data_16297_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16297
_Entry.PDB_ID 2KIV
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 14 . 1 1 1 A 15 15 GLN H H 2 8.439 8.848 -0.409 1
1 15 . 1 1 1 A 15 15 GLN HA H 2 4.594 4.811 -0.217 1
1 20 . 1 1 1 A 15 15 GLN C C 2 175.972 175.205 0.767 1
1 21 . 1 1 1 A 15 15 GLN CA C 2 56.260 55.479 0.781 1
1 22 . 1 1 1 A 15 15 GLN CB C 2 30.945 30.291 0.654 1
1 24 . 1 1 1 A 15 15 GLN N N 2 124.997 127.191 -2.194 1
1 25 . 1 1 1 A 16 16 THR H H 3 8.347 8.839 -0.492 1
1 26 . 1 1 1 A 16 16 THR HA H 3 4.555 4.825 -0.270 1
1 31 . 1 1 1 A 16 16 THR C C 3 175.495 174.987 0.508 1
1 32 . 1 1 1 A 16 16 THR CA C 3 60.010 61.553 -1.543 1
1 33 . 1 1 1 A 16 16 THR CB C 3 71.261 71.234 0.027 1
1 34 . 1 1 1 A 16 16 THR N N 3 113.011 117.735 -4.724 1
1 35 . 1 1 1 A 17 17 VAL H H 4 8.895 8.903 -0.008 1
1 36 . 1 1 1 A 17 17 VAL HA H 4 3.670 3.818 -0.148 1
1 44 . 1 1 1 A 17 17 VAL C C 4 178.449 177.900 0.549 1
1 45 . 1 1 1 A 17 17 VAL CA C 4 67.511 66.501 1.010 1
1 46 . 1 1 1 A 17 17 VAL CB C 4 31.883 31.732 0.151 1
1 49 . 1 1 1 A 17 17 VAL N N 4 121.854 125.254 -3.400 1
1 50 . 1 1 1 A 18 18 GLY H H 5 9.017 8.241 0.776 1
1 51 . 1 1 1 A 18 18 GLY HA2 H 5 3.940 3.773 0.167 1
1 52 . 1 1 1 A 18 18 GLY HA3 H 5 3.610 3.780 -0.170 1
1 53 . 1 1 1 A 18 18 GLY C C 5 176.186 175.776 0.410 1
1 54 . 1 1 1 A 18 18 GLY CA C 5 47.822 47.130 0.692 1
1 55 . 1 1 1 A 18 18 GLY N N 5 106.966 107.989 -1.023 1
1 56 . 1 1 1 A 19 19 GLN H H 6 8.072 8.317 -0.245 1
1 57 . 1 1 1 A 19 19 GLN HA H 6 4.037 4.125 -0.088 1
1 62 . 1 1 1 A 19 19 GLN C C 6 179.488 177.954 1.534 1
1 63 . 1 1 1 A 19 19 GLN CA C 6 59.073 58.716 0.357 1
1 64 . 1 1 1 A 19 19 GLN CB C 6 28.489 28.807 -0.318 1
1 66 . 1 1 1 A 19 19 GLN N N 6 122.431 120.970 1.461 1
1 67 . 1 1 1 A 20 20 TRP H H 7 8.756 8.187 0.569 1
1 68 . 1 1 1 A 20 20 TRP HA H 7 4.160 4.223 -0.063 1
1 77 . 1 1 1 A 20 20 TRP C C 7 179.620 177.931 1.689 1
1 78 . 1 1 1 A 20 20 TRP CA C 7 61.886 61.080 0.806 1
1 79 . 1 1 1 A 20 20 TRP CB C 7 28.133 29.628 -1.495 1
1 85 . 1 1 1 A 20 20 TRP N N 7 124.265 122.080 2.185 1
1 87 . 1 1 1 A 21 21 LEU H H 8 9.148 8.614 0.534 1
1 88 . 1 1 1 A 21 21 LEU HA H 8 3.440 3.532 -0.092 1
1 97 . 1 1 1 A 21 21 LEU C C 8 180.521 178.369 2.152 1
1 98 . 1 1 1 A 21 21 LEU CA C 8 56.920 58.009 -1.089 1
1 99 . 1 1 1 A 21 21 LEU CB C 8 41.700 41.420 0.280 1
1 102 . 1 1 1 A 21 21 LEU N N 8 120.548 120.682 -0.134 1
1 103 . 1 1 1 A 22 22 GLU H H 9 8.284 8.488 -0.204 1
1 104 . 1 1 1 A 22 22 GLU HA H 9 3.740 3.911 -0.171 1
1 109 . 1 1 1 A 22 22 GLU C C 9 179.960 178.550 1.410 1
1 110 . 1 1 1 A 22 22 GLU CA C 9 60.010 59.721 0.289 1
1 111 . 1 1 1 A 22 22 GLU CB C 9 29.070 29.191 -0.121 1
1 113 . 1 1 1 A 22 22 GLU N N 9 120.133 119.403 0.730 1
1 114 . 1 1 1 A 23 23 SER H H 10 7.891 7.720 0.171 1
1 115 . 1 1 1 A 23 23 SER HA H 10 4.250 4.225 0.025 1
1 118 . 1 1 1 A 23 23 SER C C 10 175.346 176.564 -1.218 1
1 119 . 1 1 1 A 23 23 SER CA C 10 60.948 61.377 -0.429 1
1 120 . 1 1 1 A 23 23 SER CB C 10 63.280 62.922 0.358 1
1 121 . 1 1 1 A 23 23 SER N N 10 117.044 114.443 2.601 1
1 122 . 1 1 1 A 24 24 ILE H H 11 6.862 7.661 -0.799 1
1 123 . 1 1 1 A 24 24 ILE HA H 11 4.487 3.874 0.613 1
1 133 . 1 1 1 A 24 24 ILE C C 11 175.812 175.647 0.165 1
1 134 . 1 1 1 A 24 24 ILE CA C 11 60.948 63.403 -2.455 1
1 135 . 1 1 1 A 24 24 ILE CB C 11 38.250 37.361 0.889 1
1 139 . 1 1 1 A 24 24 ILE N N 11 113.733 117.767 -4.034 1
1 140 . 1 1 1 A 25 25 GLY H H 12 7.628 7.512 0.116 1
1 141 . 1 1 1 A 25 25 GLY HA2 H 12 3.990 4.004 -0.014 1
1 142 . 1 1 1 A 25 25 GLY HA3 H 12 3.800 4.017 -0.217 1
1 143 . 1 1 1 A 25 25 GLY C C 12 173.647 171.759 1.888 1
1 144 . 1 1 1 A 25 25 GLY CA C 12 45.947 46.014 -0.067 1
1 145 . 1 1 1 A 25 25 GLY N N 12 109.763 109.886 -0.123 1
1 146 . 1 1 1 A 26 26 LEU H H 13 7.620 8.266 -0.646 1
1 147 . 1 1 1 A 26 26 LEU C C 13 176.186 174.107 2.079 1
1 148 . 1 1 1 A 26 26 LEU CA C 13 52.700 51.902 0.798 1
1 149 . 1 1 1 A 26 26 LEU CB C 13 43.134 45.791 -2.657 1
1 150 . 1 1 1 A 26 26 LEU N N 13 118.778 122.068 -3.290 1
1 151 . 1 1 1 A 27 27 PRO HA H 14 4.120 4.644 -0.524 1
1 154 . 1 1 1 A 27 27 PRO C C 14 177.955 175.225 2.730 1
1 155 . 1 1 1 A 27 27 PRO CA C 14 64.698 62.200 2.498 1
1 156 . 1 1 1 A 27 27 PRO CB C 14 31.883 29.179 2.704 1
1 158 . 1 1 1 A 28 28 GLN H H 15 9.838 8.410 1.428 1
1 159 . 1 1 1 A 28 28 GLN HA H 15 4.240 4.335 -0.095 1
1 162 . 1 1 1 A 28 28 GLN C C 15 176.836 176.635 0.201 1
1 163 . 1 1 1 A 28 28 GLN CA C 15 58.135 56.288 1.847 1
1 164 . 1 1 1 A 28 28 GLN CB C 15 27.195 31.062 -3.867 1
1 166 . 1 1 1 A 28 28 GLN N N 15 120.414 120.719 -0.305 1
1 167 . 1 1 1 A 29 29 TYR H H 16 6.810 7.697 -0.887 1
1 168 . 1 1 1 A 29 29 TYR HA H 16 5.720 4.585 1.135 1
1 173 . 1 1 1 A 29 29 TYR C C 16 174.814 176.547 -1.733 1
1 174 . 1 1 1 A 29 29 TYR CA C 16 57.198 57.925 -0.727 1
1 175 . 1 1 1 A 29 29 TYR CB C 16 37.509 38.708 -1.199 1
1 178 . 1 1 1 A 29 29 TYR N N 16 119.718 117.625 2.093 1
1 179 . 1 1 1 A 30 30 GLU H H 17 7.509 8.542 -1.033 1
1 180 . 1 1 1 A 30 30 GLU HA H 17 3.650 4.155 -0.505 1
1 184 . 1 1 1 A 30 30 GLU C C 17 177.552 178.394 -0.842 1
1 185 . 1 1 1 A 30 30 GLU CA C 17 60.948 59.200 1.748 1
1 186 . 1 1 1 A 30 30 GLU CB C 17 30.008 29.365 0.643 1
1 188 . 1 1 1 A 30 30 GLU N N 17 122.417 119.640 2.777 1
1 189 . 1 1 1 A 31 31 ASN H H 18 9.259 8.222 1.037 1
1 190 . 1 1 1 A 31 31 ASN HA H 18 4.451 4.509 -0.058 1
1 193 . 1 1 1 A 31 31 ASN C C 18 176.868 178.186 -1.318 1
1 194 . 1 1 1 A 31 31 ASN CA C 18 57.198 56.344 0.854 1
1 195 . 1 1 1 A 31 31 ASN CB C 18 38.446 38.624 -0.178 1
1 196 . 1 1 1 A 31 31 ASN N N 18 116.613 118.693 -2.080 1
1 197 . 1 1 1 A 32 32 HIS H H 19 8.898 8.290 0.608 1
1 198 . 1 1 1 A 32 32 HIS HA H 19 4.140 4.387 -0.247 1
1 202 . 1 1 1 A 32 32 HIS C C 19 178.269 177.806 0.463 1
1 203 . 1 1 1 A 32 32 HIS CA C 19 60.948 59.176 1.772 1
1 204 . 1 1 1 A 32 32 HIS CB C 19 30.008 30.362 -0.354 1
1 206 . 1 1 1 A 32 32 HIS N N 19 118.926 118.585 0.341 1
1 207 . 1 1 1 A 33 33 LEU H H 20 7.825 8.781 -0.956 1
1 208 . 1 1 1 A 33 33 LEU HA H 20 4.305 3.909 0.396 1
1 218 . 1 1 1 A 33 33 LEU C C 20 179.190 178.906 0.284 1
1 219 . 1 1 1 A 33 33 LEU CA C 20 60.010 58.331 1.679 1
1 220 . 1 1 1 A 33 33 LEU CB C 20 40.321 42.013 -1.692 1
1 224 . 1 1 1 A 33 33 LEU N N 20 117.434 119.815 -2.381 1
1 225 . 1 1 1 A 34 34 MET H H 21 8.861 8.445 0.416 1
1 226 . 1 1 1 A 34 34 MET HA H 21 3.980 4.069 -0.089 1
1 234 . 1 1 1 A 34 34 MET C C 21 180.340 178.119 2.221 1
1 235 . 1 1 1 A 34 34 MET CA C 21 58.135 59.120 -0.985 1
1 236 . 1 1 1 A 34 34 MET CB C 21 30.945 32.072 -1.127 1
1 238 . 1 1 1 A 34 34 MET N N 21 118.111 118.518 -0.407 1
1 239 . 1 1 1 A 35 35 ALA H H 22 9.015 8.458 0.557 1
1 240 . 1 1 1 A 35 35 ALA HA H 22 4.239 4.112 0.127 1
1 244 . 1 1 1 A 35 35 ALA C C 22 178.058 178.735 -0.677 1
1 245 . 1 1 1 A 35 35 ALA CA C 22 53.800 54.580 -0.780 1
1 246 . 1 1 1 A 35 35 ALA CB C 22 18.397 18.123 0.274 1
1 247 . 1 1 1 A 35 35 ALA N N 22 120.068 121.413 -1.345 1
1 248 . 1 1 1 A 36 36 ASN H H 23 7.143 7.976 -0.833 1
1 249 . 1 1 1 A 36 36 ASN HA H 23 4.959 4.751 0.208 1
1 254 . 1 1 1 A 36 36 ASN C C 23 174.083 175.667 -1.584 1
1 255 . 1 1 1 A 36 36 ASN CA C 23 54.000 53.087 0.913 1
1 256 . 1 1 1 A 36 36 ASN CB C 23 41.300 39.133 2.167 1
1 257 . 1 1 1 A 36 36 ASN N N 23 111.560 115.050 -3.490 1
1 259 . 1 1 1 A 37 37 GLY H H 24 7.797 8.244 -0.447 1
1 260 . 1 1 1 A 37 37 GLY HA2 H 24 3.430 3.867 -0.437 1
1 261 . 1 1 1 A 37 37 GLY HA3 H 24 3.290 3.940 -0.650 1
1 262 . 1 1 1 A 37 37 GLY C C 24 173.163 175.242 -2.079 1
1 263 . 1 1 1 A 37 37 GLY CA C 24 45.947 45.297 0.650 1
1 264 . 1 1 1 A 37 37 GLY N N 24 106.170 107.808 -1.638 1
1 265 . 1 1 1 A 38 38 PHE H H 25 8.191 7.997 0.194 1
1 266 . 1 1 1 A 38 38 PHE HA H 25 4.910 4.783 0.127 1
1 271 . 1 1 1 A 38 38 PHE C C 25 173.496 175.455 -1.959 1
1 272 . 1 1 1 A 38 38 PHE CA C 25 56.550 56.197 0.353 1
1 273 . 1 1 1 A 38 38 PHE CB C 25 37.220 36.778 0.442 1
1 276 . 1 1 1 A 38 38 PHE N N 25 122.454 119.819 2.635 1
1 277 . 1 1 1 A 39 39 ASP H H 26 6.756 8.603 -1.847 1
1 278 . 1 1 1 A 39 39 ASP HA H 26 5.077 4.789 0.288 1
1 281 . 1 1 1 A 39 39 ASP C C 26 177.463 175.877 1.586 1
1 282 . 1 1 1 A 39 39 ASP CA C 26 53.447 55.271 -1.824 1
1 283 . 1 1 1 A 39 39 ASP CB C 26 42.580 42.254 0.326 1
1 284 . 1 1 1 A 39 39 ASP N N 26 111.309 121.656 -10.347 1
1 285 . 1 1 1 A 40 40 ASN H H 27 7.495 7.943 -0.448 1
1 286 . 1 1 1 A 40 40 ASN HA H 27 4.820 4.956 -0.136 1
1 289 . 1 1 1 A 40 40 ASN C C 27 176.228 175.843 0.385 1
1 290 . 1 1 1 A 40 40 ASN CA C 27 52.510 52.006 0.504 1
1 291 . 1 1 1 A 40 40 ASN CB C 27 40.321 39.859 0.462 1
1 292 . 1 1 1 A 40 40 ASN N N 27 118.385 118.189 0.196 1
1 293 . 1 1 1 A 41 41 VAL H H 28 9.192 8.592 0.600 1
1 294 . 1 1 1 A 41 41 VAL HA H 28 3.550 3.732 -0.182 1
1 302 . 1 1 1 A 41 41 VAL C C 28 176.429 177.531 -1.102 1
1 303 . 1 1 1 A 41 41 VAL CA C 28 65.636 66.076 -0.440 1
1 304 . 1 1 1 A 41 41 VAL CB C 28 31.883 31.625 0.258 1
1 307 . 1 1 1 A 41 41 VAL N N 28 125.741 125.911 -0.170 1
1 308 . 1 1 1 A 42 42 GLN H H 29 8.203 8.444 -0.241 1
1 309 . 1 1 1 A 42 42 GLN HA H 29 4.129 4.036 0.093 1
1 314 . 1 1 1 A 42 42 GLN C C 29 176.591 177.410 -0.819 1
1 315 . 1 1 1 A 42 42 GLN CA C 29 57.198 58.138 -0.940 1
1 316 . 1 1 1 A 42 42 GLN CB C 29 28.133 27.502 0.631 1
1 318 . 1 1 1 A 42 42 GLN N N 29 116.452 119.779 -3.327 1
1 319 . 1 1 1 A 43 43 ALA H H 30 7.781 8.031 -0.250 1
1 320 . 1 1 1 A 43 43 ALA HA H 30 4.650 4.103 0.547 1
1 324 . 1 1 1 A 43 43 ALA C C 30 175.976 177.924 -1.948 1
1 325 . 1 1 1 A 43 43 ALA CA C 30 50.840 54.210 -3.370 1
1 326 . 1 1 1 A 43 43 ALA CB C 30 19.150 18.308 0.842 1
1 327 . 1 1 1 A 43 43 ALA N N 30 122.150 122.807 -0.657 1
1 328 . 1 1 1 A 44 44 MET H H 31 7.739 8.045 -0.306 1
1 332 . 1 1 1 A 44 44 MET C C 31 178.275 177.414 0.861 1
1 333 . 1 1 1 A 44 44 MET CA C 31 55.323 54.133 1.190 1
1 334 . 1 1 1 A 44 44 MET CB C 31 34.696 32.234 2.462 1
1 336 . 1 1 1 A 44 44 MET N N 31 118.149 113.988 4.161 1
1 337 . 1 1 1 A 45 45 GLY H H 32 7.611 8.419 -0.808 1
1 338 . 1 1 1 A 45 45 GLY N N 32 101.530 109.855 -8.325 1
1 339 . 1 1 1 A 47 47 ASN HA H 34 4.480 5.163 -0.683 1
1 342 . 1 1 1 A 47 47 ASN CA C 34 56.260 51.942 4.318 1
1 343 . 1 1 1 A 47 47 ASN CB C 34 39.384 40.793 -1.409 1
1 344 . 1 1 1 A 49 49 MET HA H 36 4.646 4.320 0.326 1
1 350 . 1 1 1 A 49 49 MET C C 36 173.651 175.004 -1.353 1
1 351 . 1 1 1 A 49 49 MET CA C 36 55.323 56.292 -0.969 1
1 352 . 1 1 1 A 49 49 MET CB C 36 35.633 33.539 2.094 1
1 355 . 1 1 1 A 50 50 GLU H H 37 9.203 8.575 0.628 1
1 356 . 1 1 1 A 50 50 GLU HA H 37 4.650 4.788 -0.138 1
1 361 . 1 1 1 A 50 50 GLU C C 37 177.008 176.632 0.376 1
1 362 . 1 1 1 A 50 50 GLU CA C 37 54.385 54.681 -0.296 1
1 363 . 1 1 1 A 50 50 GLU CB C 37 33.758 32.422 1.336 1
1 365 . 1 1 1 A 50 50 GLU N N 37 123.229 123.875 -0.646 1
1 366 . 1 1 1 A 51 51 ASP H H 38 9.032 9.046 -0.014 1
1 367 . 1 1 1 A 51 51 ASP HA H 38 4.149 4.165 -0.016 1
1 370 . 1 1 1 A 51 51 ASP C C 38 177.994 177.774 0.220 1
1 371 . 1 1 1 A 51 51 ASP CA C 38 59.073 58.402 0.671 1
1 372 . 1 1 1 A 51 51 ASP CB C 38 43.134 41.439 1.695 1
1 373 . 1 1 1 A 51 51 ASP N N 38 122.717 127.530 -4.813 1
1 374 . 1 1 1 A 52 52 GLN H H 39 8.950 8.138 0.812 1
1 375 . 1 1 1 A 52 52 GLN HA H 39 3.940 4.021 -0.081 1
1 378 . 1 1 1 A 52 52 GLN C C 39 177.817 178.743 -0.926 1
1 379 . 1 1 1 A 52 52 GLN CA C 39 59.073 58.904 0.169 1
1 380 . 1 1 1 A 52 52 GLN CB C 39 28.133 28.522 -0.389 1
1 381 . 1 1 1 A 52 52 GLN N N 39 114.086 118.217 -4.131 1
1 382 . 1 1 1 A 53 53 ASP H H 40 7.214 8.056 -0.842 1
1 383 . 1 1 1 A 53 53 ASP HA H 40 4.370 4.455 -0.085 1
1 386 . 1 1 1 A 53 53 ASP C C 40 177.667 178.725 -1.058 1
1 387 . 1 1 1 A 53 53 ASP CA C 40 57.198 57.087 0.111 1
1 388 . 1 1 1 A 53 53 ASP CB C 40 41.800 40.709 1.091 1
1 389 . 1 1 1 A 53 53 ASP N N 40 118.734 120.101 -1.367 1
1 390 . 1 1 1 A 54 54 LEU H H 41 7.180 8.011 -0.831 1
1 391 . 1 1 1 A 54 54 LEU HA H 41 3.990 3.985 0.005 1
1 400 . 1 1 1 A 54 54 LEU C C 41 178.204 178.339 -0.135 1
1 401 . 1 1 1 A 54 54 LEU CA C 41 56.260 57.915 -1.655 1
1 402 . 1 1 1 A 54 54 LEU CB C 41 41.259 41.563 -0.304 1
1 405 . 1 1 1 A 54 54 LEU N N 41 115.795 116.898 -1.103 1
1 406 . 1 1 1 A 55 55 LEU H H 42 7.823 7.746 0.077 1
1 407 . 1 1 1 A 55 55 LEU HA H 42 3.920 4.127 -0.207 1
1 416 . 1 1 1 A 55 55 LEU C C 42 180.876 178.351 2.525 1
1 417 . 1 1 1 A 55 55 LEU CA C 42 58.135 57.177 0.958 1
1 418 . 1 1 1 A 55 55 LEU CB C 42 42.196 42.118 0.078 1
1 421 . 1 1 1 A 55 55 LEU N N 42 120.499 121.557 -1.058 1
1 422 . 1 1 1 A 56 56 GLU H H 43 8.127 8.153 -0.026 1
1 423 . 1 1 1 A 56 56 GLU HA H 43 3.966 4.161 -0.195 1
1 428 . 1 1 1 A 56 56 GLU C C 43 178.801 179.212 -0.411 1
1 429 . 1 1 1 A 56 56 GLU CA C 43 60.010 59.147 0.863 1
1 430 . 1 1 1 A 56 56 GLU CB C 43 29.070 29.278 -0.208 1
1 432 . 1 1 1 A 56 56 GLU N N 43 120.955 118.637 2.318 1
1 433 . 1 1 1 A 57 57 ILE H H 44 7.504 7.667 -0.163 1
1 434 . 1 1 1 A 57 57 ILE HA H 44 4.524 3.871 0.653 1
1 444 . 1 1 1 A 57 57 ILE C C 44 175.691 176.962 -1.271 1
1 445 . 1 1 1 A 57 57 ILE CA C 44 61.886 64.241 -2.355 1
1 446 . 1 1 1 A 57 57 ILE CB C 44 37.300 38.344 -1.044 1
1 450 . 1 1 1 A 57 57 ILE N N 44 109.594 118.364 -8.770 1
1 451 . 1 1 1 A 58 58 GLY H H 45 7.724 7.566 0.158 1
1 452 . 1 1 1 A 58 58 GLY HA2 H 45 3.650 4.185 -0.535 1
1 453 . 1 1 1 A 58 58 GLY HA3 H 45 4.530 4.337 0.193 1
1 454 . 1 1 1 A 58 58 GLY C C 45 174.613 174.348 0.265 1
1 455 . 1 1 1 A 58 58 GLY CA C 45 45.947 45.577 0.370 1
1 456 . 1 1 1 A 58 58 GLY N N 45 106.680 106.456 0.224 1
1 457 . 1 1 1 A 59 59 ILE H H 46 8.180 8.053 0.127 1
1 458 . 1 1 1 A 59 59 ILE HA H 46 3.907 3.743 0.164 1
1 468 . 1 1 1 A 59 59 ILE C C 46 174.235 177.054 -2.819 1
1 469 . 1 1 1 A 59 59 ILE CA C 46 60.948 60.833 0.115 1
1 470 . 1 1 1 A 59 59 ILE CB C 46 33.980 37.963 -3.983 1
1 474 . 1 1 1 A 59 59 ILE N N 46 122.454 120.533 1.921 1
1 475 . 1 1 1 A 60 60 LEU H H 47 7.367 8.384 -1.017 1
1 476 . 1 1 1 A 60 60 LEU HA H 47 3.900 4.000 -0.100 1
1 479 . 1 1 1 A 60 60 LEU C C 47 177.753 175.675 2.078 1
1 480 . 1 1 1 A 60 60 LEU CA C 47 56.260 58.559 -2.299 1
1 481 . 1 1 1 A 60 60 LEU CB C 47 42.196 42.270 -0.074 1
1 482 . 1 1 1 A 60 60 LEU N N 47 125.835 127.949 -2.114 1
1 483 . 1 1 1 A 63 63 GLY HA2 H 50 3.980 4.022 -0.042 1
1 484 . 1 1 1 A 63 63 GLY HA3 H 50 3.950 4.088 -0.138 1
1 485 . 1 1 1 A 63 63 GLY C C 50 177.130 174.699 2.431 1
1 486 . 1 1 1 A 63 63 GLY CA C 50 46.884 45.403 1.481 1
1 487 . 1 1 1 A 64 64 HIS H H 51 7.926 8.063 -0.137 1
1 488 . 1 1 1 A 64 64 HIS HA H 51 4.451 4.559 -0.108 1
1 493 . 1 1 1 A 64 64 HIS C C 51 177.613 176.721 0.892 1
1 494 . 1 1 1 A 64 64 HIS CA C 51 57.198 57.080 0.118 1
1 495 . 1 1 1 A 64 64 HIS CB C 51 30.945 31.381 -0.436 1
1 498 . 1 1 1 A 64 64 HIS N N 51 122.284 118.002 4.282 1
1 499 . 1 1 1 A 65 65 ARG H H 52 8.105 8.501 -0.396 1
1 500 . 1 1 1 A 65 65 ARG HA H 52 3.685 3.793 -0.108 1
1 507 . 1 1 1 A 65 65 ARG C C 52 177.769 179.312 -1.543 1
1 508 . 1 1 1 A 65 65 ARG CA C 52 61.886 60.061 1.825 1
1 509 . 1 1 1 A 65 65 ARG CB C 52 30.945 30.068 0.877 1
1 511 . 1 1 1 A 65 65 ARG N N 52 117.775 120.328 -2.553 1
1 513 . 1 1 1 A 66 66 GLN H H 53 8.090 8.158 -0.068 1
1 514 . 1 1 1 A 66 66 GLN HA H 53 3.940 4.032 -0.092 1
1 519 . 1 1 1 A 66 66 GLN C C 53 178.583 178.172 0.411 1
1 520 . 1 1 1 A 66 66 GLN CA C 53 59.073 59.152 -0.079 1
1 521 . 1 1 1 A 66 66 GLN CB C 53 28.133 28.460 -0.327 1
1 523 . 1 1 1 A 66 66 GLN N N 53 116.452 118.779 -2.327 1
1 524 . 1 1 1 A 67 67 ARG H H 54 7.845 7.782 0.063 1
1 525 . 1 1 1 A 67 67 ARG HA H 54 4.010 4.014 -0.004 1
1 528 . 1 1 1 A 67 67 ARG C C 54 179.766 178.930 0.836 1
1 529 . 1 1 1 A 67 67 ARG CA C 54 59.073 58.864 0.209 1
1 530 . 1 1 1 A 67 67 ARG CB C 54 30.720 29.666 1.054 1
1 532 . 1 1 1 A 67 67 ARG N N 54 119.275 119.778 -0.503 1
1 533 . 1 1 1 A 68 68 ILE H H 55 8.032 8.028 0.004 1
1 534 . 1 1 1 A 68 68 ILE HA H 55 3.495 3.622 -0.127 1
1 544 . 1 1 1 A 68 68 ILE C C 55 177.108 178.624 -1.516 1
1 545 . 1 1 1 A 68 68 ILE CA C 55 66.230 65.218 1.012 1
1 546 . 1 1 1 A 68 68 ILE CB C 55 38.020 37.456 0.564 1
1 550 . 1 1 1 A 68 68 ILE N N 55 121.152 119.138 2.014 1
1 551 . 1 1 1 A 69 69 LEU H H 56 8.490 8.220 0.270 1
1 552 . 1 1 1 A 69 69 LEU HA H 56 4.010 3.813 0.197 1
1 561 . 1 1 1 A 69 69 LEU C C 56 179.917 178.884 1.033 1
1 562 . 1 1 1 A 69 69 LEU CA C 56 58.135 58.211 -0.076 1
1 563 . 1 1 1 A 69 69 LEU CB C 56 41.259 41.675 -0.416 1
1 566 . 1 1 1 A 69 69 LEU N N 56 119.072 120.665 -1.593 1
1 567 . 1 1 1 A 70 70 GLN H H 57 8.327 8.817 -0.490 1
1 568 . 1 1 1 A 70 70 GLN HA H 57 4.100 3.966 0.134 1
1 573 . 1 1 1 A 70 70 GLN C C 57 178.798 178.092 0.706 1
1 574 . 1 1 1 A 70 70 GLN CA C 57 59.073 58.911 0.162 1
1 575 . 1 1 1 A 70 70 GLN CB C 57 28.133 28.408 -0.275 1
1 577 . 1 1 1 A 70 70 GLN N N 57 118.172 118.279 -0.107 1
1 578 . 1 1 1 A 71 71 ALA H H 58 7.810 7.994 -0.184 1
1 579 . 1 1 1 A 71 71 ALA HA H 58 4.320 4.126 0.194 1
1 583 . 1 1 1 A 71 71 ALA C C 58 172.232 179.260 -7.028 1
1 584 . 1 1 1 A 71 71 ALA CA C 58 55.323 55.224 0.099 1
1 585 . 1 1 1 A 71 71 ALA CB C 58 19.720 18.976 0.744 1
1 586 . 1 1 1 A 71 71 ALA N N 58 122.536 122.175 0.361 1
1 587 . 1 1 1 A 72 72 ILE H H 59 8.840 8.542 0.298 1
1 588 . 1 1 1 A 72 72 ILE HA H 59 4.030 4.033 -0.003 1
1 598 . 1 1 1 A 72 72 ILE C C 59 178.678 177.604 1.074 1
1 599 . 1 1 1 A 72 72 ILE CA C 59 64.698 63.881 0.817 1
1 600 . 1 1 1 A 72 72 ILE CB C 59 37.850 37.515 0.335 1
1 604 . 1 1 1 A 72 72 ILE N N 59 118.111 119.095 -0.984 1
1 605 . 1 1 1 A 73 73 GLN H H 60 7.547 8.179 -0.632 1
1 606 . 1 1 1 A 73 73 GLN HA H 60 4.121 4.166 -0.045 1
1 611 . 1 1 1 A 73 73 GLN C C 60 176.556 178.307 -1.751 1
1 612 . 1 1 1 A 73 73 GLN CA C 60 58.135 58.447 -0.312 1
1 613 . 1 1 1 A 73 73 GLN CB C 60 28.300 28.573 -0.273 1
1 615 . 1 1 1 A 73 73 GLN N N 60 119.094 121.491 -2.397 1
1 616 . 1 1 1 A 74 74 LEU H H 61 7.350 8.097 -0.747 1
1 617 . 1 1 1 A 74 74 LEU HA H 61 4.408 4.139 0.269 1
1 626 . 1 1 1 A 74 74 LEU C C 61 177.960 177.193 0.767 1
1 627 . 1 1 1 A 74 74 LEU CA C 61 54.900 56.968 -2.068 1
1 628 . 1 1 1 A 74 74 LEU CB C 61 42.196 41.702 0.494 1
1 631 . 1 1 1 A 74 74 LEU N N 61 115.853 120.999 -5.146 1
1 632 . 1 1 1 A 75 75 LEU H H 62 7.358 7.491 -0.133 1
1 633 . 1 1 1 A 75 75 LEU HA H 62 4.530 4.404 0.126 1
1 642 . 1 1 1 A 75 75 LEU C C 62 177.035 175.742 1.293 1
1 643 . 1 1 1 A 75 75 LEU CA C 62 53.200 53.669 -0.469 1
1 644 . 1 1 1 A 75 75 LEU CB C 62 40.700 42.385 -1.685 1
1 647 . 1 1 1 A 75 75 LEU N N 62 121.010 122.450 -1.440 1
1 648 . 1 1 1 A 76 76 PRO HA H 63 4.382 4.603 -0.221 1
1 655 . 1 1 1 A 76 76 PRO CB C 63 31.883 29.343 2.540 1
1 657 . 1 1 1 A 77 77 LYS H H 64 8.418 8.156 0.262 1
1 658 . 1 1 1 A 77 77 LYS HA H 64 4.140 4.540 -0.400 1
1 663 . 1 1 1 A 77 77 LYS C C 64 177.122 175.566 1.556 1
1 664 . 1 1 1 A 77 77 LYS CA C 64 56.260 55.603 0.657 1
1 665 . 1 1 1 A 77 77 LYS CB C 64 33.340 33.551 -0.211 1
1 668 . 1 1 1 A 77 77 LYS N N 64 121.932 118.420 3.512 1
1 669 . 1 1 1 A 78 78 MET H H 65 8.550 7.705 0.845 1
1 670 . 1 1 1 A 78 78 MET HA H 65 4.304 4.936 -0.632 1
1 676 . 1 1 1 A 78 78 MET C C 65 176.105 176.193 -0.088 1
1 677 . 1 1 1 A 78 78 MET CA C 65 56.260 54.086 2.174 1
1 678 . 1 1 1 A 78 78 MET CB C 65 32.821 33.279 -0.458 1
1 680 . 1 1 1 A 78 78 MET N N 65 123.498 119.269 4.229 1
1 681 . 1 1 1 A 79 79 ARG H H 66 8.731 8.241 0.490 1
1 682 . 1 1 1 A 79 79 ARG C C 66 173.577 176.033 -2.456 1
1 683 . 1 1 1 A 79 79 ARG CA C 66 53.447 52.954 0.493 1
1 684 . 1 1 1 A 79 79 ARG CB C 66 30.008 31.504 -1.496 1
1 685 . 1 1 1 A 79 79 ARG N N 66 127.355 124.500 2.855 1
1 686 . 1 1 1 A 80 80 PRO HA H 67 4.780 4.081 0.699 1
1 693 . 1 1 1 A 80 80 PRO C C 67 177.043 178.287 -1.244 1
1 694 . 1 1 1 A 80 80 PRO CA C 67 61.886 64.878 -2.992 1
1 695 . 1 1 1 A 80 80 PRO CB C 67 32.821 31.996 0.825 1
1 698 . 1 1 1 A 81 81 ILE H H 68 8.580 7.562 1.018 1
1 699 . 1 1 1 A 81 81 ILE HA H 68 4.040 3.816 0.224 1
1 709 . 1 1 1 A 81 81 ILE C C 68 176.831 177.488 -0.657 1
1 710 . 1 1 1 A 81 81 ILE CA C 68 62.823 63.614 -0.791 1
1 711 . 1 1 1 A 81 81 ILE CB C 68 38.580 37.288 1.292 1
1 715 . 1 1 1 A 81 81 ILE N N 68 118.491 116.388 2.103 1
1 716 . 1 1 1 A 82 82 GLY H H 69 8.602 8.206 0.396 1
1 717 . 1 1 1 A 82 82 GLY CA C 69 45.009 47.369 -2.360 1
1 718 . 1 1 1 A 82 82 GLY N N 69 111.377 109.011 2.366 1
1 721 . 1 1 1 A 84 84 ASP HA H 71 4.490 4.659 -0.169 1
1 724 . 1 1 1 A 84 84 ASP CA C 71 54.385 53.597 0.788 1
1 725 . 1 1 1 A 84 84 ASP CB C 71 40.321 41.514 -1.193 1
1 726 . 1 1 1 A 85 85 GLY H H 72 8.054 8.442 -0.388 1
1 727 . 1 1 1 A 85 85 GLY HA2 H 72 4.040 4.251 -0.211 1
1 728 . 1 1 1 A 85 85 GLY HA3 H 72 3.750 4.283 -0.533 1
1 729 . 1 1 1 A 85 85 GLY C C 72 173.474 172.836 0.638 1
1 730 . 1 1 1 A 85 85 GLY CA C 72 45.009 44.960 0.049 1
1 731 . 1 1 1 A 85 85 GLY N N 72 108.038 109.552 -1.514 1
1 732 . 1 1 1 A 86 86 ALA H H 73 7.858 8.291 -0.433 1
1 733 . 1 1 1 A 86 86 ALA HA H 73 4.370 5.260 -0.890 1
1 737 . 1 1 1 A 86 86 ALA CA C 73 51.990 50.898 1.092 1
1 738 . 1 1 1 A 86 86 ALA CB C 73 19.220 23.788 -4.568 1
1 739 . 1 1 1 A 86 86 ALA N N 73 123.819 123.277 0.542 1
1 742 . 1 1 1 A 90 90 SER H H 77 7.839 7.892 -0.053 1
1 743 . 1 1 1 A 90 90 SER HA H 77 4.770 4.709 0.061 1
1 746 . 1 1 1 A 90 90 SER N N 77 115.163 112.604 2.559 1
1 747 . 1 1 1 A 91 91 VAL H H 78 8.578 9.041 -0.463 1
1 748 . 1 1 1 A 91 91 VAL HA H 78 3.981 3.929 0.052 1
1 756 . 1 1 1 A 91 91 VAL C C 78 177.480 177.404 0.076 1
1 757 . 1 1 1 A 91 91 VAL CA C 78 67.060 66.126 0.934 1
1 758 . 1 1 1 A 91 91 VAL CB C 78 32.500 31.648 0.852 1
1 761 . 1 1 1 A 91 91 VAL N N 78 123.481 124.310 -0.829 1
1 762 . 1 1 1 A 92 92 ALA H H 79 8.607 8.350 0.257 1
1 763 . 1 1 1 A 92 92 ALA HA H 79 4.113 4.055 0.058 1
1 767 . 1 1 1 A 92 92 ALA C C 79 179.868 179.483 0.385 1
1 768 . 1 1 1 A 92 92 ALA CA C 79 54.890 55.449 -0.559 1
1 769 . 1 1 1 A 92 92 ALA CB C 79 18.790 18.601 0.189 1
1 770 . 1 1 1 A 92 92 ALA N N 79 120.334 122.273 -1.939 1
1 771 . 1 1 1 A 93 93 GLU H H 80 7.886 8.406 -0.520 1
1 772 . 1 1 1 A 93 93 GLU HA H 80 4.010 3.996 0.014 1
1 777 . 1 1 1 A 93 93 GLU C C 80 179.719 178.690 1.029 1
1 778 . 1 1 1 A 93 93 GLU CA C 80 59.073 59.312 -0.239 1
1 779 . 1 1 1 A 93 93 GLU CB C 80 30.630 29.407 1.223 1
1 781 . 1 1 1 A 93 93 GLU N N 80 117.643 118.335 -0.692 1
1 782 . 1 1 1 A 94 94 TRP H H 81 8.299 8.055 0.244 1
1 783 . 1 1 1 A 94 94 TRP HA H 81 4.251 4.257 -0.006 1
1 792 . 1 1 1 A 94 94 TRP C C 81 178.772 178.343 0.429 1
1 793 . 1 1 1 A 94 94 TRP CA C 81 60.010 61.325 -1.315 1
1 794 . 1 1 1 A 94 94 TRP CB C 81 27.650 29.750 -2.100 1
1 800 . 1 1 1 A 94 94 TRP N N 81 122.545 122.419 0.126 1
1 802 . 1 1 1 A 95 95 LEU H H 82 8.505 8.588 -0.083 1
1 803 . 1 1 1 A 95 95 LEU HA H 82 2.880 3.176 -0.296 1
1 812 . 1 1 1 A 95 95 LEU C C 82 180.235 179.053 1.182 1
1 813 . 1 1 1 A 95 95 LEU CA C 82 57.400 57.115 0.285 1
1 814 . 1 1 1 A 95 95 LEU CB C 82 40.321 40.768 -0.447 1
1 817 . 1 1 1 A 95 95 LEU N N 82 121.110 119.073 2.037 1
1 818 . 1 1 1 A 96 96 ASP H H 83 8.185 8.137 0.048 1
1 819 . 1 1 1 A 96 96 ASP HA H 83 4.280 4.356 -0.076 1
1 822 . 1 1 1 A 96 96 ASP C C 83 175.224 177.395 -2.171 1
1 823 . 1 1 1 A 96 96 ASP CA C 83 57.310 56.940 0.370 1
1 824 . 1 1 1 A 96 96 ASP CB C 83 40.321 41.283 -0.962 1
1 825 . 1 1 1 A 96 96 ASP N N 83 119.082 119.963 -0.881 1
1 826 . 1 1 1 A 97 97 SER H H 84 7.989 7.697 0.292 1
1 827 . 1 1 1 A 97 97 SER HA H 84 4.250 4.501 -0.251 1
1 830 . 1 1 1 A 97 97 SER C C 84 175.346 174.334 1.012 1
1 831 . 1 1 1 A 97 97 SER CA C 84 60.948 58.339 2.609 1
1 832 . 1 1 1 A 97 97 SER CB C 84 63.370 63.930 -0.560 1
1 833 . 1 1 1 A 97 97 SER N N 84 117.579 111.810 5.769 1
1 834 . 1 1 1 A 98 98 ILE H H 85 6.862 7.550 -0.688 1
1 835 . 1 1 1 A 98 98 ILE HA H 85 4.550 4.299 0.251 1
1 843 . 1 1 1 A 98 98 ILE C C 85 173.308 175.410 -2.102 1
1 844 . 1 1 1 A 98 98 ILE CA C 85 60.948 60.286 0.662 1
1 845 . 1 1 1 A 98 98 ILE CB C 85 37.760 37.689 0.071 1
1 848 . 1 1 1 A 98 98 ILE N N 85 113.733 119.659 -5.926 1
1 849 . 1 1 1 A 99 99 GLU H H 86 7.705 8.019 -0.314 1
1 850 . 1 1 1 A 99 99 GLU HA H 86 4.280 3.858 0.422 1
1 853 . 1 1 1 A 99 99 GLU C C 86 175.224 174.763 0.461 1
1 854 . 1 1 1 A 99 99 GLU CA C 86 56.260 57.439 -1.179 1
1 855 . 1 1 1 A 99 99 GLU CB C 86 26.258 28.772 -2.514 1
1 857 . 1 1 1 A 99 99 GLU N N 86 115.493 120.833 -5.340 1
1 858 . 1 1 1 A 100 100 LEU H H 87 7.989 6.927 1.062 1
1 859 . 1 1 1 A 100 100 LEU HA H 87 4.220 4.729 -0.509 1
1 868 . 1 1 1 A 100 100 LEU C C 87 176.965 175.791 1.174 1
1 869 . 1 1 1 A 100 100 LEU CA C 87 52.510 53.348 -0.838 1
1 870 . 1 1 1 A 100 100 LEU CB C 87 42.196 46.010 -3.814 1
1 873 . 1 1 1 A 100 100 LEU N N 87 117.579 119.682 -2.103 1
1 874 . 1 1 1 A 101 101 GLY H H 88 8.503 8.208 0.295 1
1 875 . 1 1 1 A 101 101 GLY CA C 88 46.884 45.760 1.124 1
1 876 . 1 1 1 A 101 101 GLY N N 88 107.794 113.075 -5.281 1
1 877 . 1 1 1 A 102 102 ASP HA H 89 4.431 4.289 0.142 1
1 880 . 1 1 1 A 102 102 ASP C C 89 178.075 178.389 -0.314 1
1 881 . 1 1 1 A 102 102 ASP CA C 89 57.198 56.719 0.479 1
1 882 . 1 1 1 A 102 102 ASP CB C 89 40.321 40.117 0.204 1
1 883 . 1 1 1 A 103 103 TYR H H 90 7.899 8.024 -0.125 1
1 884 . 1 1 1 A 103 103 TYR HA H 90 4.940 4.437 0.503 1
1 889 . 1 1 1 A 103 103 TYR C C 90 175.527 178.542 -3.015 1
1 890 . 1 1 1 A 103 103 TYR CA C 90 58.135 60.493 -2.358 1
1 891 . 1 1 1 A 103 103 TYR CB C 90 38.446 37.603 0.843 1
1 894 . 1 1 1 A 103 103 TYR N N 90 115.595 119.308 -3.713 1
1 895 . 1 1 1 A 104 104 THR H H 91 7.971 8.376 -0.405 1
1 896 . 1 1 1 A 104 104 THR HA H 91 4.234 4.065 0.169 1
1 901 . 1 1 1 A 104 104 THR C C 91 175.905 176.775 -0.870 1
1 902 . 1 1 1 A 104 104 THR CA C 91 68.449 67.175 1.274 1
1 904 . 1 1 1 A 104 104 THR N N 91 118.867 116.748 2.119 1
1 905 . 1 1 1 A 105 105 LYS H H 92 8.555 7.966 0.589 1
1 906 . 1 1 1 A 105 105 LYS HA H 92 3.940 4.085 -0.145 1
1 912 . 1 1 1 A 105 105 LYS C C 92 177.310 178.575 -1.265 1
1 913 . 1 1 1 A 105 105 LYS CA C 92 60.948 59.528 1.420 1
1 914 . 1 1 1 A 105 105 LYS CB C 92 31.883 32.262 -0.379 1
1 917 . 1 1 1 A 105 105 LYS N N 92 119.259 121.206 -1.947 1
1 918 . 1 1 1 A 106 106 ALA H H 93 7.920 8.247 -0.327 1
1 919 . 1 1 1 A 106 106 ALA HA H 93 4.128 4.223 -0.095 1
1 923 . 1 1 1 A 106 106 ALA C C 93 180.972 180.360 0.612 1
1 924 . 1 1 1 A 106 106 ALA CA C 93 55.070 55.174 -0.104 1
1 925 . 1 1 1 A 106 106 ALA CB C 93 17.750 18.817 -1.067 1
1 926 . 1 1 1 A 106 106 ALA N N 93 120.398 120.982 -0.584 1
1 927 . 1 1 1 A 107 107 PHE H H 94 8.136 8.769 -0.633 1
1 928 . 1 1 1 A 107 107 PHE HA H 94 4.190 4.638 -0.448 1
1 934 . 1 1 1 A 107 107 PHE C C 94 177.955 178.324 -0.369 1
1 935 . 1 1 1 A 107 107 PHE CA C 94 63.761 61.625 2.136 1
1 936 . 1 1 1 A 107 107 PHE CB C 94 38.446 39.232 -0.786 1
1 940 . 1 1 1 A 107 107 PHE N N 94 117.119 116.201 0.918 1
1 941 . 1 1 1 A 108 108 LEU H H 95 8.351 8.718 -0.367 1
1 942 . 1 1 1 A 108 108 LEU HA H 95 3.889 4.005 -0.116 1
1 951 . 1 1 1 A 108 108 LEU C C 95 182.043 179.247 2.796 1
1 952 . 1 1 1 A 108 108 LEU CA C 95 59.073 58.562 0.511 1
1 953 . 1 1 1 A 108 108 LEU CB C 95 41.259 42.104 -0.845 1
1 956 . 1 1 1 A 108 108 LEU N N 95 118.450 119.802 -1.352 1
1 957 . 1 1 1 A 109 109 ILE H H 96 8.992 8.286 0.706 1
1 958 . 1 1 1 A 109 109 ILE HA H 96 4.069 3.865 0.204 1
1 968 . 1 1 1 A 109 109 ILE C C 96 177.094 177.707 -0.613 1
1 969 . 1 1 1 A 109 109 ILE CA C 96 63.761 64.050 -0.289 1
1 970 . 1 1 1 A 109 109 ILE CB C 96 37.509 37.710 -0.201 1
1 974 . 1 1 1 A 109 109 ILE N N 96 118.177 114.946 3.231 1
1 975 . 1 1 1 A 110 110 ASN H H 97 7.067 8.091 -1.024 1
1 976 . 1 1 1 A 110 110 ASN HA H 97 4.797 4.701 0.096 1
1 981 . 1 1 1 A 110 110 ASN C C 97 173.595 175.411 -1.816 1
1 982 . 1 1 1 A 110 110 ASN CA C 97 54.385 53.281 1.104 1
1 983 . 1 1 1 A 110 110 ASN CB C 97 40.321 38.985 1.336 1
1 984 . 1 1 1 A 110 110 ASN N N 97 116.407 118.952 -2.545 1
