055 123.153 2.902 2
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