1 986 . 1 1 1 A 111 111 GLY H H 98 7.681 8.128 -0.447 1
1 987 . 1 1 1 A 111 111 GLY HA2 H 98 4.080 3.884 0.196 1
1 988 . 1 1 1 A 111 111 GLY HA3 H 98 3.640 3.982 -0.342 1
1 989 . 1 1 1 A 111 111 GLY C C 98 174.552 174.072 0.480 1
1 990 . 1 1 1 A 111 111 GLY CA C 98 45.947 44.938 1.009 1
1 991 . 1 1 1 A 111 111 GLY N N 98 104.440 105.824 -1.384 1
1 992 . 1 1 1 A 112 112 TYR H H 99 8.427 8.158 0.269 1
1 993 . 1 1 1 A 112 112 TYR HA H 99 4.661 4.739 -0.078 1
1 998 . 1 1 1 A 112 112 TYR C C 99 174.425 175.510 -1.085 1
1 999 . 1 1 1 A 112 112 TYR CA C 99 57.198 57.689 -0.491 1
1 1000 . 1 1 1 A 112 112 TYR CB C 99 36.571 38.283 -1.712 1
1 1003 . 1 1 1 A 112 112 TYR N N 99 122.830 120.084 2.746 1
1 1004 . 1 1 1 A 113 113 THR H H 100 7.166 8.809 -1.643 1
1 1005 . 1 1 1 A 113 113 THR HA H 100 4.248 4.538 -0.290 1
1 1009 . 1 1 1 A 113 113 THR C C 100 174.897 173.932 0.965 1
1 1010 . 1 1 1 A 113 113 THR CA C 100 62.290 63.301 -1.011 1
1 1011 . 1 1 1 A 113 113 THR CB C 100 68.970 70.525 -1.555 1
1 1013 . 1 1 1 A 113 113 THR N N 100 104.304 120.058 -15.754 1
1 1014 . 1 1 1 A 114 114 SER H H 101 7.695 8.017 -0.322 1
1 1015 . 1 1 1 A 114 114 SER C C 101 174.372 174.251 0.121 1
1 1016 . 1 1 1 A 114 114 SER CA C 101 56.260 57.501 -1.241 1
1 1017 . 1 1 1 A 114 114 SER CB C 101 65.636 64.948 0.688 1
1 1018 . 1 1 1 A 114 114 SER N N 101 115.613 116.007 -0.394 1
1 1023 . 1 1 1 A 116 116 ASP HA H 103 4.260 4.298 -0.038 1
1 1026 . 1 1 1 A 116 116 ASP CA C 103 57.198 57.675 -0.477 1
1 1027 . 1 1 1 A 116 116 ASP CB C 103 40.321 40.372 -0.051 1
1 1028 . 1 1 1 A 117 117 LEU H H 104 7.345 8.139 -0.794 1
1 1029 . 1 1 1 A 117 117 LEU HA H 104 4.290 4.044 0.246 1
1 1038 . 1 1 1 A 117 117 LEU C C 104 178.488 179.177 -0.689 1
1 1039 . 1 1 1 A 117 117 LEU CA C 104 56.260 58.248 -1.988 1
1 1040 . 1 1 1 A 117 117 LEU CB C 104 42.196 41.415 0.781 1
1 1043 . 1 1 1 A 117 117 LEU N N 104 117.878 121.105 -3.227 1
1 1044 . 1 1 1 A 118 118 LEU H H 105 7.514 8.176 -0.662 1
1 1045 . 1 1 1 A 118 118 LEU HA H 105 4.210 4.168 0.042 1
1 1054 . 1 1 1 A 118 118 LEU C C 105 177.002 177.689 -0.687 1
1 1055 . 1 1 1 A 118 118 LEU CA C 105 55.323 56.959 -1.636 1
1 1056 . 1 1 1 A 118 118 LEU CB C 105 42.196 41.324 0.872 1
1 1059 . 1 1 1 A 118 118 LEU N N 105 119.094 119.817 -0.723 1
1 1060 . 1 1 1 A 120 120 LYS HA H 107 4.340 4.476 -0.136 1
1 1063 . 1 1 1 A 120 120 LYS C C 107 176.603 175.765 0.838 1
1 1064 . 1 1 1 A 120 120 LYS CA C 107 55.323 55.737 -0.414 1
1 1065 . 1 1 1 A 120 120 LYS CB C 107 31.883 32.894 -1.011 1
1 1068 . 1 1 1 A 121 121 ILE H H 108 7.539 7.588 -0.049 1
1 1069 . 1 1 1 A 121 121 ILE HA H 108 3.987 5.033 -1.046 1
1 1079 . 1 1 1 A 121 121 ILE C C 108 173.247 175.073 -1.826 1
1 1080 . 1 1 1 A 121 121 ILE CA C 108 62.823 58.717 4.106 1
1 1081 . 1 1 1 A 121 121 ILE CB C 108 38.446 41.974 -3.528 1
1 1085 . 1 1 1 A 121 121 ILE N N 108 122.417 117.445 4.972 1
1 1086 . 1 1 1 A 122 122 ALA H H 109 8.290 8.290 0.000 1
1 1087 . 1 1 1 A 122 122 ALA HA H 109 3.970 4.677 -0.707 1
1 1091 . 1 1 1 A 122 122 ALA C C 109 178.318 177.699 0.619 1
1 1092 . 1 1 1 A 122 122 ALA CA C 109 50.150 49.908 0.242 1
1 1093 . 1 1 1 A 122 122 ALA CB C 109 21.630 21.136 0.494 1
1 1094 . 1 1 1 A 122 122 ALA N N 109 127.784 124.882 2.902 1
1 1095 . 1 1 1 A 123 123 GLU HA H 110 3.707 3.949 -0.242 1
1 1099 . 1 1 1 A 123 123 GLU C C 110 178.290 178.413 -0.123 1
1 1100 . 1 1 1 A 123 123 GLU CA C 110 60.948 60.225 0.723 1
1 1101 . 1 1 1 A 123 123 GLU CB C 110 29.070 29.814 -0.744 1
1 1102 . 1 1 1 A 124 124 VAL H H 111 8.333 8.282 0.051 1
1 1103 . 1 1 1 A 124 124 VAL HA H 111 3.850 3.779 0.071 1
1 1111 . 1 1 1 A 124 124 VAL C C 111 177.406 177.584 -0.178 1
1 1112 . 1 1 1 A 124 124 VAL CA C 111 65.636 65.003 0.633 1
1 1113 . 1 1 1 A 124 124 VAL CB C 111 30.730 31.236 -0.506 1
1 1116 . 1 1 1 A 124 124 VAL N N 111 114.438 118.736 -4.298 1
1 1117 . 1 1 1 A 125 125 GLU H H 112 7.442 8.340 -0.898 1
1 1118 . 1 1 1 A 125 125 GLU HA H 112 4.152 4.060 0.092 1
1 1123 . 1 1 1 A 125 125 GLU C C 112 179.982 179.193 0.789 1
1 1124 . 1 1 1 A 125 125 GLU CA C 112 60.010 59.485 0.525 1
1 1125 . 1 1 1 A 125 125 GLU CB C 112 30.008 29.111 0.897 1
1 1127 . 1 1 1 A 125 125 GLU N N 112 121.032 121.753 -0.721 1
1 1128 . 1 1 1 A 126 126 LEU H H 113 7.666 7.746 -0.080 1
1 1129 . 1 1 1 A 126 126 LEU HA H 113 3.846 4.063 -0.217 1
1 1138 . 1 1 1 A 126 126 LEU C C 113 176.991 178.676 -1.685 1
1 1139 . 1 1 1 A 126 126 LEU CA C 113 58.135 57.936 0.199 1
1 1140 . 1 1 1 A 126 126 LEU CB C 113 41.259 41.905 -0.646 1
1 1143 . 1 1 1 A 126 126 LEU N N 113 118.731 121.450 -2.719 1
1 1144 . 1 1 1 A 127 127 ILE H H 114 7.781 8.175 -0.394 1
1 1145 . 1 1 1 A 127 127 ILE HA H 114 3.502 3.935 -0.433 1
1 1153 . 1 1 1 A 127 127 ILE C C 114 178.195 177.432 0.763 1
1 1154 . 1 1 1 A 127 127 ILE CA C 114 65.636 63.632 2.004 1
1 1155 . 1 1 1 A 127 127 ILE CB C 114 40.321 37.508 2.813 1
1 1159 . 1 1 1 A 127 127 ILE N N 114 115.084 119.620 -4.536 1
1 1160 . 1 1 1 A 128 128 ASN H H 115 8.470 8.105 0.365 1
1 1161 . 1 1 1 A 128 128 ASN HA H 115 4.502 4.718 -0.216 1
1 1166 . 1 1 1 A 128 128 ASN C C 115 176.295 176.794 -0.499 1
1 1167 . 1 1 1 A 128 128 ASN CA C 115 56.260 55.272 0.988 1
1 1168 . 1 1 1 A 128 128 ASN CB C 115 39.384 39.094 0.290 1
1 1169 . 1 1 1 A 128 128 ASN N N 115 115.158 119.490 -4.332 1
1 1171 . 1 1 1 A 129 129 VAL H H 116 8.116 7.882 0.234 1
1 1172 . 1 1 1 A 129 129 VAL HA H 116 4.090 3.840 0.250 1
1 1180 . 1 1 1 A 129 129 VAL C C 116 176.740 178.055 -1.315 1
1 1181 . 1 1 1 A 129 129 VAL CA C 116 64.400 65.081 -0.681 1
1 1182 . 1 1 1 A 129 129 VAL CB C 116 32.050 31.997 0.053 1
1 1185 . 1 1 1 A 129 129 VAL N N 116 118.698 119.944 -1.246 1
1 1186 . 1 1 1 A 130 130 LEU H H 117 7.294 7.778 -0.484 1
1 1187 . 1 1 1 A 130 130 LEU HA H 117 3.970 4.043 -0.073 1
1 1196 . 1 1 1 A 130 130 LEU C C 117 175.127 176.767 -1.640 1
1 1197 . 1 1 1 A 130 130 LEU CA C 117 56.260 56.021 0.239 1
1 1198 . 1 1 1 A 130 130 LEU CB C 117 41.259 41.982 -0.723 1
1 1201 . 1 1 1 A 130 130 LEU N N 117 116.201 119.249 -3.048 1
1 1202 . 1 1 1 A 131 131 LYS H H 118 6.594 7.649 -1.055 1
1 1203 . 1 1 1 A 131 131 LYS HA H 118 3.980 4.309 -0.329 1
1 1208 . 1 1 1 A 131 131 LYS C C 118 175.589 176.619 -1.030 1
1 1209 . 1 1 1 A 131 131 LYS CA C 118 56.260 57.289 -1.029 1
1 1210 . 1 1 1 A 131 131 LYS CB C 118 28.133 31.208 -3.075 1
1 1212 . 1 1 1 A 131 131 LYS N N 118 111.172 118.705 -7.533 1
1 1213 . 1 1 1 A 132 132 ILE H H 119 8.245 8.185 0.060 1
1 1214 . 1 1 1 A 132 132 ILE HA H 119 4.090 3.831 0.259 1
1 1224 . 1 1 1 A 132 132 ILE C C 119 175.161 176.330 -1.169 1
1 1225 . 1 1 1 A 132 132 ILE CA C 119 60.010 65.407 -5.397 1
1 1226 . 1 1 1 A 132 132 ILE CB C 119 35.633 37.588 -1.955 1
1 1230 . 1 1 1 A 132 132 ILE N N 119 119.484 118.064 1.420 1
1 1231 . 1 1 1 A 133 133 ASN H H 120 8.054 8.270 -0.216 1
1 1232 . 1 1 1 A 133 133 ASN HA H 120 4.350 4.352 -0.002 1
1 1235 . 1 1 1 A 133 133 ASN C C 120 175.136 174.405 0.731 1
1 1236 . 1 1 1 A 133 133 ASN CA C 120 54.385 53.989 0.396 1
1 1237 . 1 1 1 A 133 133 ASN CB C 120 39.384 37.343 2.041 1
1 1238 . 1 1 1 A 133 133 ASN N N 120 124.670 120.385 4.285 1
1 1239 . 1 1 1 A 134 134 LEU H H 121 7.517 7.825 -0.308 1
1 1240 . 1 1 1 A 134 134 LEU HA H 121 4.678 4.516 0.162 1
1 1249 . 1 1 1 A 134 134 LEU C C 121 178.051 176.540 1.511 1
1 1250 . 1 1 1 A 134 134 LEU CA C 121 53.447 54.377 -0.930 1
1 1251 . 1 1 1 A 134 134 LEU CB C 121 41.259 44.024 -2.765 1
1 1254 . 1 1 1 A 134 134 LEU N N 121 119.918 119.177 0.741 1
1 1255 . 1 1 1 A 135 135 ILE H H 122 9.389 8.831 0.558 1
1 1256 . 1 1 1 A 135 135 ILE HA H 122 3.540 3.685 -0.145 1
1 1266 . 1 1 1 A 135 135 ILE C C 122 176.425 177.490 -1.065 1
1 1267 . 1 1 1 A 135 135 ILE CA C 122 65.636 65.083 0.553 1
1 1268 . 1 1 1 A 135 135 ILE CB C 122 38.446 38.021 0.425 1
1 1272 . 1 1 1 A 135 135 ILE N N 122 129.949 126.947 3.002 1
1 1273 . 1 1 1 A 136 136 GLY H H 123 8.675 8.389 0.286 1
1 1274 . 1 1 1 A 136 136 GLY HA2 H 123 2.650 3.196 -0.546 1
1 1275 . 1 1 1 A 136 136 GLY HA3 H 123 2.060 3.625 -1.565 1
1 1276 . 1 1 1 A 136 136 GLY C C 123 176.854 176.331 0.523 1
1 1277 . 1 1 1 A 136 136 GLY CA C 123 45.500 47.050 -1.550 1
1 1278 . 1 1 1 A 136 136 GLY N N 123 106.314 108.082 -1.768 1
1 1279 . 1 1 1 A 137 137 HIS H H 124 6.869 7.915 -1.046 1
1 1280 . 1 1 1 A 137 137 HIS HA H 124 4.558 4.539 0.019 1
1 1285 . 1 1 1 A 137 137 HIS C C 124 176.977 177.454 -0.477 1
1 1286 . 1 1 1 A 137 137 HIS CA C 124 57.198 59.016 -1.818 1
1 1287 . 1 1 1 A 137 137 HIS CB C 124 30.945 30.094 0.851 1
1 1290 . 1 1 1 A 137 137 HIS N N 124 118.865 119.949 -1.084 1
1 1291 . 1 1 1 A 138 138 ARG H H 125 7.730 8.549 -0.819 1
1 1292 . 1 1 1 A 138 138 ARG HA H 125 3.770 3.890 -0.120 1
1 1299 . 1 1 1 A 138 138 ARG C C 125 178.288 178.503 -0.215 1
1 1300 . 1 1 1 A 138 138 ARG CA C 125 61.886 59.450 2.436 1
1 1301 . 1 1 1 A 138 138 ARG CB C 125 30.945 29.878 1.067 1
1 1304 . 1 1 1 A 138 138 ARG N N 125 118.149 119.558 -1.409 1
1 1306 . 1 1 1 A 139 139 LYS H H 126 8.679 8.319 0.360 1
1 1307 . 1 1 1 A 139 139 LYS HA H 126 3.990 3.942 0.048 1
1 1310 . 1 1 1 A 139 139 LYS C C 126 179.184 178.434 0.750 1
1 1311 . 1 1 1 A 139 139 LYS CA C 126 58.135 59.492 -1.357 1
1 1312 . 1 1 1 A 139 139 LYS CB C 126 30.945 32.111 -1.166 1
1 1314 . 1 1 1 A 139 139 LYS N N 126 114.003 119.014 -5.011 1
1 1315 . 1 1 1 A 140 140 ARG H H 127 7.248 7.886 -0.638 1
1 1316 . 1 1 1 A 140 140 ARG HA H 127 3.870 3.902 -0.032 1
1 1324 . 1 1 1 A 140 140 ARG C C 127 177.772 178.872 -1.100 1
1 1325 . 1 1 1 A 140 140 ARG CA C 127 60.010 59.299 0.711 1
1 1326 . 1 1 1 A 140 140 ARG CB C 127 30.945 29.925 1.020 1
1 1329 . 1 1 1 A 140 140 ARG N N 127 120.072 117.907 2.165 1
1 1331 . 1 1 1 A 141 141 ILE H H 128 7.706 8.039 -0.333 1
1 1332 . 1 1 1 A 141 141 ILE HA H 128 3.530 3.605 -0.075 1
1 1340 . 1 1 1 A 141 141 ILE C C 128 177.669 177.989 -0.320 1
1 1341 . 1 1 1 A 141 141 ILE CA C 128 65.636 65.639 -0.003 1
1 1342 . 1 1 1 A 141 141 ILE CB C 128 38.680 37.795 0.885 1
1 1345 . 1 1 1 A 141 141 ILE N N 128 118.730 120.688 -1.958 1
1 1346 . 1 1 1 A 142 142 LEU H H 129 8.194 8.372 -0.178 1
1 1347 . 1 1 1 A 142 142 LEU HA H 129 3.950 3.977 -0.027 1
1 1356 . 1 1 1 A 142 142 LEU C C 129 179.960 178.318 1.642 1
1 1357 . 1 1 1 A 142 142 LEU CA C 129 58.135 57.998 0.137 1
1 1358 . 1 1 1 A 142 142 LEU CB C 129 41.259 41.194 0.065 1
1 1361 . 1 1 1 A 142 142 LEU N N 129 117.675 121.071 -3.396 1
1 1362 . 1 1 1 A 143 143 ALA H H 130 8.294 8.386 -0.092 1
1 1363 . 1 1 1 A 143 143 ALA HA H 130 4.220 4.052 0.168 1
1 1367 . 1 1 1 A 143 143 ALA C C 130 179.899 179.598 0.301 1
1 1368 . 1 1 1 A 143 143 ALA CA C 130 54.385 55.166 -0.781 1
1 1369 . 1 1 1 A 143 143 ALA CB C 130 19.270 18.235 1.035 1
1 1370 . 1 1 1 A 143 143 ALA N N 130 121.096 121.096 0.000 1
1 1371 . 1 1 1 A 144 144 SER H H 131 7.813 8.268 -0.455 1
1 1372 . 1 1 1 A 144 144 SER HA H 131 4.180 4.200 -0.020 1
1 1375 . 1 1 1 A 144 144 SER C C 131 175.457 177.404 -1.947 1
1 1376 . 1 1 1 A 144 144 SER CA C 131 60.948 61.643 -0.695 1
1 1377 . 1 1 1 A 144 144 SER CB C 131 63.761 62.357 1.404 1
1 1378 . 1 1 1 A 144 144 SER N N 131 112.102 113.198 -1.096 1
1 1379 . 1 1 1 A 145 145 LEU H H 132 7.747 7.874 -0.127 1
1 1380 . 1 1 1 A 145 145 LEU HA H 132 4.140 4.157 -0.017 1
1 1389 . 1 1 1 A 145 145 LEU C C 132 178.589 177.513 1.076 1
1 1390 . 1 1 1 A 145 145 LEU CA C 132 56.260 56.579 -0.319 1
1 1391 . 1 1 1 A 145 145 LEU CB C 132 42.196 42.611 -0.415 1
1 1394 . 1 1 1 A 145 145 LEU N N 132 117.536 119.135 -1.599 1
1 1395 . 1 1 1 A 146 146 GLY H H 133 7.544 7.906 -0.362 1
1 1396 . 1 1 1 A 146 146 GLY HA2 H 133 3.950 3.960 -0.010 1
1 1397 . 1 1 1 A 146 146 GLY HA3 H 133 3.100 3.968 -0.868 1
1 1398 . 1 1 1 A 146 146 GLY C C 133 173.372 174.835 -1.463 1
1 1399 . 1 1 1 A 146 146 GLY CA C 133 45.947 46.569 -0.622 1
1 1400 . 1 1 1 A 146 146 GLY N N 133 105.351 106.806 -1.455 1
1 1401 . 1 1 1 A 147 147 ASP H H 134 8.342 8.029 0.313 1
1 1402 . 1 1 1 A 147 147 ASP HA H 134 4.650 4.169 0.481 1
1 1405 . 1 1 1 A 147 147 ASP C C 134 175.462 177.006 -1.544 1
1 1406 . 1 1 1 A 147 147 ASP CA C 134 54.385 57.291 -2.906 1
1 1407 . 1 1 1 A 147 147 ASP CB C 134 41.259 41.443 -0.184 1
1 1408 . 1 1 1 A 147 147 ASP N N 134 120.133 121.361 -1.228 1
1 14 . 2 1 1 A 15 15 GLN H H 2 8.439 8.314 0.125 1
1 15 . 2 1 1 A 15 15 GLN HA H 2 4.594 4.864 -0.270 1
1 20 . 2 1 1 A 15 15 GLN C C 2 175.972 175.159 0.813 1
1 21 . 2 1 1 A 15 15 GLN CA C 2 56.260 55.387 0.873 1
1 22 . 2 1 1 A 15 15 GLN CB C 2 30.945 30.259 0.686 1
1 24 . 2 1 1 A 15 15 GLN N N 2 124.997 120.414 4.583 1
1 25 . 2 1 1 A 16 16 THR H H 3 8.347 8.955 -0.608 1
1 26 . 2 1 1 A 16 16 THR HA H 3 4.555 4.845 -0.290 1
1 31 . 2 1 1 A 16 16 THR C C 3 175.495 174.948 0.547 1
1 32 . 2 1 1 A 16 16 THR CA C 3 60.010 61.839 -1.829 1
1 33 . 2 1 1 A 16 16 THR CB C 3 71.261 71.260 0.001 1
1 34 . 2 1 1 A 16 16 THR N N 3 113.011 118.466 -5.455 1
1 35 . 2 1 1 A 17 17 VAL H H 4 8.895 8.711 0.184 1
1 36 . 2 1 1 A 17 17 VAL HA H 4 3.670 3.764 -0.094 1
1 44 . 2 1 1 A 17 17 VAL C C 4 178.449 177.883 0.566 1
1 45 . 2 1 1 A 17 17 VAL CA C 4 67.511 66.429 1.082 1
1 46 . 2 1 1 A 17 17 VAL CB C 4 31.883 32.005 -0.122 1
1 49 . 2 1 1 A 17 17 VAL N N 4 121.854 125.527 -3.673 1
1 50 . 2 1 1 A 18 18 GLY H H 5 9.017 8.177 0.840 1
1 51 . 2 1 1 A 18 18 GLY HA2 H 5 3.940 3.774 0.166 1
1 52 . 2 1 1 A 18 18 GLY HA3 H 5 3.610 3.786 -0.176 1
1 53 . 2 1 1 A 18 18 GLY C C 5 176.186 176.033 0.153 1
1 54 . 2 1 1 A 18 18 GLY CA C 5 47.822 47.246 0.576 1
1 55 . 2 1 1 A 18 18 GLY N N 5 106.966 107.848 -0.882 1
1 56 . 2 1 1 A 19 19 GLN H H 6 8.072 7.754 0.318 1
1 57 . 2 1 1 A 19 19 GLN HA H 6 4.037 4.112 -0.075 1
1 62 . 2 1 1 A 19 19 GLN C C 6 179.488 178.726 0.762 1
1 63 . 2 1 1 A 19 19 GLN CA C 6 59.073 58.992 0.081 1
1 64 . 2 1 1 A 19 19 GLN CB C 6 28.489 28.880 -0.391 1
1 66 . 2 1 1 A 19 19 GLN N N 6 122.431 121.608 0.823 1
1 67 . 2 1 1 A 20 20 TRP H H 7 8.756 8.253 0.503 1
1 68 . 2 1 1 A 20 20 TRP HA H 7 4.160 4.353 -0.193 1
1 77 . 2 1 1 A 20 20 TRP C C 7 179.620 177.842 1.778 1
1 78 . 2 1 1 A 20 20 TRP CA C 7 61.886 61.072 0.814 1
1 79 . 2 1 1 A 20 20 TRP CB C 7 28.133 29.633 -1.500 1
1 85 . 2 1 1 A 20 20 TRP N N 7 124.265 122.488 1.777 1
1 87 . 2 1 1 A 21 21 LEU H H 8 9.148 8.769 0.379 1
1 88 . 2 1 1 A 21 21 LEU HA H 8 3.440 3.569 -0.129 1
1 97 . 2 1 1 A 21 21 LEU C C 8 180.521 178.359 2.162 1
1 98 . 2 1 1 A 21 21 LEU CA C 8 56.920 58.049 -1.129 1
1 99 . 2 1 1 A 21 21 LEU CB C 8 41.700 41.573 0.127 1
1 102 . 2 1 1 A 21 21 LEU N N 8 120.548 120.651 -0.103 1
1 103 . 2 1 1 A 22 22 GLU H H 9 8.284 8.505 -0.221 1
1 104 . 2 1 1 A 22 22 GLU HA H 9 3.740 3.945 -0.205 1
1 109 . 2 1 1 A 22 22 GLU C C 9 179.960 178.434 1.526 1
1 110 . 2 1 1 A 22 22 GLU CA C 9 60.010 59.715 0.295 1
1 111 . 2 1 1 A 22 22 GLU CB C 9 29.070 29.065 0.005 1
1 113 . 2 1 1 A 22 22 GLU N N 9 120.133 119.199 0.934 1
1 114 . 2 1 1 A 23 23 SER H H 10 7.891 7.853 0.038 1
1 115 . 2 1 1 A 23 23 SER HA H 10 4.250 4.213 0.037 1
1 118 . 2 1 1 A 23 23 SER C C 10 175.346 176.454 -1.108 1
1 119 . 2 1 1 A 23 23 SER CA C 10 60.948 61.307 -0.359 1
1 120 . 2 1 1 A 23 23 SER CB C 10 63.280 62.993 0.287 1
1 121 . 2 1 1 A 23 23 SER N N 10 117.044 114.271 2.773 1
1 122 . 2 1 1 A 24 24 ILE H H 11 6.862 7.634 -0.772 1
1 123 . 2 1 1 A 24 24 ILE HA H 11 4.487 3.949 0.538 1
1 133 . 2 1 1 A 24 24 ILE C C 11 175.812 175.871 -0.059 1
1 134 . 2 1 1 A 24 24 ILE CA C 11 60.948 63.182 -2.234 1
1 135 . 2 1 1 A 24 24 ILE CB C 11 38.250 37.271 0.979 1
1 139 . 2 1 1 A 24 24 ILE N N 11 113.733 118.105 -4.372 1
1 140 . 2 1 1 A 25 25 GLY H H 12 7.628 7.679 -0.051 1
1 141 . 2 1 1 A 25 25 GLY HA2 H 12 3.990 4.104 -0.114 1
1 142 . 2 1 1 A 25 25 GLY HA3 H 12 3.800 4.132 -0.332 1
1 143 . 2 1 1 A 25 25 GLY C C 12 173.647 171.795 1.852 1
1 144 . 2 1 1 A 25 25 GLY CA C 12 45.947 45.984 -0.037 1
1 145 . 2 1 1 A 25 25 GLY N N 12 109.763 109.901 -0.138 1
1 146 . 2 1 1 A 26 26 LEU H H 13 7.620 8.163 -0.543 1
1 147 . 2 1 1 A 26 26 LEU C C 13 176.186 174.185 2.001 1
1 148 . 2 1 1 A 26 26 LEU CA C 13 52.700 51.908 0.792 1
1 149 . 2 1 1 A 26 26 LEU CB C 13 43.134 45.799 -2.665 1
1 150 . 2 1 1 A 26 26 LEU N N 13 118.778 122.006 -3.228 1
1 151 . 2 1 1 A 27 27 PRO HA H 14 4.120 4.696 -0.576 1
1 154 . 2 1 1 A 27 27 PRO C C 14 177.955 176.585 1.370 1
1 155 . 2 1 1 A 27 27 PRO CA C 14 64.698 62.256 2.442 1
1 156 . 2 1 1 A 27 27 PRO CB C 14 31.883 29.080 2.803 1
1 158 . 2 1 1 A 28 28 GLN H H 15 9.838 8.839 0.999 1
1 159 . 2 1 1 A 28 28 GLN HA H 15 4.240 4.405 -0.165 1
1 162 . 2 1 1 A 28 28 GLN C C 15 176.836 176.186 0.650 1
1 163 . 2 1 1 A 28 28 GLN CA C 15 58.135 55.969 2.166 1
1 164 . 2 1 1 A 28 28 GLN CB C 15 27.195 30.230 -3.035 1
1 166 . 2 1 1 A 28 28 GLN N N 15 120.414 122.740 -2.326 1
1 167 . 2 1 1 A 29 29 TYR H H 16 6.810 7.913 -1.103 1
1 168 . 2 1 1 A 29 29 TYR HA H 16 5.720 4.839 0.881 1
1 173 . 2 1 1 A 29 29 TYR C C 16 174.814 176.389 -1.575 1
1 174 . 2 1 1 A 29 29 TYR CA C 16 57.198 57.233 -0.035 1
1 175 . 2 1 1 A 29 29 TYR CB C 16 37.509 38.755 -1.246 1
1 178 . 2 1 1 A 29 29 TYR N N 16 119.718 116.787 2.931 1
1 179 . 2 1 1 A 30 30 GLU H H 17 7.509 8.121 -0.612 1
1 180 . 2 1 1 A 30 30 GLU HA H 17 3.650 4.036 -0.386 1
1 184 . 2 1 1 A 30 30 GLU C C 17 177.552 178.572 -1.020 1
1 185 . 2 1 1 A 30 30 GLU CA C 17 60.948 59.754 1.194 1
1 186 . 2 1 1 A 30 30 GLU CB C 17 30.008 28.767 1.241 1
1 188 . 2 1 1 A 30 30 GLU N N 17 122.417 122.646 -0.229 1
1 189 . 2 1 1 A 31 31 ASN H H 18 9.259 8.286 0.973 1
1 190 . 2 1 1 A 31 31 ASN HA H 18 4.451 4.419 0.032 1
1 193 . 2 1 1 A 31 31 ASN C C 18 176.868 178.189 -1.321 1
1 194 . 2 1 1 A 31 31 ASN CA C 18 57.198 56.345 0.853 1
1 195 . 2 1 1 A 31 31 ASN CB C 18 38.446 38.226 0.220 1
1 196 . 2 1 1 A 31 31 ASN N N 18 116.613 118.689 -2.076 1
1 197 . 2 1 1 A 32 32 HIS H H 19 8.898 8.280 0.618 1
1 198 . 2 1 1 A 32 32 HIS HA H 19 4.140 4.337 -0.197 1
1 202 . 2 1 1 A 32 32 HIS C C 19 178.269 177.784 0.485 1
1 203 . 2 1 1 A 32 32 HIS CA C 19 60.948 59.081 1.867 1
1 204 . 2 1 1 A 32 32 HIS CB C 19 30.008 30.348 -0.340 1
1 206 . 2 1 1 A 32 32 HIS N N 19 118.926 118.593 0.333 1
1 207 . 2 1 1 A 33 33 LEU H H 20 7.825 8.699 -0.874 1
1 208 . 2 1 1 A 33 33 LEU HA H 20 4.305 3.963 0.342 1
1 218 . 2 1 1 A 33 33 LEU C C 20 179.190 179.107 0.083 1
1 219 . 2 1 1 A 33 33 LEU CA C 20 60.010 58.376 1.634 1
1 220 . 2 1 1 A 33 33 LEU CB C 20 40.321 41.960 -1.639 1
1 224 . 2 1 1 A 33 33 LEU N N 20 117.434 119.885 -2.451 1
1 225 . 2 1 1 A 34 34 MET H H 21 8.861 8.533 0.328 1
1 226 . 2 1 1 A 34 34 MET HA H 21 3.980 4.124 -0.144 1
1 234 . 2 1 1 A 34 34 MET C C 21 180.340 177.956 2.384 1
1 235 . 2 1 1 A 34 34 MET CA C 21 58.135 59.138 -1.003 1
1 236 . 2 1 1 A 34 34 MET CB C 21 30.945 32.072 -1.127 1
1 238 . 2 1 1 A 34 34 MET N N 21 118.111 118.559 -0.448 1
1 239 . 2 1 1 A 35 35 ALA H H 22 9.015 8.519 0.496 1
1 240 . 2 1 1 A 35 35 ALA HA H 22 4.239 4.172 0.067 1
1 244 . 2 1 1 A 35 35 ALA C C 22 178.058 178.634 -0.576 1
1 245 . 2 1 1 A 35 35 ALA CA C 22 53.800 54.458 -0.658 1
1 246 . 2 1 1 A 35 35 ALA CB C 22 18.397 18.309 0.088 1
1 247 . 2 1 1 A 35 35 ALA N N 22 120.068 121.413 -1.345 1
1 248 . 2 1 1 A 36 36 ASN H H 23 7.143 7.993 -0.850 1
1 249 . 2 1 1 A 36 36 ASN HA H 23 4.959 4.771 0.188 1
1 254 . 2 1 1 A 36 36 ASN C C 23 174.083 175.557 -1.474 1
1 255 . 2 1 1 A 36 36 ASN CA C 23 54.000 52.998 1.002 1
1 256 . 2 1 1 A 36 36 ASN CB C 23 41.300 39.027 2.273 1
1 257 . 2 1 1 A 36 36 ASN N N 23 111.560 115.041 -3.481 1
1 259 . 2 1 1 A 37 37 GLY H H 24 7.797 8.335 -0.538 1
1 260 . 2 1 1 A 37 37 GLY HA2 H 24 3.430 3.716 -0.286 1
1 261 . 2 1 1 A 37 37 GLY HA3 H 24 3.290 3.789 -0.499 1
1 262 . 2 1 1 A 37 37 GLY C C 24 173.163 174.919 -1.756 1
1 263 . 2 1 1 A 37 37 GLY CA C 24 45.947 45.096 0.851 1
1 264 . 2 1 1 A 37 37 GLY N N 24 106.170 107.580 -1.410 1
1 265 . 2 1 1 A 38 38 PHE H H 25 8.191 7.927 0.264 1
1 266 . 2 1 1 A 38 38 PHE HA H 25 4.910 4.792 0.118 1
1 271 . 2 1 1 A 38 38 PHE C C 25 173.496 175.840 -2.344 1
1 272 . 2 1 1 A 38 38 PHE CA C 25 56.550 56.547 0.003 1
1 273 . 2 1 1 A 38 38 PHE CB C 25 37.220 36.778 0.442 1
1 276 . 2 1 1 A 38 38 PHE N N 25 122.454 119.724 2.730 1
1 277 . 2 1 1 A 39 39 ASP H H 26 6.756 8.364 -1.608 1
1 278 . 2 1 1 A 39 39 ASP HA H 26 5.077 4.849 0.228 1
1 281 . 2 1 1 A 39 39 ASP C C 26 177.463 175.785 1.678 1
1 282 . 2 1 1 A 39 39 ASP CA C 26 53.447 54.366 -0.919 1
1 283 . 2 1 1 A 39 39 ASP CB C 26 42.580 42.053 0.527 1
1 284 . 2 1 1 A 39 39 ASP N N 26 111.309 120.062 -8.753 1
1 285 . 2 1 1 A 40 40 ASN H H 27 7.495 7.891 -0.396 1
1 286 . 2 1 1 A 40 40 ASN HA H 27 4.820 5.106 -0.286 1
1 289 . 2 1 1 A 40 40 ASN C C 27 176.228 175.426 0.802 1
1 290 . 2 1 1 A 40 40 ASN CA C 27 52.510 52.044 0.466 1
1 291 . 2 1 1 A 40 40 ASN CB C 27 40.321 41.124 -0.803 1
1 292 . 2 1 1 A 40 40 ASN N N 27 118.385 117.804 0.581 1
1 293 . 2 1 1 A 41 41 VAL H H 28 9.192 8.828 0.364 1
1 294 . 2 1 1 A 41 41 VAL HA H 28 3.550 3.713 -0.163 1
1 302 . 2 1 1 A 41 41 VAL C C 28 176.429 177.906 -1.477 1
1 303 . 2 1 1 A 41 41 VAL CA C 28 65.636 65.860 -0.224 1
1 304 . 2 1 1 A 41 41 VAL CB C 28 31.883 31.617 0.266 1
1 307 . 2 1 1 A 41 41 VAL N N 28 125.741 125.780 -0.039 1
1 308 . 2 1 1 A 42 42 GLN H H 29 8.203 8.153 0.050 1
1 309 . 2 1 1 A 42 42 GLN HA H 29 4.129 4.101 0.028 1
1 314 . 2 1 1 A 42 42 GLN C C 29 176.591 178.571 -1.980 1
1 315 . 2 1 1 A 42 42 GLN CA C 29 57.198 58.378 -1.180 1
1 316 . 2 1 1 A 42 42 GLN CB C 29 28.133 28.957 -0.824 1
1 318 . 2 1 1 A 42 42 GLN N N 29 116.452 120.551 -4.099 1
1 319 . 2 1 1 A 43 43 ALA H H 30 7.781 8.506 -0.725 1
1 320 . 2 1 1 A 43 43 ALA HA H 30 4.650 4.135 0.515 1
1 324 . 2 1 1 A 43 43 ALA C C 30 175.976 178.478 -2.502 1
1 325 . 2 1 1 A 43 43 ALA CA C 30 50.840 54.123 -3.283 1
1 326 . 2 1 1 A 43 43 ALA CB C 30 19.150 18.264 0.886 1
1 327 . 2 1 1 A 43 43 ALA N N 30 122.150 121.725 0.425 1
1 328 . 2 1 1 A 44 44 MET H H 31 7.739 8.034 -0.295 1
1 332 . 2 1 1 A 44 44 MET C C 31 178.275 176.715 1.560 1
1 333 . 2 1 1 A 44 44 MET CA C 31 55.323 55.195 0.128 1
1 334 . 2 1 1 A 44 44 MET CB C 31 34.696 31.351 3.345 1
1 336 . 2 1 1 A 44 44 MET N N 31 118.149 115.152 2.997 1
1 337 . 2 1 1 A 45 45 GLY H H 32 7.611 8.134 -0.523 1
1 338 . 2 1 1 A 45 45 GLY N N 32 101.530 108.150 -6.620 1
1 339 . 2 1 1 A 47 47 ASN HA H 34 4.480 5.057 -0.577 1
1 342 . 2 1 1 A 47 47 ASN CA C 34 56.260 52.654 3.606 1
1 343 . 2 1 1 A 47 47 ASN CB C 34 39.384 41.715 -2.331 1
1 344 . 2 1 1 A 49 49 MET HA H 36 4.646 4.583 0.063 1
1 350 . 2 1 1 A 49 49 MET C C 36 173.651 176.265 -2.614 1
1 351 . 2 1 1 A 49 49 MET CA C 36 55.323 56.011 -0.688 1
1 352 . 2 1 1 A 49 49 MET CB C 36 35.633 33.322 2.311 1
1 355 . 2 1 1 A 50 50 GLU H H 37 9.203 8.211 0.992 1
1 356 . 2 1 1 A 50 50 GLU HA H 37 4.650 4.729 -0.079 1
1 361 . 2 1 1 A 50 50 GLU C C 37 177.008 176.282 0.726 1
1 362 . 2 1 1 A 50 50 GLU CA C 37 54.385 54.887 -0.502 1
1 363 . 2 1 1 A 50 50 GLU CB C 37 33.758 33.116 0.642 1
1 365 . 2 1 1 A 50 50 GLU N N 37 123.229 121.379 1.850 1
1 366 . 2 1 1 A 51 51 ASP H H 38 9.032 9.040 -0.008 1
1 367 . 2 1 1 A 51 51 ASP HA H 38 4.149 4.396 -0.247 1
1 370 . 2 1 1 A 51 51 ASP C C 38 177.994 178.288 -0.294 1
1 371 . 2 1 1 A 51 51 ASP CA C 38 59.073 57.157 1.916 1
1 372 . 2 1 1 A 51 51 ASP CB C 38 43.134 39.778 3.356 1
1 373 . 2 1 1 A 51 51 ASP N N 38 122.717 123.174 -0.457 1
1 374 . 2 1 1 A 52 52 GLN H H 39 8.950 8.197 0.753 1
1 375 . 2 1 1 A 52 52 GLN HA H 39 3.940 4.050 -0.110 1
1 378 . 2 1 1 A 52 52 GLN C C 39 177.817 178.156 -0.339 1
1 379 . 2 1 1 A 52 52 GLN CA C 39 59.073 58.959 0.114 1
1 380 . 2 1 1 A 52 52 GLN CB C 39 28.133 28.889 -0.756 1
1 381 . 2 1 1 A 52 52 GLN N N 39 114.086 118.946 -4.860 1
1 382 . 2 1 1 A 53 53 ASP H H 40 7.214 8.139 -0.925 1
1 383 . 2 1 1 A 53 53 ASP HA H 40 4.370 4.457 -0.087 1
1 386 . 2 1 1 A 53 53 ASP C C 40 177.667 178.990 -1.323 1
1 387 . 2 1 1 A 53 53 ASP CA C 40 57.198 57.367 -0.169 1
1 388 . 2 1 1 A 53 53 ASP CB C 40 41.800 40.566 1.234 1
1 389 . 2 1 1 A 53 53 ASP N N 40 118.734 119.377 -0.643 1
1 390 . 2 1 1 A 54 54 LEU H H 41 7.180 8.272 -1.092 1
1 391 . 2 1 1 A 54 54 LEU HA H 41 3.990 3.995 -0.005 1
1 400 . 2 1 1 A 54 54 LEU C C 41 178.204 179.628 -1.424 1
1 401 . 2 1 1 A 54 54 LEU CA C 41 56.260 57.906 -1.646 1
1 402 . 2 1 1 A 54 54 LEU CB C 41 41.259 41.894 -0.635 1
1 405 . 2 1 1 A 54 54 LEU N N 41 115.795 121.218 -5.423 1
1 406 . 2 1 1 A 55 55 LEU H H 42 7.823 8.513 -0.690 1
1 407 . 2 1 1 A 55 55 LEU HA H 42 3.920 4.106 -0.186 1
1 416 . 2 1 1 A 55 55 LEU C C 42 180.876 178.625 2.251 1
1 417 . 2 1 1 A 55 55 LEU CA C 42 58.135 57.591 0.544 1
1 418 . 2 1 1 A 55 55 LEU CB C 42 42.196 41.138 1.058 1
1 421 . 2 1 1 A 55 55 LEU N N 42 120.499 119.571 0.928 1
1 422 . 2 1 1 A 56 56 GLU H H 43 8.127 8.132 -0.005 1
1 423 . 2 1 1 A 56 56 GLU HA H 43 3.966 4.130 -0.164 1
1 428 . 2 1 1 A 56 56 GLU C C 43 178.801 178.957 -0.156 1
1 429 . 2 1 1 A 56 56 GLU CA C 43 60.010 59.035 0.975 1
1 430 . 2 1 1 A 56 56 GLU CB C 43 29.070 29.140 -0.070 1
1 432 . 2 1 1 A 56 56 GLU N N 43 120.955 118.855 2.100 1
1 433 . 2 1 1 A 57 57 ILE H H 44 7.504 7.664 -0.160 1
1 434 . 2 1 1 A 57 57 ILE HA H 44 4.524 3.993 0.531 1
1 444 . 2 1 1 A 57 57 ILE C C 44 175.691 176.676 -0.985 1
1 445 . 2 1 1 A 57 57 ILE CA C 44 61.886 63.758 -1.872 1
1 446 . 2 1 1 A 57 57 ILE CB C 44 37.300 38.397 -1.097 1
1 450 . 2 1 1 A 57 57 ILE N N 44 109.594 117.720 -8.126 1
1 451 . 2 1 1 A 58 58 GLY H H 45 7.724 7.410 0.314 1
1 452 . 2 1 1 A 58 58 GLY HA2 H 45 3.650 4.160 -0.510 1
1 453 . 2 1 1 A 58 58 GLY HA3 H 45 4.530 4.312 0.218 1
1 454 . 2 1 1 A 58 58 GLY C C 45 174.613 175.511 -0.898 1
1 455 . 2 1 1 A 58 58 GLY CA C 45 45.947 45.363 0.584 1
1 456 . 2 1 1 A 58 58 GLY N N 45 106.680 107.527 -0.847 1
1 457 . 2 1 1 A 59 59 ILE H H 46 8.180 7.608 0.572 1
1 458 . 2 1 1 A 59 59 ILE HA H 46 3.907 4.249 -0.342 1
1 468 . 2 1 1 A 59 59 ILE C C 46 174.235 177.595 -3.360 1
1 469 . 2 1 1 A 59 59 ILE CA C 46 60.948 63.083 -2.135 1
1 470 . 2 1 1 A 59 59 ILE CB C 46 33.980 37.758 -3.778 1
1 474 . 2 1 1 A 59 59 ILE N N 46 122.454 117.241 5.213 1
1 475 . 2 1 1 A 60 60 LEU H H 47 7.367 8.096 -0.729 1
1 476 . 2 1 1 A 60 60 LEU HA H 47 3.900 4.074 -0.174 1
1 479 . 2 1 1 A 60 60 LEU C C 47 177.753 178.626 -0.873 1
1 480 . 2 1 1 A 60 60 LEU CA C 47 56.260 57.684 -1.424 1
1 481 . 2 1 1 A 60 60 LEU CB C 47 42.196 41.694 0.502 1
1 482 . 2 1 1 A 60 60 LEU N N 47 125.835 122.529 3.306 1
1 483 . 2 1 1 A 63 63 GLY HA2 H 50 3.980 4.170 -0.190 1
1 484 . 2 1 1 A 63 63 GLY HA3 H 50 3.950 4.180 -0.230 1
1 485 . 2 1 1 A 63 63 GLY C C 50 177.130 174.510 2.620 1
1 486 . 2 1 1 A 63 63 GLY CA C 50 46.884 45.626 1.258 1
1 487 . 2 1 1 A 64 64 HIS H H 51 7.926 8.190 -0.264 1
1 488 . 2 1 1 A 64 64 HIS HA H 51 4.451 4.728 -0.277 1
1 493 . 2 1 1 A 64 64 HIS C C 51 177.613 176.131 1.482 1
1 494 . 2 1 1 A 64 64 HIS CA C 51 57.198 55.522 1.676 1
1 495 . 2 1 1 A 64 64 HIS CB C 51 30.945 30.498 0.447 1
1 498 . 2 1 1 A 64 64 HIS N N 51 122.284 119.414 2.870 1
1 499 . 2 1 1 A 65 65 ARG H H 52 8.105 7.923 0.182 1
1 500 . 2 1 1 A 65 65 ARG HA H 52 3.685 3.675 0.010 1
1 507 . 2 1 1 A 65 65 ARG C C 52 177.769 178.157 -0.388 1
1 508 . 2 1 1 A 65 65 ARG CA C 52 61.886 59.706 2.180 1
1 509 . 2 1 1 A 65 65 ARG CB C 52 30.945 29.709 1.236 1
1 511 . 2 1 1 A 65 65 ARG N N 52 117.775 120.150 -2.375 1
1 513 . 2 1 1 A 66 66 GLN H H 53 8.090 8.175 -0.085 1
1 514 . 2 1 1 A 66 66 GLN HA H 53 3.940 3.888 0.052 1
1 519 . 2 1 1 A 66 66 GLN C C 53 178.583 178.556 0.027 1
1 520 . 2 1 1 A 66 66 GLN CA C 53 59.073 59.302 -0.229 1
1 521 . 2 1 1 A 66 66 GLN CB C 53 28.133 27.836 0.297 1
1 523 . 2 1 1 A 66 66 GLN N N 53 116.452 117.656 -1.204 1
1 524 . 2 1 1 A 67 67 ARG H H 54 7.845 7.735 0.110 1
1 525 . 2 1 1 A 67 67 ARG HA H 54 4.010 3.824 0.186 1
1 528 . 2 1 1 A 67 67 ARG C C 54 179.766 178.629 1.137 1
1 529 . 2 1 1 A 67 67 ARG CA C 54 59.073 58.895 0.178 1
1 530 . 2 1 1 A 67 67 ARG CB C 54 30.720 29.525 1.195 1
1 532 . 2 1 1 A 67 67 ARG N N 54 119.275 119.682 -0.407 1
1 533 . 2 1 1 A 68 68 ILE H H 55 8.032 7.676 0.356 1
1 534 . 2 1 1 A 68 68 ILE HA H 55 3.495 3.402 0.093 1
1 544 . 2 1 1 A 68 68 ILE C C 55 177.108 178.490 -1.382 1
1 545 . 2 1 1 A 68 68 ILE CA C 55 66.230 65.415 0.815 1
1 546 . 2 1 1 A 68 68 ILE CB C 55 38.020 37.813 0.207 1
1 550 . 2 1 1 A 68 68 ILE N N 55 121.152 120.095 1.057 1
1 551 . 2 1 1 A 69 69 LEU H H 56 8.490 8.500 -0.010 1
1 552 . 2 1 1 A 69 69 LEU HA H 56 4.010 3.798 0.212 1
1 561 . 2 1 1 A 69 69 LEU C C 56 179.917 178.882 1.035 1
1 562 . 2 1 1 A 69 69 LEU CA C 56 58.135 58.198 -0.063 1
1 563 . 2 1 1 A 69 69 LEU CB C 56 41.259 41.691 -0.432 1
1 566 . 2 1 1 A 69 69 LEU N N 56 119.072 120.151 -1.079 1
1 567 . 2 1 1 A 70 70 GLN H H 57 8.327 8.466 -0.139 1
1 568 . 2 1 1 A 70 70 GLN HA H 57 4.100 4.037 0.063 1
1 573 . 2 1 1 A 70 70 GLN C C 57 178.798 178.456 0.342 1
1 574 . 2 1 1 A 70 70 GLN CA C 57 59.073 58.783 0.290 1
1 575 . 2 1 1 A 70 70 GLN CB C 57 28.133 28.458 -0.325 1
1 577 . 2 1 1 A 70 70 GLN N N 57 118.172 117.291 0.881 1
1 578 . 2 1 1 A 71 71 ALA H H 58 7.810 7.753 0.057 1
1 579 . 2 1 1 A 71 71 ALA HA H 58 4.320 4.107 0.213 1
1 583 . 2 1 1 A 71 71 ALA C C 58 172.232 179.515 -7.283 1
1 584 . 2 1 1 A 71 71 ALA CA C 58 55.323 55.225 0.098 1
1 585 . 2 1 1 A 71 71 ALA CB C 58 19.720 18.716 1.004 1
1 586 . 2 1 1 A 71 71 ALA N N 58 122.536 122.161 0.375 1
1 587 . 2 1 1 A 72 72 ILE H H 59 8.840 8.587 0.253 1
1 588 . 2 1 1 A 72 72 ILE HA H 59 4.030 4.002 0.028 1
1 598 . 2 1 1 A 72 72 ILE C C 59 178.678 177.670 1.008 1
1 599 . 2 1 1 A 72 72 ILE CA C 59 64.698 63.877 0.821 1
1 600 . 2 1 1 A 72 72 ILE CB C 59 37.850 37.466 0.384 1
1 604 . 2 1 1 A 72 72 ILE N N 59 118.111 118.842 -0.731 1
1 605 . 2 1 1 A 73 73 GLN H H 60 7.547 8.157 -0.610 1
1 606 . 2 1 1 A 73 73 GLN HA H 60 4.121 4.084 0.037 1
1 611 . 2 1 1 A 73 73 GLN C C 60 176.556 178.217 -1.661 1
1 612 . 2 1 1 A 73 73 GLN CA C 60 58.135 58.662 -0.527 1
1 613 . 2 1 1 A 73 73 GLN CB C 60 28.300 28.618 -0.318 1
1 615 . 2 1 1 A 73 73 GLN N N 60 119.094 121.106 -2.012 1
1 616 . 2 1 1 A 74 74 LEU H H 61 7.350 7.725 -0.375 1
1 617 . 2 1 1 A 74 74 LEU HA H 61 4.408 4.308 0.100 1
1 626 . 2 1 1 A 74 74 LEU C C 61 177.960 177.286 0.674 1
1 627 . 2 1 1 A 74 74 LEU CA C 61 54.900 55.841 -0.941 1
1 628 . 2 1 1 A 74 74 LEU CB C 61 42.196 42.782 -0.586 1
1 631 . 2 1 1 A 74 74 LEU N N 61 115.853 118.567 -2.714 1
1 632 . 2 1 1 A 75 75 LEU H H 62 7.358 7.526 -0.168 1
1 633 . 2 1 1 A 75 75 LEU HA H 62 4.530 4.454 0.076 1
1 642 . 2 1 1 A 75 75 LEU C C 62 177.035 176.781 0.254 1
1 643 . 2 1 1 A 75 75 LEU CA C 62 53.200 53.794 -0.594 1
1 644 . 2 1 1 A 75 75 LEU CB C 62 40.700 41.401 -0.701 1
1 647 . 2 1 1 A 75 75 LEU N N 62 121.010 120.754 0.256 1
1 648 . 2 1 1 A 76 76 PRO HA H 63 4.382 4.352 0.030 1
1 655 . 2 1 1 A 76 76 PRO CB C 63 31.883 31.973 -0.090 1
1 657 . 2 1 1 A 77 77 LYS H H 64 8.418 7.961 0.457 1
1 658 . 2 1 1 A 77 77 LYS HA H 64 4.140 3.926 0.214 1
1 663 . 2 1 1 A 77 77 LYS C C 64 177.122 175.236 1.886 1
1 664 . 2 1 1 A 77 77 LYS CA C 64 56.260 57.098 -0.838 1
1 665 . 2 1 1 A 77 77 LYS CB C 64 33.340 30.134 3.206 1
1 668 . 2 1 1 A 77 77 LYS N N 64 121.932 117.447 4.485 1
1 669 . 2 1 1 A 78 78 MET H H 65 8.550 7.389 1.161 1
1 670 . 2 1 1 A 78 78 MET HA H 65 4.304 5.151 -0.847 1
1 676 . 2 1 1 A 78 78 MET C C 65 176.105 174.622 1.483 1
1 677 . 2 1 1 A 78 78 MET CA C 65 56.260 54.270 1.990 1
1 678 . 2 1 1 A 78 78 MET CB C 65 32.821 38.061 -5.240 1
1 680 . 2 1 1 A 78 78 MET N N 65 123.498 118.630 4.868 1
1 681 . 2 1 1 A 79 79 ARG H H 66 8.731 8.619 0.112 1
1 682 . 2 1 1 A 79 79 ARG C C 66 173.577 176.085 -2.508 1
1 683 . 2 1 1 A 79 79 ARG CA C 66 53.447 54.678 -1.231 1
1 684 . 2 1 1 A 79 79 ARG CB C 66 30.008 32.482 -2.474 1
1 685 . 2 1 1 A 79 79 ARG N N 66 127.355 117.808 9.547 1
1 686 . 2 1 1 A 80 80 PRO HA H 67 4.780 4.418 0.362 1
1 693 . 2 1 1 A 80 80 PRO C C 67 177.043 178.042 -0.999 1
1 694 . 2 1 1 A 80 80 PRO CA C 67 61.886 64.383 -2.497 1
1 695 . 2 1 1 A 80 80 PRO CB C 67 32.821 31.852 0.969 1
1 698 . 2 1 1 A 81 81 ILE H H 68 8.580 7.712 0.868 1
1 699 . 2 1 1 A 81 81 ILE HA H 68 4.040 3.768 0.272 1
1 709 . 2 1 1 A 81 81 ILE C C 68 176.831 177.059 -0.228 1
1 710 . 2 1 1 A 81 81 ILE CA C 68 62.823 63.807 -0.984 1
1 711 . 2 1 1 A 81 81 ILE CB C 68 38.580 38.120 0.460 1
1 715 . 2 1 1 A 81 81 ILE N N 68 118.491 117.220 1.271 1
1 716 . 2 1 1 A 82 82 GLY H H 69 8.602 7.616 0.986 1
1 717 . 2 1 1 A 82 82 GLY CA C 69 45.009 47.032 -2.023 1
1 718 . 2 1 1 A 82 82 GLY N N 69 111.377 110.363 1.014 1
1 721 . 2 1 1 A 84 84 ASP HA H 71 4.490 5.127 -0.637 1
1 724 . 2 1 1 A 84 84 ASP CA C 71 54.385 52.761 1.624 1
1 725 . 2 1 1 A 84 84 ASP CB C 71 40.321 43.435 -3.114 1
1 726 . 2 1 1 A 85 85 GLY H H 72 8.054 8.289 -0.235 1
1 727 . 2 1 1 A 85 85 GLY HA2 H 72 4.040 4.054 -0.014 1
1 728 . 2 1 1 A 85 85 GLY HA3 H 72 3.750 4.066 -0.316 1
1 729 . 2 1 1 A 85 85 GLY C C 72 173.474 172.989 0.485 1
1 730 . 2 1 1 A 85 85 GLY CA C 72 45.009 44.586 0.423 1
1 731 . 2 1 1 A 85 85 GLY N N 72 108.038 108.260 -0.222 1
1 732 . 2 1 1 A 86 86 ALA H H 73 7.858 8.187 -0.329 1
1 733 . 2 1 1 A 86 86 ALA HA H 73 4.370 4.919 -0.549 1
1 737 . 2 1 1 A 86 86 ALA CA C 73 51.990 51.199 0.791 1
1 738 . 2 1 1 A 86 86 ALA CB C 73 19.220 21.041 -1.821 1
1 739 . 2 1 1 A 86 86 ALA N N 73 123.819 125.955 -2.136 1
1 742 . 2 1 1 A 90 90 SER H H 77 7.839 8.571 -0.732 1
1 743 . 2 1 1 A 90 90 SER HA H 77 4.770 4.637 0.133 1
1 746 . 2 1 1 A 90 90 SER N N 77 115.163 116.531 -1.368 1
1 747 . 2 1 1 A 91 91 VAL H H 78 8.578 8.896 -0.318 1
1 748 . 2 1 1 A 91 91 VAL HA H 78 3.981 3.975 0.006 1
1 756 . 2 1 1 A 91 91 VAL C C 78 177.480 177.033 0.447 1
1 757 . 2 1 1 A 91 91 VAL CA C 78 67.060 66.453 0.607 1
1 758 . 2 1 1 A 91 91 VAL CB C 78 32.500 31.792 0.708 1
1 761 . 2 1 1 A 91 91 VAL N N 78 123.481 123.632 -0.151 1
1 762 . 2 1 1 A 92 92 ALA H H 79 8.607 8.367 0.240 1
1 763 . 2 1 1 A 92 92 ALA HA H 79 4.113 4.071 0.042 1
1 767 . 2 1 1 A 92 92 ALA C C 79 179.868 179.352 0.516 1
1 768 . 2 1 1 A 92 92 ALA CA C 79 54.890 55.749 -0.859 1
1 769 . 2 1 1 A 92 92 ALA CB C 79 18.790 18.379 0.411 1
1 770 . 2 1 1 A 92 92 ALA N N 79 120.334 122.451 -2.117 1
1 771 . 2 1 1 A 93 93 GLU H H 80 7.886 8.122 -0.236 1
1 772 . 2 1 1 A 93 93 GLU HA H 80 4.010 4.086 -0.076 1
1 777 . 2 1 1 A 93 93 GLU C C 80 179.719 178.815 0.904 1
1 778 . 2 1 1 A 93 93 GLU CA C 80 59.073 59.185 -0.112 1
1 779 . 2 1 1 A 93 93 GLU CB C 80 30.630 29.348 1.282 1
1 781 . 2 1 1 A 93 93 GLU N N 80 117.643 118.663 -1.020 1
1 782 . 2 1 1 A 94 94 TRP H H 81 8.299 8.145 0.154 1
1 783 . 2 1 1 A 94 94 TRP HA H 81 4.251 4.412 -0.161 1
1 792 . 2 1 1 A 94 94 TRP C C 81 178.772 178.363 0.409 1
1 793 . 2 1 1 A 94 94 TRP CA C 81 60.010 61.450 -1.440 1
1 794 . 2 1 1 A 94 94 TRP CB C 81 27.650 30.127 -2.477 1
1 800 . 2 1 1 A 94 94 TRP N N 81 122.545 122.369 0.176 1
1 802 . 2 1 1 A 95 95 LEU H H 82 8.505 8.423 0.082 1
1 803 . 2 1 1 A 95 95 LEU HA H 82 2.880 3.203 -0.323 1
1 812 . 2 1 1 A 95 95 LEU C C 82 180.235 178.960 1.275 1
1 813 . 2 1 1 A 95 95 LEU CA C 82 57.400 56.867 0.533 1
1 814 . 2 1 1 A 95 95 LEU CB C 82 40.321 40.586 -0.265 1
1 817 . 2 1 1 A 95 95 LEU N N 82 121.110 119.266 1.844 1
1 818 . 2 1 1 A 96 96 ASP H H 83 8.185 8.501 -0.316 1
1 819 . 2 1 1 A 96 96 ASP HA H 83 4.280 4.356 -0.076 1
1 822 . 2 1 1 A 96 96 ASP C C 83 175.224 177.553 -2.329 1
1 823 . 2 1 1 A 96 96 ASP CA C 83 57.310 57.063 0.247 1
1 824 . 2 1 1 A 96 96 ASP CB C 83 40.321 41.434 -1.113 1
1 825 . 2 1 1 A 96 96 ASP N N 83 119.082 120.185 -1.103 1
1 826 . 2 1 1 A 97 97 SER H H 84 7.989 7.596 0.393 1
1 827 . 2 1 1 A 97 97 SER HA H 84 4.250 4.406 -0.156 1
1 830 . 2 1 1 A 97 97 SER C C 84 175.346 174.924 0.422 1
1 831 . 2 1 1 A 97 97 SER CA C 84 60.948 58.497 2.451 1
1 832 . 2 1 1 A 97 97 SER CB C 84 63.370 63.418 -0.048 1
1 833 . 2 1 1 A 97 97 SER N N 84 117.579 111.450 6.129 1
1 834 . 2 1 1 A 98 98 ILE H H 85 6.862 7.553 -0.691 1
1 835 . 2 1 1 A 98 98 ILE HA H 85 4.550 4.316 0.234 1
1 843 . 2 1 1 A 98 98 ILE C C 85 173.308 175.360 -2.052 1
1 844 . 2 1 1 A 98 98 ILE CA C 85 60.948 60.288 0.660 1
1 845 . 2 1 1 A 98 98 ILE CB C 85 37.760 37.956 -0.196 1
1 848 . 2 1 1 A 98 98 ILE N N 85 113.733 119.482 -5.749 1
1 849 . 2 1 1 A 99 99 GLU H H 86 7.705 7.907 -0.202 1
1 850 . 2 1 1 A 99 99 GLU HA H 86 4.280 3.822 0.458 1
1 853 . 2 1 1 A 99 99 GLU C C 86 175.224 174.606 0.618 1
1 854 . 2 1 1 A 99 99 GLU CA C 86 56.260 57.571 -1.311 1
1 855 . 2 1 1 A 99 99 GLU CB C 86 26.258 27.072 -0.814 1
1 857 . 2 1 1 A 99 99 GLU N N 86 115.493 118.457 -2.964 1
1 858 . 2 1 1 A 100 100 LEU H H 87 7.989 7.260 0.729 1
1 859 . 2 1 1 A 100 100 LEU HA H 87 4.220 4.577 -0.357 1
1 868 . 2 1 1 A 100 100 LEU C C 87 176.965 175.864 1.101 1
1 869 . 2 1 1 A 100 100 LEU CA C 87 52.510 53.280 -0.770 1
1 870 . 2 1 1 A 100 100 LEU CB C 87 42.196 44.442 -2.246 1
1 873 . 2 1 1 A 100 100 LEU N N 87 117.579 119.371 -1.792 1
1 874 . 2 1 1 A 101 101 GLY H H 88 8.503 8.159 0.344 1
1 875 . 2 1 1 A 101 101 GLY CA C 88 46.884 45.804 1.080 1
1 876 . 2 1 1 A 101 101 GLY N N 88 107.794 114.320 -6.526 1
1 877 . 2 1 1 A 102 102 ASP HA H 89 4.431 4.243 0.188 1
1 880 . 2 1 1 A 102 102 ASP C C 89 178.075 178.092 -0.017 1
1 881 . 2 1 1 A 102 102 ASP CA C 89 57.198 57.134 0.064 1
1 882 . 2 1 1 A 102 102 ASP CB C 89 40.321 41.298 -0.977 1
1 883 . 2 1 1 A 103 103 TYR H H 90 7.899 8.058 -0.159 1
1 884 . 2 1 1 A 103 103 TYR HA H 90 4.940 4.412 0.528 1
1 889 . 2 1 1 A 103 103 TYR C C 90 175.527 178.523 -2.996 1
1 890 . 2 1 1 A 103 103 TYR CA C 90 58.135 60.502 -2.367 1
1 891 . 2 1 1 A 103 103 TYR CB C 90 38.446 37.475 0.971 1
1 894 . 2 1 1 A 103 103 TYR N N 90 115.595 119.670 -4.075 1
1 895 . 2 1 1 A 104 104 THR H H 91 7.971 8.367 -0.396 1
1 896 . 2 1 1 A 104 104 THR HA H 91 4.234 3.991 0.243 1
1 901 . 2 1 1 A 104 104 THR C C 91 175.905 176.472 -0.567 1
1 902 . 2 1 1 A 104 104 THR CA C 91 68.449 67.180 1.269 1
1 904 . 2 1 1 A 104 104 THR N N 91 118.867 116.705 2.162 1
1 905 . 2 1 1 A 105 105 LYS H H 92 8.555 7.849 0.706 1
1 906 . 2 1 1 A 105 105 LYS HA H 92 3.940 4.072 -0.132 1
1 912 . 2 1 1 A 105 105 LYS C C 92 177.310 178.631 -1.321 1
1 913 . 2 1 1 A 105 105 LYS CA C 92 60.948 59.482 1.466 1
1 914 . 2 1 1 A 105 105 LYS CB C 92 31.883 32.397 -0.514 1
1 917 . 2 1 1 A 105 105 LYS N N 92 119.259 120.930 -1.671 1
1 918 . 2 1 1 A 106 106 ALA H H 93 7.920 8.054 -0.134 1
1 919 . 2 1 1 A 106 106 ALA HA H 93 4.128 4.169 -0.041 1
1 923 . 2 1 1 A 106 106 ALA C C 93 180.972 180.397 0.575 1
1 924 . 2 1 1 A 106 106 ALA CA C 93 55.070 55.098 -0.028 1
1 925 . 2 1 1 A 106 106 ALA CB C 93 17.750 18.528 -0.778 1
1 926 . 2 1 1 A 106 106 ALA N N 93 120.398 121.338 -0.940 1
1 927 . 2 1 1 A 107 107 PHE H H 94 8.136 8.770 -0.634 1
1 928 . 2 1 1 A 107 107 PHE HA H 94 4.190 4.629 -0.439 1
1 934 . 2 1 1 A 107 107 PHE C C 94 177.955 178.318 -0.363 1
1 935 . 2 1 1 A 107 107 PHE CA C 94 63.761 61.583 2.178 1
1 936 . 2 1 1 A 107 107 PHE CB C 94 38.446 39.052 -0.606 1
1 940 . 2 1 1 A 107 107 PHE N N 94 117.119 116.186 0.933 1
1 941 . 2 1 1 A 108 108 LEU H H 95 8.351 8.660 -0.309 1
1 942 . 2 1 1 A 108 108 LEU HA H 95 3.889 3.977 -0.088 1
1 951 . 2 1 1 A 108 108 LEU C C 95 182.043 179.208 2.835 1
1 952 . 2 1 1 A 108 108 LEU CA C 95 59.073 58.560 0.513 1
1 953 . 2 1 1 A 108 108 LEU CB C 95 41.259 42.043 -0.784 1
1 956 . 2 1 1 A 108 108 LEU N N 95 118.450 119.819 -1.369 1
1 957 . 2 1 1 A 109 109 ILE H H 96 8.992 8.149 0.843 1
1 958 . 2 1 1 A 109 109 ILE HA H 96 4.069 3.837 0.232 1
1 968 . 2 1 1 A 109 109 ILE C C 96 177.094 177.867 -0.773 1
1 969 . 2 1 1 A 109 109 ILE CA C 96 63.761 64.474 -0.713 1
1 970 . 2 1 1 A 109 109 ILE CB C 96 37.509 37.665 -0.156 1
1 974 . 2 1 1 A 109 109 ILE N N 96 118.177 115.147 3.030 1
1 975 . 2 1 1 A 110 110 ASN H H 97 7.067 7.989 -0.922 1
1 976 . 2 1 1 A 110 110 ASN HA H 97 4.797 4.616 0.181 1
1 981 . 2 1 1 A 110 110 ASN C C 97 173.595 175.345 -1.750 1
1 982 . 2 1 1 A 110 110 ASN CA C 97 54.385 53.461 0.924 1
1 983 . 2 1 1 A 110 110 ASN CB C 97 40.321 38.662 1.659 1
1 984 . 2 1 1 A 110 110 ASN N N 97 116.407 119.561 -3.154 1
1 986 . 2 1 1 A 111 111 GLY H H 98 7.681 8.005 -0.324 1
1 987 . 2 1 1 A 111 111 GLY HA2 H 98 4.080 3.943 0.137 1
1 988 . 2 1 1 A 111 111 GLY HA3 H 98 3.640 4.036 -0.396 1
1 989 . 2 1 1 A 111 111 GLY C C 98 174.552 174.086 0.466 1
1 990 . 2 1 1 A 111 111 GLY CA C 98 45.947 44.941 1.006 1
1 991 . 2 1 1 A 111 111 GLY N N 98 104.440 105.743 -1.303 1
1 992 . 2 1 1 A 112 112 TYR H H 99 8.427 8.182 0.245 1
1 993 . 2 1 1 A 112 112 TYR HA H 99 4.661 4.748 -0.087 1
1 998 . 2 1 1 A 112 112 TYR C C 99 174.425 175.782 -1.357 1
1 999 . 2 1 1 A 112 112 TYR CA C 99 57.198 57.775 -0.577 1
1 1000 . 2 1 1 A 112 112 TYR CB C 99 36.571 38.302 -1.731 1
1 1003 . 2 1 1 A 112 112 TYR N N 99 122.830 120.102 2.728 1
1 1004 . 2 1 1 A 113 113 THR H H 100 7.166 8.799 -1.633 1
1 1005 . 2 1 1 A 113 113 THR HA H 100 4.248 4.663 -0.415 1
1 1009 . 2 1 1 A 113 113 THR C C 100 174.897 174.602 0.295 1
1 1010 . 2 1 1 A 113 113 THR CA C 100 62.290 62.370 -0.080 1
1 1011 . 2 1 1 A 113 113 THR CB C 100 68.970 70.013 -1.043 1
1 1013 . 2 1 1 A 113 113 THR N N 100 104.304 116.117 -11.813 1
1 1014 . 2 1 1 A 114 114 SER H H 101 7.695 8.148 -0.453 1
1 1015 . 2 1 1 A 114 114 SER C C 101 174.372 174.614 -0.242 1
1 1016 . 2 1 1 A 114 114 SER CA C 101 56.260 57.885 -1.625 1
1 1017 . 2 1 1 A 114 114 SER CB C 101 65.636 64.595 1.041 1
1 1018 . 2 1 1 A 114 114 SER N N 101 115.613 116.497 -0.884 1
1 1023 . 2 1 1 A 116 116 ASP HA H 103 4.260 4.293 -0.033 1
1 1026 . 2 1 1 A 116 116 ASP CA C 103 57.198 57.642 -0.444 1
1 1027 . 2 1 1 A 116 116 ASP CB C 103 40.321 40.413 -0.092 1
1 1028 . 2 1 1 A 117 117 LEU H H 104 7.345 8.256 -0.911 1
1 1029 . 2 1 1 A 117 117 LEU HA H 104 4.290 4.011 0.279 1
1 1038 . 2 1 1 A 117 117 LEU C C 104 178.488 179.066 -0.578 1
1 1039 . 2 1 1 A 117 117 LEU CA C 104 56.260 58.366 -2.106 1
1 1040 . 2 1 1 A 117 117 LEU CB C 104 42.196 41.490 0.706 1
1 1043 . 2 1 1 A 117 117 LEU N N 104 117.878 121.168 -3.290 1
1 1044 . 2 1 1 A 118 118 LEU H H 105 7.514 8.317 -0.803 1
1 1045 . 2 1 1 A 118 118 LEU HA H 105 4.210 4.058 0.152 1
1 1054 . 2 1 1 A 118 118 LEU C C 105 177.002 179.120 -2.118 1
1 1055 . 2 1 1 A 118 118 LEU CA C 105 55.323 57.085 -1.762 1
1 1056 . 2 1 1 A 118 118 LEU CB C 105 42.196 41.172 1.024 1
1 1059 . 2 1 1 A 118 118 LEU N N 105 119.094 119.410 -0.316 1
1 1060 . 2 1 1 A 120 120 LYS HA H 107 4.340 4.390 -0.050 1
1 1063 . 2 1 1 A 120 120 LYS C C 107 176.603 175.675 0.928 1
1 1064 . 2 1 1 A 120 120 LYS CA C 107 55.323 55.916 -0.593 1
1 1065 . 2 1 1 A 120 120 LYS CB C 107 31.883 32.632 -0.749 1
1 1068 . 2 1 1 A 121 121 ILE H H 108 7.539 7.401 0.138 1
1 1069 . 2 1 1 A 121 121 ILE HA H 108 3.987 4.413 -0.426 1
1 1079 . 2 1 1 A 121 121 ILE C C 108 173.247 175.116 -1.869 1
1 1080 . 2 1 1 A 121 121 ILE CA C 108 62.823 60.311 2.512 1
1 1081 . 2 1 1 A 121 121 ILE CB C 108 38.446 39.184 -0.738 1
1 1085 . 2 1 1 A 121 121 ILE N N 108 122.417 121.035 1.382 1
1 1086 . 2 1 1 A 122 122 ALA H H 109 8.290 8.466 -0.176 1
1 1087 . 2 1 1 A 122 122 ALA HA H 109 3.970 4.751 -0.781 1
1 1091 . 2 1 1 A 122 122 ALA C C 109 178.318 177.958 0.360 1
1 1092 . 2 1 1 A 122 122 ALA CA C 109 50.150 49.820 0.330 1
1 1093 . 2 1 1 A 122 122 ALA CB C 109 21.630 21.009 0.621 1
1 1094 . 2 1 1 A 122 122 ALA N N 109 127.784 129.781 -1.997 1
1 1095 . 2 1 1 A 123 123 GLU HA H 110 3.707 3.970 -0.263 1
1 1099 . 2 1 1 A 123 123 GLU C C 110 178.290 178.967 -0.677 1
1 1100 . 2 1 1 A 123 123 GLU CA C 110 60.948 59.746 1.202 1
1 1101 . 2 1 1 A 123 123 GLU CB C 110 29.070 29.572 -0.502 1
1 1102 . 2 1 1 A 124 124 VAL H H 111 8.333 8.251 0.082 1
1 1103 . 2 1 1 A 124 124 VAL HA H 111 3.850 3.739 0.111 1
1 1111 . 2 1 1 A 124 124 VAL C C 111 177.406 177.456 -0.050 1
1 1112 . 2 1 1 A 124 124 VAL CA C 111 65.636 65.117 0.519 1
1 1113 . 2 1 1 A 124 124 VAL CB C 111 30.730 31.191 -0.461 1
1 1116 . 2 1 1 A 124 124 VAL N N 111 114.438 120.529 -6.091 1
1 1117 . 2 1 1 A 125 125 GLU H H 112 7.442 8.186 -0.744 1
1 1118 . 2 1 1 A 125 125 GLU HA H 112 4.152 4.035 0.117 1
1 1123 . 2 1 1 A 125 125 GLU C C 112 179.982 179.251 0.731 1
1 1124 . 2 1 1 A 125 125 GLU CA C 112 60.010 59.303 0.707 1
1 1125 . 2 1 1 A 125 125 GLU CB C 112 30.008 29.633 0.375 1
1 1127 . 2 1 1 A 125 125 GLU N N 112 121.032 121.838 -0.806 1
1 1128 . 2 1 1 A 126 126 LEU H H 113 7.666 7.824 -0.158 1
1 1129 . 2 1 1 A 126 126 LEU HA H 113 3.846 4.028 -0.182 1
1 1138 . 2 1 1 A 126 126 LEU C C 113 176.991 178.814 -1.823 1
1 1139 . 2 1 1 A 126 126 LEU CA C 113 58.135 58.142 -0.007 1
1 1140 . 2 1 1 A 126 126 LEU CB C 113 41.259 41.674 -0.415 1
1 1143 . 2 1 1 A 126 126 LEU N N 113 118.731 121.429 -2.698 1
1 1144 . 2 1 1 A 127 127 ILE H H 114 7.781 8.226 -0.445 1
1 1145 . 2 1 1 A 127 127 ILE HA H 114 3.502 3.812 -0.310 1
1 1153 . 2 1 1 A 127 127 ILE C C 114 178.195 177.869 0.326 1
1 1154 . 2 1 1 A 127 127 ILE CA C 114 65.636 63.708 1.928 1
1 1155 . 2 1 1 A 127 127 ILE CB C 114 40.321 37.140 3.181 1
1 1159 . 2 1 1 A 127 127 ILE N N 114 115.084 119.524 -4.440 1
1 1160 . 2 1 1 A 128 128 ASN H H 115 8.470 8.176 0.294 1
1 1161 . 2 1 1 A 128 128 ASN HA H 115 4.502 4.621 -0.119 1
1 1166 . 2 1 1 A 128 128 ASN C C 115 176.295 175.918 0.377 1
1 1167 . 2 1 1 A 128 128 ASN CA C 115 56.260 55.604 0.656 1
1 1168 . 2 1 1 A 128 128 ASN CB C 115 39.384 38.871 0.513 1
1 1169 . 2 1 1 A 128 128 ASN N N 115 115.158 119.886 -4.728 1
1 1171 . 2 1 1 A 129 129 VAL H H 116 8.116 7.688 0.428 1
1 1172 . 2 1 1 A 129 129 VAL HA H 116 4.090 3.987 0.103 1
1 1180 . 2 1 1 A 129 129 VAL C C 116 176.740 177.569 -0.829 1
1 1181 . 2 1 1 A 129 129 VAL CA C 116 64.400 64.605 -0.205 1
1 1182 . 2 1 1 A 129 129 VAL CB C 116 32.050 32.263 -0.213 1
1 1185 . 2 1 1 A 129 129 VAL N N 116 118.698 117.799 0.899 1
1 1186 . 2 1 1 A 130 130 LEU H H 117 7.294 7.915 -0.621 1
1 1187 . 2 1 1 A 130 130 LEU HA H 117 3.970 4.106 -0.136 1
1 1196 . 2 1 1 A 130 130 LEU C C 117 175.127 176.942 -1.815 1
1 1197 . 2 1 1 A 130 130 LEU CA C 117 56.260 56.770 -0.510 1
1 1198 . 2 1 1 A 130 130 LEU CB C 117 41.259 42.355 -1.096 1
1 1201 . 2 1 1 A 130 130 LEU N N 117 116.201 119.032 -2.831 1
1 1202 . 2 1 1 A 131 131 LYS H H 118 6.594 8.388 -1.794 1
1 1203 . 2 1 1 A 131 131 LYS HA H 118 3.980 4.006 -0.026 1
1 1208 . 2 1 1 A 131 131 LYS C C 118 175.589 176.556 -0.967 1
1 1209 . 2 1 1 A 131 131 LYS CA C 118 56.260 57.406 -1.146 1
1 1210 . 2 1 1 A 131 131 LYS CB C 118 28.133 31.323 -3.190 1
1 1212 . 2 1 1 A 131 131 LYS N N 118 111.172 118.729 -7.557 1
1 1213 . 2 1 1 A 132 132 ILE H H 119 8.245 8.037 0.208 1
1 1214 . 2 1 1 A 132 132 ILE HA H 119 4.090 3.807 0.283 1
1 1224 . 2 1 1 A 132 132 ILE C C 119 175.161 176.236 -1.075 1
1 1225 . 2 1 1 A 132 132 ILE CA C 119 60.010 65.622 -5.612 1
1 1226 . 2 1 1 A 132 132 ILE CB C 119 35.633 37.639 -2.006 1
1 1230 . 2 1 1 A 132 132 ILE N N 119 119.484 118.728 0.756 1
1 1231 . 2 1 1 A 133 133 ASN H H 120 8.054 8.210 -0.156 1
1 1232 . 2 1 1 A 133 133 ASN HA H 120 4.350 4.362 -0.012 1
1 1235 . 2 1 1 A 133 133 ASN C C 120 175.136 174.349 0.787 1
1 1236 . 2 1 1 A 133 133 ASN CA C 120 54.385 54.178 0.207 1
1 1237 . 2 1 1 A 133 133 ASN CB C 120 39.384 37.554 1.830 1
1 1238 . 2 1 1 A 133 133 ASN N N 120 124.670 120.522 4.148 1
1 1239 . 2 1 1 A 134 134 LEU H H 121 7.517 7.778 -0.261 1
1 1240 . 2 1 1 A 134 134 LEU HA H 121 4.678 4.517 0.161 1
1 1249 . 2 1 1 A 134 134 LEU C C 121 178.051 176.230 1.821 1
1 1250 . 2 1 1 A 134 134 LEU CA C 121 53.447 54.469 -1.022 1
1 1251 . 2 1 1 A 134 134 LEU CB C 121 41.259 44.843 -3.584 1
1 1254 . 2 1 1 A 134 134 LEU N N 121 119.918 118.978 0.940 1
1 1255 . 2 1 1 A 135 135 ILE H H 122 9.389 8.749 0.640 1
1 1256 . 2 1 1 A 135 135 ILE HA H 122 3.540 3.690 -0.150 1
1 1266 . 2 1 1 A 135 135 ILE C C 122 176.425 177.547 -1.122 1
1 1267 . 2 1 1 A 135 135 ILE CA C 122 65.636 65.223 0.413 1
1 1268 . 2 1 1 A 135 135 ILE CB C 122 38.446 37.867 0.579 1
1 1272 . 2 1 1 A 135 135 ILE N N 122 129.949 126.247 3.702 1
1 1273 . 2 1 1 A 136 136 GLY H H 123 8.675 8.134 0.541 1
1 1274 . 2 1 1 A 136 136 GLY HA2 H 123 2.650 2.968 -0.318 1
1 1275 . 2 1 1 A 136 136 GLY HA3 H 123 2.060 3.376 -1.316 1
1 1276 . 2 1 1 A 136 136 GLY C C 123 176.854 176.426 0.428 1
1 1277 . 2 1 1 A 136 136 GLY CA C 123 45.500 46.988 -1.488 1
1 1278 . 2 1 1 A 136 136 GLY N N 123 106.314 107.880 -1.566 1
1 1279 . 2 1 1 A 137 137 HIS H H 124 6.869 7.722 -0.853 1
1 1280 . 2 1 1 A 137 137 HIS HA H 124 4.558 4.524 0.034 1
1 1285 . 2 1 1 A 137 137 HIS C C 124 176.977 177.635 -0.658 1
1 1286 . 2 1 1 A 137 137 HIS CA C 124 57.198 58.419 -1.221 1
1 1287 . 2 1 1 A 137 137 HIS CB C 124 30.945 29.144 1.801 1
1 1290 . 2 1 1 A 137 137 HIS N N 124 118.865 120.177 -1.312 1
1 1291 . 2 1 1 A 138 138 ARG H H 125 7.730 8.171 -0.441 1
1 1292 . 2 1 1 A 138 138 ARG HA H 125 3.770 3.966 -0.196 1
1 1299 . 2 1 1 A 138 138 ARG C C 125 178.288 178.386 -0.098 1
1 1300 . 2 1 1 A 138 138 ARG CA C 125 61.886 58.686 3.200 1
1 1301 . 2 1 1 A 138 138 ARG CB C 125 30.945 30.078 0.867 1
1 1304 . 2 1 1 A 138 138 ARG N N 125 118.149 118.250 -0.101 1
1 1306 . 2 1 1 A 139 139 LYS H H 126 8.679 7.921 0.758 1
1 1307 . 2 1 1 A 139 139 LYS HA H 126 3.990 3.996 -0.006 1
1 1310 . 2 1 1 A 139 139 LYS C C 126 179.184 178.957 0.227 1
1 1311 . 2 1 1 A 139 139 LYS CA C 126 58.135 59.627 -1.492 1
1 1312 . 2 1 1 A 139 139 LYS CB C 126 30.945 32.194 -1.249 1
1 1314 . 2 1 1 A 139 139 LYS N N 126 114.003 119.481 -5.478 1
1 1315 . 2 1 1 A 140 140 ARG H H 127 7.248 7.991 -0.743 1
1 1316 . 2 1 1 A 140 140 ARG HA H 127 3.870 3.957 -0.087 1
1 1324 . 2 1 1 A 140 140 ARG C C 127 177.772 178.819 -1.047 1
1 1325 . 2 1 1 A 140 140 ARG CA C 127 60.010 59.163 0.847 1
1 1326 . 2 1 1 A 140 140 ARG CB C 127 30.945 29.825 1.120 1
1 1329 . 2 1 1 A 140 140 ARG N N 127 120.072 118.397 1.675 1
1 1331 . 2 1 1 A 141 141 ILE H H 128 7.706 7.686 0.020 1
1 1332 . 2 1 1 A 141 141 ILE HA H 128 3.530 4.003 -0.473 1
1 1340 . 2 1 1 A 141 141 ILE C C 128 177.669 178.148 -0.479 1
1 1341 . 2 1 1 A 141 141 ILE CA C 128 65.636 64.452 1.184 1
1 1342 . 2 1 1 A 141 141 ILE CB C 128 38.680 37.555 1.125 1
1 1345 . 2 1 1 A 141 141 ILE N N 128 118.730 117.399 1.331 1
1 1346 . 2 1 1 A 142 142 LEU H H 129 8.194 8.118 0.076 1
1 1347 . 2 1 1 A 142 142 LEU HA H 129 3.950 4.078 -0.128 1
1 1356 . 2 1 1 A 142 142 LEU C C 129 179.960 178.354 1.606 1
1 1357 . 2 1 1 A 142 142 LEU CA C 129 58.135 58.048 0.087 1
1 1358 . 2 1 1 A 142 142 LEU CB C 129 41.259 41.541 -0.282 1
1 1361 . 2 1 1 A 142 142 LEU N N 129 117.675 124.153 -6.478 1
1 1362 . 2 1 1 A 143 143 ALA H H 130 8.294 8.843 -0.549 1
1 1363 . 2 1 1 A 143 143 ALA HA H 130 4.220 4.019 0.201 1
1 1367 . 2 1 1 A 143 143 ALA C C 130 179.899 179.798 0.101 1
1 1368 . 2 1 1 A 143 143 ALA CA C 130 54.385 55.193 -0.808 1
1 1369 . 2 1 1 A 143 143 ALA CB C 130 19.270 17.926 1.344 1
1 1370 . 2 1 1 A 143 143 ALA N N 130 121.096 120.904 0.192 1
1 1371 . 2 1 1 A 144 144 SER H H 131 7.813 7.961 -0.148 1
1 1372 . 2 1 1 A 144 144 SER HA H 131 4.180 4.294 -0.114 1
1 1375 . 2 1 1 A 144 144 SER C C 131 175.457 177.455 -1.998 1
1 1376 . 2 1 1 A 144 144 SER CA C 131 60.948 61.629 -0.681 1
1 1377 . 2 1 1 A 144 144 SER CB C 131 63.761 63.213 0.548 1
1 1378 . 2 1 1 A 144 144 SER N N 131 112.102 113.902 -1.800 1
1 1379 . 2 1 1 A 145 145 LEU H H 132 7.747 8.077 -0.330 1
1 1380 . 2 1 1 A 145 145 LEU HA H 132 4.140 3.956 0.184 1
1 1389 . 2 1 1 A 145 145 LEU C C 132 178.589 177.089 1.500 1
1 1390 . 2 1 1 A 145 145 LEU CA C 132 56.260 56.828 -0.568 1
1 1391 . 2 1 1 A 145 145 LEU CB C 132 42.196 42.574 -0.378 1
1 1394 . 2 1 1 A 145 145 LEU N N 132 117.536 118.833 -1.297 1
1 1395 . 2 1 1 A 146 146 GLY H H 133 7.544 7.489 0.055 1
1 1396 . 2 1 1 A 146 146 GLY HA2 H 133 3.950 4.006 -0.056 1
1 1397 . 2 1 1 A 146 146 GLY HA3 H 133 3.100 4.022 -0.922 1
1 1398 . 2 1 1 A 146 146 GLY C C 133 173.372 171.330 2.042 1
1 1399 . 2 1 1 A 146 146 GLY CA C 133 45.947 44.693 1.254 1
1 1400 . 2 1 1 A 146 146 GLY N N 133 105.351 104.080 1.271 1
1 1401 . 2 1 1 A 147 147 ASP H H 134 8.342 8.701 -0.359 1
1 1402 . 2 1 1 A 147 147 ASP HA H 134 4.650 5.265 -0.615 1
1 1405 . 2 1 1 A 147 147 ASP C C 134 175.462 175.393 0.069 1
1 1406 . 2 1 1 A 147 147 ASP CA C 134 54.385 52.475 1.910 1
1 1407 . 2 1 1 A 147 147 ASP CB C 134 41.259 44.222 -2.963 1
1 1408 . 2 1 1 A 147 147 ASP N N 134 120.133 118.581 1.552 1
1 14 . 3 1 1 A 15 15 GLN H H 2 8.439 8.614 -0.175 1
1 15 . 3 1 1 A 15 15 GLN HA H 2 4.594 4.827 -0.233 1
1 20 . 3 1 1 A 15 15 GLN C C 2 175.972 173.776 2.196 1
1 21 . 3 1 1 A 15 15 GLN CA C 2 56.260 55.160 1.100 1
1 22 . 3 1 1 A 15 15 GLN CB C 2 30.945 32.460 -1.515 1
1 24 . 3 1 1 A 15 15 GLN N N 2 124.997 120.279 4.718 1
1 25 . 3 1 1 A 16 16 THR H H 3 8.347 8.583 -0.236 1
1 26 . 3 1 1 A 16 16 THR HA H 3 4.555 4.855 -0.300 1
1 31 . 3 1 1 A 16 16 THR C C 3 175.495 174.800 0.695 1
1 32 . 3 1 1 A 16 16 THR CA C 3 60.010 61.422 -1.412 1
1 33 . 3 1 1 A 16 16 THR CB C 3 71.261 72.119 -0.858 1
1 34 . 3 1 1 A 16 16 THR N N 3 113.011 116.845 -3.834 1
1 35 . 3 1 1 A 17 17 VAL H H 4 8.895 8.981 -0.086 1
1 36 . 3 1 1 A 17 17 VAL HA H 4 3.670 3.838 -0.168 1
1 44 . 3 1 1 A 17 17 VAL C C 4 178.449 177.892 0.557 1
1 45 . 3 1 1 A 17 17 VAL CA C 4 67.511 66.592 0.919 1
1 46 . 3 1 1 A 17 17 VAL CB C 4 31.883 31.755 0.128 1
1 49 . 3 1 1 A 17 17 VAL N N 4 121.854 124.730 -2.876 1
1 50 . 3 1 1 A 18 18 GLY H H 5 9.017 8.327 0.690 1
1 51 . 3 1 1 A 18 18 GLY HA2 H 5 3.940 3.785 0.155 1
1 52 . 3 1 1 A 18 18 GLY HA3 H 5 3.610 3.802 -0.192 1
1 53 . 3 1 1 A 18 18 GLY C C 5 176.186 175.647 0.539 1
1 54 . 3 1 1 A 18 18 GLY CA C 5 47.822 47.305 0.517 1
1 55 . 3 1 1 A 18 18 GLY N N 5 106.966 107.962 -0.996 1
1 56 . 3 1 1 A 19 19 GLN H H 6 8.072 8.079 -0.007 1
1 57 . 3 1 1 A 19 19 GLN HA H 6 4.037 4.110 -0.073 1
1 62 . 3 1 1 A 19 19 GLN C C 6 179.488 178.388 1.100 1
1 63 . 3 1 1 A 19 19 GLN CA C 6 59.073 59.039 0.034 1
1 64 . 3 1 1 A 19 19 GLN CB C 6 28.489 28.755 -0.266 1
1 66 . 3 1 1 A 19 19 GLN N N 6 122.431 120.955 1.476 1
1 67 . 3 1 1 A 20 20 TRP H H 7 8.756 8.152 0.604 1
1 68 . 3 1 1 A 20 20 TRP HA H 7 4.160 4.277 -0.117 1
1 77 . 3 1 1 A 20 20 TRP C C 7 179.620 178.110 1.510 1
1 78 . 3 1 1 A 20 20 TRP CA C 7 61.886 61.109 0.777 1
1 79 . 3 1 1 A 20 20 TRP CB C 7 28.133 30.072 -1.939 1
1 85 . 3 1 1 A 20 20 TRP N N 7 124.265 122.594 1.671 1
1 87 . 3 1 1 A 21 21 LEU H H 8 9.148 8.630 0.518 1
1 88 . 3 1 1 A 21 21 LEU HA H 8 3.440 3.498 -0.058 1
1 97 . 3 1 1 A 21 21 LEU C C 8 180.521 178.442 2.079 1
1 98 . 3 1 1 A 21 21 LEU CA C 8 56.920 57.881 -0.961 1
1 99 . 3 1 1 A 21 21 LEU CB C 8 41.700 41.350 0.350 1
1 102 . 3 1 1 A 21 21 LEU N N 8 120.548 120.672 -0.124 1
1 103 . 3 1 1 A 22 22 GLU H H 9 8.284 8.489 -0.205 1
1 104 . 3 1 1 A 22 22 GLU HA H 9 3.740 3.913 -0.173 1
1 109 . 3 1 1 A 22 22 GLU C C 9 179.960 178.541 1.419 1
1 110 . 3 1 1 A 22 22 GLU CA C 9 60.010 59.825 0.185 1
1 111 . 3 1 1 A 22 22 GLU CB C 9 29.070 29.125 -0.055 1
1 113 . 3 1 1 A 22 22 GLU N N 9 120.133 119.515 0.618 1
1 114 . 3 1 1 A 23 23 SER H H 10 7.891 7.731 0.160 1
1 115 . 3 1 1 A 23 23 SER HA H 10 4.250 4.207 0.043 1
1 118 . 3 1 1 A 23 23 SER C C 10 175.346 176.546 -1.200 1
1 119 . 3 1 1 A 23 23 SER CA C 10 60.948 61.412 -0.464 1
1 120 . 3 1 1 A 23 23 SER CB C 10 63.280 62.998 0.282 1
1 121 . 3 1 1 A 23 23 SER N N 10 117.044 114.417 2.627 1
1 122 . 3 1 1 A 24 24 ILE H H 11 6.862 7.736 -0.874 1
1 123 . 3 1 1 A 24 24 ILE HA H 11 4.487 3.805 0.682 1
1 133 . 3 1 1 A 24 24 ILE C C 11 175.812 175.814 -0.002 1
1 134 . 3 1 1 A 24 24 ILE CA C 11 60.948 63.657 -2.709 1
1 135 . 3 1 1 A 24 24 ILE CB C 11 38.250 37.253 0.997 1
1 139 . 3 1 1 A 24 24 ILE N N 11 113.733 117.365 -3.632 1
1 140 . 3 1 1 A 25 25 GLY H H 12 7.628 7.573 0.055 1
1 141 . 3 1 1 A 25 25 GLY HA2 H 12 3.990 4.016 -0.026 1
1 142 . 3 1 1 A 25 25 GLY HA3 H 12 3.800 4.046 -0.246 1
1 143 . 3 1 1 A 25 25 GLY C C 12 173.647 171.768 1.879 1
1 144 . 3 1 1 A 25 25 GLY CA C 12 45.947 45.961 -0.014 1
1 145 . 3 1 1 A 25 25 GLY N N 12 109.763 109.795 -0.032 1
1 146 . 3 1 1 A 26 26 LEU H H 13 7.620 8.166 -0.546 1
1 147 . 3 1 1 A 26 26 LEU C C 13 176.186 174.178 2.008 1
1 148 . 3 1 1 A 26 26 LEU CA C 13 52.700 51.844 0.856 1
1 149 . 3 1 1 A 26 26 LEU CB C 13 43.134 45.965 -2.831 1
1 150 . 3 1 1 A 26 26 LEU N N 13 118.778 122.085 -3.307 1
1 151 . 3 1 1 A 27 27 PRO HA H 14 4.120 4.681 -0.561 1
1 154 . 3 1 1 A 27 27 PRO C C 14 177.955 175.087 2.868 1
1 155 . 3 1 1 A 27 27 PRO CA C 14 64.698 62.249 2.449 1
1 156 . 3 1 1 A 27 27 PRO CB C 14 31.883 29.072 2.811 1
1 158 . 3 1 1 A 28 28 GLN H H 15 9.838 8.571 1.267 1
1 159 . 3 1 1 A 28 28 GLN HA H 15 4.240 4.293 -0.053 1
1 162 . 3 1 1 A 28 28 GLN C C 15 176.836 176.568 0.268 1
1 163 . 3 1 1 A 28 28 GLN CA C 15 58.135 56.156 1.979 1
1 164 . 3 1 1 A 28 28 GLN CB C 15 27.195 30.880 -3.685 1
1 166 . 3 1 1 A 28 28 GLN N N 15 120.414 121.191 -0.777 1
1 167 . 3 1 1 A 29 29 TYR H H 16 6.810 7.751 -0.941 1
1 168 . 3 1 1 A 29 29 TYR HA H 16 5.720 4.592 1.128 1
1 173 . 3 1 1 A 29 29 TYR C C 16 174.814 176.839 -2.025 1
1 174 . 3 1 1 A 29 29 TYR CA C 16 57.198 58.141 -0.943 1
1 175 . 3 1 1 A 29 29 TYR CB C 16 37.509 39.164 -1.655 1
1 178 . 3 1 1 A 29 29 TYR N N 16 119.718 117.501 2.217 1
1 179 . 3 1 1 A 30 30 GLU H H 17 7.509 8.293 -0.784 1
1 180 . 3 1 1 A 30 30 GLU HA H 17 3.650 4.080 -0.430 1
1 184 . 3 1 1 A 30 30 GLU C C 17 177.552 178.329 -0.777 1
1 185 . 3 1 1 A 30 30 GLU CA C 17 60.948 59.901 1.047 1
1 186 . 3 1 1 A 30 30 GLU CB C 17 30.008 29.198 0.810 1
1 188 . 3 1 1 A 30 30 GLU N N 17 122.417 122.661 -0.244 1
1 189 . 3 1 1 A 31 31 ASN H H 18 9.259 8.186 1.073 1
1 190 . 3 1 1 A 31 31 ASN HA H 18 4.451 4.524 -0.073 1
1 193 . 3 1 1 A 31 31 ASN C C 18 176.868 177.998 -1.130 1
1 194 . 3 1 1 A 31 31 ASN CA C 18 57.198 56.333 0.865 1
1 195 . 3 1 1 A 31 31 ASN CB C 18 38.446 39.206 -0.760 1
1 196 . 3 1 1 A 31 31 ASN N N 18 116.613 118.154 -1.541 1
1 197 . 3 1 1 A 32 32 HIS H H 19 8.898 8.277 0.621 1
1 198 . 3 1 1 A 32 32 HIS HA H 19 4.140 4.367 -0.227 1
1 202 . 3 1 1 A 32 32 HIS C C 19 178.269 177.763 0.506 1
1 203 . 3 1 1 A 32 32 HIS CA C 19 60.948 59.036 1.912 1
1 204 . 3 1 1 A 32 32 HIS CB C 19 30.008 29.954 0.054 1
1 206 . 3 1 1 A 32 32 HIS N N 19 118.926 117.300 1.626 1
1 207 . 3 1 1 A 33 33 LEU H H 20 7.825 8.876 -1.051 1
1 208 . 3 1 1 A 33 33 LEU HA H 20 4.305 3.888 0.417 1
1 218 . 3 1 1 A 33 33 LEU C C 20 179.190 179.082 0.108 1
1 219 . 3 1 1 A 33 33 LEU CA C 20 60.010 58.499 1.511 1
1 220 . 3 1 1 A 33 33 LEU CB C 20 40.321 42.071 -1.750 1
1 224 . 3 1 1 A 33 33 LEU N N 20 117.434 120.040 -2.606 1
1 225 . 3 1 1 A 34 34 MET H H 21 8.861 8.774 0.087 1
1 226 . 3 1 1 A 34 34 MET HA H 21 3.980 4.306 -0.326 1
1 234 . 3 1 1 A 34 34 MET C C 21 180.340 178.666 1.674 1
1 235 . 3 1 1 A 34 34 MET CA C 21 58.135 58.363 -0.228 1
1 236 . 3 1 1 A 34 34 MET CB C 21 30.945 32.370 -1.425 1
1 238 . 3 1 1 A 34 34 MET N N 21 118.111 117.644 0.467 1
1 239 . 3 1 1 A 35 35 ALA H H 22 9.015 8.693 0.322 1
1 240 . 3 1 1 A 35 35 ALA HA H 22 4.239 4.136 0.103 1
1 244 . 3 1 1 A 35 35 ALA C C 22 178.058 178.547 -0.489 1
1 245 . 3 1 1 A 35 35 ALA CA C 22 53.800 54.796 -0.996 1
1 246 . 3 1 1 A 35 35 ALA CB C 22 18.397 18.273 0.124 1
1 247 . 3 1 1 A 35 35 ALA N N 22 120.068 122.460 -2.392 1
1 248 . 3 1 1 A 36 36 ASN H H 23 7.143 8.124 -0.981 1
1 249 . 3 1 1 A 36 36 ASN HA H 23 4.959 4.914 0.045 1
1 254 . 3 1 1 A 36 36 ASN C C 23 174.083 175.422 -1.339 1
1 255 . 3 1 1 A 36 36 ASN CA C 23 54.000 52.651 1.349 1
1 256 . 3 1 1 A 36 36 ASN CB C 23 41.300 38.926 2.374 1
1 257 . 3 1 1 A 36 36 ASN N N 23 111.560 114.871 -3.311 1
1 259 . 3 1 1 A 37 37 GLY H H 24 7.797 8.282 -0.485 1
1 260 . 3 1 1 A 37 37 GLY HA2 H 24 3.430 3.908 -0.478 1
1 261 . 3 1 1 A 37 37 GLY HA3 H 24 3.290 3.938 -0.648 1
1 262 . 3 1 1 A 37 37 GLY C C 24 173.163 174.760 -1.597 1
1 263 . 3 1 1 A 37 37 GLY CA C 24 45.947 45.272 0.675 1
1 264 . 3 1 1 A 37 37 GLY N N 24 106.170 107.929 -1.759 1
1 265 . 3 1 1 A 38 38 PHE H H 25 8.191 7.963 0.228 1
1 266 . 3 1 1 A 38 38 PHE HA H 25 4.910 4.764 0.146 1
1 271 . 3 1 1 A 38 38 PHE C C 25 173.496 175.283 -1.787 1
1 272 . 3 1 1 A 38 38 PHE CA C 25 56.550 56.491 0.059 1
1 273 . 3 1 1 A 38 38 PHE CB C 25 37.220 37.143 0.077 1
1 276 . 3 1 1 A 38 38 PHE N N 25 122.454 119.842 2.612 1
1 277 . 3 1 1 A 39 39 ASP H H 26 6.756 9.047 -2.291 1
1 278 . 3 1 1 A 39 39 ASP HA H 26 5.077 4.959 0.118 1
1 281 . 3 1 1 A 39 39 ASP C C 26 177.463 175.786 1.677 1
1 282 . 3 1 1 A 39 39 ASP CA C 26 53.447 54.707 -1.260 1
1 283 . 3 1 1 A 39 39 ASP CB C 26 42.580 42.478 0.102 1
1 284 . 3 1 1 A 39 39 ASP N N 26 111.309 124.980 -13.671 1
1 285 . 3 1 1 A 40 40 ASN H H 27 7.495 7.893 -0.398 1
1 286 . 3 1 1 A 40 40 ASN HA H 27 4.820 4.963 -0.143 1
1 289 . 3 1 1 A 40 40 ASN C C 27 176.228 175.781 0.447 1
1 290 . 3 1 1 A 40 40 ASN CA C 27 52.510 51.919 0.591 1
1 291 . 3 1 1 A 40 40 ASN CB C 27 40.321 39.903 0.418 1
1 292 . 3 1 1 A 40 40 ASN N N 27 118.385 118.111 0.274 1
1 293 . 3 1 1 A 41 41 VAL H H 28 9.192 8.547 0.645 1
1 294 . 3 1 1 A 41 41 VAL HA H 28 3.550 3.561 -0.011 1
1 302 . 3 1 1 A 41 41 VAL C C 28 176.429 177.605 -1.176 1
1 303 . 3 1 1 A 41 41 VAL CA C 28 65.636 65.882 -0.246 1
1 304 . 3 1 1 A 41 41 VAL CB C 28 31.883 31.643 0.240 1
1 307 . 3 1 1 A 41 41 VAL N N 28 125.741 125.649 0.092 1
1 308 . 3 1 1 A 42 42 GLN H H 29 8.203 8.179 0.024 1
1 309 . 3 1 1 A 42 42 GLN HA H 29 4.129 3.871 0.258 1
1 314 . 3 1 1 A 42 42 GLN C C 29 176.591 178.126 -1.535 1
1 315 . 3 1 1 A 42 42 GLN CA C 29 57.198 58.779 -1.581 1
1 316 . 3 1 1 A 42 42 GLN CB C 29 28.133 28.505 -0.372 1
1 318 . 3 1 1 A 42 42 GLN N N 29 116.452 120.612 -4.160 1
1 319 . 3 1 1 A 43 43 ALA H H 30 7.781 8.236 -0.455 1
1 320 . 3 1 1 A 43 43 ALA HA H 30 4.650 3.977 0.673 1
1 324 . 3 1 1 A 43 43 ALA C C 30 175.976 179.914 -3.938 1
1 325 . 3 1 1 A 43 43 ALA CA C 30 50.840 54.402 -3.562 1
1 326 . 3 1 1 A 43 43 ALA CB C 30 19.150 18.189 0.961 1
1 327 . 3 1 1 A 43 43 ALA N N 30 122.150 121.003 1.147 1
1 328 . 3 1 1 A 44 44 MET H H 31 7.739 8.063 -0.324 1
1 332 . 3 1 1 A 44 44 MET C C 31 178.275 177.052 1.223 1
1 333 . 3 1 1 A 44 44 MET CA C 31 55.323 57.022 -1.699 1
1 334 . 3 1 1 A 44 44 MET CB C 31 34.696 32.199 2.497 1
1 336 . 3 1 1 A 44 44 MET N N 31 118.149 117.031 1.118 1
1 337 . 3 1 1 A 45 45 GLY H H 32 7.611 8.081 -0.470 1
1 338 . 3 1 1 A 45 45 GLY N N 32 101.530 108.638 -7.108 1
1 339 . 3 1 1 A 47 47 ASN HA H 34 4.480 5.019 -0.539 1
1 342 . 3 1 1 A 47 47 ASN CA C 34 56.260 51.897 4.363 1
1 343 . 3 1 1 A 47 47 ASN CB C 34 39.384 38.499 0.885 1
1 344 . 3 1 1 A 49 49 MET HA H 36 4.646 4.408 0.238 1
1 350 . 3 1 1 A 49 49 MET C C 36 173.651 175.653 -2.002 1
1 351 . 3 1 1 A 49 49 MET CA C 36 55.323 56.197 -0.874 1
1 352 . 3 1 1 A 49 49 MET CB C 36 35.633 32.765 2.868 1
1 355 . 3 1 1 A 50 50 GLU H H 37 9.203 9.311 -0.108 1
1 356 . 3 1 1 A 50 50 GLU HA H 37 4.650 4.660 -0.010 1
1 361 . 3 1 1 A 50 50 GLU C C 37 177.008 177.122 -0.114 1
1 362 . 3 1 1 A 50 50 GLU CA C 37 54.385 54.816 -0.431 1
1 363 . 3 1 1 A 50 50 GLU CB C 37 33.758 31.883 1.875 1
1 365 . 3 1 1 A 50 50 GLU N N 37 123.229 126.463 -3.234 1
1 366 . 3 1 1 A 51 51 ASP H H 38 9.032 8.885 0.147 1
1 367 . 3 1 1 A 51 51 ASP HA H 38 4.149 4.373 -0.224 1
1 370 . 3 1 1 A 51 51 ASP C C 38 177.994 178.266 -0.272 1
1 371 . 3 1 1 A 51 51 ASP CA C 38 59.073 57.120 1.953 1
1 372 . 3 1 1 A 51 51 ASP CB C 38 43.134 39.889 3.245 1
1 373 . 3 1 1 A 51 51 ASP N N 38 122.717 121.724 0.993 1
1 374 . 3 1 1 A 52 52 GLN H H 39 8.950 8.250 0.700 1
1 375 . 3 1 1 A 52 52 GLN HA H 39 3.940 3.984 -0.044 1
1 378 . 3 1 1 A 52 52 GLN C C 39 177.817 178.732 -0.915 1
1 379 . 3 1 1 A 52 52 GLN CA C 39 59.073 59.074 -0.001 1
1 380 . 3 1 1 A 52 52 GLN CB C 39 28.133 28.454 -0.321 1
1 381 . 3 1 1 A 52 52 GLN N N 39 114.086 119.378 -5.292 1
1 382 . 3 1 1 A 53 53 ASP H H 40 7.214 7.983 -0.769 1
1 383 . 3 1 1 A 53 53 ASP HA H 40 4.370 4.496 -0.126 1
1 386 . 3 1 1 A 53 53 ASP C C 40 177.667 178.953 -1.286 1
1 387 . 3 1 1 A 53 53 ASP CA C 40 57.198 56.928 0.270 1
1 388 . 3 1 1 A 53 53 ASP CB C 40 41.800 40.891 0.909 1
1 389 . 3 1 1 A 53 53 ASP N N 40 118.734 120.253 -1.519 1
1 390 . 3 1 1 A 54 54 LEU H H 41 7.180 7.986 -0.806 1
1 391 . 3 1 1 A 54 54 LEU HA H 41 3.990 3.944 0.046 1
1 400 . 3 1 1 A 54 54 LEU C C 41 178.204 178.140 0.064 1
1 401 . 3 1 1 A 54 54 LEU CA C 41 56.260 57.902 -1.642 1
1 402 . 3 1 1 A 54 54 LEU CB C 41 41.259 41.469 -0.210 1
1 405 . 3 1 1 A 54 54 LEU N N 41 115.795 117.951 -2.156 1
1 406 . 3 1 1 A 55 55 LEU H H 42 7.823 7.687 0.136 1
1 407 . 3 1 1 A 55 55 LEU HA H 42 3.920 4.134 -0.214 1
1 416 . 3 1 1 A 55 55 LEU C C 42 180.876 178.360 2.516 1
1 417 . 3 1 1 A 55 55 LEU CA C 42 58.135 56.748 1.387 1
1 418 . 3 1 1 A 55 55 LEU CB C 42 42.196 42.718 -0.522 1
1 421 . 3 1 1 A 55 55 LEU N N 42 120.499 121.456 -0.957 1
1 422 . 3 1 1 A 56 56 GLU H H 43 8.127 8.321 -0.194 1
1 423 . 3 1 1 A 56 56 GLU HA H 43 3.966 4.134 -0.168 1
1 428 . 3 1 1 A 56 56 GLU C C 43 178.801 179.199 -0.398 1
1 429 . 3 1 1 A 56 56 GLU CA C 43 60.010 59.167 0.843 1
1 430 . 3 1 1 A 56 56 GLU CB C 43 29.070 29.382 -0.312 1
1 432 . 3 1 1 A 56 56 GLU N N 43 120.955 118.787 2.168 1
1 433 . 3 1 1 A 57 57 ILE H H 44 7.504 7.585 -0.081 1
1 434 . 3 1 1 A 57 57 ILE HA H 44 4.524 3.867 0.657 1
1 444 . 3 1 1 A 57 57 ILE C C 44 175.691 176.983 -1.292 1
1 445 . 3 1 1 A 57 57 ILE CA C 44 61.886 64.742 -2.856 1
1 446 . 3 1 1 A 57 57 ILE CB C 44 37.300 38.346 -1.046 1
1 450 . 3 1 1 A 57 57 ILE N N 44 109.594 118.664 -9.070 1
1 451 . 3 1 1 A 58 58 GLY H H 45 7.724 7.611 0.113 1
1 452 . 3 1 1 A 58 58 GLY HA2 H 45 3.650 4.195 -0.545 1
1 453 . 3 1 1 A 58 58 GLY HA3 H 45 4.530 4.342 0.188 1
1 454 . 3 1 1 A 58 58 GLY C C 45 174.613 174.480 0.133 1
1 455 . 3 1 1 A 58 58 GLY CA C 45 45.947 45.272 0.675 1
1 456 . 3 1 1 A 58 58 GLY N N 45 106.680 107.068 -0.388 1
1 457 . 3 1 1 A 59 59 ILE H H 46 8.180 7.928 0.252 1
1 458 . 3 1 1 A 59 59 ILE HA H 46 3.907 4.177 -0.270 1
1 468 . 3 1 1 A 59 59 ILE C C 46 174.235 176.065 -1.830 1
1 469 . 3 1 1 A 59 59 ILE CA C 46 60.948 60.726 0.222 1
1 470 . 3 1 1 A 59 59 ILE CB C 46 33.980 37.913 -3.933 1
1 474 . 3 1 1 A 59 59 ILE N N 46 122.454 121.322 1.132 1
1 475 . 3 1 1 A 60 60 LEU H H 47 7.367 8.526 -1.159 1
1 476 . 3 1 1 A 60 60 LEU HA H 47 3.900 4.512 -0.612 1
1 479 . 3 1 1 A 60 60 LEU C C 47 177.753 178.087 -0.334 1
1 480 . 3 1 1 A 60 60 LEU CA C 47 56.260 54.413 1.847 1
1 481 . 3 1 1 A 60 60 LEU CB C 47 42.196 42.280 -0.084 1
1 482 . 3 1 1 A 60 60 LEU N N 47 125.835 126.512 -0.677 1
1 483 . 3 1 1 A 63 63 GLY HA2 H 50 3.980 4.053 -0.073 1
1 484 . 3 1 1 A 63 63 GLY HA3 H 50 3.950 4.060 -0.110 1
1 485 . 3 1 1 A 63 63 GLY C C 50 177.130 174.464 2.666 1
1 486 . 3 1 1 A 63 63 GLY CA C 50 46.884 45.302 1.582 1
1 487 . 3 1 1 A 64 64 HIS H H 51 7.926 8.124 -0.198 1
1 488 . 3 1 1 A 64 64 HIS HA H 51 4.451 4.476 -0.025 1
1 493 . 3 1 1 A 64 64 HIS C C 51 177.613 176.907 0.706 1
1 494 . 3 1 1 A 64 64 HIS CA C 51 57.198 57.215 -0.017 1
1 495 . 3 1 1 A 64 64 HIS CB C 51 30.945 30.923 0.022 1
1 498 . 3 1 1 A 64 64 HIS N N 51 122.284 119.597 2.687 1
1 499 . 3 1 1 A 65 65 ARG H H 52 8.105 8.318 -0.213 1
1 500 . 3 1 1 A 65 65 ARG HA H 52 3.685 3.727 -0.042 1
1 507 . 3 1 1 A 65 65 ARG C C 52 177.769 178.432 -0.663 1
1 508 . 3 1 1 A 65 65 ARG CA C 52 61.886 59.675 2.211 1
1 509 . 3 1 1 A 65 65 ARG CB C 52 30.945 29.958 0.987 1
1 511 . 3 1 1 A 65 65 ARG N N 52 117.775 118.358 -0.583 1
1 513 . 3 1 1 A 66 66 GLN H H 53 8.090 7.933 0.157 1
1 514 . 3 1 1 A 66 66 GLN HA H 53 3.940 3.980 -0.040 1
1 519 . 3 1 1 A 66 66 GLN C C 53 178.583 178.186 0.397 1
1 520 . 3 1 1 A 66 66 GLN CA C 53 59.073 59.097 -0.024 1
1 521 . 3 1 1 A 66 66 GLN CB C 53 28.133 28.370 -0.237 1
1 523 . 3 1 1 A 66 66 GLN N N 53 116.452 118.915 -2.463 1
1 524 . 3 1 1 A 67 67 ARG H H 54 7.845 7.850 -0.005 1
1 525 . 3 1 1 A 67 67 ARG HA H 54 4.010 4.118 -0.108 1
1 528 . 3 1 1 A 67 67 ARG C C 54 179.766 178.916 0.850 1
1 529 . 3 1 1 A 67 67 ARG CA C 54 59.073 59.074 -0.001 1
1 530 . 3 1 1 A 67 67 ARG CB C 54 30.720 29.937 0.783 1
1 532 . 3 1 1 A 67 67 ARG N N 54 119.275 118.345 0.930 1
1 533 . 3 1 1 A 68 68 ILE H H 55 8.032 7.955 0.077 1
1 534 . 3 1 1 A 68 68 ILE HA H 55 3.495 3.487 0.008 1
1 544 . 3 1 1 A 68 68 ILE C C 55 177.108 178.486 -1.378 1
1 545 . 3 1 1 A 68 68 ILE CA C 55 66.230 65.494 0.736 1
1 546 . 3 1 1 A 68 68 ILE CB C 55 38.020 37.753 0.267 1
1 550 . 3 1 1 A 68 68 ILE N N 55 121.152 120.951 0.201 1
1 551 . 3 1 1 A 69 69 LEU H H 56 8.490 8.233 0.257 1
1 552 . 3 1 1 A 69 69 LEU HA H 56 4.010 3.820 0.190 1
1 561 . 3 1 1 A 69 69 LEU C C 56 179.917 179.002 0.915 1
1 562 . 3 1 1 A 69 69 LEU CA C 56 58.135 58.032 0.103 1
1 563 . 3 1 1 A 69 69 LEU CB C 56 41.259 41.645 -0.386 1
1 566 . 3 1 1 A 69 69 LEU N N 56 119.072 120.008 -0.936 1
1 567 . 3 1 1 A 70 70 GLN H H 57 8.327 8.653 -0.326 1
1 568 . 3 1 1 A 70 70 GLN HA H 57 4.100 4.075 0.025 1
1 573 . 3 1 1 A 70 70 GLN C C 57 178.798 178.118 0.680 1
1 574 . 3 1 1 A 70 70 GLN CA C 57 59.073 58.373 0.700 1
1 575 . 3 1 1 A 70 70 GLN CB C 57 28.133 28.581 -0.448 1
1 577 . 3 1 1 A 70 70 GLN N N 57 118.172 117.361 0.811 1
1 578 . 3 1 1 A 71 71 ALA H H 58 7.810 7.800 0.010 1
1 579 . 3 1 1 A 71 71 ALA HA H 58 4.320 4.171 0.149 1
1 583 . 3 1 1 A 71 71 ALA C C 58 172.232 180.006 -7.774 1
1 584 . 3 1 1 A 71 71 ALA CA C 58 55.323 55.267 0.056 1
1 585 . 3 1 1 A 71 71 ALA CB C 58 19.720 18.857 0.863 1
1 586 . 3 1 1 A 71 71 ALA N N 58 122.536 121.820 0.716 1
1 587 . 3 1 1 A 72 72 ILE H H 59 8.840 8.413 0.427 1
1 588 . 3 1 1 A 72 72 ILE HA H 59 4.030 3.626 0.404 1
1 598 . 3 1 1 A 72 72 ILE C C 59 178.678 178.173 0.505 1
1 599 . 3 1 1 A 72 72 ILE CA C 59 64.698 64.836 -0.138 1
1 600 . 3 1 1 A 72 72 ILE CB C 59 37.850 37.491 0.359 1
1 604 . 3 1 1 A 72 72 ILE N N 59 118.111 117.566 0.545 1
1 605 . 3 1 1 A 73 73 GLN H H 60 7.547 8.162 -0.615 1
1 606 . 3 1 1 A 73 73 GLN HA H 60 4.121 4.389 -0.268 1
1 611 . 3 1 1 A 73 73 GLN C C 60 176.556 177.778 -1.222 1
1 612 . 3 1 1 A 73 73 GLN CA C 60 58.135 58.685 -0.550 1
1 613 . 3 1 1 A 73 73 GLN CB C 60 28.300 28.369 -0.069 1
1 615 . 3 1 1 A 73 73 GLN N N 60 119.094 120.750 -1.656 1
1 616 . 3 1 1 A 74 74 LEU H H 61 7.350 7.942 -0.592 1
1 617 . 3 1 1 A 74 74 LEU HA H 61 4.408 4.247 0.161 1
1 626 . 3 1 1 A 74 74 LEU C C 61 177.960 177.280 0.680 1
1 627 . 3 1 1 A 74 74 LEU CA C 61 54.900 56.749 -1.849 1
1 628 . 3 1 1 A 74 74 LEU CB C 61 42.196 42.552 -0.356 1
1 631 . 3 1 1 A 74 74 LEU N N 61 115.853 120.069 -4.216 1
1 632 . 3 1 1 A 75 75 LEU H H 62 7.358 7.461 -0.103 1
1 633 . 3 1 1 A 75 75 LEU HA H 62 4.530 4.402 0.128 1
1 642 . 3 1 1 A 75 75 LEU C C 62 177.035 174.788 2.247 1
1 643 . 3 1 1 A 75 75 LEU CA C 62 53.200 53.819 -0.619 1
1 644 . 3 1 1 A 75 75 LEU CB C 62 40.700 41.450 -0.750 1
1 647 . 3 1 1 A 75 75 LEU N N 62 121.010 122.535 -1.525 1
1 648 . 3 1 1 A 76 76 PRO HA H 63 4.382 4.470 -0.088 1
1 655 . 3 1 1 A 76 76 PRO CB C 63 31.883 32.676 -0.793 1
1 657 . 3 1 1 A 77 77 LYS H H 64 8.418 8.718 -0.300 1
1 658 . 3 1 1 A 77 77 LYS HA H 64 4.140 3.692 0.448 1
1 663 . 3 1 1 A 77 77 LYS C C 64 177.122 177.064 0.058 1
1 664 . 3 1 1 A 77 77 LYS CA C 64 56.260 56.825 -0.565 1
1 665 . 3 1 1 A 77 77 LYS CB C 64 33.340 29.889 3.451 1
1 668 . 3 1 1 A 77 77 LYS N N 64 121.932 115.976 5.956 1
1 669 . 3 1 1 A 78 78 MET H H 65 8.550 8.104 0.446 1
1 670 . 3 1 1 A 78 78 MET HA H 65 4.304 4.543 -0.239 1
1 676 . 3 1 1 A 78 78 MET C C 65 176.105 175.719 0.386 1
1 677 . 3 1 1 A 78 78 MET CA C 65 56.260 56.144 0.116 1
1 678 . 3 1 1 A 78 78 MET CB C 65 32.821 33.191 -0.370 1
1 680 . 3 1 1 A 78 78 MET N N 65 123.498 116.706 6.792 1
1 681 . 3 1 1 A 79 79 ARG H H 66 8.731 7.772 0.959 1
1 682 . 3 1 1 A 79 79 ARG C C 66 173.577 176.766 -3.189 1
1 683 . 3 1 1 A 79 79 ARG CA C 66 53.447 56.390 -2.943 1
1 684 . 3 1 1 A 79 79 ARG CB C 66 30.008 27.983 2.025 1
1 685 . 3 1 1 A 79 79 ARG N N 66 127.355 115.175 12.180 1
1 686 . 3 1 1 A 80 80 PRO HA H 67 4.780 4.313 0.467 1
1 693 . 3 1 1 A 80 80 PRO C C 67 177.043 178.429 -1.386 1
1 694 . 3 1 1 A 80 80 PRO CA C 67 61.886 64.951 -3.065 1
1 695 . 3 1 1 A 80 80 PRO CB C 67 32.821 31.906 0.915 1
1 698 . 3 1 1 A 81 81 ILE H H 68 8.580 8.077 0.503 1
1 699 . 3 1 1 A 81 81 ILE HA H 68 4.040 4.002 0.038 1
1 709 . 3 1 1 A 81 81 ILE C C 68 176.831 176.184 0.647 1
1 710 . 3 1 1 A 81 81 ILE CA C 68 62.823 63.270 -0.447 1
1 711 . 3 1 1 A 81 81 ILE CB C 68 38.580 37.829 0.751 1
1 715 . 3 1 1 A 81 81 ILE N N 68 118.491 115.235 3.256 1
1 716 . 3 1 1 A 82 82 GLY H H 69 8.602 7.240 1.362 1
1 717 . 3 1 1 A 82 82 GLY CA C 69 45.009 45.627 -0.618 1
1 718 . 3 1 1 A 82 82 GLY N N 69 111.377 109.082 2.295 1
1 721 . 3 1 1 A 84 84 ASP HA H 71 4.490 5.067 -0.577 1
1 724 . 3 1 1 A 84 84 ASP CA C 71 54.385 52.933 1.452 1
1 725 . 3 1 1 A 84 84 ASP CB C 71 40.321 45.128 -4.807 1
1 726 . 3 1 1 A 85 85 GLY H H 72 8.054 8.517 -0.463 1
1 727 . 3 1 1 A 85 85 GLY HA2 H 72 4.040 4.184 -0.144 1
1 728 . 3 1 1 A 85 85 GLY HA3 H 72 3.750 4.203 -0.453 1
1 729 . 3 1 1 A 85 85 GLY C C 72 173.474 171.967 1.507 1
1 730 . 3 1 1 A 85 85 GLY CA C 72 45.009 45.819 -0.810 1
1 731 . 3 1 1 A 85 85 GLY N N 72 108.038 107.867 0.171 1
1 732 . 3 1 1 A 86 86 ALA H H 73 7.858 8.783 -0.925 1
1 733 . 3 1 1 A 86 86 ALA HA H 73 4.370 5.372 -1.002 1
1 737 . 3 1 1 A 86 86 ALA CA C 73 51.990 50.581 1.409 1
1 738 . 3 1 1 A 86 86 ALA CB C 73 19.220 21.935 -2.715 1
1 739 . 3 1 1 A 86 86 ALA N N 73 123.819 126.957 -3.138 1
1 742 . 3 1 1 A 90 90 SER H H 77 7.839 8.559 -0.720 1
1 743 . 3 1 1 A 90 90 SER HA H 77 4.770 4.764 0.006 1
1 746 . 3 1 1 A 90 90 SER N N 77 115.163 117.316 -2.153 1
1 747 . 3 1 1 A 91 91 VAL H H 78 8.578 8.905 -0.327 1
1 748 . 3 1 1 A 91 91 VAL HA H 78 3.981 3.959 0.022 1
1 756 . 3 1 1 A 91 91 VAL C C 78 177.480 177.327 0.153 1
1 757 . 3 1 1 A 91 91 VAL CA C 78 67.060 66.303 0.757 1
1 758 . 3 1 1 A 91 91 VAL CB C 78 32.500 31.695 0.805 1
1 761 . 3 1 1 A 91 91 VAL N N 78 123.481 126.409 -2.928 1
1 762 . 3 1 1 A 92 92 ALA H H 79 8.607 8.390 0.217 1
1 763 . 3 1 1 A 92 92 ALA HA H 79 4.113 4.036 0.077 1
1 767 . 3 1 1 A 92 92 ALA C C 79 179.868 180.423 -0.555 1
1 768 . 3 1 1 A 92 92 ALA CA C 79 54.890 55.571 -0.681 1
1 769 . 3 1 1 A 92 92 ALA CB C 79 18.790 18.395 0.395 1
1 770 . 3 1 1 A 92 92 ALA N N 79 120.334 122.380 -2.046 1
1 771 . 3 1 1 A 93 93 GLU H H 80 7.886 8.165 -0.279 1
1 772 . 3 1 1 A 93 93 GLU HA H 80 4.010 4.015 -0.005 1
1 777 . 3 1 1 A 93 93 GLU C C 80 179.719 178.822 0.897 1
1 778 . 3 1 1 A 93 93 GLU CA C 80 59.073 59.487 -0.414 1
1 779 . 3 1 1 A 93 93 GLU CB C 80 30.630 29.436 1.194 1
1 781 . 3 1 1 A 93 93 GLU N N 80 117.643 117.527 0.116 1
1 782 . 3 1 1 A 94 94 TRP H H 81 8.299 8.068 0.231 1
1 783 . 3 1 1 A 94 94 TRP HA H 81 4.251 4.213 0.038 1
1 792 . 3 1 1 A 94 94 TRP C C 81 178.772 178.375 0.397 1
1 793 . 3 1 1 A 94 94 TRP CA C 81 60.010 61.037 -1.027 1
1 794 . 3 1 1 A 94 94 TRP CB C 81 27.650 29.991 -2.341 1
1 800 . 3 1 1 A 94 94 TRP N N 81 122.545 122.824 -0.279 1
1 802 . 3 1 1 A 95 95 LEU H H 82 8.505 8.791 -0.286 1
1 803 . 3 1 1 A 95 95 LEU HA H 82 2.880 3.149 -0.269 1
1 812 . 3 1 1 A 95 95 LEU C C 82 180.235 178.942 1.293 1
1 813 . 3 1 1 A 95 95 LEU CA C 82 57.400 56.968 0.432 1
1 814 . 3 1 1 A 95 95 LEU CB C 82 40.321 40.746 -0.425 1
1 817 . 3 1 1 A 95 95 LEU N N 82 121.110 119.082 2.028 1
1 818 . 3 1 1 A 96 96 ASP H H 83 8.185 8.257 -0.072 1
1 819 . 3 1 1 A 96 96 ASP HA H 83 4.280 4.379 -0.099 1
1 822 . 3 1 1 A 96 96 ASP C C 83 175.224 177.096 -1.872 1
1 823 . 3 1 1 A 96 96 ASP CA C 83 57.310 56.347 0.963 1
1 824 . 3 1 1 A 96 96 ASP CB C 83 40.321 41.085 -0.764 1
1 825 . 3 1 1 A 96 96 ASP N N 83 119.082 119.858 -0.776 1
1 826 . 3 1 1 A 97 97 SER H H 84 7.989 8.036 -0.047 1
1 827 . 3 1 1 A 97 97 SER HA H 84 4.250 4.413 -0.163 1
1 830 . 3 1 1 A 97 97 SER C C 84 175.346 174.640 0.706 1
1 831 . 3 1 1 A 97 97 SER CA C 84 60.948 59.286 1.662 1
1 832 . 3 1 1 A 97 97 SER CB C 84 63.370 64.311 -0.941 1
1 833 . 3 1 1 A 97 97 SER N N 84 117.579 113.439 4.140 1
1 834 . 3 1 1 A 98 98 ILE H H 85 6.862 7.200 -0.338 1
1 835 . 3 1 1 A 98 98 ILE HA H 85 4.550 4.030 0.520 1
1 843 . 3 1 1 A 98 98 ILE C C 85 173.308 175.120 -1.812 1
1 844 . 3 1 1 A 98 98 ILE CA C 85 60.948 60.775 0.173 1
1 845 . 3 1 1 A 98 98 ILE CB C 85 37.760 37.527 0.233 1
1 848 . 3 1 1 A 98 98 ILE N N 85 113.733 116.751 -3.018 1
1 849 . 3 1 1 A 99 99 GLU H H 86 7.705 7.941 -0.236 1
1 850 . 3 1 1 A 99 99 GLU HA H 86 4.280 3.824 0.456 1
1 853 . 3 1 1 A 99 99 GLU C C 86 175.224 175.007 0.217 1
1 854 . 3 1 1 A 99 99 GLU CA C 86 56.260 57.571 -1.311 1
1 855 . 3 1 1 A 99 99 GLU CB C 86 26.258 27.747 -1.489 1
1 857 . 3 1 1 A 99 99 GLU N N 86 115.493 119.272 -3.779 1
1 858 . 3 1 1 A 100 100 LEU H H 87 7.989 7.055 0.934 1
1 859 . 3 1 1 A 100 100 LEU HA H 87 4.220 4.718 -0.498 1
1 868 . 3 1 1 A 100 100 LEU C C 87 176.965 176.099 0.866 1
1 869 . 3 1 1 A 100 100 LEU CA C 87 52.510 53.330 -0.820 1
1 870 . 3 1 1 A 100 100 LEU CB C 87 42.196 44.281 -2.085 1
1 873 . 3 1 1 A 100 100 LEU N N 87 117.579 120.294 -2.715 1
1 874 . 3 1 1 A 101 101 GLY H H 88 8.503 8.040 0.463 1
1 875 . 3 1 1 A 101 101 GLY CA C 88 46.884 45.685 1.199 1
1 876 . 3 1 1 A 101 101 GLY N N 88 107.794 109.049 -1.255 1
1 877 . 3 1 1 A 102 102 ASP HA H 89 4.431 4.255 0.176 1
1 880 . 3 1 1 A 102 102 ASP C C 89 178.075 178.339 -0.264 1
1 881 . 3 1 1 A 102 102 ASP CA C 89 57.198 56.889 0.309 1
1 882 . 3 1 1 A 102 102 ASP CB C 89 40.321 40.548 -0.227 1
1 883 . 3 1 1 A 103 103 TYR H H 90 7.899 8.036 -0.137 1
1 884 . 3 1 1 A 103 103 TYR HA H 90 4.940 4.445 0.495 1
1 889 . 3 1 1 A 103 103 TYR C C 90 175.527 178.554 -3.027 1
1 890 . 3 1 1 A 103 103 TYR CA C 90 58.135 60.517 -2.382 1
1 891 . 3 1 1 A 103 103 TYR CB C 90 38.446 37.515 0.931 1
1 894 . 3 1 1 A 103 103 TYR N N 90 115.595 119.617 -4.022 1
1 895 . 3 1 1 A 104 104 THR H H 91 7.971 8.520 -0.549 1
1 896 . 3 1 1 A 104 104 THR HA H 91 4.234 4.062 0.172 1
1 901 . 3 1 1 A 104 104 THR C C 91 175.905 176.573 -0.668 1
1 902 . 3 1 1 A 104 104 THR CA C 91 68.449 66.989 1.460 1
1 904 . 3 1 1 A 104 104 THR N N 91 118.867 116.646 2.221 1
1 905 . 3 1 1 A 105 105 LYS H H 92 8.555 7.840 0.715 1
1 906 . 3 1 1 A 105 105 LYS HA H 92 3.940 4.074 -0.134 1
1 912 . 3 1 1 A 105 105 LYS C C 92 177.310 178.707 -1.397 1
1 913 . 3 1 1 A 105 105 LYS CA C 92 60.948 59.481 1.467 1
1 914 . 3 1 1 A 105 105 LYS CB C 92 31.883 32.281 -0.398 1
1 917 . 3 1 1 A 105 105 LYS N N 92 119.259 120.972 -1.713 1
1 918 . 3 1 1 A 106 106 ALA H H 93 7.920 7.971 -0.051 1
1 919 . 3 1 1 A 106 106 ALA HA H 93 4.128 4.198 -0.070 1
1 923 . 3 1 1 A 106 106 ALA C C 93 180.972 180.215 0.757 1
1 924 . 3 1 1 A 106 106 ALA CA C 93 55.070 55.382 -0.312 1
1 925 . 3 1 1 A 106 106 ALA CB C 93 17.750 18.306 -0.556 1
1 926 . 3 1 1 A 106 106 ALA N N 93 120.398 121.975 -1.577 1
1 927 . 3 1 1 A 107 107 PHE H H 94 8.136 8.875 -0.739 1
1 928 . 3 1 1 A 107 107 PHE HA H 94 4.190 4.613 -0.423 1
1 934 . 3 1 1 A 107 107 PHE C C 94 177.955 178.309 -0.354 1
1 935 . 3 1 1 A 107 107 PHE CA C 94 63.761 61.722 2.039 1
1 936 . 3 1 1 A 107 107 PHE CB C 94 38.446 38.581 -0.135 1
1 940 . 3 1 1 A 107 107 PHE N N 94 117.119 116.240 0.879 1
1 941 . 3 1 1 A 108 108 LEU H H 95 8.351 8.579 -0.228 1
1 942 . 3 1 1 A 108 108 LEU HA H 95 3.889 4.018 -0.129 1
1 951 . 3 1 1 A 108 108 LEU C C 95 182.043 179.157 2.886 1
1 952 . 3 1 1 A 108 108 LEU CA C 95 59.073 58.557 0.516 1
1 953 . 3 1 1 A 108 108 LEU CB C 95 41.259 41.622 -0.363 1
1 956 . 3 1 1 A 108 108 LEU N N 95 118.450 119.880 -1.430 1
1 957 . 3 1 1 A 109 109 ILE H H 96 8.992 8.247 0.745 1
1 958 . 3 1 1 A 109 109 ILE HA H 96 4.069 3.886 0.183 1
1 968 . 3 1 1 A 109 109 ILE C C 96 177.094 177.761 -0.667 1
1 969 . 3 1 1 A 109 109 ILE CA C 96 63.761 64.349 -0.588 1
1 970 . 3 1 1 A 109 109 ILE CB C 96 37.509 37.756 -0.247 1
1 974 . 3 1 1 A 109 109 ILE N N 96 118.177 115.428 2.749 1
1 975 . 3 1 1 A 110 110 ASN H H 97 7.067 7.814 -0.747 1
1 976 . 3 1 1 A 110 110 ASN HA H 97 4.797 4.777 0.020 1
1 981 . 3 1 1 A 110 110 ASN C C 97 173.595 175.502 -1.907 1
1 982 . 3 1 1 A 110 110 ASN CA C 97 54.385 53.356 1.029 1
1 983 . 3 1 1 A 110 110 ASN CB C 97 40.321 39.147 1.174 1
1 984 . 3 1 1 A 110 110 ASN N N 97 116.407 120.011 -3.604 1
1 986 . 3 1 1 A 111 111 GLY H H 98 7.681 7.926 -0.245 1
1 987 . 3 1 1 A 111 111 GLY HA2 H 98 4.080 3.940 0.140 1
1 988 . 3 1 1 A 111 111 GLY HA3 H 98 3.640 4.015 -0.375 1
1 989 . 3 1 1 A 111 111 GLY C C 98 174.552 174.636 -0.084 1
1 990 . 3 1 1 A 111 111 GLY CA C 98 45.947 46.068 -0.121 1
1 991 . 3 1 1 A 111 111 GLY N N 98 104.440 106.714 -2.274 1
1 992 . 3 1 1 A 112 112 TYR H H 99 8.427 8.324 0.103 1
1 993 . 3 1 1 A 112 112 TYR HA H 99 4.661 4.727 -0.066 1
1 998 . 3 1 1 A 112 112 TYR C C 99 174.425 176.298 -1.873 1
1 999 . 3 1 1 A 112 112 TYR CA C 99 57.198 57.940 -0.742 1
1 1000 . 3 1 1 A 112 112 TYR CB C 99 36.571 38.248 -1.677 1
1 1003 . 3 1 1 A 112 112 TYR N N 99 122.830 118.756 4.074 1
1 1004 . 3 1 1 A 113 113 THR H H 100 7.166 7.777 -0.611 1
1 1005 . 3 1 1 A 113 113 THR HA H 100 4.248 3.844 0.404 1
1 1009 . 3 1 1 A 113 113 THR C C 100 174.897 175.799 -0.902 1
1 1010 . 3 1 1 A 113 113 THR CA C 100 62.290 66.225 -3.935 1
1 1011 . 3 1 1 A 113 113 THR CB C 100 68.970 68.702 0.268 1
1 1013 . 3 1 1 A 113 113 THR N N 100 104.304 115.413 -11.109 1
1 1014 . 3 1 1 A 114 114 SER H H 101 7.695 7.903 -0.208 1
1 1015 . 3 1 1 A 114 114 SER C C 101 174.372 175.295 -0.923 1
1 1016 . 3 1 1 A 114 114 SER CA C 101 56.260 58.557 -2.297 1
1 1017 . 3 1 1 A 114 114 SER CB C 101 65.636 64.261 1.375 1
1 1018 . 3 1 1 A 114 114 SER N N 101 115.613 114.822 0.791 1
1 1023 . 3 1 1 A 116 116 ASP HA H 103 4.260 4.321 -0.061 1
1 1026 . 3 1 1 A 116 116 ASP CA C 103 57.198 57.644 -0.446 1
1 1027 . 3 1 1 A 116 116 ASP CB C 103 40.321 40.557 -0.236 1
1 1028 . 3 1 1 A 117 117 LEU H H 104 7.345 7.636 -0.291 1
1 1029 . 3 1 1 A 117 117 LEU HA H 104 4.290 4.031 0.259 1
1 1038 . 3 1 1 A 117 117 LEU C C 104 178.488 178.525 -0.037 1
1 1039 . 3 1 1 A 117 117 LEU CA C 104 56.260 58.127 -1.867 1
1 1040 . 3 1 1 A 117 117 LEU CB C 104 42.196 41.459 0.737 1
1 1043 . 3 1 1 A 117 117 LEU N N 104 117.878 121.459 -3.581 1
1 1044 . 3 1 1 A 118 118 LEU H H 105 7.514 8.299 -0.785 1
1 1045 . 3 1 1 A 118 118 LEU HA H 105 4.210 4.089 0.121 1
1 1054 . 3 1 1 A 118 118 LEU C C 105 177.002 177.556 -0.554 1
1 1055 . 3 1 1 A 118 118 LEU CA C 105 55.323 57.215 -1.892 1
1 1056 . 3 1 1 A 118 118 LEU CB C 105 42.196 41.493 0.703 1
1 1059 . 3 1 1 A 118 118 LEU N N 105 119.094 118.839 0.255 1
1 1060 . 3 1 1 A 120 120 LYS HA H 107 4.340 4.449 -0.109 1
1 1063 . 3 1 1 A 120 120 LYS C C 107 176.603 176.053 0.550 1
1 1064 . 3 1 1 A 120 120 LYS CA C 107 55.323 56.061 -0.738 1
1 1065 . 3 1 1 A 120 120 LYS CB C 107 31.883 32.959 -1.076 1
1 1068 . 3 1 1 A 121 121 ILE H H 108 7.539 7.554 -0.015 1
1 1069 . 3 1 1 A 121 121 ILE HA H 108 3.987 4.915 -0.928 1
1 1079 . 3 1 1 A 121 121 ILE C C 108 173.247 174.477 -1.230 1
1 1080 . 3 1 1 A 121 121 ILE CA C 108 62.823 58.547 4.276 1
1 1081 . 3 1 1 A 121 121 ILE CB C 108 38.446 41.764 -3.318 1
1 1085 . 3 1 1 A 121 121 ILE N N 108 122.417 116.602 5.815 1
1 1086 . 3 1 1 A 122 122 ALA H H 109 8.290 8.391 -0.101 1
1 1087 . 3 1 1 A 122 122 ALA HA H 109 3.970 4.692 -0.722 1
1 1091 . 3 1 1 A 122 122 ALA C C 109 178.318 177.884 0.434 1
1 1092 . 3 1 1 A 122 122 ALA CA C 109 50.150 50.073 0.077 1
1 1093 . 3 1 1 A 122 122 ALA CB C 109 21.630 22.248 -0.618 1
1 1094 . 3 1 1 A 122 122 ALA N N 109 127.784 122.995 4.789 1
1 1095 . 3 1 1 A 123 123 GLU HA H 110 3.707 3.917 -0.210 1
1 1099 . 3 1 1 A 123 123 GLU C C 110 178.290 178.364 -0.074 1
1 1100 . 3 1 1 A 123 123 GLU CA C 110 60.948 60.319 0.629 1
1 1101 . 3 1 1 A 123 123 GLU CB C 110 29.070 29.802 -0.732 1
1 1102 . 3 1 1 A 124 124 VAL H H 111 8.333 8.299 0.034 1
1 1103 . 3 1 1 A 124 124 VAL HA H 111 3.850 3.732 0.118 1
1 1111 . 3 1 1 A 124 124 VAL C C 111 177.406 177.622 -0.216 1
1 1112 . 3 1 1 A 124 124 VAL CA C 111 65.636 65.152 0.484 1
1 1113 . 3 1 1 A 124 124 VAL CB C 111 30.730 31.325 -0.595 1
1 1116 . 3 1 1 A 124 124 VAL N N 111 114.438 118.790 -4.352 1
1 1117 . 3 1 1 A 125 125 GLU H H 112 7.442 8.225 -0.783 1
1 1118 . 3 1 1 A 125 125 GLU HA H 112 4.152 4.098 0.054 1
1 1123 . 3 1 1 A 125 125 GLU C C 112 179.982 178.851 1.131 1
1 1124 . 3 1 1 A 125 125 GLU CA C 112 60.010 59.434 0.576 1
1 1125 . 3 1 1 A 125 125 GLU CB C 112 30.008 29.555 0.453 1
1 1127 . 3 1 1 A 125 125 GLU N N 112 121.032 121.542 -0.510 1
1 1128 . 3 1 1 A 126 126 LEU H H 113 7.666 7.981 -0.315 1
1 1129 . 3 1 1 A 126 126 LEU HA H 113 3.846 4.061 -0.215 1
1 1138 . 3 1 1 A 126 126 LEU C C 113 176.991 178.844 -1.853 1
1 1139 . 3 1 1 A 126 126 LEU CA C 113 58.135 57.924 0.211 1
1 1140 . 3 1 1 A 126 126 LEU CB C 113 41.259 41.771 -0.512 1
1 1143 . 3 1 1 A 126 126 LEU N N 113 118.731 120.645 -1.914 1
1 1144 . 3 1 1 A 127 127 ILE H H 114 7.781 7.991 -0.210 1
1 1145 . 3 1 1 A 127 127 ILE HA H 114 3.502 3.840 -0.338 1
1 1153 . 3 1 1 A 127 127 ILE C C 114 178.195 176.799 1.396 1
1 1154 . 3 1 1 A 127 127 ILE CA C 114 65.636 63.635 2.001 1
1 1155 . 3 1 1 A 127 127 ILE CB C 114 40.321 37.562 2.759 1
1 1159 . 3 1 1 A 127 127 ILE N N 114 115.084 119.251 -4.167 1
1 1160 . 3 1 1 A 128 128 ASN H H 115 8.470 8.001 0.469 1
1 1161 . 3 1 1 A 128 128 ASN HA H 115 4.502 4.714 -0.212 1
1 1166 . 3 1 1 A 128 128 ASN C C 115 176.295 175.816 0.479 1
1 1167 . 3 1 1 A 128 128 ASN CA C 115 56.260 54.422 1.838 1
1 1168 . 3 1 1 A 128 128 ASN CB C 115 39.384 39.351 0.033 1
1 1169 . 3 1 1 A 128 128 ASN N N 115 115.158 119.006 -3.848 1
1 1171 . 3 1 1 A 129 129 VAL H H 116 8.116 7.728 0.388 1
1 1172 . 3 1 1 A 129 129 VAL HA H 116 4.090 3.994 0.096 1
1 1180 . 3 1 1 A 129 129 VAL C C 116 176.740 177.471 -0.731 1
1 1181 . 3 1 1 A 129 129 VAL CA C 116 64.400 64.611 -0.211 1
1 1182 . 3 1 1 A 129 129 VAL CB C 116 32.050 32.350 -0.300 1
1 1185 . 3 1 1 A 129 129 VAL N N 116 118.698 117.833 0.865 1
1 1186 . 3 1 1 A 130 130 LEU H H 117 7.294 7.937 -0.643 1
1 1187 . 3 1 1 A 130 130 LEU HA H 117 3.970 4.189 -0.219 1
1 1196 . 3 1 1 A 130 130 LEU C C 117 175.127 176.122 -0.995 1
1 1197 . 3 1 1 A 130 130 LEU CA C 117 56.260 55.136 1.124 1
1 1198 . 3 1 1 A 130 130 LEU CB C 117 41.259 42.251 -0.992 1
1 1201 . 3 1 1 A 130 130 LEU N N 117 116.201 118.973 -2.772 1
1 1202 . 3 1 1 A 131 131 LYS H H 118 6.594 7.837 -1.243 1
1 1203 . 3 1 1 A 131 131 LYS HA H 118 3.980 4.216 -0.236 1
1 1208 . 3 1 1 A 131 131 LYS C C 118 175.589 175.501 0.088 1
1 1209 . 3 1 1 A 131 131 LYS CA C 118 56.260 57.464 -1.204 1
1 1210 . 3 1 1 A 131 131 LYS CB C 118 28.133 29.494 -1.361 1
1 1212 . 3 1 1 A 131 131 LYS N N 118 111.172 115.825 -4.653 1
1 1213 . 3 1 1 A 132 132 ILE H H 119 8.245 8.007 0.238 1
1 1214 . 3 1 1 A 132 132 ILE HA H 119 4.090 4.374 -0.284 1
1 1224 . 3 1 1 A 132 132 ILE C C 119 175.161 175.856 -0.695 1
1 1225 . 3 1 1 A 132 132 ILE CA C 119 60.010 61.397 -1.387 1
1 1226 . 3 1 1 A 132 132 ILE CB C 119 35.633 36.529 -0.896 1
1 1230 . 3 1 1 A 132 132 ILE N N 119 119.484 119.902 -0.418 1
1 1231 . 3 1 1 A 133 133 ASN H H 120 8.054 9.109 -1.055 1
1 1232 . 3 1 1 A 133 133 ASN HA H 120 4.350 4.748 -0.398 1
1 1235 . 3 1 1 A 133 133 ASN C C 120 175.136 175.942 -0.806 1
1 1236 . 3 1 1 A 133 133 ASN CA C 120 54.385 54.971 -0.586 1
1 1237 . 3 1 1 A 133 133 ASN CB C 120 39.384 39.084 0.300 1
1 1238 . 3 1 1 A 133 133 ASN N N 120 124.670 127.151 -2.481 1
1 1239 . 3 1 1 A 134 134 LEU H H 121 7.517 7.393 0.124 1
1 1240 . 3 1 1 A 134 134 LEU HA H 121 4.678 4.134 0.544 1
1 1249 . 3 1 1 A 134 134 LEU C C 121 178.051 176.973 1.078 1
1 1250 . 3 1 1 A 134 134 LEU CA C 121 53.447 55.760 -2.313 1
1 1251 . 3 1 1 A 134 134 LEU CB C 121 41.259 42.995 -1.736 1
1 1254 . 3 1 1 A 134 134 LEU N N 121 119.918 119.134 0.784 1
1 1255 . 3 1 1 A 135 135 ILE H H 122 9.389 8.767 0.622 1
1 1256 . 3 1 1 A 135 135 ILE HA H 122 3.540 3.708 -0.168 1
1 1266 . 3 1 1 A 135 135 ILE C C 122 176.425 177.832 -1.407 1
1 1267 . 3 1 1 A 135 135 ILE CA C 122 65.636 64.948 0.688 1
1 1268 . 3 1 1 A 135 135 ILE CB C 122 38.446 38.214 0.232 1
1 1272 . 3 1 1 A 135 135 ILE N N 122 129.949 127.181 2.768 1
1 1273 . 3 1 1 A 136 136 GLY H H 123 8.675 8.743 -0.068 1
1 1274 . 3 1 1 A 136 136 GLY HA2 H 123 2.650 3.438 -0.788 1
1 1275 . 3 1 1 A 136 136 GLY HA3 H 123 2.060 3.692 -1.632 1
1 1276 . 3 1 1 A 136 136 GLY C C 123 176.854 176.383 0.471 1
1 1277 . 3 1 1 A 136 136 GLY CA C 123 45.500 47.137 -1.637 1
1 1278 . 3 1 1 A 136 136 GLY N N 123 106.314 108.187 -1.873 1
1 1279 . 3 1 1 A 137 137 HIS H H 124 6.869 7.982 -1.113 1
1 1280 . 3 1 1 A 137 137 HIS HA H 124 4.558 4.501 0.057 1
1 1285 . 3 1 1 A 137 137 HIS C C 124 176.977 177.503 -0.526 1
1 1286 . 3 1 1 A 137 137 HIS CA C 124 57.198 58.950 -1.752 1
1 1287 . 3 1 1 A 137 137 HIS CB C 124 30.945 29.954 0.991 1
1 1290 . 3 1 1 A 137 137 HIS N N 124 118.865 120.003 -1.138 1
1 1291 . 3 1 1 A 138 138 ARG H H 125 7.730 8.612 -0.882 1
1 1292 . 3 1 1 A 138 138 ARG HA H 125 3.770 3.883 -0.113 1
1 1299 . 3 1 1 A 138 138 ARG C C 125 178.288 178.339 -0.051 1
1 1300 . 3 1 1 A 138 138 ARG CA C 125 61.886 59.269 2.617 1
1 1301 . 3 1 1 A 138 138 ARG CB C 125 30.945 30.015 0.930 1
1 1304 . 3 1 1 A 138 138 ARG N N 125 118.149 119.670 -1.521 1
1 1306 . 3 1 1 A 139 139 LYS H H 126 8.679 8.320 0.359 1
1 1307 . 3 1 1 A 139 139 LYS HA H 126 3.990 3.954 0.036 1
1 1310 . 3 1 1 A 139 139 LYS C C 126 179.184 178.643 0.541 1
1 1311 . 3 1 1 A 139 139 LYS CA C 126 58.135 59.356 -1.221 1
1 1312 . 3 1 1 A 139 139 LYS CB C 126 30.945 32.165 -1.220 1
1 1314 . 3 1 1 A 139 139 LYS N N 126 114.003 118.978 -4.975 1
1 1315 . 3 1 1 A 140 140 ARG H H 127 7.248 8.110 -0.862 1
1 1316 . 3 1 1 A 140 140 ARG HA H 127 3.870 3.915 -0.045 1
1 1324 . 3 1 1 A 140 140 ARG C C 127 177.772 179.076 -1.304 1
1 1325 . 3 1 1 A 140 140 ARG CA C 127 60.010 59.326 0.684 1
1 1326 . 3 1 1 A 140 140 ARG CB C 127 30.945 29.905 1.040 1
1 1329 . 3 1 1 A 140 140 ARG N N 127 120.072 117.840 2.232 1
1 1331 . 3 1 1 A 141 141 ILE H H 128 7.706 8.142 -0.436 1
1 1332 . 3 1 1 A 141 141 ILE HA H 128 3.530 3.636 -0.106 1
1 1340 . 3 1 1 A 141 141 ILE C C 128 177.669 178.149 -0.480 1
1 1341 . 3 1 1 A 141 141 ILE CA C 128 65.636 65.849 -0.213 1
1 1342 . 3 1 1 A 141 141 ILE CB C 128 38.680 38.069 0.611 1
1 1345 . 3 1 1 A 141 141 ILE N N 128 118.730 120.563 -1.833 1
1 1346 . 3 1 1 A 142 142 LEU H H 129 8.194 8.455 -0.261 1
1 1347 . 3 1 1 A 142 142 LEU HA H 129 3.950 3.996 -0.046 1
1 1356 . 3 1 1 A 142 142 LEU C C 129 179.960 178.569 1.391 1
1 1357 . 3 1 1 A 142 142 LEU CA C 129 58.135 57.952 0.183 1
1 1358 . 3 1 1 A 142 142 LEU CB C 129 41.259 41.263 -0.004 1
1 1361 . 3 1 1 A 142 142 LEU N N 129 117.675 121.401 -3.726 1
1 1362 . 3 1 1 A 143 143 ALA H H 130 8.294 8.589 -0.295 1
1 1363 . 3 1 1 A 143 143 ALA HA H 130 4.220 4.046 0.174 1
1 1367 . 3 1 1 A 143 143 ALA C C 130 179.899 179.638 0.261 1
1 1368 . 3 1 1 A 143 143 ALA CA C 130 54.385 55.243 -0.858 1
1 1369 . 3 1 1 A 143 143 ALA CB C 130 19.270 18.387 0.883 1
1 1370 . 3 1 1 A 143 143 ALA N N 130 121.096 121.369 -0.273 1
1 1371 . 3 1 1 A 144 144 SER H H 131 7.813 8.344 -0.531 1
1 1372 . 3 1 1 A 144 144 SER HA H 131 4.180 4.247 -0.067 1
1 1375 . 3 1 1 A 144 144 SER C C 131 175.457 177.723 -2.266 1
1 1376 . 3 1 1 A 144 144 SER CA C 131 60.948 61.740 -0.792 1
1 1377 . 3 1 1 A 144 144 SER CB C 131 63.761 62.565 1.196 1
1 1378 . 3 1 1 A 144 144 SER N N 131 112.102 113.510 -1.408 1
1 1379 . 3 1 1 A 145 145 LEU H H 132 7.747 7.937 -0.190 1
1 1380 . 3 1 1 A 145 145 LEU HA H 132 4.140 4.038 0.102 1
1 1389 . 3 1 1 A 145 145 LEU C C 132 178.589 177.084 1.505 1
1 1390 . 3 1 1 A 145 145 LEU CA C 132 56.260 56.930 -0.670 1
1 1391 . 3 1 1 A 145 145 LEU CB C 132 42.196 42.678 -0.482 1
1 1394 . 3 1 1 A 145 145 LEU N N 132 117.536 118.808 -1.272 1
1 1395 . 3 1 1 A 146 146 GLY H H 133 7.544 7.549 -0.005 1
1 1396 . 3 1 1 A 146 146 GLY HA2 H 133 3.950 4.021 -0.071 1
1 1397 . 3 1 1 A 146 146 GLY HA3 H 133 3.100 4.030 -0.930 1
1 1398 . 3 1 1 A 146 146 GLY C C 133 173.372 172.247 1.125 1
1 1399 . 3 1 1 A 146 146 GLY CA C 133 45.947 45.221 0.726 1
1 1400 . 3 1 1 A 146 146 GLY N N 133 105.351 104.033 1.318 1
1 1401 . 3 1 1 A 147 147 ASP H H 134 8.342 8.494 -0.152 1
1 1402 . 3 1 1 A 147 147 ASP HA H 134 4.650 4.761 -0.111 1
1 1405 . 3 1 1 A 147 147 ASP C C 134 175.462 175.867 -0.405 1
1 1406 . 3 1 1 A 147 147 ASP CA C 134 54.385 53.836 0.549 1
1 1407 . 3 1 1 A 147 147 ASP CB C 134 41.259 42.058 -0.799 1
1 1408 . 3 1 1 A 147 147 ASP N N 134 120.133 121.953 -1.820 1
1 14 . 4 1 1 A 15 15 GLN H H 2 8.439 8.784 -0.345 1
1 15 . 4 1 1 A 15 15 GLN HA H 2 4.594 5.121 -0.527 1
1 20 . 4 1 1 A 15 15 GLN C C 2 175.972 173.592 2.380 1
1 21 . 4 1 1 A 15 15 GLN CA C 2 56.260 54.702 1.558 1
1 22 . 4 1 1 A 15 15 GLN CB C 2 30.945 32.683 -1.738 1
1 24 . 4 1 1 A 15 15 GLN N N 2 124.997 120.184 4.813 1
1 25 . 4 1 1 A 16 16 THR H H 3 8.347 8.464 -0.117 1
1 26 . 4 1 1 A 16 16 THR HA H 3 4.555 4.776 -0.221 1
1 31 . 4 1 1 A 16 16 THR C C 3 175.495 174.644 0.851 1
1 32 . 4 1 1 A 16 16 THR CA C 3 60.010 61.234 -1.224 1
1 33 . 4 1 1 A 16 16 THR CB C 3 71.261 72.295 -1.034 1
1 34 . 4 1 1 A 16 16 THR N N 3 113.011 113.163 -0.152 1
1 35 . 4 1 1 A 17 17 VAL H H 4 8.895 9.075 -0.180 1
1 36 . 4 1 1 A 17 17 VAL HA H 4 3.670 3.807 -0.137 1
1 44 . 4 1 1 A 17 17 VAL C C 4 178.449 177.916 0.533 1
1 45 . 4 1 1 A 17 17 VAL CA C 4 67.511 66.441 1.070 1
1 46 . 4 1 1 A 17 17 VAL CB C 4 31.883 31.749 0.134 1
1 49 . 4 1 1 A 17 17 VAL N N 4 121.854 124.689 -2.835 1
1 50 . 4 1 1 A 18 18 GLY H H 5 9.017 8.256 0.761 1
1 51 . 4 1 1 A 18 18 GLY HA2 H 5 3.940 3.782 0.158 1
1 52 . 4 1 1 A 18 18 GLY HA3 H 5 3.610 3.794 -0.184 1
1 53 . 4 1 1 A 18 18 GLY C C 5 176.186 176.131 0.055 1
1 54 . 4 1 1 A 18 18 GLY CA C 5 47.822 47.333 0.489 1
1 55 . 4 1 1 A 18 18 GLY N N 5 106.966 107.759 -0.793 1
1 56 . 4 1 1 A 19 19 GLN H H 6 8.072 7.819 0.253 1
1 57 . 4 1 1 A 19 19 GLN HA H 6 4.037 4.105 -0.068 1
1 62 . 4 1 1 A 19 19 GLN C C 6 179.488 178.680 0.808 1
1 63 . 4 1 1 A 19 19 GLN CA C 6 59.073 59.009 0.064 1
1 64 . 4 1 1 A 19 19 GLN CB C 6 28.489 28.708 -0.219 1
1 66 . 4 1 1 A 19 19 GLN N N 6 122.431 121.393 1.038 1
1 67 . 4 1 1 A 20 20 TRP H H 7 8.756 8.330 0.426 1
1 68 . 4 1 1 A 20 20 TRP HA H 7 4.160 4.326 -0.166 1
1 77 . 4 1 1 A 20 20 TRP C C 7 179.620 177.728 1.892 1
1 78 . 4 1 1 A 20 20 TRP CA C 7 61.886 61.269 0.617 1
1 79 . 4 1 1 A 20 20 TRP CB C 7 28.133 29.472 -1.339 1
1 85 . 4 1 1 A 20 20 TRP N N 7 124.265 122.501 1.764 1
1 87 . 4 1 1 A 21 21 LEU H H 8 9.148 8.734 0.414 1
1 88 . 4 1 1 A 21 21 LEU HA H 8 3.440 3.555 -0.115 1
1 97 . 4 1 1 A 21 21 LEU C C 8 180.521 178.304 2.217 1
1 98 . 4 1 1 A 21 21 LEU CA C 8 56.920 58.008 -1.088 1
1 99 . 4 1 1 A 21 21 LEU CB C 8 41.700 41.690 0.010 1
1 102 . 4 1 1 A 21 21 LEU N N 8 120.548 120.681 -0.133 1
1 103 . 4 1 1 A 22 22 GLU H H 9 8.284 8.583 -0.299 1
1 104 . 4 1 1 A 22 22 GLU HA H 9 3.740 3.908 -0.168 1
1 109 . 4 1 1 A 22 22 GLU C C 9 179.960 178.516 1.444 1
1 110 . 4 1 1 A 22 22 GLU CA C 9 60.010 59.770 0.240 1
1 111 . 4 1 1 A 22 22 GLU CB C 9 29.070 29.225 -0.155 1
1 113 . 4 1 1 A 22 22 GLU N N 9 120.133 119.422 0.711 1
1 114 . 4 1 1 A 23 23 SER H H 10 7.891 7.732 0.159 1
1 115 . 4 1 1 A 23 23 SER HA H 10 4.250 4.234 0.016 1
1 118 . 4 1 1 A 23 23 SER C C 10 175.346 176.531 -1.185 1
1 119 . 4 1 1 A 23 23 SER CA C 10 60.948 61.348 -0.400 1
1 120 . 4 1 1 A 23 23 SER CB C 10 63.280 62.963 0.317 1
1 121 . 4 1 1 A 23 23 SER N N 10 117.044 114.407 2.637 1
1 122 . 4 1 1 A 24 24 ILE H H 11 6.862 7.659 -0.797 1
1 123 . 4 1 1 A 24 24 ILE HA H 11 4.487 3.857 0.630 1
1 133 . 4 1 1 A 24 24 ILE C C 11 175.812 175.600 0.212 1
1 134 . 4 1 1 A 24 24 ILE CA C 11 60.948 63.356 -2.408 1
1 135 . 4 1 1 A 24 24 ILE CB C 11 38.250 37.299 0.951 1
1 139 . 4 1 1 A 24 24 ILE N N 11 113.733 117.755 -4.022 1
1 140 . 4 1 1 A 25 25 GLY H H 12 7.628 7.513 0.115 1
1 141 . 4 1 1 A 25 25 GLY HA2 H 12 3.990 4.028 -0.038 1
1 142 . 4 1 1 A 25 25 GLY HA3 H 12 3.800 4.031 -0.231 1
1 143 . 4 1 1 A 25 25 GLY C C 12 173.647 171.756 1.891 1
1 144 . 4 1 1 A 25 25 GLY CA C 12 45.947 46.036 -0.089 1
1 145 . 4 1 1 A 25 25 GLY N N 12 109.763 109.644 0.119 1
1 146 . 4 1 1 A 26 26 LEU H H 13 7.620 8.065 -0.445 1
1 147 . 4 1 1 A 26 26 LEU C C 13 176.186 174.113 2.073 1
1 148 . 4 1 1 A 26 26 LEU CA C 13 52.700 51.919 0.781 1
1 149 . 4 1 1 A 26 26 LEU CB C 13 43.134 45.672 -2.538 1
1 150 . 4 1 1 A 26 26 LEU N N 13 118.778 122.253 -3.475 1
1 151 . 4 1 1 A 27 27 PRO HA H 14 4.120 4.681 -0.561 1
1 154 . 4 1 1 A 27 27 PRO C C 14 177.955 175.204 2.751 1
1 155 . 4 1 1 A 27 27 PRO CA C 14 64.698 62.205 2.493 1
1 156 . 4 1 1 A 27 27 PRO CB C 14 31.883 29.304 2.579 1
1 158 . 4 1 1 A 28 28 GLN H H 15 9.838 8.340 1.498 1
1 159 . 4 1 1 A 28 28 GLN HA H 15 4.240 4.368 -0.128 1
1 162 . 4 1 1 A 28 28 GLN C C 15 176.836 176.562 0.274 1
1 163 . 4 1 1 A 28 28 GLN CA C 15 58.135 56.305 1.830 1
1 164 . 4 1 1 A 28 28 GLN CB C 15 27.195 31.038 -3.843 1
1 166 . 4 1 1 A 28 28 GLN N N 15 120.414 120.512 -0.098 1
1 167 . 4 1 1 A 29 29 TYR H H 16 6.810 7.800 -0.990 1
1 168 . 4 1 1 A 29 29 TYR HA H 16 5.720 4.402 1.318 1
1 173 . 4 1 1 A 29 29 TYR C C 16 174.814 177.250 -2.436 1
1 174 . 4 1 1 A 29 29 TYR CA C 16 57.198 59.544 -2.346 1
1 175 . 4 1 1 A 29 29 TYR CB C 16 37.509 38.227 -0.718 1
1 178 . 4 1 1 A 29 29 TYR N N 16 119.718 118.185 1.533 1
1 179 . 4 1 1 A 30 30 GLU H H 17 7.509 8.301 -0.792 1
1 180 . 4 1 1 A 30 30 GLU HA H 17 3.650 4.109 -0.459 1
1 184 . 4 1 1 A 30 30 GLU C C 17 177.552 179.069 -1.517 1
1 185 . 4 1 1 A 30 30 GLU CA C 17 60.948 60.141 0.807 1
1 186 . 4 1 1 A 30 30 GLU CB C 17 30.008 29.279 0.729 1
1 188 . 4 1 1 A 30 30 GLU N N 17 122.417 122.276 0.141 1
1 189 . 4 1 1 A 31 31 ASN H H 18 9.259 8.203 1.056 1
1 190 . 4 1 1 A 31 31 ASN HA H 18 4.451 4.491 -0.040 1
1 193 . 4 1 1 A 31 31 ASN C C 18 176.868 178.292 -1.424 1
1 194 . 4 1 1 A 31 31 ASN CA C 18 57.198 56.253 0.945 1
1 195 . 4 1 1 A 31 31 ASN CB C 18 38.446 38.519 -0.073 1
1 196 . 4 1 1 A 31 31 ASN N N 18 116.613 118.375 -1.762 1
1 197 . 4 1 1 A 32 32 HIS H H 19 8.898 8.165 0.733 1
1 198 . 4 1 1 A 32 32 HIS HA H 19 4.140 4.398 -0.258 1
1 202 . 4 1 1 A 32 32 HIS C C 19 178.269 177.803 0.466 1
1 203 . 4 1 1 A 32 32 HIS CA C 19 60.948 59.214 1.734 1
1 204 . 4 1 1 A 32 32 HIS CB C 19 30.008 30.229 -0.221 1
1 206 . 4 1 1 A 32 32 HIS N N 19 118.926 118.642 0.284 1
1 207 . 4 1 1 A 33 33 LEU H H 20 7.825 9.028 -1.203 1
1 208 . 4 1 1 A 33 33 LEU HA H 20 4.305 3.928 0.377 1
1 218 . 4 1 1 A 33 33 LEU C C 20 179.190 179.102 0.088 1
1 219 . 4 1 1 A 33 33 LEU CA C 20 60.010 58.363 1.647 1
1 220 . 4 1 1 A 33 33 LEU CB C 20 40.321 41.687 -1.366 1
1 224 . 4 1 1 A 33 33 LEU N N 20 117.434 119.836 -2.402 1
1 225 . 4 1 1 A 34 34 MET H H 21 8.861 8.599 0.262 1
1 226 . 4 1 1 A 34 34 MET HA H 21 3.980 4.170 -0.190 1
1 234 . 4 1 1 A 34 34 MET C C 21 180.340 178.772 1.568 1
1 235 . 4 1 1 A 34 34 MET CA C 21 58.135 58.698 -0.563 1
1 236 . 4 1 1 A 34 34 MET CB C 21 30.945 32.336 -1.391 1
1 238 . 4 1 1 A 34 34 MET N N 21 118.111 116.511 1.600 1
1 239 . 4 1 1 A 35 35 ALA H H 22 9.015 8.281 0.734 1
1 240 . 4 1 1 A 35 35 ALA HA H 22 4.239 4.094 0.145 1
1 244 . 4 1 1 A 35 35 ALA C C 22 178.058 178.730 -0.672 1
1 245 . 4 1 1 A 35 35 ALA CA C 22 53.800 54.681 -0.881 1
1 246 . 4 1 1 A 35 35 ALA CB C 22 18.397 18.092 0.305 1
1 247 . 4 1 1 A 35 35 ALA N N 22 120.068 121.587 -1.519 1
1 248 . 4 1 1 A 36 36 ASN H H 23 7.143 7.916 -0.773 1
1 249 . 4 1 1 A 36 36 ASN HA H 23 4.959 4.762 0.197 1
1 254 . 4 1 1 A 36 36 ASN C C 23 174.083 175.612 -1.529 1
1 255 . 4 1 1 A 36 36 ASN CA C 23 54.000 53.068 0.932 1
1 256 . 4 1 1 A 36 36 ASN CB C 23 41.300 39.261 2.039 1
1 257 . 4 1 1 A 36 36 ASN N N 23 111.560 115.158 -3.598 1
1 259 . 4 1 1 A 37 37 GLY H H 24 7.797 8.205 -0.408 1
1 260 . 4 1 1 A 37 37 GLY HA2 H 24 3.430 3.874 -0.444 1
1 261 . 4 1 1 A 37 37 GLY HA3 H 24 3.290 3.922 -0.632 1
1 262 . 4 1 1 A 37 37 GLY C C 24 173.163 175.121 -1.958 1
1 263 . 4 1 1 A 37 37 GLY CA C 24 45.947 45.334 0.613 1
1 264 . 4 1 1 A 37 37 GLY N N 24 106.170 107.719 -1.549 1
1 265 . 4 1 1 A 38 38 PHE H H 25 8.191 7.996 0.195 1
1 266 . 4 1 1 A 38 38 PHE HA H 25 4.910 4.754 0.156 1
1 271 . 4 1 1 A 38 38 PHE C C 25 173.496 176.005 -2.509 1
1 272 . 4 1 1 A 38 38 PHE CA C 25 56.550 56.255 0.295 1
1 273 . 4 1 1 A 38 38 PHE CB C 25 37.220 36.818 0.402 1
1 276 . 4 1 1 A 38 38 PHE N N 25 122.454 119.810 2.644 1
1 277 . 4 1 1 A 39 39 ASP H H 26 6.756 8.171 -1.415 1
1 278 . 4 1 1 A 39 39 ASP HA H 26 5.077 4.694 0.383 1
1 281 . 4 1 1 A 39 39 ASP C C 26 177.463 175.535 1.928 1
1 282 . 4 1 1 A 39 39 ASP CA C 26 53.447 54.379 -0.932 1
1 283 . 4 1 1 A 39 39 ASP CB C 26 42.580 41.592 0.988 1
1 284 . 4 1 1 A 39 39 ASP N N 26 111.309 118.598 -7.289 1
1 285 . 4 1 1 A 40 40 ASN H H 27 7.495 7.904 -0.409 1
1 286 . 4 1 1 A 40 40 ASN HA H 27 4.820 5.055 -0.235 1
1 289 . 4 1 1 A 40 40 ASN C C 27 176.228 175.934 0.294 1
1 290 . 4 1 1 A 40 40 ASN CA C 27 52.510 51.819 0.691 1
1 291 . 4 1 1 A 40 40 ASN CB C 27 40.321 40.502 -0.181 1
1 292 . 4 1 1 A 40 40 ASN N N 27 118.385 118.059 0.326 1
1 293 . 4 1 1 A 41 41 VAL H H 28 9.192 8.625 0.567 1
1 294 . 4 1 1 A 41 41 VAL HA H 28 3.550 3.617 -0.067 1
1 302 . 4 1 1 A 41 41 VAL C C 28 176.429 177.599 -1.170 1
1 303 . 4 1 1 A 41 41 VAL CA C 28 65.636 66.377 -0.741 1
1 304 . 4 1 1 A 41 41 VAL CB C 28 31.883 31.473 0.410 1
1 307 . 4 1 1 A 41 41 VAL N N 28 125.741 125.984 -0.243 1
1 308 . 4 1 1 A 42 42 GLN H H 29 8.203 8.171 0.032 1
1 309 . 4 1 1 A 42 42 GLN HA H 29 4.129 3.960 0.169 1
1 314 . 4 1 1 A 42 42 GLN C C 29 176.591 178.486 -1.895 1
1 315 . 4 1 1 A 42 42 GLN CA C 29 57.198 58.618 -1.420 1
1 316 . 4 1 1 A 42 42 GLN CB C 29 28.133 28.524 -0.391 1
1 318 . 4 1 1 A 42 42 GLN N N 29 116.452 119.968 -3.516 1
1 319 . 4 1 1 A 43 43 ALA H H 30 7.781 8.432 -0.651 1
1 320 . 4 1 1 A 43 43 ALA HA H 30 4.650 3.992 0.658 1
1 324 . 4 1 1 A 43 43 ALA C C 30 175.976 179.994 -4.018 1
1 325 . 4 1 1 A 43 43 ALA CA C 30 50.840 54.641 -3.801 1
1 326 . 4 1 1 A 43 43 ALA CB C 30 19.150 18.322 0.828 1
1 327 . 4 1 1 A 43 43 ALA N N 30 122.150 121.377 0.773 1
1 328 . 4 1 1 A 44 44 MET H H 31 7.739 8.093 -0.354 1
1 332 . 4 1 1 A 44 44 MET C C 31 178.275 176.909 1.366 1
1 333 . 4 1 1 A 44 44 MET CA C 31 55.323 57.893 -2.570 1
1 334 . 4 1 1 A 44 44 MET CB C 31 34.696 32.585 2.111 1
1 336 . 4 1 1 A 44 44 MET N N 31 118.149 117.290 0.859 1
1 337 . 4 1 1 A 45 45 GLY H H 32 7.611 8.032 -0.421 1
1 338 . 4 1 1 A 45 45 GLY N N 32 101.530 107.983 -6.453 1
1 339 . 4 1 1 A 47 47 ASN HA H 34 4.480 4.650 -0.170 1
1 342 . 4 1 1 A 47 47 ASN CA C 34 56.260 55.541 0.719 1
1 343 . 4 1 1 A 47 47 ASN CB C 34 39.384 39.905 -0.521 1
1 344 . 4 1 1 A 49 49 MET HA H 36 4.646 4.628 0.018 1
1 350 . 4 1 1 A 49 49 MET C C 36 173.651 176.196 -2.545 1
1 351 . 4 1 1 A 49 49 MET CA C 36 55.323 55.821 -0.498 1
1 352 . 4 1 1 A 49 49 MET CB C 36 35.633 33.092 2.541 1
1 355 . 4 1 1 A 50 50 GLU H H 37 9.203 9.058 0.145 1
1 356 . 4 1 1 A 50 50 GLU HA H 37 4.650 4.433 0.217 1
1 361 . 4 1 1 A 50 50 GLU C C 37 177.008 177.552 -0.544 1
1 362 . 4 1 1 A 50 50 GLU CA C 37 54.385 56.485 -2.100 1
1 363 . 4 1 1 A 50 50 GLU CB C 37 33.758 30.630 3.128 1
1 365 . 4 1 1 A 50 50 GLU N N 37 123.229 122.859 0.370 1
1 366 . 4 1 1 A 51 51 ASP H H 38 9.032 9.134 -0.102 1
1 367 . 4 1 1 A 51 51 ASP HA H 38 4.149 4.286 -0.137 1
1 370 . 4 1 1 A 51 51 ASP C C 38 177.994 178.169 -0.175 1
1 371 . 4 1 1 A 51 51 ASP CA C 38 59.073 57.115 1.958 1
1 372 . 4 1 1 A 51 51 ASP CB C 38 43.134 39.834 3.300 1
1 373 . 4 1 1 A 51 51 ASP N N 38 122.717 123.733 -1.016 1
1 374 . 4 1 1 A 52 52 GLN H H 39 8.950 8.259 0.691 1
1 375 . 4 1 1 A 52 52 GLN HA H 39 3.940 3.941 -0.001 1
1 378 . 4 1 1 A 52 52 GLN C C 39 177.817 178.732 -0.915 1
1 379 . 4 1 1 A 52 52 GLN CA C 39 59.073 59.219 -0.146 1
1 380 . 4 1 1 A 52 52 GLN CB C 39 28.133 28.123 0.010 1
1 381 . 4 1 1 A 52 52 GLN N N 39 114.086 119.711 -5.625 1
1 382 . 4 1 1 A 53 53 ASP H H 40 7.214 8.046 -0.832 1
1 383 . 4 1 1 A 53 53 ASP HA H 40 4.370 4.498 -0.128 1
1 386 . 4 1 1 A 53 53 ASP C C 40 177.667 178.632 -0.965 1
1 387 . 4 1 1 A 53 53 ASP CA C 40 57.198 57.254 -0.056 1
1 388 . 4 1 1 A 53 53 ASP CB C 40 41.800 40.939 0.861 1
1 389 . 4 1 1 A 53 53 ASP N N 40 118.734 120.194 -1.460 1
1 390 . 4 1 1 A 54 54 LEU H H 41 7.180 8.172 -0.992 1
1 391 . 4 1 1 A 54 54 LEU HA H 41 3.990 3.955 0.035 1
1 400 . 4 1 1 A 54 54 LEU C C 41 178.204 178.408 -0.204 1
1 401 . 4 1 1 A 54 54 LEU CA C 41 56.260 58.463 -2.203 1
1 402 . 4 1 1 A 54 54 LEU CB C 41 41.259 41.709 -0.450 1
1 405 . 4 1 1 A 54 54 LEU N N 41 115.795 121.883 -6.088 1
1 406 . 4 1 1 A 55 55 LEU H H 42 7.823 8.523 -0.700 1
1 407 . 4 1 1 A 55 55 LEU HA H 42 3.920 4.119 -0.199 1
1 416 . 4 1 1 A 55 55 LEU C C 42 180.876 178.443 2.433 1
1 417 . 4 1 1 A 55 55 LEU CA C 42 58.135 58.112 0.023 1
1 418 . 4 1 1 A 55 55 LEU CB C 42 42.196 41.360 0.836 1
1 421 . 4 1 1 A 55 55 LEU N N 42 120.499 119.806 0.693 1
1 422 . 4 1 1 A 56 56 GLU H H 43 8.127 8.265 -0.138 1
1 423 . 4 1 1 A 56 56 GLU HA H 43 3.966 4.150 -0.184 1
1 428 . 4 1 1 A 56 56 GLU C C 43 178.801 179.175 -0.374 1
1 429 . 4 1 1 A 56 56 GLU CA C 43 60.010 59.225 0.785 1
1 430 . 4 1 1 A 56 56 GLU CB C 43 29.070 29.339 -0.269 1
1 432 . 4 1 1 A 56 56 GLU N N 43 120.955 118.515 2.440 1
1 433 . 4 1 1 A 57 57 ILE H H 44 7.504 7.781 -0.277 1
1 434 . 4 1 1 A 57 57 ILE HA H 44 4.524 3.914 0.610 1
1 444 . 4 1 1 A 57 57 ILE C C 44 175.691 176.079 -0.388 1
1 445 . 4 1 1 A 57 57 ILE CA C 44 61.886 64.169 -2.283 1
1 446 . 4 1 1 A 57 57 ILE CB C 44 37.300 38.441 -1.141 1
1 450 . 4 1 1 A 57 57 ILE N N 44 109.594 118.861 -9.267 1
1 451 . 4 1 1 A 58 58 GLY H H 45 7.724 7.851 -0.127 1
1 452 . 4 1 1 A 58 58 GLY HA2 H 45 3.650 4.154 -0.504 1
1 453 . 4 1 1 A 58 58 GLY HA3 H 45 4.530 4.304 0.226 1
1 454 . 4 1 1 A 58 58 GLY C C 45 174.613 174.746 -0.133 1
1 455 . 4 1 1 A 58 58 GLY CA C 45 45.947 45.282 0.665 1
1 456 . 4 1 1 A 58 58 GLY N N 45 106.680 108.433 -1.753 1
1 457 . 4 1 1 A 59 59 ILE H H 46 8.180 7.858 0.322 1
1 458 . 4 1 1 A 59 59 ILE HA H 46 3.907 4.062 -0.155 1
1 468 . 4 1 1 A 59 59 ILE C C 46 174.235 176.018 -1.783 1
1 469 . 4 1 1 A 59 59 ILE CA C 46 60.948 61.861 -0.913 1
1 470 . 4 1 1 A 59 59 ILE CB C 46 33.980 38.086 -4.106 1
1 474 . 4 1 1 A 59 59 ILE N N 46 122.454 122.893 -0.439 1
1 475 . 4 1 1 A 60 60 LEU H H 47 7.367 8.494 -1.127 1
1 476 . 4 1 1 A 60 60 LEU HA H 47 3.900 4.291 -0.391 1
1 479 . 4 1 1 A 60 60 LEU C C 47 177.753 177.424 0.329 1
1 480 . 4 1 1 A 60 60 LEU CA C 47 56.260 54.913 1.347 1
1 481 . 4 1 1 A 60 60 LEU CB C 47 42.196 42.807 -0.611 1
1 482 . 4 1 1 A 60 60 LEU N N 47 125.835 128.762 -2.927 1
1 483 . 4 1 1 A 63 63 GLY HA2 H 50 3.980 3.947 0.033 1
1 484 . 4 1 1 A 63 63 GLY HA3 H 50 3.950 3.968 -0.018 1
1 485 . 4 1 1 A 63 63 GLY C C 50 177.130 175.264 1.866 1
1 486 . 4 1 1 A 63 63 GLY CA C 50 46.884 45.028 1.856 1
1 487 . 4 1 1 A 64 64 HIS H H 51 7.926 7.625 0.301 1
1 488 . 4 1 1 A 64 64 HIS HA H 51 4.451 4.606 -0.155 1
1 493 . 4 1 1 A 64 64 HIS C C 51 177.613 176.378 1.235 1
1 494 . 4 1 1 A 64 64 HIS CA C 51 57.198 56.897 0.301 1
1 495 . 4 1 1 A 64 64 HIS CB C 51 30.945 31.610 -0.665 1
1 498 . 4 1 1 A 64 64 HIS N N 51 122.284 116.582 5.702 1
1 499 . 4 1 1 A 65 65 ARG H H 52 8.105 8.347 -0.242 1
1 500 . 4 1 1 A 65 65 ARG HA H 52 3.685 3.818 -0.133 1
1 507 . 4 1 1 A 65 65 ARG C C 52 177.769 179.040 -1.271 1
1 508 . 4 1 1 A 65 65 ARG CA C 52 61.886 59.921 1.965 1
1 509 . 4 1 1 A 65 65 ARG CB C 52 30.945 29.911 1.034 1
1 511 . 4 1 1 A 65 65 ARG N N 52 117.775 120.424 -2.649 1
1 513 . 4 1 1 A 66 66 GLN H H 53 8.090 8.247 -0.157 1
1 514 . 4 1 1 A 66 66 GLN HA H 53 3.940 4.086 -0.146 1
1 519 . 4 1 1 A 66 66 GLN C C 53 178.583 178.481 0.102 1
1 520 . 4 1 1 A 66 66 GLN CA C 53 59.073 59.001 0.072 1
1 521 . 4 1 1 A 66 66 GLN CB C 53 28.133 28.074 0.059 1
1 523 . 4 1 1 A 66 66 GLN N N 53 116.452 119.163 -2.711 1
1 524 . 4 1 1 A 67 67 ARG H H 54 7.845 7.885 -0.040 1
1 525 . 4 1 1 A 67 67 ARG HA H 54 4.010 3.995 0.015 1
1 528 . 4 1 1 A 67 67 ARG C C 54 179.766 178.884 0.882 1
1 529 . 4 1 1 A 67 67 ARG CA C 54 59.073 59.360 -0.287 1
1 530 . 4 1 1 A 67 67 ARG CB C 54 30.720 29.995 0.725 1
1 532 . 4 1 1 A 67 67 ARG N N 54 119.275 119.385 -0.110 1
1 533 . 4 1 1 A 68 68 ILE H H 55 8.032 8.384 -0.352 1
1 534 . 4 1 1 A 68 68 ILE HA H 55 3.495 3.536 -0.041 1
1 544 . 4 1 1 A 68 68 ILE C C 55 177.108 178.295 -1.187 1
1 545 . 4 1 1 A 68 68 ILE CA C 55 66.230 65.844 0.386 1
1 546 . 4 1 1 A 68 68 ILE CB C 55 38.020 37.922 0.098 1
1 550 . 4 1 1 A 68 68 ILE N N 55 121.152 120.539 0.613 1
1 551 . 4 1 1 A 69 69 LEU H H 56 8.490 8.249 0.241 1
1 552 . 4 1 1 A 69 69 LEU HA H 56 4.010 3.859 0.151 1
1 561 . 4 1 1 A 69 69 LEU C C 56 179.917 178.893 1.024 1
1 562 . 4 1 1 A 69 69 LEU CA C 56 58.135 58.242 -0.107 1
1 563 . 4 1 1 A 69 69 LEU CB C 56 41.259 41.631 -0.372 1
1 566 . 4 1 1 A 69 69 LEU N N 56 119.072 119.619 -0.547 1
1 567 . 4 1 1 A 70 70 GLN H H 57 8.327 8.713 -0.386 1
1 568 . 4 1 1 A 70 70 GLN HA H 57 4.100 3.998 0.102 1
1 573 . 4 1 1 A 70 70 GLN C C 57 178.798 178.468 0.330 1
1 574 . 4 1 1 A 70 70 GLN CA C 57 59.073 59.014 0.059 1
1 575 . 4 1 1 A 70 70 GLN CB C 57 28.133 28.577 -0.444 1
1 577 . 4 1 1 A 70 70 GLN N N 57 118.172 117.378 0.794 1
1 578 . 4 1 1 A 71 71 ALA H H 58 7.810 7.760 0.050 1
1 579 . 4 1 1 A 71 71 ALA HA H 58 4.320 4.118 0.202 1
1 583 . 4 1 1 A 71 71 ALA C C 58 172.232 179.598 -7.366 1
1 584 . 4 1 1 A 71 71 ALA CA C 58 55.323 55.243 0.080 1
1 585 . 4 1 1 A 71 71 ALA CB C 58 19.720 18.799 0.921 1
1 586 . 4 1 1 A 71 71 ALA N N 58 122.536 122.093 0.443 1
1 587 . 4 1 1 A 72 72 ILE H H 59 8.840 8.578 0.262 1
1 588 . 4 1 1 A 72 72 ILE HA H 59 4.030 4.063 -0.033 1
1 598 . 4 1 1 A 72 72 ILE C C 59 178.678 177.605 1.073 1
1 599 . 4 1 1 A 72 72 ILE CA C 59 64.698 63.892 0.806 1
1 600 . 4 1 1 A 72 72 ILE CB C 59 37.850 37.500 0.350 1
1 604 . 4 1 1 A 72 72 ILE N N 59 118.111 118.897 -0.786 1
1 605 . 4 1 1 A 73 73 GLN H H 60 7.547 8.081 -0.534 1
1 606 . 4 1 1 A 73 73 GLN HA H 60 4.121 4.071 0.050 1
1 611 . 4 1 1 A 73 73 GLN C C 60 176.556 178.096 -1.540 1
1 612 . 4 1 1 A 73 73 GLN CA C 60 58.135 58.616 -0.481 1
1 613 . 4 1 1 A 73 73 GLN CB C 60 28.300 28.850 -0.550 1
1 615 . 4 1 1 A 73 73 GLN N N 60 119.094 120.928 -1.834 1
1 616 . 4 1 1 A 74 74 LEU H H 61 7.350 7.939 -0.589 1
1 617 . 4 1 1 A 74 74 LEU HA H 61 4.408 4.312 0.096 1
1 626 . 4 1 1 A 74 74 LEU C C 61 177.960 177.714 0.246 1
1 627 . 4 1 1 A 74 74 LEU CA C 61 54.900 55.128 -0.228 1
1 628 . 4 1 1 A 74 74 LEU CB C 61 42.196 42.242 -0.046 1
1 631 . 4 1 1 A 74 74 LEU N N 61 115.853 118.940 -3.087 1
1 632 . 4 1 1 A 75 75 LEU H H 62 7.358 7.617 -0.259 1
1 633 . 4 1 1 A 75 75 LEU HA H 62 4.530 4.118 0.412 1
1 642 . 4 1 1 A 75 75 LEU C C 62 177.035 177.773 -0.738 1
1 643 . 4 1 1 A 75 75 LEU CA C 62 53.200 60.059 -6.859 1
1 644 . 4 1 1 A 75 75 LEU CB C 62 40.700 40.320 0.380 1
1 647 . 4 1 1 A 75 75 LEU N N 62 121.010 120.479 0.531 1
1 648 . 4 1 1 A 76 76 PRO HA H 63 4.382 4.631 -0.249 1
1 655 . 4 1 1 A 76 76 PRO CB C 63 31.883 30.170 1.713 1
1 657 . 4 1 1 A 77 77 LYS H H 64 8.418 8.458 -0.040 1
1 658 . 4 1 1 A 77 77 LYS HA H 64 4.140 4.250 -0.110 1
1 663 . 4 1 1 A 77 77 LYS C C 64 177.122 175.755 1.367 1
1 664 . 4 1 1 A 77 77 LYS CA C 64 56.260 59.212 -2.952 1
1 665 . 4 1 1 A 77 77 LYS CB C 64 33.340 33.517 -0.177 1
1 668 . 4 1 1 A 77 77 LYS N N 64 121.932 124.903 -2.971 1
1 669 . 4 1 1 A 78 78 MET H H 65 8.550 7.940 0.610 1
1 670 . 4 1 1 A 78 78 MET HA H 65 4.304 4.807 -0.503 1
1 676 . 4 1 1 A 78 78 MET C C 65 176.105 176.085 0.020 1
1 677 . 4 1 1 A 78 78 MET CA C 65 56.260 54.415 1.845 1
1 678 . 4 1 1 A 78 78 MET CB C 65 32.821 37.177 -4.356 1
1 680 . 4 1 1 A 78 78 MET N N 65 123.498 115.605 7.893 1
1 681 . 4 1 1 A 79 79 ARG H H 66 8.731 8.985 -0.254 1
1 682 . 4 1 1 A 79 79 ARG C C 66 173.577 175.966 -2.389 1
1 683 . 4 1 1 A 79 79 ARG CA C 66 53.447 56.955 -3.508 1
1 684 . 4 1 1 A 79 79 ARG CB C 66 30.008 28.807 1.201 1
1 685 . 4 1 1 A 79 79 ARG N N 66 127.355 123.052 4.303 1
1 686 . 4 1 1 A 80 80 PRO HA H 67 4.780 4.675 0.105 1
1 693 . 4 1 1 A 80 80 PRO C C 67 177.043 176.104 0.939 1
1 694 . 4 1 1 A 80 80 PRO CA C 67 61.886 62.375 -0.489 1
1 695 . 4 1 1 A 80 80 PRO CB C 67 32.821 29.894 2.927 1
1 698 . 4 1 1 A 81 81 ILE H H 68 8.580 8.238 0.342 1
1 699 . 4 1 1 A 81 81 ILE HA H 68 4.040 4.184 -0.144 1
1 709 . 4 1 1 A 81 81 ILE C C 68 176.831 175.434 1.397 1
1 710 . 4 1 1 A 81 81 ILE CA C 68 62.823 62.038 0.785 1
1 711 . 4 1 1 A 81 81 ILE CB C 68 38.580 38.261 0.319 1
1 715 . 4 1 1 A 81 81 ILE N N 68 118.491 123.282 -4.791 1
1 716 . 4 1 1 A 82 82 GLY H H 69 8.602 8.430 0.172 1
1 717 . 4 1 1 A 82 82 GLY CA C 69 45.009 45.777 -0.768 1
1 718 . 4 1 1 A 82 82 GLY N N 69 111.377 114.566 -3.189 1
1 721 . 4 1 1 A 84 84 ASP HA H 71 4.490 4.283 0.207 1
1 724 . 4 1 1 A 84 84 ASP CA C 71 54.385 54.413 -0.028 1
1 725 . 4 1 1 A 84 84 ASP CB C 71 40.321 41.867 -1.546 1
1 726 . 4 1 1 A 85 85 GLY H H 72 8.054 8.727 -0.673 1
1 727 . 4 1 1 A 85 85 GLY HA2 H 72 4.040 4.298 -0.258 1
1 728 . 4 1 1 A 85 85 GLY HA3 H 72 3.750 4.301 -0.551 1
1 729 . 4 1 1 A 85 85 GLY C C 72 173.474 172.592 0.882 1
1 730 . 4 1 1 A 85 85 GLY CA C 72 45.009 44.596 0.413 1
1 731 . 4 1 1 A 85 85 GLY N N 72 108.038 111.798 -3.760 1
1 732 . 4 1 1 A 86 86 ALA H H 73 7.858 8.495 -0.637 1
1 733 . 4 1 1 A 86 86 ALA HA H 73 4.370 4.611 -0.241 1
1 737 . 4 1 1 A 86 86 ALA CA C 73 51.990 51.767 0.223 1
1 738 . 4 1 1 A 86 86 ALA CB C 73 19.220 20.113 -0.893 1
1 739 . 4 1 1 A 86 86 ALA N N 73 123.819 123.790 0.029 1
1 742 . 4 1 1 A 90 90 SER H H 77 7.839 8.713 -0.874 1
1 743 . 4 1 1 A 90 90 SER HA H 77 4.770 4.632 0.138 1
1 746 . 4 1 1 A 90 90 SER N N 77 115.163 117.030 -1.867 1
1 747 . 4 1 1 A 91 91 VAL H H 78 8.578 8.881 -0.303 1
1 748 . 4 1 1 A 91 91 VAL HA H 78 3.981 3.933 0.048 1
1 756 . 4 1 1 A 91 91 VAL C C 78 177.480 177.591 -0.111 1
1 757 . 4 1 1 A 91 91 VAL CA C 78 67.060 66.329 0.731 1
1 758 . 4 1 1 A 91 91 VAL CB C 78 32.500 31.622 0.878 1
1 761 . 4 1 1 A 91 91 VAL N N 78 123.481 123.643 -0.162 1
1 762 . 4 1 1 A 92 92 ALA H H 79 8.607 8.344 0.263 1
1 763 . 4 1 1 A 92 92 ALA HA H 79 4.113 4.053 0.060 1
1 767 . 4 1 1 A 92 92 ALA C C 79 179.868 179.438 0.430 1
1 768 . 4 1 1 A 92 92 ALA CA C 79 54.890 55.457 -0.567 1
1 769 . 4 1 1 A 92 92 ALA CB C 79 18.790 18.592 0.198 1
1 770 . 4 1 1 A 92 92 ALA N N 79 120.334 122.030 -1.696 1
1 771 . 4 1 1 A 93 93 GLU H H 80 7.886 8.372 -0.486 1
1 772 . 4 1 1 A 93 93 GLU HA H 80 4.010 4.010 0.000 1
1 777 . 4 1 1 A 93 93 GLU C C 80 179.719 178.643 1.076 1
1 778 . 4 1 1 A 93 93 GLU CA C 80 59.073 59.319 -0.246 1
1 779 . 4 1 1 A 93 93 GLU CB C 80 30.630 29.399 1.231 1
1 781 . 4 1 1 A 93 93 GLU N N 80 117.643 118.606 -0.963 1
1 782 . 4 1 1 A 94 94 TRP H H 81 8.299 8.200 0.099 1
1 783 . 4 1 1 A 94 94 TRP HA H 81 4.251 4.321 -0.070 1
1 792 . 4 1 1 A 94 94 TRP C C 81 178.772 177.883 0.889 1
1 793 . 4 1 1 A 94 94 TRP CA C 81 60.010 61.238 -1.228 1
1 794 . 4 1 1 A 94 94 TRP CB C 81 27.650 29.863 -2.213 1
1 800 . 4 1 1 A 94 94 TRP N N 81 122.545 122.240 0.305 1
1 802 . 4 1 1 A 95 95 LEU H H 82 8.505 8.374 0.131 1
1 803 . 4 1 1 A 95 95 LEU HA H 82 2.880 3.225 -0.345 1
1 812 . 4 1 1 A 95 95 LEU C C 82 180.235 178.914 1.321 1
1 813 . 4 1 1 A 95 95 LEU CA C 82 57.400 56.973 0.427 1
1 814 . 4 1 1 A 95 95 LEU CB C 82 40.321 40.813 -0.492 1
1 817 . 4 1 1 A 95 95 LEU N N 82 121.110 119.110 2.000 1
1 818 . 4 1 1 A 96 96 ASP H H 83 8.185 8.222 -0.037 1
1 819 . 4 1 1 A 96 96 ASP HA H 83 4.280 4.364 -0.084 1
1 822 . 4 1 1 A 96 96 ASP C C 83 175.224 177.381 -2.157 1
1 823 . 4 1 1 A 96 96 ASP CA C 83 57.310 56.838 0.472 1
1 824 . 4 1 1 A 96 96 ASP CB C 83 40.321 41.175 -0.854 1
1 825 . 4 1 1 A 96 96 ASP N N 83 119.082 120.182 -1.100 1
1 826 . 4 1 1 A 97 97 SER H H 84 7.989 7.564 0.425 1
1 827 . 4 1 1 A 97 97 SER HA H 84 4.250 4.624 -0.374 1
1 830 . 4 1 1 A 97 97 SER C C 84 175.346 174.788 0.558 1
1 831 . 4 1 1 A 97 97 SER CA C 84 60.948 58.150 2.798 1
1 832 . 4 1 1 A 97 97 SER CB C 84 63.370 63.748 -0.378 1
1 833 . 4 1 1 A 97 97 SER N N 84 117.579 111.968 5.611 1
1 834 . 4 1 1 A 98 98 ILE H H 85 6.862 7.548 -0.686 1
1 835 . 4 1 1 A 98 98 ILE HA H 85 4.550 4.203 0.347 1
1 843 . 4 1 1 A 98 98 ILE C C 85 173.308 175.482 -2.174 1
1 844 . 4 1 1 A 98 98 ILE CA C 85 60.948 60.394 0.554 1
1 845 . 4 1 1 A 98 98 ILE CB C 85 37.760 38.357 -0.597 1
1 848 . 4 1 1 A 98 98 ILE N N 85 113.733 118.987 -5.254 1
1 849 . 4 1 1 A 99 99 GLU H H 86 7.705 7.944 -0.239 1
1 850 . 4 1 1 A 99 99 GLU HA H 86 4.280 3.844 0.436 1
1 853 . 4 1 1 A 99 99 GLU C C 86 175.224 174.764 0.460 1
1 854 . 4 1 1 A 99 99 GLU CA C 86 56.260 57.740 -1.480 1
1 855 . 4 1 1 A 99 99 GLU CB C 86 26.258 28.846 -2.588 1
1 857 . 4 1 1 A 99 99 GLU N N 86 115.493 120.734 -5.241 1
1 858 . 4 1 1 A 100 100 LEU H H 87 7.989 7.304 0.685 1
1 859 . 4 1 1 A 100 100 LEU HA H 87 4.220 4.628 -0.408 1
1 868 . 4 1 1 A 100 100 LEU C C 87 176.965 176.219 0.746 1
1 869 . 4 1 1 A 100 100 LEU CA C 87 52.510 53.211 -0.701 1
1 870 . 4 1 1 A 100 100 LEU CB C 87 42.196 43.882 -1.686 1
1 873 . 4 1 1 A 100 100 LEU N N 87 117.579 120.936 -3.357 1
1 874 . 4 1 1 A 101 101 GLY H H 88 8.503 7.967 0.536 1
1 875 . 4 1 1 A 101 101 GLY CA C 88 46.884 45.846 1.038 1
1 876 . 4 1 1 A 101 101 GLY N N 88 107.794 112.899 -5.105 1
1 877 . 4 1 1 A 102 102 ASP HA H 89 4.431 4.376 0.055 1
1 880 . 4 1 1 A 102 102 ASP C C 89 178.075 178.077 -0.002 1
1 881 . 4 1 1 A 102 102 ASP CA C 89 57.198 56.639 0.559 1
1 882 . 4 1 1 A 102 102 ASP CB C 89 40.321 39.941 0.380 1
1 883 . 4 1 1 A 103 103 TYR H H 90 7.899 8.025 -0.126 1
1 884 . 4 1 1 A 103 103 TYR HA H 90 4.940 4.410 0.530 1
1 889 . 4 1 1 A 103 103 TYR C C 90 175.527 178.413 -2.886 1
1 890 . 4 1 1 A 103 103 TYR CA C 90 58.135 60.508 -2.373 1
1 891 . 4 1 1 A 103 103 TYR CB C 90 38.446 37.738 0.708 1
1 894 . 4 1 1 A 103 103 TYR N N 90 115.595 118.191 -2.596 1
1 895 . 4 1 1 A 104 104 THR H H 91 7.971 8.579 -0.608 1
1 896 . 4 1 1 A 104 104 THR HA H 91 4.234 4.016 0.218 1
1 901 . 4 1 1 A 104 104 THR C C 91 175.905 176.486 -0.581 1
1 902 . 4 1 1 A 104 104 THR CA C 91 68.449 67.193 1.256 1
1 904 . 4 1 1 A 104 104 THR N N 91 118.867 116.764 2.103 1
1 905 . 4 1 1 A 105 105 LYS H H 92 8.555 7.872 0.683 1
1 906 . 4 1 1 A 105 105 LYS HA H 92 3.940 4.085 -0.145 1
1 912 . 4 1 1 A 105 105 LYS C C 92 177.310 178.586 -1.276 1
1 913 . 4 1 1 A 105 105 LYS CA C 92 60.948 59.491 1.457 1
1 914 . 4 1 1 A 105 105 LYS CB C 92 31.883 32.435 -0.552 1
1 917 . 4 1 1 A 105 105 LYS N N 92 119.259 120.950 -1.691 1
1 918 . 4 1 1 A 106 106 ALA H H 93 7.920 8.081 -0.161 1
1 919 . 4 1 1 A 106 106 ALA HA H 93 4.128 4.175 -0.047 1
1 923 . 4 1 1 A 106 106 ALA C C 93 180.972 180.337 0.635 1
1 924 . 4 1 1 A 106 106 ALA CA C 93 55.070 55.179 -0.109 1
1 925 . 4 1 1 A 106 106 ALA CB C 93 17.750 18.706 -0.956 1
1 926 . 4 1 1 A 106 106 ALA N N 93 120.398 121.234 -0.836 1
1 927 . 4 1 1 A 107 107 PHE H H 94 8.136 8.932 -0.796 1
1 928 . 4 1 1 A 107 107 PHE HA H 94 4.190 4.625 -0.435 1
1 934 . 4 1 1 A 107 107 PHE C C 94 177.955 178.281 -0.326 1
1 935 . 4 1 1 A 107 107 PHE CA C 94 63.761 61.468 2.293 1
1 936 . 4 1 1 A 107 107 PHE CB C 94 38.446 38.742 -0.296 1
1 940 . 4 1 1 A 107 107 PHE N N 94 117.119 116.146 0.973 1
1 941 . 4 1 1 A 108 108 LEU H H 95 8.351 8.630 -0.279 1
1 942 . 4 1 1 A 108 108 LEU HA H 95 3.889 3.963 -0.074 1
1 951 . 4 1 1 A 108 108 LEU C C 95 182.043 179.318 2.725 1
1 952 . 4 1 1 A 108 108 LEU CA C 95 59.073 58.574 0.499 1
1 953 . 4 1 1 A 108 108 LEU CB C 95 41.259 42.136 -0.877 1
1 956 . 4 1 1 A 108 108 LEU N N 95 118.450 119.846 -1.396 1
1 957 . 4 1 1 A 109 109 ILE H H 96 8.992 8.118 0.874 1
1 958 . 4 1 1 A 109 109 ILE HA H 96 4.069 3.871 0.198 1
1 968 . 4 1 1 A 109 109 ILE C C 96 177.094 177.642 -0.548 1
1 969 . 4 1 1 A 109 109 ILE CA C 96 63.761 64.394 -0.633 1
1 970 . 4 1 1 A 109 109 ILE CB C 96 37.509 37.579 -0.070 1
1 974 . 4 1 1 A 109 109 ILE N N 96 118.177 114.916 3.261 1
1 975 . 4 1 1 A 110 110 ASN H H 97 7.067 8.267 -1.200 1
1 976 . 4 1 1 A 110 110 ASN HA H 97 4.797 4.677 0.120 1
1 981 . 4 1 1 A 110 110 ASN C C 97 173.595 175.781 -2.186 1
1 982 . 4 1 1 A 110 110 ASN CA C 97 54.385 53.169 1.216 1
1 983 . 4 1 1 A 110 110 ASN CB C 97 40.321 38.949 1.372 1
1 984 . 4 1 1 A 110 110 ASN N N 97 116.407 119.236 -2.829 1
1 986 . 4 1 1 A 111 111 GLY H H 98 7.681 8.067 -0.386 1
1 987 . 4 1 1 A 111 111 GLY HA2 H 98 4.080 3.902 0.178 1
1 988 . 4 1 1 A 111 111 GLY HA3 H 98 3.640 3.977 -0.337 1
1 989 . 4 1 1 A 111 111 GLY C C 98 174.552 174.675 -0.123 1
1 990 . 4 1 1 A 111 111 GLY CA C 98 45.947 45.960 -0.013 1
1 991 . 4 1 1 A 111 111 GLY N N 98 104.440 107.287 -2.847 1
1 992 . 4 1 1 A 112 112 TYR H H 99 8.427 8.096 0.331 1
1 993 . 4 1 1 A 112 112 TYR HA H 99 4.661 4.631 0.030 1
1 998 . 4 1 1 A 112 112 TYR C C 99 174.425 176.549 -2.124 1
1 999 . 4 1 1 A 112 112 TYR CA C 99 57.198 58.360 -1.162 1
1 1000 . 4 1 1 A 112 112 TYR CB C 99 36.571 38.127 -1.556 1
1 1003 . 4 1 1 A 112 112 TYR N N 99 122.830 119.461 3.369 1
1 1004 . 4 1 1 A 113 113 THR H H 100 7.166 8.248 -1.082 1
1 1005 . 4 1 1 A 113 113 THR HA H 100 4.248 4.206 0.042 1
1 1009 . 4 1 1 A 113 113 THR C C 100 174.897 174.993 -0.096 1
1 1010 . 4 1 1 A 113 113 THR CA C 100 62.290 65.008 -2.718 1
1 1011 . 4 1 1 A 113 113 THR CB C 100 68.970 68.493 0.477 1
1 1013 . 4 1 1 A 113 113 THR N N 100 104.304 113.826 -9.522 1
1 1014 . 4 1 1 A 114 114 SER H H 101 7.695 8.023 -0.328 1
1 1015 . 4 1 1 A 114 114 SER C C 101 174.372 174.714 -0.342 1
1 1016 . 4 1 1 A 114 114 SER CA C 101 56.260 57.928 -1.668 1
1 1017 . 4 1 1 A 114 114 SER CB C 101 65.636 64.335 1.301 1
1 1018 . 4 1 1 A 114 114 SER N N 101 115.613 117.106 -1.493 1
1 1023 . 4 1 1 A 116 116 ASP HA H 103 4.260 4.332 -0.072 1
1 1026 . 4 1 1 A 116 116 ASP CA C 103 57.198 57.626 -0.428 1
1 1027 . 4 1 1 A 116 116 ASP CB C 103 40.321 40.241 0.080 1
1 1028 . 4 1 1 A 117 117 LEU H H 104 7.345 7.987 -0.642 1
1 1029 . 4 1 1 A 117 117 LEU HA H 104 4.290 4.027 0.263 1
1 1038 . 4 1 1 A 117 117 LEU C C 104 178.488 179.451 -0.963 1
1 1039 . 4 1 1 A 117 117 LEU CA C 104 56.260 58.195 -1.935 1
1 1040 . 4 1 1 A 117 117 LEU CB C 104 42.196 41.149 1.047 1
1 1043 . 4 1 1 A 117 117 LEU N N 104 117.878 120.720 -2.842 1
1 1044 . 4 1 1 A 118 118 LEU H H 105 7.514 8.149 -0.635 1
1 1045 . 4 1 1 A 118 118 LEU HA H 105 4.210 4.086 0.124 1
1 1054 . 4 1 1 A 118 118 LEU C C 105 177.002 177.394 -0.392 1
1 1055 . 4 1 1 A 118 118 LEU CA C 105 55.323 56.935 -1.612 1
1 1056 . 4 1 1 A 118 118 LEU CB C 105 42.196 41.418 0.778 1
1 1059 . 4 1 1 A 118 118 LEU N N 105 119.094 119.002 0.092 1
1 1060 . 4 1 1 A 120 120 LYS HA H 107 4.340 4.566 -0.226 1
1 1063 . 4 1 1 A 120 120 LYS C C 107 176.603 175.687 0.916 1
1 1064 . 4 1 1 A 120 120 LYS CA C 107 55.323 55.005 0.318 1
1 1065 . 4 1 1 A 120 120 LYS CB C 107 31.883 32.977 -1.094 1
1 1068 . 4 1 1 A 121 121 ILE H H 108 7.539 7.621 -0.082 1
1 1069 . 4 1 1 A 121 121 ILE HA H 108 3.987 4.980 -0.993 1
1 1079 . 4 1 1 A 121 121 ILE C C 108 173.247 175.281 -2.034 1
1 1080 . 4 1 1 A 121 121 ILE CA C 108 62.823 58.783 4.040 1
1 1081 . 4 1 1 A 121 121 ILE CB C 108 38.446 41.944 -3.498 1
1 1085 . 4 1 1 A 121 121 ILE N N 108 122.417 116.568 5.849 1
1 1086 . 4 1 1 A 122 122 ALA H H 109 8.290 8.230 0.060 1
1 1087 . 4 1 1 A 122 122 ALA HA H 109 3.970 4.673 -0.703 1
1 1091 . 4 1 1 A 122 122 ALA C C 109 178.318 178.271 0.047 1
1 1092 . 4 1 1 A 122 122 ALA CA C 109 50.150 49.786 0.364 1
1 1093 . 4 1 1 A 122 122 ALA CB C 109 21.630 20.955 0.675 1
1 1094 . 4 1 1 A 122 122 ALA N N 109 127.784 124.929 2.855 1
1 1095 . 4 1 1 A 123 123 GLU HA H 110 3.707 3.983 -0.276 1
1 1099 . 4 1 1 A 123 123 GLU C C 110 178.290 178.685 -0.395 1
1 1100 . 4 1 1 A 123 123 GLU CA C 110 60.948 59.777 1.171 1
1 1101 . 4 1 1 A 123 123 GLU CB C 110 29.070 29.341 -0.271 1
1 1102 . 4 1 1 A 124 124 VAL H H 111 8.333 8.316 0.017 1
1 1103 . 4 1 1 A 124 124 VAL HA H 111 3.850 3.768 0.082 1
1 1111 . 4 1 1 A 124 124 VAL C C 111 177.406 177.517 -0.111 1
1 1112 . 4 1 1 A 124 124 VAL CA C 111 65.636 65.307 0.329 1
1 1113 . 4 1 1 A 124 124 VAL CB C 111 30.730 31.110 -0.380 1
1 1116 . 4 1 1 A 124 124 VAL N N 111 114.438 120.433 -5.995 1
1 1117 . 4 1 1 A 125 125 GLU H H 112 7.442 8.255 -0.813 1
1 1118 . 4 1 1 A 125 125 GLU HA H 112 4.152 4.026 0.126 1
1 1123 . 4 1 1 A 125 125 GLU C C 112 179.982 179.314 0.668 1
1 1124 . 4 1 1 A 125 125 GLU CA C 112 60.010 59.303 0.707 1
1 1125 . 4 1 1 A 125 125 GLU CB C 112 30.008 29.560 0.448 1
1 1127 . 4 1 1 A 125 125 GLU N N 112 121.032 121.643 -0.611 1
1 1128 . 4 1 1 A 126 126 LEU H H 113 7.666 7.857 -0.191 1
1 1129 . 4 1 1 A 126 126 LEU HA H 113 3.846 4.038 -0.192 1
1 1138 . 4 1 1 A 126 126 LEU C C 113 176.991 178.813 -1.822 1
1 1139 . 4 1 1 A 126 126 LEU CA C 113 58.135 58.160 -0.025 1
1 1140 . 4 1 1 A 126 126 LEU CB C 113 41.259 41.699 -0.440 1
1 1143 . 4 1 1 A 126 126 LEU N N 113 118.731 121.541 -2.810 1
1 1144 . 4 1 1 A 127 127 ILE H H 114 7.781 8.106 -0.325 1
1 1145 . 4 1 1 A 127 127 ILE HA H 114 3.502 3.901 -0.399 1
1 1153 . 4 1 1 A 127 127 ILE C C 114 178.195 177.338 0.857 1
1 1154 . 4 1 1 A 127 127 ILE CA C 114 65.636 63.179 2.457 1
1 1155 . 4 1 1 A 127 127 ILE CB C 114 40.321 37.566 2.755 1
1 1159 . 4 1 1 A 127 127 ILE N N 114 115.084 119.349 -4.265 1
1 1160 . 4 1 1 A 128 128 ASN H H 115 8.470 8.199 0.271 1
1 1161 . 4 1 1 A 128 128 ASN HA H 115 4.502 4.630 -0.128 1
1 1166 . 4 1 1 A 128 128 ASN C C 115 176.295 175.752 0.543 1
1 1167 . 4 1 1 A 128 128 ASN CA C 115 56.260 55.096 1.164 1
1 1168 . 4 1 1 A 128 128 ASN CB C 115 39.384 39.084 0.300 1
1 1169 . 4 1 1 A 128 128 ASN N N 115 115.158 119.410 -4.252 1
1 1171 . 4 1 1 A 129 129 VAL H H 116 8.116 7.614 0.502 1
1 1172 . 4 1 1 A 129 129 VAL HA H 116 4.090 4.007 0.083 1
1 1180 . 4 1 1 A 129 129 VAL C C 116 176.740 177.329 -0.589 1
1 1181 . 4 1 1 A 129 129 VAL CA C 116 64.400 64.379 0.021 1
1 1182 . 4 1 1 A 129 129 VAL CB C 116 32.050 32.806 -0.756 1
1 1185 . 4 1 1 A 129 129 VAL N N 116 118.698 117.027 1.671 1
1 1186 . 4 1 1 A 130 130 LEU H H 117 7.294 7.954 -0.660 1
1 1187 . 4 1 1 A 130 130 LEU HA H 117 3.970 4.156 -0.186 1
1 1196 . 4 1 1 A 130 130 LEU C C 117 175.127 176.211 -1.084 1
1 1197 . 4 1 1 A 130 130 LEU CA C 117 56.260 55.473 0.787 1
1 1198 . 4 1 1 A 130 130 LEU CB C 117 41.259 42.291 -1.032 1
1 1201 . 4 1 1 A 130 130 LEU N N 117 116.201 118.786 -2.585 1
1 1202 . 4 1 1 A 131 131 LYS H H 118 6.594 7.984 -1.390 1
1 1203 . 4 1 1 A 131 131 LYS HA H 118 3.980 4.184 -0.204 1
1 1208 . 4 1 1 A 131 131 LYS C C 118 175.589 175.502 0.087 1
1 1209 . 4 1 1 A 131 131 LYS CA C 118 56.260 57.457 -1.197 1
1 1210 . 4 1 1 A 131 131 LYS CB C 118 28.133 29.384 -1.251 1
1 1212 . 4 1 1 A 131 131 LYS N N 118 111.172 115.786 -4.614 1
1 1213 . 4 1 1 A 132 132 ILE H H 119 8.245 8.024 0.221 1
1 1214 . 4 1 1 A 132 132 ILE HA H 119 4.090 4.389 -0.299 1
1 1224 . 4 1 1 A 132 132 ILE C C 119 175.161 176.471 -1.310 1
1 1225 . 4 1 1 A 132 132 ILE CA C 119 60.010 61.297 -1.287 1
1 1226 . 4 1 1 A 132 132 ILE CB C 119 35.633 36.512 -0.879 1
1 1230 . 4 1 1 A 132 132 ILE N N 119 119.484 120.051 -0.567 1
1 1231 . 4 1 1 A 133 133 ASN H H 120 8.054 8.785 -0.731 1
1 1232 . 4 1 1 A 133 133 ASN HA H 120 4.350 4.700 -0.350 1
1 1235 . 4 1 1 A 133 133 ASN C C 120 175.136 175.076 0.060 1
1 1236 . 4 1 1 A 133 133 ASN CA C 120 54.385 54.590 -0.205 1
1 1237 . 4 1 1 A 133 133 ASN CB C 120 39.384 39.104 0.280 1
1 1238 . 4 1 1 A 133 133 ASN N N 120 124.670 125.745 -1.075 1
1 1239 . 4 1 1 A 134 134 LEU H H 121 7.517 7.172 0.345 1
1 1240 . 4 1 1 A 134 134 LEU HA H 121 4.678 4.177 0.501 1
1 1249 . 4 1 1 A 134 134 LEU C C 121 178.051 176.881 1.170 1
1 1250 . 4 1 1 A 134 134 LEU CA C 121 53.447 55.651 -2.204 1
1 1251 . 4 1 1 A 134 134 LEU CB C 121 41.259 42.900 -1.641 1
1 1254 . 4 1 1 A 134 134 LEU N N 121 119.918 119.452 0.466 1
1 1255 . 4 1 1 A 135 135 ILE H H 122 9.389 8.608 0.781 1
1 1256 . 4 1 1 A 135 135 ILE HA H 122 3.540 3.741 -0.201 1
1 1266 . 4 1 1 A 135 135 ILE C C 122 176.425 177.688 -1.263 1
1 1267 . 4 1 1 A 135 135 ILE CA C 122 65.636 65.141 0.495 1
1 1268 . 4 1 1 A 135 135 ILE CB C 122 38.446 38.124 0.322 1
1 1272 . 4 1 1 A 135 135 ILE N N 122 129.949 127.225 2.724 1
1 1273 . 4 1 1 A 136 136 GLY H H 123 8.675 8.686 -0.011 1
1 1274 . 4 1 1 A 136 136 GLY HA2 H 123 2.650 3.209 -0.559 1
1 1275 . 4 1 1 A 136 136 GLY HA3 H 123 2.060 3.598 -1.538 1
1 1276 . 4 1 1 A 136 136 GLY C C 123 176.854 176.340 0.514 1
1 1277 . 4 1 1 A 136 136 GLY CA C 123 45.500 47.032 -1.532 1
1 1278 . 4 1 1 A 136 136 GLY N N 123 106.314 108.172 -1.858 1
1 1279 . 4 1 1 A 137 137 HIS H H 124 6.869 7.955 -1.086 1
1 1280 . 4 1 1 A 137 137 HIS HA H 124 4.558 4.435 0.123 1
1 1285 . 4 1 1 A 137 137 HIS C C 124 176.977 177.479 -0.502 1
1 1286 . 4 1 1 A 137 137 HIS CA C 124 57.198 58.956 -1.758 1
1 1287 . 4 1 1 A 137 137 HIS CB C 124 30.945 29.848 1.097 1
1 1290 . 4 1 1 A 137 137 HIS N N 124 118.865 119.973 -1.108 1
1 1291 . 4 1 1 A 138 138 ARG H H 125 7.730 8.333 -0.603 1
1 1292 . 4 1 1 A 138 138 ARG HA H 125 3.770 3.875 -0.105 1
1 1299 . 4 1 1 A 138 138 ARG C C 125 178.288 178.530 -0.242 1
1 1300 . 4 1 1 A 138 138 ARG CA C 125 61.886 59.440 2.446 1
1 1301 . 4 1 1 A 138 138 ARG CB C 125 30.945 29.924 1.021 1
1 1304 . 4 1 1 A 138 138 ARG N N 125 118.149 119.576 -1.427 1
1 1306 . 4 1 1 A 139 139 LYS H H 126 8.679 8.353 0.326 1
1 1307 . 4 1 1 A 139 139 LYS HA H 126 3.990 3.982 0.008 1
1 1310 . 4 1 1 A 139 139 LYS C C 126 179.184 178.749 0.435 1
1 1311 . 4 1 1 A 139 139 LYS CA C 126 58.135 59.467 -1.332 1
1 1312 . 4 1 1 A 139 139 LYS CB C 126 30.945 32.339 -1.394 1
1 1314 . 4 1 1 A 139 139 LYS N N 126 114.003 119.024 -5.021 1
1 1315 . 4 1 1 A 140 140 ARG H H 127 7.248 8.119 -0.871 1
1 1316 . 4 1 1 A 140 140 ARG HA H 127 3.870 3.971 -0.101 1
1 1324 . 4 1 1 A 140 140 ARG C C 127 177.772 178.870 -1.098 1
1 1325 . 4 1 1 A 140 140 ARG CA C 127 60.010 58.743 1.267 1
1 1326 . 4 1 1 A 140 140 ARG CB C 127 30.945 29.887 1.058 1
1 1329 . 4 1 1 A 140 140 ARG N N 127 120.072 119.287 0.785 1
1 1331 . 4 1 1 A 141 141 ILE H H 128 7.706 8.035 -0.329 1
1 1332 . 4 1 1 A 141 141 ILE HA H 128 3.530 3.608 -0.078 1
1 1340 . 4 1 1 A 141 141 ILE C C 128 177.669 178.087 -0.418 1
1 1341 . 4 1 1 A 141 141 ILE CA C 128 65.636 65.753 -0.117 1
1 1342 . 4 1 1 A 141 141 ILE CB C 128 38.680 37.853 0.827 1
1 1345 . 4 1 1 A 141 141 ILE N N 128 118.730 119.599 -0.869 1
1 1346 . 4 1 1 A 142 142 LEU H H 129 8.194 8.572 -0.378 1
1 1347 . 4 1 1 A 142 142 LEU HA H 129 3.950 3.986 -0.036 1
1 1356 . 4 1 1 A 142 142 LEU C C 129 179.960 179.557 0.403 1
1 1357 . 4 1 1 A 142 142 LEU CA C 129 58.135 57.960 0.175 1
1 1358 . 4 1 1 A 142 142 LEU CB C 129 41.259 41.476 -0.217 1
1 1361 . 4 1 1 A 142 142 LEU N N 129 117.675 119.429 -1.754 1
1 1362 . 4 1 1 A 143 143 ALA H H 130 8.294 8.464 -0.170 1
1 1363 . 4 1 1 A 143 143 ALA HA H 130 4.220 4.080 0.140 1
1 1367 . 4 1 1 A 143 143 ALA C C 130 179.899 179.677 0.222 1
1 1368 . 4 1 1 A 143 143 ALA CA C 130 54.385 55.099 -0.714 1
1 1369 . 4 1 1 A 143 143 ALA CB C 130 19.270 18.172 1.098 1
1 1370 . 4 1 1 A 143 143 ALA N N 130 121.096 122.067 -0.971 1
1 1371 . 4 1 1 A 144 144 SER H H 131 7.813 7.970 -0.157 1
1 1372 . 4 1 1 A 144 144 SER HA H 131 4.180 4.248 -0.068 1
1 1375 . 4 1 1 A 144 144 SER C C 131 175.457 177.158 -1.701 1
1 1376 . 4 1 1 A 144 144 SER CA C 131 60.948 61.467 -0.519 1
1 1377 . 4 1 1 A 144 144 SER CB C 131 63.761 63.089 0.672 1
1 1378 . 4 1 1 A 144 144 SER N N 131 112.102 114.043 -1.941 1
1 1379 . 4 1 1 A 145 145 LEU H H 132 7.747 7.771 -0.024 1
1 1380 . 4 1 1 A 145 145 LEU HA H 132 4.140 4.180 -0.040 1
1 1389 . 4 1 1 A 145 145 LEU C C 132 178.589 176.950 1.639 1
1 1390 . 4 1 1 A 145 145 LEU CA C 132 56.260 56.407 -0.147 1
1 1391 . 4 1 1 A 145 145 LEU CB C 132 42.196 42.848 -0.652 1
1 1394 . 4 1 1 A 145 145 LEU N N 132 117.536 118.951 -1.415 1
1 1395 . 4 1 1 A 146 146 GLY H H 133 7.544 7.362 0.182 1
1 1396 . 4 1 1 A 146 146 GLY HA2 H 133 3.950 3.987 -0.037 1
1 1397 . 4 1 1 A 146 146 GLY HA3 H 133 3.100 3.990 -0.890 1
1 1398 . 4 1 1 A 146 146 GLY C C 133 173.372 171.780 1.592 1
1 1399 . 4 1 1 A 146 146 GLY CA C 133 45.947 45.654 0.293 1
1 1400 . 4 1 1 A 146 146 GLY N N 133 105.351 104.316 1.035 1
1 1401 . 4 1 1 A 147 147 ASP H H 134 8.342 8.499 -0.157 1
1 1402 . 4 1 1 A 147 147 ASP HA H 134 4.650 5.042 -0.392 1
1 1405 . 4 1 1 A 147 147 ASP C C 134 175.462 176.314 -0.852 1
1 1406 . 4 1 1 A 147 147 ASP CA C 134 54.385 53.542 0.843 1
1 1407 . 4 1 1 A 147 147 ASP CB C 134 41.259 41.951 -0.692 1
1 1408 . 4 1 1 A 147 147 ASP N N 134 120.133 121.823 -1.690 1
1 14 . 5 1 1 A 15 15 GLN H H 2 8.439 8.827 -0.388 1
1 15 . 5 1 1 A 15 15 GLN HA H 2 4.594 5.191 -0.597 1
1 20 . 5 1 1 A 15 15 GLN C C 2 175.972 174.514 1.458 1
1 21 . 5 1 1 A 15 15 GLN CA C 2 56.260 53.986 2.274 1
1 22 . 5 1 1 A 15 15 GLN CB C 2 30.945 31.467 -0.522 1
1 24 . 5 1 1 A 15 15 GLN N N 2 124.997 127.864 -2.867 1
1 25 . 5 1 1 A 16 16 THR H H 3 8.347 9.080 -0.733 1
1 26 . 5 1 1 A 16 16 THR HA H 3 4.555 4.717 -0.162 1
1 31 . 5 1 1 A 16 16 THR C C 3 175.495 174.734 0.761 1
1 32 . 5 1 1 A 16 16 THR CA C 3 60.010 61.913 -1.903 1
1 33 . 5 1 1 A 16 16 THR CB C 3 71.261 70.727 0.534 1
1 34 . 5 1 1 A 16 16 THR N N 3 113.011 120.381 -7.370 1
1 35 . 5 1 1 A 17 17 VAL H H 4 8.895 8.700 0.195 1
1 36 . 5 1 1 A 17 17 VAL HA H 4 3.670 3.762 -0.092 1
1 44 . 5 1 1 A 17 17 VAL C C 4 178.449 177.976 0.473 1
1 45 . 5 1 1 A 17 17 VAL CA C 4 67.511 66.547 0.964 1
1 46 . 5 1 1 A 17 17 VAL CB C 4 31.883 31.681 0.202 1
1 49 . 5 1 1 A 17 17 VAL N N 4 121.854 125.279 -3.425 1
1 50 . 5 1 1 A 18 18 GLY H H 5 9.017 8.391 0.626 1
1 51 . 5 1 1 A 18 18 GLY HA2 H 5 3.940 3.787 0.153 1
1 52 . 5 1 1 A 18 18 GLY HA3 H 5 3.610 3.804 -0.194 1
1 53 . 5 1 1 A 18 18 GLY C C 5 176.186 175.705 0.481 1
1 54 . 5 1 1 A 18 18 GLY CA C 5 47.822 47.209 0.613 1
1 55 . 5 1 1 A 18 18 GLY N N 5 106.966 107.752 -0.786 1
1 56 . 5 1 1 A 19 19 GLN H H 6 8.072 8.331 -0.259 1
1 57 . 5 1 1 A 19 19 GLN HA H 6 4.037 4.061 -0.024 1
1 62 . 5 1 1 A 19 19 GLN C C 6 179.488 178.014 1.474 1
1 63 . 5 1 1 A 19 19 GLN CA C 6 59.073 58.715 0.358 1
1 64 . 5 1 1 A 19 19 GLN CB C 6 28.489 28.488 0.001 1
1 66 . 5 1 1 A 19 19 GLN N N 6 122.431 121.117 1.314 1
1 67 . 5 1 1 A 20 20 TRP H H 7 8.756 8.167 0.589 1
1 68 . 5 1 1 A 20 20 TRP HA H 7 4.160 4.339 -0.179 1
1 77 . 5 1 1 A 20 20 TRP C C 7 179.620 177.888 1.732 1
1 78 . 5 1 1 A 20 20 TRP CA C 7 61.886 61.413 0.473 1
1 79 . 5 1 1 A 20 20 TRP CB C 7 28.133 29.953 -1.820 1
1 85 . 5 1 1 A 20 20 TRP N N 7 124.265 122.298 1.967 1
1 87 . 5 1 1 A 21 21 LEU H H 8 9.148 8.749 0.399 1
1 88 . 5 1 1 A 21 21 LEU HA H 8 3.440 3.611 -0.171 1
1 97 . 5 1 1 A 21 21 LEU C C 8 180.521 178.652 1.869 1
1 98 . 5 1 1 A 21 21 LEU CA C 8 56.920 57.788 -0.868 1
1 99 . 5 1 1 A 21 21 LEU CB C 8 41.700 41.561 0.139 1
1 102 . 5 1 1 A 21 21 LEU N N 8 120.548 120.853 -0.305 1
1 103 . 5 1 1 A 22 22 GLU H H 9 8.284 8.406 -0.122 1
1 104 . 5 1 1 A 22 22 GLU HA H 9 3.740 4.058 -0.318 1
1 109 . 5 1 1 A 22 22 GLU C C 9 179.960 178.315 1.645 1
1 110 . 5 1 1 A 22 22 GLU CA C 9 60.010 59.199 0.811 1
1 111 . 5 1 1 A 22 22 GLU CB C 9 29.070 28.701 0.369 1
1 113 . 5 1 1 A 22 22 GLU N N 9 120.133 119.969 0.164 1
1 114 . 5 1 1 A 23 23 SER H H 10 7.891 7.858 0.033 1
1 115 . 5 1 1 A 23 23 SER HA H 10 4.250 4.174 0.076 1
1 118 . 5 1 1 A 23 23 SER C C 10 175.346 176.000 -0.654 1
1 119 . 5 1 1 A 23 23 SER CA C 10 60.948 61.003 -0.055 1
1 120 . 5 1 1 A 23 23 SER CB C 10 63.280 63.021 0.259 1
1 121 . 5 1 1 A 23 23 SER N N 10 117.044 115.558 1.486 1
1 122 . 5 1 1 A 24 24 ILE H H 11 6.862 7.238 -0.376 1
1 123 . 5 1 1 A 24 24 ILE HA H 11 4.487 3.885 0.602 1
1 133 . 5 1 1 A 24 24 ILE C C 11 175.812 176.465 -0.653 1
1 134 . 5 1 1 A 24 24 ILE CA C 11 60.948 62.101 -1.153 1
1 135 . 5 1 1 A 24 24 ILE CB C 11 38.250 38.344 -0.094 1
1 139 . 5 1 1 A 24 24 ILE N N 11 113.733 117.228 -3.495 1
1 140 . 5 1 1 A 25 25 GLY H H 12 7.628 7.764 -0.136 1
1 141 . 5 1 1 A 25 25 GLY HA2 H 12 3.990 3.970 0.020 1
1 142 . 5 1 1 A 25 25 GLY HA3 H 12 3.800 4.164 -0.364 1
1 143 . 5 1 1 A 25 25 GLY C C 12 173.647 172.467 1.180 1
1 144 . 5 1 1 A 25 25 GLY CA C 12 45.947 45.334 0.613 1
1 145 . 5 1 1 A 25 25 GLY N N 12 109.763 110.561 -0.798 1
1 146 . 5 1 1 A 26 26 LEU H H 13 7.620 8.252 -0.632 1
1 147 . 5 1 1 A 26 26 LEU C C 13 176.186 176.648 -0.462 1
1 148 . 5 1 1 A 26 26 LEU CA C 13 52.700 51.953 0.747 1
1 149 . 5 1 1 A 26 26 LEU CB C 13 43.134 45.517 -2.383 1
1 150 . 5 1 1 A 26 26 LEU N N 13 118.778 121.909 -3.131 1
1 151 . 5 1 1 A 27 27 PRO HA H 14 4.120 4.457 -0.337 1
1 154 . 5 1 1 A 27 27 PRO C C 14 177.955 177.560 0.395 1
1 155 . 5 1 1 A 27 27 PRO CA C 14 64.698 64.323 0.375 1
1 156 . 5 1 1 A 27 27 PRO CB C 14 31.883 31.845 0.038 1
1 158 . 5 1 1 A 28 28 GLN H H 15 9.838 8.413 1.425 1
1 159 . 5 1 1 A 28 28 GLN HA H 15 4.240 4.010 0.230 1
1 162 . 5 1 1 A 28 28 GLN C C 15 176.836 176.262 0.574 1
1 163 . 5 1 1 A 28 28 GLN CA C 15 58.135 57.960 0.175 1
1 164 . 5 1 1 A 28 28 GLN CB C 15 27.195 28.168 -0.973 1
1 166 . 5 1 1 A 28 28 GLN N N 15 120.414 116.983 3.431 1
1 167 . 5 1 1 A 29 29 TYR H H 16 6.810 7.228 -0.418 1
1 168 . 5 1 1 A 29 29 TYR HA H 16 5.720 4.635 1.085 1
1 173 . 5 1 1 A 29 29 TYR C C 16 174.814 176.847 -2.033 1
1 174 . 5 1 1 A 29 29 TYR CA C 16 57.198 57.744 -0.546 1
1 175 . 5 1 1 A 29 29 TYR CB C 16 37.509 39.519 -2.010 1
1 178 . 5 1 1 A 29 29 TYR N N 16 119.718 117.721 1.997 1
1 179 . 5 1 1 A 30 30 GLU H H 17 7.509 8.340 -0.831 1
1 180 . 5 1 1 A 30 30 GLU HA H 17 3.650 4.067 -0.417 1
1 184 . 5 1 1 A 30 30 GLU C C 17 177.552 179.477 -1.925 1
1 185 . 5 1 1 A 30 30 GLU CA C 17 60.948 59.575 1.373 1
1 186 . 5 1 1 A 30 30 GLU CB C 17 30.008 29.273 0.735 1
1 188 . 5 1 1 A 30 30 GLU N N 17 122.417 121.157 1.260 1
1 189 . 5 1 1 A 31 31 ASN H H 18 9.259 8.233 1.026 1
1 190 . 5 1 1 A 31 31 ASN HA H 18 4.451 4.450 0.001 1
1 193 . 5 1 1 A 31 31 ASN C C 18 176.868 178.328 -1.460 1
1 194 . 5 1 1 A 31 31 ASN CA C 18 57.198 56.621 0.577 1
1 195 . 5 1 1 A 31 31 ASN CB C 18 38.446 38.355 0.091 1
1 196 . 5 1 1 A 31 31 ASN N N 18 116.613 118.719 -2.106 1
1 197 . 5 1 1 A 32 32 HIS H H 19 8.898 7.998 0.900 1
1 198 . 5 1 1 A 32 32 HIS HA H 19 4.140 4.330 -0.190 1
1 202 . 5 1 1 A 32 32 HIS C C 19 178.269 177.773 0.496 1
1 203 . 5 1 1 A 32 32 HIS CA C 19 60.948 59.292 1.656 1
1 204 . 5 1 1 A 32 32 HIS CB C 19 30.008 30.082 -0.074 1
1 206 . 5 1 1 A 32 32 HIS N N 19 118.926 119.169 -0.243 1
1 207 . 5 1 1 A 33 33 LEU H H 20 7.825 8.953 -1.128 1
1 208 . 5 1 1 A 33 33 LEU HA H 20 4.305 4.019 0.286 1
1 218 . 5 1 1 A 33 33 LEU C C 20 179.190 179.046 0.144 1
1 219 . 5 1 1 A 33 33 LEU CA C 20 60.010 58.395 1.615 1
1 220 . 5 1 1 A 33 33 LEU CB C 20 40.321 41.989 -1.668 1
1 224 . 5 1 1 A 33 33 LEU N N 20 117.434 119.900 -2.466 1
1 225 . 5 1 1 A 34 34 MET H H 21 8.861 8.610 0.251 1
1 226 . 5 1 1 A 34 34 MET HA H 21 3.980 4.209 -0.229 1
1 234 . 5 1 1 A 34 34 MET C C 21 180.340 178.749 1.591 1
1 235 . 5 1 1 A 34 34 MET CA C 21 58.135 58.686 -0.551 1
1 236 . 5 1 1 A 34 34 MET CB C 21 30.945 32.498 -1.553 1
1 238 . 5 1 1 A 34 34 MET N N 21 118.111 116.441 1.670 1
1 239 . 5 1 1 A 35 35 ALA H H 22 9.015 8.245 0.770 1
1 240 . 5 1 1 A 35 35 ALA HA H 22 4.239 4.119 0.120 1
1 244 . 5 1 1 A 35 35 ALA C C 22 178.058 178.308 -0.250 1
1 245 . 5 1 1 A 35 35 ALA CA C 22 53.800 54.572 -0.772 1
1 246 . 5 1 1 A 35 35 ALA CB C 22 18.397 18.199 0.198 1
1 247 . 5 1 1 A 35 35 ALA N N 22 120.068 121.468 -1.400 1
1 248 . 5 1 1 A 36 36 ASN H H 23 7.143 8.005 -0.862 1
1 249 . 5 1 1 A 36 36 ASN HA H 23 4.959 4.830 0.129 1
1 254 . 5 1 1 A 36 36 ASN C C 23 174.083 175.344 -1.261 1
1 255 . 5 1 1 A 36 36 ASN CA C 23 54.000 52.585 1.415 1
1 256 . 5 1 1 A 36 36 ASN CB C 23 41.300 38.670 2.630 1
1 257 . 5 1 1 A 36 36 ASN N N 23 111.560 114.952 -3.392 1
1 259 . 5 1 1 A 37 37 GLY H H 24 7.797 8.234 -0.437 1
1 260 . 5 1 1 A 37 37 GLY HA2 H 24 3.430 3.764 -0.334 1
1 261 . 5 1 1 A 37 37 GLY HA3 H 24 3.290 3.899 -0.609 1
1 262 . 5 1 1 A 37 37 GLY C C 24 173.163 174.720 -1.557 1
1 263 . 5 1 1 A 37 37 GLY CA C 24 45.947 45.181 0.766 1
1 264 . 5 1 1 A 37 37 GLY N N 24 106.170 107.891 -1.721 1
1 265 . 5 1 1 A 38 38 PHE H H 25 8.191 7.831 0.360 1
1 266 . 5 1 1 A 38 38 PHE HA H 25 4.910 4.754 0.156 1
1 271 . 5 1 1 A 38 38 PHE C C 25 173.496 175.574 -2.078 1
1 272 . 5 1 1 A 38 38 PHE CA C 25 56.550 56.557 -0.007 1
1 273 . 5 1 1 A 38 38 PHE CB C 25 37.220 37.155 0.065 1
1 276 . 5 1 1 A 38 38 PHE N N 25 122.454 119.837 2.617 1
1 277 . 5 1 1 A 39 39 ASP H H 26 6.756 8.605 -1.849 1
1 278 . 5 1 1 A 39 39 ASP HA H 26 5.077 4.994 0.083 1
1 281 . 5 1 1 A 39 39 ASP C C 26 177.463 175.425 2.038 1
1 282 . 5 1 1 A 39 39 ASP CA C 26 53.447 53.999 -0.552 1
1 283 . 5 1 1 A 39 39 ASP CB C 26 42.580 42.239 0.341 1
1 284 . 5 1 1 A 39 39 ASP N N 26 111.309 120.528 -9.219 1
1 285 . 5 1 1 A 40 40 ASN H H 27 7.495 7.977 -0.482 1
1 286 . 5 1 1 A 40 40 ASN HA H 27 4.820 5.068 -0.248 1
1 289 . 5 1 1 A 40 40 ASN C C 27 176.228 175.654 0.574 1
1 290 . 5 1 1 A 40 40 ASN CA C 27 52.510 51.812 0.698 1
1 291 . 5 1 1 A 40 40 ASN CB C 27 40.321 40.806 -0.485 1
1 292 . 5 1 1 A 40 40 ASN N N 27 118.385 118.127 0.258 1
1 293 . 5 1 1 A 41 41 VAL H H 28 9.192 8.607 0.585 1
1 294 . 5 1 1 A 41 41 VAL HA H 28 3.550 3.564 -0.014 1
1 302 . 5 1 1 A 41 41 VAL C C 28 176.429 177.456 -1.027 1
1 303 . 5 1 1 A 41 41 VAL CA C 28 65.636 66.034 -0.398 1
1 304 . 5 1 1 A 41 41 VAL CB C 28 31.883 31.444 0.439 1
1 307 . 5 1 1 A 41 41 VAL N N 28 125.741 125.955 -0.214 1
1 308 . 5 1 1 A 42 42 GLN H H 29 8.203 8.158 0.045 1
1 309 . 5 1 1 A 42 42 GLN HA H 29 4.129 4.016 0.113 1
1 314 . 5 1 1 A 42 42 GLN C C 29 176.591 178.720 -2.129 1
1 315 . 5 1 1 A 42 42 GLN CA C 29 57.198 59.076 -1.878 1
1 316 . 5 1 1 A 42 42 GLN CB C 29 28.133 27.998 0.135 1
1 318 . 5 1 1 A 42 42 GLN N N 29 116.452 118.918 -2.466 1
1 319 . 5 1 1 A 43 43 ALA H H 30 7.781 8.105 -0.324 1
1 320 . 5 1 1 A 43 43 ALA HA H 30 4.650 4.171 0.479 1
1 324 . 5 1 1 A 43 43 ALA C C 30 175.976 178.657 -2.681 1
1 325 . 5 1 1 A 43 43 ALA CA C 30 50.840 54.366 -3.526 1
1 326 . 5 1 1 A 43 43 ALA CB C 30 19.150 18.471 0.679 1
1 327 . 5 1 1 A 43 43 ALA N N 30 122.150 120.714 1.436 1
1 328 . 5 1 1 A 44 44 MET H H 31 7.739 7.803 -0.064 1
1 332 . 5 1 1 A 44 44 MET C C 31 178.275 177.096 1.179 1
1 333 . 5 1 1 A 44 44 MET CA C 31 55.323 55.222 0.101 1
1 334 . 5 1 1 A 44 44 MET CB C 31 34.696 33.175 1.521 1
1 336 . 5 1 1 A 44 44 MET N N 31 118.149 115.541 2.608 1
1 337 . 5 1 1 A 45 45 GLY H H 32 7.611 8.478 -0.867 1
1 338 . 5 1 1 A 45 45 GLY N N 32 101.530 109.537 -8.007 1
1 339 . 5 1 1 A 47 47 ASN HA H 34 4.480 4.758 -0.278 1
1 342 . 5 1 1 A 47 47 ASN CA C 34 56.260 52.222 4.038 1
1 343 . 5 1 1 A 47 47 ASN CB C 34 39.384 39.452 -0.068 1
1 344 . 5 1 1 A 49 49 MET HA H 36 4.646 4.459 0.187 1
1 350 . 5 1 1 A 49 49 MET C C 36 173.651 175.896 -2.245 1
1 351 . 5 1 1 A 49 49 MET CA C 36 55.323 56.078 -0.755 1
1 352 . 5 1 1 A 49 49 MET CB C 36 35.633 33.077 2.556 1
1 355 . 5 1 1 A 50 50 GLU H H 37 9.203 9.016 0.187 1
1 356 . 5 1 1 A 50 50 GLU HA H 37 4.650 4.652 -0.002 1
1 361 . 5 1 1 A 50 50 GLU C C 37 177.008 177.582 -0.574 1
1 362 . 5 1 1 A 50 50 GLU CA C 37 54.385 55.403 -1.018 1
1 363 . 5 1 1 A 50 50 GLU CB C 37 33.758 31.209 2.549 1
1 365 . 5 1 1 A 50 50 GLU N N 37 123.229 126.964 -3.735 1
1 366 . 5 1 1 A 51 51 ASP H H 38 9.032 8.919 0.113 1
1 367 . 5 1 1 A 51 51 ASP HA H 38 4.149 4.328 -0.179 1
1 370 . 5 1 1 A 51 51 ASP C C 38 177.994 178.379 -0.385 1
1 371 . 5 1 1 A 51 51 ASP CA C 38 59.073 57.168 1.905 1
1 372 . 5 1 1 A 51 51 ASP CB C 38 43.134 40.112 3.022 1
1 373 . 5 1 1 A 51 51 ASP N N 38 122.717 121.841 0.876 1
1 374 . 5 1 1 A 52 52 GLN H H 39 8.950 8.247 0.703 1
1 375 . 5 1 1 A 52 52 GLN HA H 39 3.940 3.949 -0.009 1
1 378 . 5 1 1 A 52 52 GLN C C 39 177.817 178.366 -0.549 1
1 379 . 5 1 1 A 52 52 GLN CA C 39 59.073 59.144 -0.071 1
1 380 . 5 1 1 A 52 52 GLN CB C 39 28.133 28.477 -0.344 1
1 381 . 5 1 1 A 52 52 GLN N N 39 114.086 119.599 -5.513 1
1 382 . 5 1 1 A 53 53 ASP H H 40 7.214 8.095 -0.881 1
1 383 . 5 1 1 A 53 53 ASP HA H 40 4.370 4.517 -0.147 1
1 386 . 5 1 1 A 53 53 ASP C C 40 177.667 178.723 -1.056 1
1 387 . 5 1 1 A 53 53 ASP CA C 40 57.198 57.502 -0.304 1
1 388 . 5 1 1 A 53 53 ASP CB C 40 41.800 40.340 1.460 1
1 389 . 5 1 1 A 53 53 ASP N N 40 118.734 120.075 -1.341 1
1 390 . 5 1 1 A 54 54 LEU H H 41 7.180 8.216 -1.036 1
1 391 . 5 1 1 A 54 54 LEU HA H 41 3.990 4.013 -0.023 1
1 400 . 5 1 1 A 54 54 LEU C C 41 178.204 178.415 -0.211 1
1 401 . 5 1 1 A 54 54 LEU CA C 41 56.260 58.247 -1.987 1
1 402 . 5 1 1 A 54 54 LEU CB C 41 41.259 41.553 -0.294 1
1 405 . 5 1 1 A 54 54 LEU N N 41 115.795 122.362 -6.567 1
1 406 . 5 1 1 A 55 55 LEU H H 42 7.823 8.076 -0.253 1
1 407 . 5 1 1 A 55 55 LEU HA H 42 3.920 4.079 -0.159 1
1 416 . 5 1 1 A 55 55 LEU C C 42 180.876 178.835 2.041 1
1 417 . 5 1 1 A 55 55 LEU CA C 42 58.135 57.053 1.082 1
1 418 . 5 1 1 A 55 55 LEU CB C 42 42.196 41.906 0.290 1
1 421 . 5 1 1 A 55 55 LEU N N 42 120.499 119.264 1.235 1
1 422 . 5 1 1 A 56 56 GLU H H 43 8.127 8.296 -0.169 1
1 423 . 5 1 1 A 56 56 GLU HA H 43 3.966 4.039 -0.073 1
1 428 . 5 1 1 A 56 56 GLU C C 43 178.801 179.130 -0.329 1
1 429 . 5 1 1 A 56 56 GLU CA C 43 60.010 59.222 0.788 1
1 430 . 5 1 1 A 56 56 GLU CB C 43 29.070 29.527 -0.457 1
1 432 . 5 1 1 A 56 56 GLU N N 43 120.955 120.024 0.931 1
1 433 . 5 1 1 A 57 57 ILE H H 44 7.504 7.651 -0.147 1
1 434 . 5 1 1 A 57 57 ILE HA H 44 4.524 3.900 0.624 1
1 444 . 5 1 1 A 57 57 ILE C C 44 175.691 176.765 -1.074 1
1 445 . 5 1 1 A 57 57 ILE CA C 44 61.886 64.102 -2.216 1
1 446 . 5 1 1 A 57 57 ILE CB C 44 37.300 38.443 -1.143 1
1 450 . 5 1 1 A 57 57 ILE N N 44 109.594 118.803 -9.209 1
1 451 . 5 1 1 A 58 58 GLY H H 45 7.724 7.624 0.100 1
1 452 . 5 1 1 A 58 58 GLY HA2 H 45 3.650 4.132 -0.482 1
1 453 . 5 1 1 A 58 58 GLY HA3 H 45 4.530 4.279 0.251 1
1 454 . 5 1 1 A 58 58 GLY C C 45 174.613 174.193 0.420 1
1 455 . 5 1 1 A 58 58 GLY CA C 45 45.947 45.107 0.840 1
1 456 . 5 1 1 A 58 58 GLY N N 45 106.680 107.041 -0.361 1
1 457 . 5 1 1 A 59 59 ILE H H 46 8.180 7.805 0.375 1
1 458 . 5 1 1 A 59 59 ILE HA H 46 3.907 3.872 0.035 1
1 468 . 5 1 1 A 59 59 ILE C C 46 174.235 174.493 -0.258 1
1 469 . 5 1 1 A 59 59 ILE CA C 46 60.948 60.091 0.857 1
1 470 . 5 1 1 A 59 59 ILE CB C 46 33.980 38.364 -4.384 1
1 474 . 5 1 1 A 59 59 ILE N N 46 122.454 121.421 1.033 1
1 475 . 5 1 1 A 60 60 LEU H H 47 7.367 9.002 -1.635 1
1 476 . 5 1 1 A 60 60 LEU HA H 47 3.900 5.086 -1.186 1
1 479 . 5 1 1 A 60 60 LEU C C 47 177.753 175.268 2.485 1
1 480 . 5 1 1 A 60 60 LEU CA C 47 56.260 53.491 2.769 1
1 481 . 5 1 1 A 60 60 LEU CB C 47 42.196 42.975 -0.779 1
1 482 . 5 1 1 A 60 60 LEU N N 47 125.835 128.513 -2.678 1
1 483 . 5 1 1 A 63 63 GLY HA2 H 50 3.980 3.936 0.044 1
1 484 . 5 1 1 A 63 63 GLY HA3 H 50 3.950 3.949 0.001 1
1 485 . 5 1 1 A 63 63 GLY C C 50 177.130 175.039 2.091 1
1 486 . 5 1 1 A 63 63 GLY CA C 50 46.884 45.529 1.355 1
1 487 . 5 1 1 A 64 64 HIS H H 51 7.926 8.170 -0.244 1
1 488 . 5 1 1 A 64 64 HIS HA H 51 4.451 4.229 0.222 1
1 493 . 5 1 1 A 64 64 HIS C C 51 177.613 177.289 0.324 1
1 494 . 5 1 1 A 64 64 HIS CA C 51 57.198 59.489 -2.291 1
1 495 . 5 1 1 A 64 64 HIS CB C 51 30.945 30.279 0.666 1
1 498 . 5 1 1 A 64 64 HIS N N 51 122.284 121.101 1.183 1
1 499 . 5 1 1 A 65 65 ARG H H 52 8.105 8.119 -0.014 1
1 500 . 5 1 1 A 65 65 ARG HA H 52 3.685 3.838 -0.153 1
1 507 . 5 1 1 A 65 65 ARG C C 52 177.769 178.880 -1.111 1
1 508 . 5 1 1 A 65 65 ARG CA C 52 61.886 59.746 2.140 1
1 509 . 5 1 1 A 65 65 ARG CB C 52 30.945 30.154 0.791 1
1 511 . 5 1 1 A 65 65 ARG N N 52 117.775 118.579 -0.804 1
1 513 . 5 1 1 A 66 66 GLN H H 53 8.090 7.952 0.138 1
1 514 . 5 1 1 A 66 66 GLN HA H 53 3.940 4.031 -0.091 1
1 519 . 5 1 1 A 66 66 GLN C C 53 178.583 177.999 0.584 1
1 520 . 5 1 1 A 66 66 GLN CA C 53 59.073 59.023 0.050 1
1 521 . 5 1 1 A 66 66 GLN CB C 53 28.133 28.368 -0.235 1
1 523 . 5 1 1 A 66 66 GLN N N 53 116.452 118.744 -2.292 1
1 524 . 5 1 1 A 67 67 ARG H H 54 7.845 7.887 -0.042 1
1 525 . 5 1 1 A 67 67 ARG HA H 54 4.010 3.979 0.031 1
1 528 . 5 1 1 A 67 67 ARG C C 54 179.766 178.920 0.846 1
1 529 . 5 1 1 A 67 67 ARG CA C 54 59.073 58.947 0.126 1
1 530 . 5 1 1 A 67 67 ARG CB C 54 30.720 29.767 0.953 1
1 532 . 5 1 1 A 67 67 ARG N N 54 119.275 119.687 -0.412 1
1 533 . 5 1 1 A 68 68 ILE H H 55 8.032 8.035 -0.003 1
1 534 . 5 1 1 A 68 68 ILE HA H 55 3.495 3.517 -0.022 1
1 544 . 5 1 1 A 68 68 ILE C C 55 177.108 178.392 -1.284 1
1 545 . 5 1 1 A 68 68 ILE CA C 55 66.230 65.581 0.649 1
1 546 . 5 1 1 A 68 68 ILE CB C 55 38.020 37.676 0.344 1
1 550 . 5 1 1 A 68 68 ILE N N 55 121.152 119.487 1.665 1
1 551 . 5 1 1 A 69 69 LEU H H 56 8.490 8.216 0.274 1
1 552 . 5 1 1 A 69 69 LEU HA H 56 4.010 3.884 0.126 1
1 561 . 5 1 1 A 69 69 LEU C C 56 179.917 178.979 0.938 1
1 562 . 5 1 1 A 69 69 LEU CA C 56 58.135 58.021 0.114 1
1 563 . 5 1 1 A 69 69 LEU CB C 56 41.259 41.902 -0.643 1
1 566 . 5 1 1 A 69 69 LEU N N 56 119.072 120.354 -1.282 1
1 567 . 5 1 1 A 70 70 GLN H H 57 8.327 8.444 -0.117 1
1 568 . 5 1 1 A 70 70 GLN HA H 57 4.100 3.901 0.199 1
1 573 . 5 1 1 A 70 70 GLN C C 57 178.798 178.042 0.756 1
1 574 . 5 1 1 A 70 70 GLN CA C 57 59.073 58.908 0.165 1
1 575 . 5 1 1 A 70 70 GLN CB C 57 28.133 28.366 -0.233 1
1 577 . 5 1 1 A 70 70 GLN N N 57 118.172 118.075 0.097 1
1 578 . 5 1 1 A 71 71 ALA H H 58 7.810 7.922 -0.112 1
1 579 . 5 1 1 A 71 71 ALA HA H 58 4.320 4.115 0.205 1
1 583 . 5 1 1 A 71 71 ALA C C 58 172.232 179.523 -7.291 1
1 584 . 5 1 1 A 71 71 ALA CA C 58 55.323 55.192 0.131 1
1 585 . 5 1 1 A 71 71 ALA CB C 58 19.720 18.795 0.925 1
1 586 . 5 1 1 A 71 71 ALA N N 58 122.536 121.902 0.634 1
1 587 . 5 1 1 A 72 72 ILE H H 59 8.840 8.428 0.412 1
1 588 . 5 1 1 A 72 72 ILE HA H 59 4.030 4.010 0.020 1
1 598 . 5 1 1 A 72 72 ILE C C 59 178.678 177.627 1.051 1
1 599 . 5 1 1 A 72 72 ILE CA C 59 64.698 63.877 0.821 1
1 600 . 5 1 1 A 72 72 ILE CB C 59 37.850 37.487 0.363 1
1 604 . 5 1 1 A 72 72 ILE N N 59 118.111 118.727 -0.616 1
1 605 . 5 1 1 A 73 73 GLN H H 60 7.547 8.090 -0.543 1
1 606 . 5 1 1 A 73 73 GLN HA H 60 4.121 4.092 0.029 1
1 611 . 5 1 1 A 73 73 GLN C C 60 176.556 177.805 -1.249 1
1 612 . 5 1 1 A 73 73 GLN CA C 60 58.135 58.783 -0.648 1
1 613 . 5 1 1 A 73 73 GLN CB C 60 28.300 28.650 -0.350 1
1 615 . 5 1 1 A 73 73 GLN N N 60 119.094 121.019 -1.925 1
1 616 . 5 1 1 A 74 74 LEU H H 61 7.350 7.803 -0.453 1
1 617 . 5 1 1 A 74 74 LEU HA H 61 4.408 4.336 0.072 1
1 626 . 5 1 1 A 74 74 LEU C C 61 177.960 177.807 0.153 1
1 627 . 5 1 1 A 74 74 LEU CA C 61 54.900 55.313 -0.413 1
1 628 . 5 1 1 A 74 74 LEU CB C 61 42.196 42.318 -0.122 1
1 631 . 5 1 1 A 74 74 LEU N N 61 115.853 118.620 -2.767 1
1 632 . 5 1 1 A 75 75 LEU H H 62 7.358 7.632 -0.274 1
1 633 . 5 1 1 A 75 75 LEU HA H 62 4.530 4.083 0.447 1
1 642 . 5 1 1 A 75 75 LEU C C 62 177.035 175.738 1.297 1
1 643 . 5 1 1 A 75 75 LEU CA C 62 53.200 60.076 -6.876 1
1 644 . 5 1 1 A 75 75 LEU CB C 62 40.700 40.298 0.402 1
1 647 . 5 1 1 A 75 75 LEU N N 62 121.010 120.556 0.454 1
1 648 . 5 1 1 A 76 76 PRO HA H 63 4.382 4.356 0.026 1
1 655 . 5 1 1 A 76 76 PRO CB C 63 31.883 31.097 0.786 1
1 657 . 5 1 1 A 77 77 LYS H H 64 8.418 8.159 0.259 1
1 658 . 5 1 1 A 77 77 LYS HA H 64 4.140 4.097 0.043 1
1 663 . 5 1 1 A 77 77 LYS C C 64 177.122 177.962 -0.840 1
1 664 . 5 1 1 A 77 77 LYS CA C 64 56.260 59.400 -3.140 1
1 665 . 5 1 1 A 77 77 LYS CB C 64 33.340 32.114 1.226 1
1 668 . 5 1 1 A 77 77 LYS N N 64 121.932 118.551 3.381 1
1 669 . 5 1 1 A 78 78 MET H H 65 8.550 7.796 0.754 1
1 670 . 5 1 1 A 78 78 MET HA H 65 4.304 4.655 -0.351 1
1 676 . 5 1 1 A 78 78 MET C C 65 176.105 176.070 0.035 1
1 677 . 5 1 1 A 78 78 MET CA C 65 56.260 56.504 -0.244 1
1 678 . 5 1 1 A 78 78 MET CB C 65 32.821 34.061 -1.240 1
1 680 . 5 1 1 A 78 78 MET N N 65 123.498 117.614 5.884 1
1 681 . 5 1 1 A 79 79 ARG H H 66 8.731 7.824 0.907 1
1 682 . 5 1 1 A 79 79 ARG C C 66 173.577 174.525 -0.948 1
1 683 . 5 1 1 A 79 79 ARG CA C 66 53.447 53.742 -0.295 1
1 684 . 5 1 1 A 79 79 ARG CB C 66 30.008 30.814 -0.806 1
1 685 . 5 1 1 A 79 79 ARG N N 66 127.355 117.528 9.827 1
1 686 . 5 1 1 A 80 80 PRO HA H 67 4.780 4.275 0.505 1
1 693 . 5 1 1 A 80 80 PRO C C 67 177.043 177.651 -0.608 1
1 694 . 5 1 1 A 80 80 PRO CA C 67 61.886 65.569 -3.683 1
1 695 . 5 1 1 A 80 80 PRO CB C 67 32.821 31.601 1.220 1
1 698 . 5 1 1 A 81 81 ILE H H 68 8.580 7.931 0.649 1
1 699 . 5 1 1 A 81 81 ILE HA H 68 4.040 3.794 0.246 1
1 709 . 5 1 1 A 81 81 ILE C C 68 176.831 175.535 1.296 1
1 710 . 5 1 1 A 81 81 ILE CA C 68 62.823 62.283 0.540 1
1 711 . 5 1 1 A 81 81 ILE CB C 68 38.580 36.817 1.763 1
1 715 . 5 1 1 A 81 81 ILE N N 68 118.491 117.921 0.570 1
1 716 . 5 1 1 A 82 82 GLY H H 69 8.602 8.178 0.424 1
1 717 . 5 1 1 A 82 82 GLY CA C 69 45.009 45.624 -0.615 1
1 718 . 5 1 1 A 82 82 GLY N N 69 111.377 110.654 0.723 1
1 721 . 5 1 1 A 84 84 ASP HA H 71 4.490 5.383 -0.893 1
1 724 . 5 1 1 A 84 84 ASP CA C 71 54.385 52.085 2.300 1
1 725 . 5 1 1 A 84 84 ASP CB C 71 40.321 44.851 -4.530 1
1 726 . 5 1 1 A 85 85 GLY H H 72 8.054 8.398 -0.344 1
1 727 . 5 1 1 A 85 85 GLY HA2 H 72 4.040 4.161 -0.121 1
1 728 . 5 1 1 A 85 85 GLY HA3 H 72 3.750 4.170 -0.420 1
1 729 . 5 1 1 A 85 85 GLY C C 72 173.474 172.314 1.160 1
1 730 . 5 1 1 A 85 85 GLY CA C 72 45.009 45.799 -0.790 1
1 731 . 5 1 1 A 85 85 GLY N N 72 108.038 105.916 2.122 1
1 732 . 5 1 1 A 86 86 ALA H H 73 7.858 8.672 -0.814 1
1 733 . 5 1 1 A 86 86 ALA HA H 73 4.370 4.998 -0.628 1
1 737 . 5 1 1 A 86 86 ALA CA C 73 51.990 51.533 0.457 1
1 738 . 5 1 1 A 86 86 ALA CB C 73 19.220 20.038 -0.818 1
1 739 . 5 1 1 A 86 86 ALA N N 73 123.819 123.913 -0.094 1
1 742 . 5 1 1 A 90 90 SER H H 77 7.839 8.958 -1.119 1
1 743 . 5 1 1 A 90 90 SER HA H 77 4.770 4.770 0.000 1
1 746 . 5 1 1 A 90 90 SER N N 77 115.163 117.811 -2.648 1
1 747 . 5 1 1 A 91 91 VAL H H 78 8.578 8.950 -0.372 1
1 748 . 5 1 1 A 91 91 VAL HA H 78 3.981 3.959 0.022 1
1 756 . 5 1 1 A 91 91 VAL C C 78 177.480 177.553 -0.073 1
1 757 . 5 1 1 A 91 91 VAL CA C 78 67.060 66.111 0.949 1
1 758 . 5 1 1 A 91 91 VAL CB C 78 32.500 31.635 0.865 1
1 761 . 5 1 1 A 91 91 VAL N N 78 123.481 121.862 1.619 1
1 762 . 5 1 1 A 92 92 ALA H H 79 8.607 8.248 0.359 1
1 763 . 5 1 1 A 92 92 ALA HA H 79 4.113 3.976 0.137 1
1 767 . 5 1 1 A 92 92 ALA C C 79 179.868 180.273 -0.405 1
1 768 . 5 1 1 A 92 92 ALA CA C 79 54.890 55.584 -0.694 1
1 769 . 5 1 1 A 92 92 ALA CB C 79 18.790 18.914 -0.124 1
1 770 . 5 1 1 A 92 92 ALA N N 79 120.334 122.084 -1.750 1
1 771 . 5 1 1 A 93 93 GLU H H 80 7.886 8.142 -0.256 1
1 772 . 5 1 1 A 93 93 GLU HA H 80 4.010 4.101 -0.091 1
1 777 . 5 1 1 A 93 93 GLU C C 80 179.719 178.935 0.784 1
1 778 . 5 1 1 A 93 93 GLU CA C 80 59.073 59.029 0.044 1
1 779 . 5 1 1 A 93 93 GLU CB C 80 30.630 29.301 1.329 1
1 781 . 5 1 1 A 93 93 GLU N N 80 117.643 117.227 0.416 1
1 782 . 5 1 1 A 94 94 TRP H H 81 8.299 8.372 -0.073 1
1 783 . 5 1 1 A 94 94 TRP HA H 81 4.251 4.299 -0.048 1
1 792 . 5 1 1 A 94 94 TRP C C 81 178.772 178.374 0.398 1
1 793 . 5 1 1 A 94 94 TRP CA C 81 60.010 61.300 -1.290 1
1 794 . 5 1 1 A 94 94 TRP CB C 81 27.650 30.022 -2.372 1
1 800 . 5 1 1 A 94 94 TRP N N 81 122.545 122.618 -0.073 1
1 802 . 5 1 1 A 95 95 LEU H H 82 8.505 8.572 -0.067 1
1 803 . 5 1 1 A 95 95 LEU HA H 82 2.880 3.081 -0.201 1
1 812 . 5 1 1 A 95 95 LEU C C 82 180.235 178.535 1.700 1
1 813 . 5 1 1 A 95 95 LEU CA C 82 57.400 57.186 0.214 1
1 814 . 5 1 1 A 95 95 LEU CB C 82 40.321 40.673 -0.352 1
1 817 . 5 1 1 A 95 95 LEU N N 82 121.110 119.056 2.054 1
1 818 . 5 1 1 A 96 96 ASP H H 83 8.185 8.449 -0.264 1
1 819 . 5 1 1 A 96 96 ASP HA H 83 4.280 4.296 -0.016 1
1 822 . 5 1 1 A 96 96 ASP C C 83 175.224 178.128 -2.904 1
1 823 . 5 1 1 A 96 96 ASP CA C 83 57.310 57.808 -0.498 1
1 824 . 5 1 1 A 96 96 ASP CB C 83 40.321 41.932 -1.611 1
1 825 . 5 1 1 A 96 96 ASP N N 83 119.082 120.701 -1.619 1
1 826 . 5 1 1 A 97 97 SER H H 84 7.989 7.689 0.300 1
1 827 . 5 1 1 A 97 97 SER HA H 84 4.250 4.160 0.090 1
1 830 . 5 1 1 A 97 97 SER C C 84 175.346 175.520 -0.174 1
1 831 . 5 1 1 A 97 97 SER CA C 84 60.948 60.877 0.071 1
1 832 . 5 1 1 A 97 97 SER CB C 84 63.370 63.099 0.271 1
1 833 . 5 1 1 A 97 97 SER N N 84 117.579 113.500 4.079 1
1 834 . 5 1 1 A 98 98 ILE H H 85 6.862 7.383 -0.521 1
1 835 . 5 1 1 A 98 98 ILE HA H 85 4.550 4.097 0.453 1
1 843 . 5 1 1 A 98 98 ILE C C 85 173.308 175.292 -1.984 1
1 844 . 5 1 1 A 98 98 ILE CA C 85 60.948 60.750 0.198 1
1 845 . 5 1 1 A 98 98 ILE CB C 85 37.760 37.646 0.114 1
1 848 . 5 1 1 A 98 98 ILE N N 85 113.733 117.869 -4.136 1
1 849 . 5 1 1 A 99 99 GLU H H 86 7.705 7.696 0.009 1
1 850 . 5 1 1 A 99 99 GLU HA H 86 4.280 3.868 0.412 1
1 853 . 5 1 1 A 99 99 GLU C C 86 175.224 174.738 0.486 1
1 854 . 5 1 1 A 99 99 GLU CA C 86 56.260 57.640 -1.380 1
1 855 . 5 1 1 A 99 99 GLU CB C 86 26.258 28.824 -2.566 1
1 857 . 5 1 1 A 99 99 GLU N N 86 115.493 120.801 -5.308 1
1 858 . 5 1 1 A 100 100 LEU H H 87 7.989 7.258 0.731 1
1 859 . 5 1 1 A 100 100 LEU HA H 87 4.220 4.628 -0.408 1
1 868 . 5 1 1 A 100 100 LEU C C 87 176.965 175.872 1.093 1
1 869 . 5 1 1 A 100 100 LEU CA C 87 52.510 53.233 -0.723 1
1 870 . 5 1 1 A 100 100 LEU CB C 87 42.196 44.918 -2.722 1
1 873 . 5 1 1 A 100 100 LEU N N 87 117.579 119.967 -2.388 1
1 874 . 5 1 1 A 101 101 GLY H H 88 8.503 8.097 0.406 1
1 875 . 5 1 1 A 101 101 GLY CA C 88 46.884 45.888 0.996 1
1 876 . 5 1 1 A 101 101 GLY N N 88 107.794 114.177 -6.383 1
1 877 . 5 1 1 A 102 102 ASP HA H 89 4.431 4.253 0.178 1
1 880 . 5 1 1 A 102 102 ASP C C 89 178.075 178.041 0.034 1
1 881 . 5 1 1 A 102 102 ASP CA C 89 57.198 57.168 0.030 1
1 882 . 5 1 1 A 102 102 ASP CB C 89 40.321 41.211 -0.890 1
1 883 . 5 1 1 A 103 103 TYR H H 90 7.899 8.044 -0.145 1
1 884 . 5 1 1 A 103 103 TYR HA H 90 4.940 4.423 0.517 1
1 889 . 5 1 1 A 103 103 TYR C C 90 175.527 178.389 -2.862 1
1 890 . 5 1 1 A 103 103 TYR CA C 90 58.135 60.417 -2.282 1
1 891 . 5 1 1 A 103 103 TYR CB C 90 38.446 37.543 0.903 1
1 894 . 5 1 1 A 103 103 TYR N N 90 115.595 119.756 -4.161 1
1 895 . 5 1 1 A 104 104 THR H H 91 7.971 8.329 -0.358 1
1 896 . 5 1 1 A 104 104 THR HA H 91 4.234 3.907 0.327 1
1 901 . 5 1 1 A 104 104 THR C C 91 175.905 176.421 -0.516 1
1 902 . 5 1 1 A 104 104 THR CA C 91 68.449 67.195 1.254 1
1 904 . 5 1 1 A 104 104 THR N N 91 118.867 116.657 2.210 1
1 905 . 5 1 1 A 105 105 LYS H H 92 8.555 7.988 0.567 1
1 906 . 5 1 1 A 105 105 LYS HA H 92 3.940 4.019 -0.079 1
1 912 . 5 1 1 A 105 105 LYS C C 92 177.310 178.510 -1.200 1
1 913 . 5 1 1 A 105 105 LYS CA C 92 60.948 59.481 1.467 1
1 914 . 5 1 1 A 105 105 LYS CB C 92 31.883 32.381 -0.498 1
1 917 . 5 1 1 A 105 105 LYS N N 92 119.259 121.605 -2.346 1
1 918 . 5 1 1 A 106 106 ALA H H 93 7.920 8.097 -0.177 1
1 919 . 5 1 1 A 106 106 ALA HA H 93 4.128 4.158 -0.030 1
1 923 . 5 1 1 A 106 106 ALA C C 93 180.972 180.504 0.468 1
1 924 . 5 1 1 A 106 106 ALA CA C 93 55.070 55.140 -0.070 1
1 925 . 5 1 1 A 106 106 ALA CB C 93 17.750 18.891 -1.141 1
1 926 . 5 1 1 A 106 106 ALA N N 93 120.398 122.310 -1.912 1
1 927 . 5 1 1 A 107 107 PHE H H 94 8.136 8.593 -0.457 1
1 928 . 5 1 1 A 107 107 PHE HA H 94 4.190 4.532 -0.342 1
1 934 . 5 1 1 A 107 107 PHE C C 94 177.955 178.345 -0.390 1
1 935 . 5 1 1 A 107 107 PHE CA C 94 63.761 61.555 2.206 1
1 936 . 5 1 1 A 107 107 PHE CB C 94 38.446 39.085 -0.639 1
1 940 . 5 1 1 A 107 107 PHE N N 94 117.119 116.124 0.995 1
1 941 . 5 1 1 A 108 108 LEU H H 95 8.351 8.676 -0.325 1
1 942 . 5 1 1 A 108 108 LEU HA H 95 3.889 3.997 -0.108 1
1 951 . 5 1 1 A 108 108 LEU C C 95 182.043 179.369 2.674 1
1 952 . 5 1 1 A 108 108 LEU CA C 95 59.073 58.556 0.517 1
1 953 . 5 1 1 A 108 108 LEU CB C 95 41.259 42.247 -0.988 1
1 956 . 5 1 1 A 108 108 LEU N N 95 118.450 119.765 -1.315 1
1 957 . 5 1 1 A 109 109 ILE H H 96 8.992 8.073 0.919 1
1 958 . 5 1 1 A 109 109 ILE HA H 96 4.069 3.875 0.194 1
1 968 . 5 1 1 A 109 109 ILE C C 96 177.094 177.418 -0.324 1
1 969 . 5 1 1 A 109 109 ILE CA C 96 63.761 64.058 -0.297 1
1 970 . 5 1 1 A 109 109 ILE CB C 96 37.509 37.597 -0.088 1
1 974 . 5 1 1 A 109 109 ILE N N 96 118.177 115.287 2.890 1
1 975 . 5 1 1 A 110 110 ASN H H 97 7.067 8.169 -1.102 1
1 976 . 5 1 1 A 110 110 ASN HA H 97 4.797 4.776 0.021 1
1 981 . 5 1 1 A 110 110 ASN C C 97 173.595 175.826 -2.231 1
1 982 . 5 1 1 A 110 110 ASN CA C 97 54.385 53.232 1.153 1
1 983 . 5 1 1 A 110 110 ASN CB C 97 40.321 39.201 1.120 1
1 984 . 5 1 1 A 110 110 ASN N N 97 116.407 118.833 -2.426 1
1 986 . 5 1 1 A 111 111 GLY H H 98 7.681 8.126 -0.445 1
1 987 . 5 1 1 A 111 111 GLY HA2 H 98 4.080 3.906 0.174 1
1 988 . 5 1 1 A 111 111 GLY HA3 H 98 3.640 3.980 -0.340 1
1 989 . 5 1 1 A 111 111 GLY C C 98 174.552 174.519 0.033 1
1 990 . 5 1 1 A 111 111 GLY CA C 98 45.947 45.829 0.118 1
1 991 . 5 1 1 A 111 111 GLY N N 98 104.440 107.126 -2.686 1
1 992 . 5 1 1 A 112 112 TYR H H 99 8.427 8.344 0.083 1
1 993 . 5 1 1 A 112 112 TYR HA H 99 4.661 4.729 -0.068 1
1 998 . 5 1 1 A 112 112 TYR C C 99 174.425 176.570 -2.145 1
1 999 . 5 1 1 A 112 112 TYR CA C 99 57.198 58.041 -0.843 1
1 1000 . 5 1 1 A 112 112 TYR CB C 99 36.571 37.971 -1.400 1
1 1003 . 5 1 1 A 112 112 TYR N N 99 122.830 119.516 3.314 1
1 1004 . 5 1 1 A 113 113 THR H H 100 7.166 8.185 -1.019 1
1 1005 . 5 1 1 A 113 113 THR HA H 100 4.248 4.073 0.175 1
1 1009 . 5 1 1 A 113 113 THR C C 100 174.897 175.399 -0.502 1
1 1010 . 5 1 1 A 113 113 THR CA C 100 62.290 65.632 -3.342 1
1 1011 . 5 1 1 A 113 113 THR CB C 100 68.970 68.150 0.820 1
1 1013 . 5 1 1 A 113 113 THR N N 100 104.304 113.818 -9.514 1
1 1014 . 5 1 1 A 114 114 SER H H 101 7.695 7.886 -0.191 1
1 1015 . 5 1 1 A 114 114 SER C C 101 174.372 173.918 0.454 1
1 1016 . 5 1 1 A 114 114 SER CA C 101 56.260 59.052 -2.792 1
1 1017 . 5 1 1 A 114 114 SER CB C 101 65.636 63.790 1.846 1
1 1018 . 5 1 1 A 114 114 SER N N 101 115.613 117.110 -1.497 1
1 1023 . 5 1 1 A 116 116 ASP HA H 103 4.260 4.429 -0.169 1
1 1026 . 5 1 1 A 116 116 ASP CA C 103 57.198 57.571 -0.373 1
1 1027 . 5 1 1 A 116 116 ASP CB C 103 40.321 40.660 -0.339 1
1 1028 . 5 1 1 A 117 117 LEU H H 104 7.345 7.869 -0.524 1
1 1029 . 5 1 1 A 117 117 LEU HA H 104 4.290 3.983 0.307 1
1 1038 . 5 1 1 A 117 117 LEU C C 104 178.488 178.582 -0.094 1
1 1039 . 5 1 1 A 117 117 LEU CA C 104 56.260 57.729 -1.469 1
1 1040 . 5 1 1 A 117 117 LEU CB C 104 42.196 41.304 0.892 1
1 1043 . 5 1 1 A 117 117 LEU N N 104 117.878 117.472 0.406 1
1 1044 . 5 1 1 A 118 118 LEU H H 105 7.514 7.884 -0.370 1
1 1045 . 5 1 1 A 118 118 LEU HA H 105 4.210 4.231 -0.021 1
1 1054 . 5 1 1 A 118 118 LEU C C 105 177.002 177.446 -0.444 1
1 1055 . 5 1 1 A 118 118 LEU CA C 105 55.323 56.992 -1.669 1
1 1056 . 5 1 1 A 118 118 LEU CB C 105 42.196 41.592 0.604 1
1 1059 . 5 1 1 A 118 118 LEU N N 105 119.094 119.026 0.068 1
1 1060 . 5 1 1 A 120 120 LYS HA H 107 4.340 4.388 -0.048 1
1 1063 . 5 1 1 A 120 120 LYS C C 107 176.603 176.248 0.355 1
1 1064 . 5 1 1 A 120 120 LYS CA C 107 55.323 56.428 -1.105 1
1 1065 . 5 1 1 A 120 120 LYS CB C 107 31.883 34.695 -2.812 1
1 1068 . 5 1 1 A 121 121 ILE H H 108 7.539 7.455 0.084 1
1 1069 . 5 1 1 A 121 121 ILE HA H 108 3.987 4.350 -0.363 1
1 1079 . 5 1 1 A 121 121 ILE C C 108 173.247 175.947 -2.700 1
1 1080 . 5 1 1 A 121 121 ILE CA C 108 62.823 60.184 2.639 1
1 1081 . 5 1 1 A 121 121 ILE CB C 108 38.446 39.431 -0.985 1
1 1085 . 5 1 1 A 121 121 ILE N N 108 122.417 115.993 6.424 1
1 1086 . 5 1 1 A 122 122 ALA H H 109 8.290 8.346 -0.056 1
1 1087 . 5 1 1 A 122 122 ALA HA H 109 3.970 4.725 -0.755 1
1 1091 . 5 1 1 A 122 122 ALA C C 109 178.318 177.868 0.450 1
1 1092 . 5 1 1 A 122 122 ALA CA C 109 50.150 49.785 0.365 1
1 1093 . 5 1 1 A 122 122 ALA CB C 109 21.630 21.293 0.337 1
1 1094 . 5 1 1 A 122 122 ALA N N 109 127.784 125.466 2.318 1
1 1095 . 5 1 1 A 123 123 GLU HA H 110 3.707 3.987 -0.280 1
1 1099 . 5 1 1 A 123 123 GLU C C 110 178.290 178.824 -0.534 1
1 1100 . 5 1 1 A 123 123 GLU CA C 110 60.948 60.048 0.900 1
1 1101 . 5 1 1 A 123 123 GLU CB C 110 29.070 29.558 -0.488 1
1 1102 . 5 1 1 A 124 124 VAL H H 111 8.333 8.246 0.087 1
1 1103 . 5 1 1 A 124 124 VAL HA H 111 3.850 3.754 0.096 1
1 1111 . 5 1 1 A 124 124 VAL C C 111 177.406 177.580 -0.174 1
1 1112 . 5 1 1 A 124 124 VAL CA C 111 65.636 65.003 0.633 1
1 1113 . 5 1 1 A 124 124 VAL CB C 111 30.730 31.199 -0.469 1
1 1116 . 5 1 1 A 124 124 VAL N N 111 114.438 120.065 -5.627 1
1 1117 . 5 1 1 A 125 125 GLU H H 112 7.442 8.435 -0.993 1
1 1118 . 5 1 1 A 125 125 GLU HA H 112 4.152 4.098 0.054 1
1 1123 . 5 1 1 A 125 125 GLU C C 112 179.982 179.257 0.725 1
1 1124 . 5 1 1 A 125 125 GLU CA C 112 60.010 59.548 0.462 1
1 1125 . 5 1 1 A 125 125 GLU CB C 112 30.008 29.183 0.825 1
1 1127 . 5 1 1 A 125 125 GLU N N 112 121.032 121.794 -0.762 1
1 1128 . 5 1 1 A 126 126 LEU H H 113 7.666 7.911 -0.245 1
1 1129 . 5 1 1 A 126 126 LEU HA H 113 3.846 4.072 -0.226 1
1 1138 . 5 1 1 A 126 126 LEU C C 113 176.991 178.943 -1.952 1
1 1139 . 5 1 1 A 126 126 LEU CA C 113 58.135 57.951 0.184 1
1 1140 . 5 1 1 A 126 126 LEU CB C 113 41.259 41.828 -0.569 1
1 1143 . 5 1 1 A 126 126 LEU N N 113 118.731 121.357 -2.626 1
1 1144 . 5 1 1 A 127 127 ILE H H 114 7.781 8.003 -0.222 1
1 1145 . 5 1 1 A 127 127 ILE HA H 114 3.502 3.883 -0.381 1
1 1153 . 5 1 1 A 127 127 ILE C C 114 178.195 176.883 1.312 1
1 1154 . 5 1 1 A 127 127 ILE CA C 114 65.636 63.364 2.272 1
1 1155 . 5 1 1 A 127 127 ILE CB C 114 40.321 37.665 2.656 1
1 1159 . 5 1 1 A 127 127 ILE N N 114 115.084 119.098 -4.014 1
1 1160 . 5 1 1 A 128 128 ASN H H 115 8.470 7.991 0.479 1
1 1161 . 5 1 1 A 128 128 ASN HA H 115 4.502 4.717 -0.215 1
1 1166 . 5 1 1 A 128 128 ASN C C 115 176.295 175.953 0.342 1
1 1167 . 5 1 1 A 128 128 ASN CA C 115 56.260 54.480 1.780 1
1 1168 . 5 1 1 A 128 128 ASN CB C 115 39.384 39.440 -0.056 1
1 1169 . 5 1 1 A 128 128 ASN N N 115 115.158 118.915 -3.757 1
1 1171 . 5 1 1 A 129 129 VAL H H 116 8.116 7.775 0.341 1
1 1172 . 5 1 1 A 129 129 VAL HA H 116 4.090 3.981 0.109 1
1 1180 . 5 1 1 A 129 129 VAL C C 116 176.740 177.766 -1.026 1
1 1181 . 5 1 1 A 129 129 VAL CA C 116 64.400 64.651 -0.251 1
1 1182 . 5 1 1 A 129 129 VAL CB C 116 32.050 32.338 -0.288 1
1 1185 . 5 1 1 A 129 129 VAL N N 116 118.698 117.885 0.813 1
1 1186 . 5 1 1 A 130 130 LEU H H 117 7.294 7.941 -0.647 1
1 1187 . 5 1 1 A 130 130 LEU HA H 117 3.970 4.201 -0.231 1
1 1196 . 5 1 1 A 130 130 LEU C C 117 175.127 176.186 -1.059 1
1 1197 . 5 1 1 A 130 130 LEU CA C 117 56.260 55.003 1.257 1
1 1198 . 5 1 1 A 130 130 LEU CB C 117 41.259 42.200 -0.941 1
1 1201 . 5 1 1 A 130 130 LEU N N 117 116.201 119.115 -2.914 1
1 1202 . 5 1 1 A 131 131 LYS H H 118 6.594 7.561 -0.967 1
1 1203 . 5 1 1 A 131 131 LYS HA H 118 3.980 4.238 -0.258 1
1 1208 . 5 1 1 A 131 131 LYS C C 118 175.589 175.586 0.003 1
1 1209 . 5 1 1 A 131 131 LYS CA C 118 56.260 57.370 -1.110 1
1 1210 . 5 1 1 A 131 131 LYS CB C 118 28.133 28.998 -0.865 1
1 1212 . 5 1 1 A 131 131 LYS N N 118 111.172 115.618 -4.446 1
1 1213 . 5 1 1 A 132 132 ILE H H 119 8.245 7.972 0.273 1
1 1214 . 5 1 1 A 132 132 ILE HA H 119 4.090 4.358 -0.268 1
1 1224 . 5 1 1 A 132 132 ILE C C 119 175.161 175.678 -0.517 1
1 1225 . 5 1 1 A 132 132 ILE CA C 119 60.010 61.628 -1.618 1
1 1226 . 5 1 1 A 132 132 ILE CB C 119 35.633 36.439 -0.806 1
1 1230 . 5 1 1 A 132 132 ILE N N 119 119.484 120.348 -0.864 1
1 1231 . 5 1 1 A 133 133 ASN H H 120 8.054 8.116 -0.062 1
1 1232 . 5 1 1 A 133 133 ASN HA H 120 4.350 4.932 -0.582 1
1 1235 . 5 1 1 A 133 133 ASN C C 120 175.136 175.412 -0.276 1
1 1236 . 5 1 1 A 133 133 ASN CA C 120 54.385 54.186 0.199 1
1 1237 . 5 1 1 A 133 133 ASN CB C 120 39.384 39.777 -0.393 1
1 1238 . 5 1 1 A 133 133 ASN N N 120 124.670 125.912 -1.242 1
1 1239 . 5 1 1 A 134 134 LEU H H 121 7.517 7.249 0.268 1
1 1240 . 5 1 1 A 134 134 LEU HA H 121 4.678 4.037 0.641 1
1 1249 . 5 1 1 A 134 134 LEU C C 121 178.051 177.311 0.740 1
1 1250 . 5 1 1 A 134 134 LEU CA C 121 53.447 55.968 -2.521 1
1 1251 . 5 1 1 A 134 134 LEU CB C 121 41.259 42.862 -1.603 1
1 1254 . 5 1 1 A 134 134 LEU N N 121 119.918 119.590 0.328 1
1 1255 . 5 1 1 A 135 135 ILE H H 122 9.389 8.344 1.045 1
1 1256 . 5 1 1 A 135 135 ILE HA H 122 3.540 3.627 -0.087 1
1 1266 . 5 1 1 A 135 135 ILE C C 122 176.425 177.424 -0.999 1
1 1267 . 5 1 1 A 135 135 ILE CA C 122 65.636 65.061 0.575 1
1 1268 . 5 1 1 A 135 135 ILE CB C 122 38.446 37.913 0.533 1
1 1272 . 5 1 1 A 135 135 ILE N N 122 129.949 126.365 3.584 1
1 1273 . 5 1 1 A 136 136 GLY H H 123 8.675 8.258 0.417 1
1 1274 . 5 1 1 A 136 136 GLY HA2 H 123 2.650 3.191 -0.541 1
1 1275 . 5 1 1 A 136 136 GLY HA3 H 123 2.060 3.511 -1.451 1
1 1276 . 5 1 1 A 136 136 GLY C C 123 176.854 176.505 0.349 1
1 1277 . 5 1 1 A 136 136 GLY CA C 123 45.500 47.100 -1.600 1
1 1278 . 5 1 1 A 136 136 GLY N N 123 106.314 107.568 -1.254 1
1 1279 . 5 1 1 A 137 137 HIS H H 124 6.869 7.798 -0.929 1
1 1280 . 5 1 1 A 137 137 HIS HA H 124 4.558 4.545 0.013 1
1 1285 . 5 1 1 A 137 137 HIS C C 124 176.977 177.255 -0.278 1
1 1286 . 5 1 1 A 137 137 HIS CA C 124 57.198 58.364 -1.166 1
1 1287 . 5 1 1 A 137 137 HIS CB C 124 30.945 29.532 1.413 1
1 1290 . 5 1 1 A 137 137 HIS N N 124 118.865 120.121 -1.256 1
1 1291 . 5 1 1 A 138 138 ARG H H 125 7.730 8.475 -0.745 1
1 1292 . 5 1 1 A 138 138 ARG HA H 125 3.770 3.867 -0.097 1
1 1299 . 5 1 1 A 138 138 ARG C C 125 178.288 178.399 -0.111 1
1 1300 . 5 1 1 A 138 138 ARG CA C 125 61.886 59.432 2.454 1
1 1301 . 5 1 1 A 138 138 ARG CB C 125 30.945 29.888 1.057 1
1 1304 . 5 1 1 A 138 138 ARG N N 125 118.149 119.206 -1.057 1
1 1306 . 5 1 1 A 139 139 LYS H H 126 8.679 8.209 0.470 1
1 1307 . 5 1 1 A 139 139 LYS HA H 126 3.990 3.973 0.017 1
1 1310 . 5 1 1 A 139 139 LYS C C 126 179.184 178.471 0.713 1
1 1311 . 5 1 1 A 139 139 LYS CA C 126 58.135 59.391 -1.256 1
1 1312 . 5 1 1 A 139 139 LYS CB C 126 30.945 32.202 -1.257 1
1 1314 . 5 1 1 A 139 139 LYS N N 126 114.003 119.009 -5.006 1
1 1315 . 5 1 1 A 140 140 ARG H H 127 7.248 8.012 -0.764 1
1 1316 . 5 1 1 A 140 140 ARG HA H 127 3.870 3.947 -0.077 1
1 1324 . 5 1 1 A 140 140 ARG C C 127 177.772 178.963 -1.191 1
1 1325 . 5 1 1 A 140 140 ARG CA C 127 60.010 59.473 0.537 1
1 1326 . 5 1 1 A 140 140 ARG CB C 127 30.945 29.959 0.986 1
1 1329 . 5 1 1 A 140 140 ARG N N 127 120.072 117.925 2.147 1
1 1331 . 5 1 1 A 141 141 ILE H H 128 7.706 8.133 -0.427 1
1 1332 . 5 1 1 A 141 141 ILE HA H 128 3.530 3.667 -0.137 1
1 1340 . 5 1 1 A 141 141 ILE C C 128 177.669 177.997 -0.328 1
1 1341 . 5 1 1 A 141 141 ILE CA C 128 65.636 65.657 -0.021 1
1 1342 . 5 1 1 A 141 141 ILE CB C 128 38.680 37.696 0.984 1
1 1345 . 5 1 1 A 141 141 ILE N N 128 118.730 120.712 -1.982 1
1 1346 . 5 1 1 A 142 142 LEU H H 129 8.194 8.360 -0.166 1
1 1347 . 5 1 1 A 142 142 LEU HA H 129 3.950 3.989 -0.039 1
1 1356 . 5 1 1 A 142 142 LEU C C 129 179.960 178.399 1.561 1
1 1357 . 5 1 1 A 142 142 LEU CA C 129 58.135 58.004 0.131 1
1 1358 . 5 1 1 A 142 142 LEU CB C 129 41.259 41.265 -0.006 1
1 1361 . 5 1 1 A 142 142 LEU N N 129 117.675 121.058 -3.383 1
1 1362 . 5 1 1 A 143 143 ALA H H 130 8.294 8.254 0.040 1
1 1363 . 5 1 1 A 143 143 ALA HA H 130 4.220 4.191 0.029 1
1 1367 . 5 1 1 A 143 143 ALA C C 130 179.899 179.740 0.159 1
1 1368 . 5 1 1 A 143 143 ALA CA C 130 54.385 55.065 -0.680 1
1 1369 . 5 1 1 A 143 143 ALA CB C 130 19.270 18.305 0.965 1
1 1370 . 5 1 1 A 143 143 ALA N N 130 121.096 121.236 -0.140 1
1 1371 . 5 1 1 A 144 144 SER H H 131 7.813 7.958 -0.145 1
1 1372 . 5 1 1 A 144 144 SER HA H 131 4.180 4.294 -0.114 1
1 1375 . 5 1 1 A 144 144 SER C C 131 175.457 176.123 -0.666 1
1 1376 . 5 1 1 A 144 144 SER CA C 131 60.948 61.369 -0.421 1
1 1377 . 5 1 1 A 144 144 SER CB C 131 63.761 63.437 0.324 1
1 1378 . 5 1 1 A 144 144 SER N N 131 112.102 114.018 -1.916 1
1 1379 . 5 1 1 A 145 145 LEU H H 132 7.747 8.009 -0.262 1
1 1380 . 5 1 1 A 145 145 LEU HA H 132 4.140 4.361 -0.221 1
1 1389 . 5 1 1 A 145 145 LEU C C 132 178.589 177.001 1.588 1
1 1390 . 5 1 1 A 145 145 LEU CA C 132 56.260 55.977 0.283 1
1 1391 . 5 1 1 A 145 145 LEU CB C 132 42.196 42.776 -0.580 1
1 1394 . 5 1 1 A 145 145 LEU N N 132 117.536 118.890 -1.354 1
1 1395 . 5 1 1 A 146 146 GLY H H 133 7.544 7.478 0.066 1
1 1396 . 5 1 1 A 146 146 GLY HA2 H 133 3.950 4.118 -0.168 1
1 1397 . 5 1 1 A 146 146 GLY HA3 H 133 3.100 4.127 -1.027 1
1 1398 . 5 1 1 A 146 146 GLY C C 133 173.372 173.978 -0.606 1
1 1399 . 5 1 1 A 146 146 GLY CA C 133 45.947 45.313 0.634 1
1 1400 . 5 1 1 A 146 146 GLY N N 133 105.351 105.797 -0.446 1
1 1401 . 5 1 1 A 147 147 ASP H H 134 8.342 8.931 -0.589 1
1 1402 . 5 1 1 A 147 147 ASP HA H 134 4.650 4.616 0.034 1
1 1405 . 5 1 1 A 147 147 ASP C C 134 175.462 175.984 -0.522 1
1 1406 . 5 1 1 A 147 147 ASP CA C 134 54.385 55.384 -0.999 1
1 1407 . 5 1 1 A 147 147 ASP CB C 134 41.259 41.856 -0.597 1
1 1408 . 5 1 1 A 147 147 ASP N N 134 120.133 121.885 -1.752 1
1 14 . 6 1 1 A 15 15 GLN H H 2 8.439 8.496 -0.057 1
1 15 . 6 1 1 A 15 15 GLN HA H 2 4.594 4.810 -0.216 1
1 20 . 6 1 1 A 15 15 GLN C C 2 175.972 174.337 1.635 1
1 21 . 6 1 1 A 15 15 GLN CA C 2 56.260 54.361 1.899 1
1 22 . 6 1 1 A 15 15 GLN CB C 2 30.945 33.001 -2.056 1
1 24 . 6 1 1 A 15 15 GLN N N 2 124.997 120.009 4.988 1
1 25 . 6 1 1 A 16 16 THR H H 3 8.347 8.470 -0.123 1
1 26 . 6 1 1 A 16 16 THR HA H 3 4.555 4.962 -0.407 1
1 31 . 6 1 1 A 16 16 THR C C 3 175.495 176.079 -0.584 1
1 32 . 6 1 1 A 16 16 THR CA C 3 60.010 60.642 -0.632 1
1 33 . 6 1 1 A 16 16 THR CB C 3 71.261 70.424 0.837 1
1 34 . 6 1 1 A 16 16 THR N N 3 113.011 114.446 -1.435 1
1 35 . 6 1 1 A 17 17 VAL H H 4 8.895 8.657 0.238 1
1 36 . 6 1 1 A 17 17 VAL HA H 4 3.670 3.781 -0.111 1
1 44 . 6 1 1 A 17 17 VAL C C 4 178.449 177.938 0.511 1
1 45 . 6 1 1 A 17 17 VAL CA C 4 67.511 66.456 1.055 1
1 46 . 6 1 1 A 17 17 VAL CB C 4 31.883 31.714 0.169 1
1 49 . 6 1 1 A 17 17 VAL N N 4 121.854 122.962 -1.108 1
1 50 . 6 1 1 A 18 18 GLY H H 5 9.017 8.493 0.524 1
1 51 . 6 1 1 A 18 18 GLY HA2 H 5 3.940 3.818 0.122 1
1 52 . 6 1 1 A 18 18 GLY HA3 H 5 3.610 3.836 -0.226 1
1 53 . 6 1 1 A 18 18 GLY C C 5 176.186 175.549 0.637 1
1 54 . 6 1 1 A 18 18 GLY CA C 5 47.822 47.408 0.414 1
1 55 . 6 1 1 A 18 18 GLY N N 5 106.966 107.509 -0.543 1
1 56 . 6 1 1 A 19 19 GLN H H 6 8.072 8.031 0.041 1
1 57 . 6 1 1 A 19 19 GLN HA H 6 4.037 4.131 -0.094 1
1 62 . 6 1 1 A 19 19 GLN C C 6 179.488 178.179 1.309 1
1 63 . 6 1 1 A 19 19 GLN CA C 6 59.073 58.555 0.518 1
1 64 . 6 1 1 A 19 19 GLN CB C 6 28.489 28.710 -0.221 1
1 66 . 6 1 1 A 19 19 GLN N N 6 122.431 120.846 1.585 1
1 67 . 6 1 1 A 20 20 TRP H H 7 8.756 8.313 0.443 1
1 68 . 6 1 1 A 20 20 TRP HA H 7 4.160 4.398 -0.238 1
1 77 . 6 1 1 A 20 20 TRP C C 7 179.620 177.742 1.878 1
1 78 . 6 1 1 A 20 20 TRP CA C 7 61.886 61.141 0.745 1
1 79 . 6 1 1 A 20 20 TRP CB C 7 28.133 29.728 -1.595 1
1 85 . 6 1 1 A 20 20 TRP N N 7 124.265 122.118 2.147 1
1 87 . 6 1 1 A 21 21 LEU H H 8 9.148 8.604 0.544 1
1 88 . 6 1 1 A 21 21 LEU HA H 8 3.440 3.563 -0.123 1
1 97 . 6 1 1 A 21 21 LEU C C 8 180.521 178.400 2.121 1
1 98 . 6 1 1 A 21 21 LEU CA C 8 56.920 58.428 -1.508 1
1 99 . 6 1 1 A 21 21 LEU CB C 8 41.700 40.790 0.910 1
1 102 . 6 1 1 A 21 21 LEU N N 8 120.548 120.675 -0.127 1
1 103 . 6 1 1 A 22 22 GLU H H 9 8.284 8.376 -0.092 1
1 104 . 6 1 1 A 22 22 GLU HA H 9 3.740 3.984 -0.244 1
1 109 . 6 1 1 A 22 22 GLU C C 9 179.960 178.377 1.583 1
1 110 . 6 1 1 A 22 22 GLU CA C 9 60.010 59.633 0.377 1
1 111 . 6 1 1 A 22 22 GLU CB C 9 29.070 29.095 -0.025 1
1 113 . 6 1 1 A 22 22 GLU N N 9 120.133 119.205 0.928 1
1 114 . 6 1 1 A 23 23 SER H H 10 7.891 7.918 -0.027 1
1 115 . 6 1 1 A 23 23 SER HA H 10 4.250 4.211 0.039 1
1 118 . 6 1 1 A 23 23 SER C C 10 175.346 176.426 -1.080 1
1 119 . 6 1 1 A 23 23 SER CA C 10 60.948 61.281 -0.333 1
1 120 . 6 1 1 A 23 23 SER CB C 10 63.280 63.053 0.227 1
1 121 . 6 1 1 A 23 23 SER N N 10 117.044 114.253 2.791 1
1 122 . 6 1 1 A 24 24 ILE H H 11 6.862 7.673 -0.811 1
1 123 . 6 1 1 A 24 24 ILE HA H 11 4.487 3.888 0.599 1
1 133 . 6 1 1 A 24 24 ILE C C 11 175.812 176.119 -0.307 1
1 134 . 6 1 1 A 24 24 ILE CA C 11 60.948 63.280 -2.332 1
1 135 . 6 1 1 A 24 24 ILE CB C 11 38.250 37.126 1.124 1
1 139 . 6 1 1 A 24 24 ILE N N 11 113.733 118.118 -4.385 1
1 140 . 6 1 1 A 25 25 GLY H H 12 7.628 7.610 0.018 1
1 141 . 6 1 1 A 25 25 GLY HA2 H 12 3.990 4.141 -0.151 1
1 142 . 6 1 1 A 25 25 GLY HA3 H 12 3.800 4.239 -0.439 1
1 143 . 6 1 1 A 25 25 GLY C C 12 173.647 171.883 1.764 1
1 144 . 6 1 1 A 25 25 GLY CA C 12 45.947 46.008 -0.061 1
1 145 . 6 1 1 A 25 25 GLY N N 12 109.763 109.876 -0.113 1
1 146 . 6 1 1 A 26 26 LEU H H 13 7.620 8.202 -0.582 1
1 147 . 6 1 1 A 26 26 LEU C C 13 176.186 174.137 2.049 1
1 148 . 6 1 1 A 26 26 LEU CA C 13 52.700 51.862 0.838 1
1 149 . 6 1 1 A 26 26 LEU CB C 13 43.134 45.805 -2.671 1
1 150 . 6 1 1 A 26 26 LEU N N 13 118.778 122.054 -3.276 1
1 151 . 6 1 1 A 27 27 PRO HA H 14 4.120 4.676 -0.556 1
1 154 . 6 1 1 A 27 27 PRO C C 14 177.955 175.300 2.655 1
1 155 . 6 1 1 A 27 27 PRO CA C 14 64.698 62.221 2.477 1
1 156 . 6 1 1 A 27 27 PRO CB C 14 31.883 29.267 2.616 1
1 158 . 6 1 1 A 28 28 GLN H H 15 9.838 8.504 1.334 1
1 159 . 6 1 1 A 28 28 GLN HA H 15 4.240 4.339 -0.099 1
1 162 . 6 1 1 A 28 28 GLN C C 15 176.836 176.732 0.104 1
1 163 . 6 1 1 A 28 28 GLN CA C 15 58.135 56.304 1.831 1
1 164 . 6 1 1 A 28 28 GLN CB C 15 27.195 31.281 -4.086 1
1 166 . 6 1 1 A 28 28 GLN N N 15 120.414 120.418 -0.004 1
1 167 . 6 1 1 A 29 29 TYR H H 16 6.810 7.869 -1.059 1
1 168 . 6 1 1 A 29 29 TYR HA H 16 5.720 4.652 1.068 1
1 173 . 6 1 1 A 29 29 TYR C C 16 174.814 176.349 -1.535 1
1 174 . 6 1 1 A 29 29 TYR CA C 16 57.198 57.759 -0.561 1
1 175 . 6 1 1 A 29 29 TYR CB C 16 37.509 38.097 -0.588 1
1 178 . 6 1 1 A 29 29 TYR N N 16 119.718 116.911 2.807 1
1 179 . 6 1 1 A 30 30 GLU H H 17 7.509 8.204 -0.695 1
1 180 . 6 1 1 A 30 30 GLU HA H 17 3.650 4.140 -0.490 1
1 184 . 6 1 1 A 30 30 GLU C C 17 177.552 178.842 -1.290 1
1 185 . 6 1 1 A 30 30 GLU CA C 17 60.948 59.605 1.343 1
1 186 . 6 1 1 A 30 30 GLU CB C 17 30.008 29.377 0.631 1
1 188 . 6 1 1 A 30 30 GLU N N 17 122.417 121.475 0.942 1
1 189 . 6 1 1 A 31 31 ASN H H 18 9.259 8.251 1.008 1
1 190 . 6 1 1 A 31 31 ASN HA H 18 4.451 4.462 -0.011 1
1 193 . 6 1 1 A 31 31 ASN C C 18 176.868 177.937 -1.069 1
1 194 . 6 1 1 A 31 31 ASN CA C 18 57.198 56.317 0.881 1
1 195 . 6 1 1 A 31 31 ASN CB C 18 38.446 39.741 -1.295 1
1 196 . 6 1 1 A 31 31 ASN N N 18 116.613 119.119 -2.506 1
1 197 . 6 1 1 A 32 32 HIS H H 19 8.898 8.188 0.710 1
1 198 . 6 1 1 A 32 32 HIS HA H 19 4.140 4.347 -0.207 1
1 202 . 6 1 1 A 32 32 HIS C C 19 178.269 177.759 0.510 1
1 203 . 6 1 1 A 32 32 HIS CA C 19 60.948 58.946 2.002 1
1 204 . 6 1 1 A 32 32 HIS CB C 19 30.008 30.269 -0.261 1
1 206 . 6 1 1 A 32 32 HIS N N 19 118.926 118.660 0.266 1
1 207 . 6 1 1 A 33 33 LEU H H 20 7.825 8.733 -0.908 1
1 208 . 6 1 1 A 33 33 LEU HA H 20 4.305 3.912 0.393 1
1 218 . 6 1 1 A 33 33 LEU C C 20 179.190 179.071 0.119 1
1 219 . 6 1 1 A 33 33 LEU CA C 20 60.010 58.349 1.661 1
1 220 . 6 1 1 A 33 33 LEU CB C 20 40.321 41.953 -1.632 1
1 224 . 6 1 1 A 33 33 LEU N N 20 117.434 119.879 -2.445 1
1 225 . 6 1 1 A 34 34 MET H H 21 8.861 8.469 0.392 1
1 226 . 6 1 1 A 34 34 MET HA H 21 3.980 4.096 -0.116 1
1 234 . 6 1 1 A 34 34 MET C C 21 180.340 177.962 2.378 1
1 235 . 6 1 1 A 34 34 MET CA C 21 58.135 59.048 -0.913 1
1 236 . 6 1 1 A 34 34 MET CB C 21 30.945 32.119 -1.174 1
1 238 . 6 1 1 A 34 34 MET N N 21 118.111 118.598 -0.487 1
1 239 . 6 1 1 A 35 35 ALA H H 22 9.015 8.375 0.640 1
1 240 . 6 1 1 A 35 35 ALA HA H 22 4.239 4.129 0.110 1
1 244 . 6 1 1 A 35 35 ALA C C 22 178.058 178.793 -0.735 1
1 245 . 6 1 1 A 35 35 ALA CA C 22 53.800 54.620 -0.820 1
1 246 . 6 1 1 A 35 35 ALA CB C 22 18.397 18.108 0.289 1
1 247 . 6 1 1 A 35 35 ALA N N 22 120.068 121.633 -1.565 1
1 248 . 6 1 1 A 36 36 ASN H H 23 7.143 7.959 -0.816 1
1 249 . 6 1 1 A 36 36 ASN HA H 23 4.959 4.782 0.177 1
1 254 . 6 1 1 A 36 36 ASN C C 23 174.083 175.658 -1.575 1
1 255 . 6 1 1 A 36 36 ASN CA C 23 54.000 53.069 0.931 1
1 256 . 6 1 1 A 36 36 ASN CB C 23 41.300 39.138 2.162 1
1 257 . 6 1 1 A 36 36 ASN N N 23 111.560 115.126 -3.566 1
1 259 . 6 1 1 A 37 37 GLY H H 24 7.797 8.287 -0.490 1
1 260 . 6 1 1 A 37 37 GLY HA2 H 24 3.430 3.870 -0.440 1
1 261 . 6 1 1 A 37 37 GLY HA3 H 24 3.290 3.927 -0.637 1
1 262 . 6 1 1 A 37 37 GLY C C 24 173.163 174.927 -1.764 1
1 263 . 6 1 1 A 37 37 GLY CA C 24 45.947 45.243 0.704 1
1 264 . 6 1 1 A 37 37 GLY N N 24 106.170 107.689 -1.519 1
1 265 . 6 1 1 A 38 38 PHE H H 25 8.191 8.029 0.162 1
1 266 . 6 1 1 A 38 38 PHE HA H 25 4.910 4.776 0.134 1
1 271 . 6 1 1 A 38 38 PHE C C 25 173.496 175.825 -2.329 1
1 272 . 6 1 1 A 38 38 PHE CA C 25 56.550 56.434 0.116 1
1 273 . 6 1 1 A 38 38 PHE CB C 25 37.220 37.093 0.127 1
1 276 . 6 1 1 A 38 38 PHE N N 25 122.454 119.732 2.722 1
1 277 . 6 1 1 A 39 39 ASP H H 26 6.756 8.379 -1.623 1
1 278 . 6 1 1 A 39 39 ASP HA H 26 5.077 4.885 0.192 1
1 281 . 6 1 1 A 39 39 ASP C C 26 177.463 175.644 1.819 1
1 282 . 6 1 1 A 39 39 ASP CA C 26 53.447 54.346 -0.899 1
1 283 . 6 1 1 A 39 39 ASP CB C 26 42.580 41.989 0.591 1
1 284 . 6 1 1 A 39 39 ASP N N 26 111.309 120.933 -9.624 1
1 285 . 6 1 1 A 40 40 ASN H H 27 7.495 7.825 -0.330 1
1 286 . 6 1 1 A 40 40 ASN HA H 27 4.820 5.051 -0.231 1
1 289 . 6 1 1 A 40 40 ASN C C 27 176.228 175.612 0.616 1
1 290 . 6 1 1 A 40 40 ASN CA C 27 52.510 51.862 0.648 1
1 291 . 6 1 1 A 40 40 ASN CB C 27 40.321 41.004 -0.683 1
1 292 . 6 1 1 A 40 40 ASN N N 27 118.385 117.929 0.456 1
1 293 . 6 1 1 A 41 41 VAL H H 28 9.192 8.637 0.555 1
1 294 . 6 1 1 A 41 41 VAL HA H 28 3.550 3.666 -0.116 1
1 302 . 6 1 1 A 41 41 VAL C C 28 176.429 177.508 -1.079 1
1 303 . 6 1 1 A 41 41 VAL CA C 28 65.636 65.846 -0.210 1
1 304 . 6 1 1 A 41 41 VAL CB C 28 31.883 31.711 0.172 1
1 307 . 6 1 1 A 41 41 VAL N N 28 125.741 125.743 -0.002 1
1 308 . 6 1 1 A 42 42 GLN H H 29 8.203 8.171 0.032 1
1 309 . 6 1 1 A 42 42 GLN HA H 29 4.129 4.029 0.100 1
1 314 . 6 1 1 A 42 42 GLN C C 29 176.591 178.630 -2.039 1
1 315 . 6 1 1 A 42 42 GLN CA C 29 57.198 59.025 -1.827 1
1 316 . 6 1 1 A 42 42 GLN CB C 29 28.133 28.057 0.076 1
1 318 . 6 1 1 A 42 42 GLN N N 29 116.452 118.931 -2.479 1
1 319 . 6 1 1 A 43 43 ALA H H 30 7.781 8.433 -0.652 1
1 320 . 6 1 1 A 43 43 ALA HA H 30 4.650 4.050 0.600 1
1 324 . 6 1 1 A 43 43 ALA C C 30 175.976 177.916 -1.940 1
1 325 . 6 1 1 A 43 43 ALA CA C 30 50.840 54.531 -3.691 1
1 326 . 6 1 1 A 43 43 ALA CB C 30 19.150 18.244 0.906 1
1 327 . 6 1 1 A 43 43 ALA N N 30 122.150 120.627 1.523 1
1 328 . 6 1 1 A 44 44 MET H H 31 7.739 8.118 -0.379 1
1 332 . 6 1 1 A 44 44 MET C C 31 178.275 177.440 0.835 1
1 333 . 6 1 1 A 44 44 MET CA C 31 55.323 54.055 1.268 1
1 334 . 6 1 1 A 44 44 MET CB C 31 34.696 31.852 2.844 1
1 336 . 6 1 1 A 44 44 MET N N 31 118.149 113.680 4.469 1
1 337 . 6 1 1 A 45 45 GLY H H 32 7.611 8.565 -0.954 1
1 338 . 6 1 1 A 45 45 GLY N N 32 101.530 109.947 -8.417 1
1 339 . 6 1 1 A 47 47 ASN HA H 34 4.480 5.071 -0.591 1
1 342 . 6 1 1 A 47 47 ASN CA C 34 56.260 51.648 4.612 1
1 343 . 6 1 1 A 47 47 ASN CB C 34 39.384 39.105 0.279 1
1 344 . 6 1 1 A 49 49 MET HA H 36 4.646 4.407 0.239 1
1 350 . 6 1 1 A 49 49 MET C C 36 173.651 175.878 -2.227 1
1 351 . 6 1 1 A 49 49 MET CA C 36 55.323 56.249 -0.926 1
1 352 . 6 1 1 A 49 49 MET CB C 36 35.633 33.376 2.257 1
1 355 . 6 1 1 A 50 50 GLU H H 37 9.203 8.318 0.885 1
1 356 . 6 1 1 A 50 50 GLU HA H 37 4.650 4.670 -0.020 1
1 361 . 6 1 1 A 50 50 GLU C C 37 177.008 176.892 0.116 1
1 362 . 6 1 1 A 50 50 GLU CA C 37 54.385 54.503 -0.118 1
1 363 . 6 1 1 A 50 50 GLU CB C 37 33.758 32.374 1.384 1
1 365 . 6 1 1 A 50 50 GLU N N 37 123.229 123.682 -0.453 1
1 366 . 6 1 1 A 51 51 ASP H H 38 9.032 8.934 0.098 1
1 367 . 6 1 1 A 51 51 ASP HA H 38 4.149 4.349 -0.200 1
1 370 . 6 1 1 A 51 51 ASP C C 38 177.994 178.183 -0.189 1
1 371 . 6 1 1 A 51 51 ASP CA C 38 59.073 57.132 1.941 1
1 372 . 6 1 1 A 51 51 ASP CB C 38 43.134 39.840 3.294 1
1 373 . 6 1 1 A 51 51 ASP N N 38 122.717 122.063 0.654 1
1 374 . 6 1 1 A 52 52 GLN H H 39 8.950 8.220 0.730 1
1 375 . 6 1 1 A 52 52 GLN HA H 39 3.940 3.940 0.000 1
1 378 . 6 1 1 A 52 52 GLN C C 39 177.817 178.383 -0.566 1
1 379 . 6 1 1 A 52 52 GLN CA C 39 59.073 59.146 -0.073 1
1 380 . 6 1 1 A 52 52 GLN CB C 39 28.133 28.464 -0.331 1
1 381 . 6 1 1 A 52 52 GLN N N 39 114.086 119.740 -5.654 1
1 382 . 6 1 1 A 53 53 ASP H H 40 7.214 8.075 -0.861 1
1 383 . 6 1 1 A 53 53 ASP HA H 40 4.370 4.519 -0.149 1
1 386 . 6 1 1 A 53 53 ASP C C 40 177.667 178.562 -0.895 1
1 387 . 6 1 1 A 53 53 ASP CA C 40 57.198 57.492 -0.294 1
1 388 . 6 1 1 A 53 53 ASP CB C 40 41.800 40.182 1.618 1
1 389 . 6 1 1 A 53 53 ASP N N 40 118.734 120.043 -1.309 1
1 390 . 6 1 1 A 54 54 LEU H H 41 7.180 8.094 -0.914 1
1 391 . 6 1 1 A 54 54 LEU HA H 41 3.990 3.921 0.069 1
1 400 . 6 1 1 A 54 54 LEU C C 41 178.204 178.208 -0.004 1
1 401 . 6 1 1 A 54 54 LEU CA C 41 56.260 58.083 -1.823 1
1 402 . 6 1 1 A 54 54 LEU CB C 41 41.259 41.585 -0.326 1
1 405 . 6 1 1 A 54 54 LEU N N 41 115.795 122.277 -6.482 1
1 406 . 6 1 1 A 55 55 LEU H H 42 7.823 7.735 0.088 1
1 407 . 6 1 1 A 55 55 LEU HA H 42 3.920 4.144 -0.224 1
1 416 . 6 1 1 A 55 55 LEU C C 42 180.876 178.356 2.520 1
1 417 . 6 1 1 A 55 55 LEU CA C 42 58.135 57.123 1.012 1
1 418 . 6 1 1 A 55 55 LEU CB C 42 42.196 41.889 0.307 1
1 421 . 6 1 1 A 55 55 LEU N N 42 120.499 119.435 1.064 1
1 422 . 6 1 1 A 56 56 GLU H H 43 8.127 8.178 -0.051 1
1 423 . 6 1 1 A 56 56 GLU HA H 43 3.966 4.173 -0.207 1
1 428 . 6 1 1 A 56 56 GLU C C 43 178.801 179.375 -0.574 1
1 429 . 6 1 1 A 56 56 GLU CA C 43 60.010 59.133 0.877 1
1 430 . 6 1 1 A 56 56 GLU CB C 43 29.070 29.416 -0.346 1
1 432 . 6 1 1 A 56 56 GLU N N 43 120.955 118.539 2.416 1
1 433 . 6 1 1 A 57 57 ILE H H 44 7.504 7.603 -0.099 1
1 434 . 6 1 1 A 57 57 ILE HA H 44 4.524 4.024 0.500 1
1 444 . 6 1 1 A 57 57 ILE C C 44 175.691 177.310 -1.619 1
1 445 . 6 1 1 A 57 57 ILE CA C 44 61.886 64.718 -2.832 1
1 446 . 6 1 1 A 57 57 ILE CB C 44 37.300 38.442 -1.142 1
1 450 . 6 1 1 A 57 57 ILE N N 44 109.594 118.820 -9.226 1
1 451 . 6 1 1 A 58 58 GLY H H 45 7.724 7.521 0.203 1
1 452 . 6 1 1 A 58 58 GLY HA2 H 45 3.650 4.259 -0.609 1
1 453 . 6 1 1 A 58 58 GLY HA3 H 45 4.530 4.418 0.112 1
1 454 . 6 1 1 A 58 58 GLY C C 45 174.613 173.294 1.319 1
1 455 . 6 1 1 A 58 58 GLY CA C 45 45.947 45.719 0.228 1
1 456 . 6 1 1 A 58 58 GLY N N 45 106.680 105.857 0.823 1
1 457 . 6 1 1 A 59 59 ILE H H 46 8.180 8.171 0.009 1
1 458 . 6 1 1 A 59 59 ILE HA H 46 3.907 4.730 -0.823 1
1 468 . 6 1 1 A 59 59 ILE C C 46 174.235 175.537 -1.302 1
1 469 . 6 1 1 A 59 59 ILE CA C 46 60.948 60.193 0.755 1
1 470 . 6 1 1 A 59 59 ILE CB C 46 33.980 40.229 -6.249 1
1 474 . 6 1 1 A 59 59 ILE N N 46 122.454 120.698 1.756 1
1 475 . 6 1 1 A 60 60 LEU H H 47 7.367 8.785 -1.418 1
1 476 . 6 1 1 A 60 60 LEU HA H 47 3.900 4.346 -0.446 1
1 479 . 6 1 1 A 60 60 LEU C C 47 177.753 177.321 0.432 1
1 480 . 6 1 1 A 60 60 LEU CA C 47 56.260 55.016 1.244 1
1 481 . 6 1 1 A 60 60 LEU CB C 47 42.196 42.263 -0.067 1
1 482 . 6 1 1 A 60 60 LEU N N 47 125.835 128.755 -2.920 1
1 483 . 6 1 1 A 63 63 GLY HA2 H 50 3.980 4.128 -0.148 1
1 484 . 6 1 1 A 63 63 GLY HA3 H 50 3.950 4.142 -0.192 1
1 485 . 6 1 1 A 63 63 GLY C C 50 177.130 174.630 2.500 1
1 486 . 6 1 1 A 63 63 GLY CA C 50 46.884 46.053 0.831 1
1 487 . 6 1 1 A 64 64 HIS H H 51 7.926 8.026 -0.100 1
1 488 . 6 1 1 A 64 64 HIS HA H 51 4.451 4.478 -0.027 1
1 493 . 6 1 1 A 64 64 HIS C C 51 177.613 177.087 0.526 1
1 494 . 6 1 1 A 64 64 HIS CA C 51 57.198 57.150 0.048 1
1 495 . 6 1 1 A 64 64 HIS CB C 51 30.945 30.758 0.187 1
1 498 . 6 1 1 A 64 64 HIS N N 51 122.284 123.470 -1.186 1
1 499 . 6 1 1 A 65 65 ARG H H 52 8.105 8.311 -0.206 1
1 500 . 6 1 1 A 65 65 ARG HA H 52 3.685 3.717 -0.032 1
1 507 . 6 1 1 A 65 65 ARG C C 52 177.769 178.545 -0.776 1
1 508 . 6 1 1 A 65 65 ARG CA C 52 61.886 59.707 2.179 1
1 509 . 6 1 1 A 65 65 ARG CB C 52 30.945 29.957 0.988 1
1 511 . 6 1 1 A 65 65 ARG N N 52 117.775 118.453 -0.678 1
1 513 . 6 1 1 A 66 66 GLN H H 53 8.090 7.934 0.156 1
1 514 . 6 1 1 A 66 66 GLN HA H 53 3.940 3.961 -0.021 1
1 519 . 6 1 1 A 66 66 GLN C C 53 178.583 178.114 0.469 1
1 520 . 6 1 1 A 66 66 GLN CA C 53 59.073 59.103 -0.030 1
1 521 . 6 1 1 A 66 66 GLN CB C 53 28.133 28.213 -0.080 1
1 523 . 6 1 1 A 66 66 GLN N N 53 116.452 118.861 -2.409 1
1 524 . 6 1 1 A 67 67 ARG H H 54 7.845 7.688 0.157 1
1 525 . 6 1 1 A 67 67 ARG HA H 54 4.010 3.861 0.149 1
1 528 . 6 1 1 A 67 67 ARG C C 54 179.766 178.745 1.021 1
1 529 . 6 1 1 A 67 67 ARG CA C 54 59.073 58.972 0.101 1
1 530 . 6 1 1 A 67 67 ARG CB C 54 30.720 29.626 1.094 1
1 532 . 6 1 1 A 67 67 ARG N N 54 119.275 118.350 0.925 1
1 533 . 6 1 1 A 68 68 ILE H H 55 8.032 7.601 0.431 1
1 534 . 6 1 1 A 68 68 ILE HA H 55 3.495 3.421 0.074 1
1 544 . 6 1 1 A 68 68 ILE C C 55 177.108 178.433 -1.325 1
1 545 . 6 1 1 A 68 68 ILE CA C 55 66.230 65.609 0.621 1
1 546 . 6 1 1 A 68 68 ILE CB C 55 38.020 37.805 0.215 1
1 550 . 6 1 1 A 68 68 ILE N N 55 121.152 120.134 1.018 1
1 551 . 6 1 1 A 69 69 LEU H H 56 8.490 8.244 0.246 1
1 552 . 6 1 1 A 69 69 LEU HA H 56 4.010 3.838 0.172 1
1 561 . 6 1 1 A 69 69 LEU C C 56 179.917 178.899 1.018 1
1 562 . 6 1 1 A 69 69 LEU CA C 56 58.135 58.123 0.012 1
1 563 . 6 1 1 A 69 69 LEU CB C 56 41.259 41.670 -0.411 1
1 566 . 6 1 1 A 69 69 LEU N N 56 119.072 119.693 -0.621 1
1 567 . 6 1 1 A 70 70 GLN H H 57 8.327 8.628 -0.301 1
1 568 . 6 1 1 A 70 70 GLN HA H 57 4.100 3.883 0.217 1
1 573 . 6 1 1 A 70 70 GLN C C 57 178.798 177.987 0.811 1
1 574 . 6 1 1 A 70 70 GLN CA C 57 59.073 59.240 -0.167 1
1 575 . 6 1 1 A 70 70 GLN CB C 57 28.133 28.304 -0.171 1
1 577 . 6 1 1 A 70 70 GLN N N 57 118.172 118.285 -0.113 1
1 578 . 6 1 1 A 71 71 ALA H H 58 7.810 7.780 0.030 1
1 579 . 6 1 1 A 71 71 ALA HA H 58 4.320 4.114 0.206 1
1 583 . 6 1 1 A 71 71 ALA C C 58 172.232 180.028 -7.796 1
1 584 . 6 1 1 A 71 71 ALA CA C 58 55.323 55.026 0.297 1
1 585 . 6 1 1 A 71 71 ALA CB C 58 19.720 18.520 1.200 1
1 586 . 6 1 1 A 71 71 ALA N N 58 122.536 122.000 0.536 1
1 587 . 6 1 1 A 72 72 ILE H H 59 8.840 8.622 0.218 1
1 588 . 6 1 1 A 72 72 ILE HA H 59 4.030 3.695 0.335 1
1 598 . 6 1 1 A 72 72 ILE C C 59 178.678 178.208 0.470 1
1 599 . 6 1 1 A 72 72 ILE CA C 59 64.698 65.172 -0.474 1
1 600 . 6 1 1 A 72 72 ILE CB C 59 37.850 37.684 0.166 1
1 604 . 6 1 1 A 72 72 ILE N N 59 118.111 117.928 0.183 1
1 605 . 6 1 1 A 73 73 GLN H H 60 7.547 8.106 -0.559 1
1 606 . 6 1 1 A 73 73 GLN HA H 60 4.121 4.118 0.003 1
1 611 . 6 1 1 A 73 73 GLN C C 60 176.556 177.952 -1.396 1
1 612 . 6 1 1 A 73 73 GLN CA C 60 58.135 58.377 -0.242 1
1 613 . 6 1 1 A 73 73 GLN CB C 60 28.300 28.242 0.058 1
1 615 . 6 1 1 A 73 73 GLN N N 60 119.094 120.604 -1.510 1
1 616 . 6 1 1 A 74 74 LEU H H 61 7.350 8.026 -0.676 1
1 617 . 6 1 1 A 74 74 LEU HA H 61 4.408 4.137 0.271 1
1 626 . 6 1 1 A 74 74 LEU C C 61 177.960 177.195 0.765 1
1 627 . 6 1 1 A 74 74 LEU CA C 61 54.900 57.023 -2.123 1
1 628 . 6 1 1 A 74 74 LEU CB C 61 42.196 41.865 0.331 1
1 631 . 6 1 1 A 74 74 LEU N N 61 115.853 120.349 -4.496 1
1 632 . 6 1 1 A 75 75 LEU H H 62 7.358 7.567 -0.209 1
1 633 . 6 1 1 A 75 75 LEU HA H 62 4.530 4.423 0.107 1
1 642 . 6 1 1 A 75 75 LEU C C 62 177.035 175.744 1.291 1
1 643 . 6 1 1 A 75 75 LEU CA C 62 53.200 53.679 -0.479 1
1 644 . 6 1 1 A 75 75 LEU CB C 62 40.700 42.406 -1.706 1
1 647 . 6 1 1 A 75 75 LEU N N 62 121.010 122.420 -1.410 1
1 648 . 6 1 1 A 76 76 PRO HA H 63 4.382 4.743 -0.361 1
1 655 . 6 1 1 A 76 76 PRO CB C 63 31.883 29.316 2.567 1
1 657 . 6 1 1 A 77 77 LYS H H 64 8.418 8.406 0.012 1
1 658 . 6 1 1 A 77 77 LYS HA H 64 4.140 4.976 -0.836 1
1 663 . 6 1 1 A 77 77 LYS C C 64 177.122 174.985 2.137 1
1 664 . 6 1 1 A 77 77 LYS CA C 64 56.260 55.276 0.984 1
1 665 . 6 1 1 A 77 77 LYS CB C 64 33.340 36.410 -3.070 1
1 668 . 6 1 1 A 77 77 LYS N N 64 121.932 123.859 -1.927 1
1 669 . 6 1 1 A 78 78 MET H H 65 8.550 8.884 -0.334 1
1 670 . 6 1 1 A 78 78 MET HA H 65 4.304 5.288 -0.984 1
1 676 . 6 1 1 A 78 78 MET C C 65 176.105 174.690 1.415 1
1 677 . 6 1 1 A 78 78 MET CA C 65 56.260 53.620 2.640 1
1 678 . 6 1 1 A 78 78 MET CB C 65 32.821 37.150 -4.329 1
1 680 . 6 1 1 A 78 78 MET N N 65 123.498 124.624 -1.126 1
1 681 . 6 1 1 A 79 79 ARG H H 66 8.731 8.624 0.107 1
1 682 . 6 1 1 A 79 79 ARG C C 66 173.577 174.635 -1.058 1
1 683 . 6 1 1 A 79 79 ARG CA C 66 53.447 53.025 0.422 1
1 684 . 6 1 1 A 79 79 ARG CB C 66 30.008 30.826 -0.818 1
1 685 . 6 1 1 A 79 79 ARG N N 66 127.355 122.594 4.761 1
1 686 . 6 1 1 A 80 80 PRO HA H 67 4.780 4.492 0.288 1
1 693 . 6 1 1 A 80 80 PRO C C 67 177.043 175.722 1.321 1
1 694 . 6 1 1 A 80 80 PRO CA C 67 61.886 64.687 -2.801 1
1 695 . 6 1 1 A 80 80 PRO CB C 67 32.821 32.276 0.545 1
1 698 . 6 1 1 A 81 81 ILE H H 68 8.580 7.422 1.158 1
1 699 . 6 1 1 A 81 81 ILE HA H 68 4.040 4.735 -0.695 1
1 709 . 6 1 1 A 81 81 ILE C C 68 176.831 174.859 1.972 1
1 710 . 6 1 1 A 81 81 ILE CA C 68 62.823 58.860 3.963 1
1 711 . 6 1 1 A 81 81 ILE CB C 68 38.580 42.110 -3.530 1
1 715 . 6 1 1 A 81 81 ILE N N 68 118.491 111.205 7.286 1
1 716 . 6 1 1 A 82 82 GLY H H 69 8.602 8.293 0.309 1
1 717 . 6 1 1 A 82 82 GLY CA C 69 45.009 45.385 -0.376 1
1 718 . 6 1 1 A 82 82 GLY N N 69 111.377 109.250 2.127 1
1 721 . 6 1 1 A 84 84 ASP HA H 71 4.490 4.773 -0.283 1
1 724 . 6 1 1 A 84 84 ASP CA C 71 54.385 54.818 -0.433 1
1 725 . 6 1 1 A 84 84 ASP CB C 71 40.321 42.397 -2.076 1
1 726 . 6 1 1 A 85 85 GLY H H 72 8.054 7.757 0.297 1
1 727 . 6 1 1 A 85 85 GLY HA2 H 72 4.040 4.070 -0.030 1
1 728 . 6 1 1 A 85 85 GLY HA3 H 72 3.750 4.082 -0.332 1
1 729 . 6 1 1 A 85 85 GLY C C 72 173.474 172.451 1.023 1
1 730 . 6 1 1 A 85 85 GLY CA C 72 45.009 44.655 0.354 1
1 731 . 6 1 1 A 85 85 GLY N N 72 108.038 107.737 0.301 1
1 732 . 6 1 1 A 86 86 ALA H H 73 7.858 8.576 -0.718 1
1 733 . 6 1 1 A 86 86 ALA HA H 73 4.370 5.219 -0.849 1
1 737 . 6 1 1 A 86 86 ALA CA C 73 51.990 51.050 0.940 1
1 738 . 6 1 1 A 86 86 ALA CB C 73 19.220 22.262 -3.042 1
1 739 . 6 1 1 A 86 86 ALA N N 73 123.819 122.654 1.165 1
1 742 . 6 1 1 A 90 90 SER H H 77 7.839 8.935 -1.096 1
1 743 . 6 1 1 A 90 90 SER HA H 77 4.770 4.739 0.031 1
1 746 . 6 1 1 A 90 90 SER N N 77 115.163 118.313 -3.150 1
1 747 . 6 1 1 A 91 91 VAL H H 78 8.578 8.553 0.025 1
1 748 . 6 1 1 A 91 91 VAL HA H 78 3.981 3.947 0.034 1
1 756 . 6 1 1 A 91 91 VAL C C 78 177.480 177.331 0.149 1
1 757 . 6 1 1 A 91 91 VAL CA C 78 67.060 66.211 0.849 1
1 758 . 6 1 1 A 91 91 VAL CB C 78 32.500 31.619 0.881 1
1 761 . 6 1 1 A 91 91 VAL N N 78 123.481 123.340 0.141 1
1 762 . 6 1 1 A 92 92 ALA H H 79 8.607 8.222 0.385 1
1 763 . 6 1 1 A 92 92 ALA HA H 79 4.113 3.939 0.174 1
1 767 . 6 1 1 A 92 92 ALA C C 79 179.868 180.260 -0.392 1
1 768 . 6 1 1 A 92 92 ALA CA C 79 54.890 55.568 -0.678 1
1 769 . 6 1 1 A 92 92 ALA CB C 79 18.790 18.629 0.161 1
1 770 . 6 1 1 A 92 92 ALA N N 79 120.334 121.850 -1.516 1
1 771 . 6 1 1 A 93 93 GLU H H 80 7.886 8.082 -0.196 1
1 772 . 6 1 1 A 93 93 GLU HA H 80 4.010 4.046 -0.036 1
1 777 . 6 1 1 A 93 93 GLU C C 80 179.719 178.863 0.856 1
1 778 . 6 1 1 A 93 93 GLU CA C 80 59.073 58.973 0.100 1
1 779 . 6 1 1 A 93 93 GLU CB C 80 30.630 29.256 1.374 1
1 781 . 6 1 1 A 93 93 GLU N N 80 117.643 117.614 0.029 1
1 782 . 6 1 1 A 94 94 TRP H H 81 8.299 8.008 0.291 1
1 783 . 6 1 1 A 94 94 TRP HA H 81 4.251 4.293 -0.042 1
1 792 . 6 1 1 A 94 94 TRP C C 81 178.772 178.105 0.667 1
1 793 . 6 1 1 A 94 94 TRP CA C 81 60.010 61.377 -1.367 1
1 794 . 6 1 1 A 94 94 TRP CB C 81 27.650 29.780 -2.130 1
1 800 . 6 1 1 A 94 94 TRP N N 81 122.545 123.492 -0.947 1
1 802 . 6 1 1 A 95 95 LEU H H 82 8.505 8.416 0.089 1
1 803 . 6 1 1 A 95 95 LEU HA H 82 2.880 3.035 -0.155 1
1 812 . 6 1 1 A 95 95 LEU C C 82 180.235 178.815 1.420 1
1 813 . 6 1 1 A 95 95 LEU CA C 82 57.400 56.699 0.701 1
1 814 . 6 1 1 A 95 95 LEU CB C 82 40.321 40.760 -0.439 1
1 817 . 6 1 1 A 95 95 LEU N N 82 121.110 118.966 2.144 1
1 818 . 6 1 1 A 96 96 ASP H H 83 8.185 8.240 -0.055 1
1 819 . 6 1 1 A 96 96 ASP HA H 83 4.280 4.320 -0.040 1
1 822 . 6 1 1 A 96 96 ASP C C 83 175.224 177.852 -2.628 1
1 823 . 6 1 1 A 96 96 ASP CA C 83 57.310 57.089 0.221 1
1 824 . 6 1 1 A 96 96 ASP CB C 83 40.321 41.672 -1.351 1
1 825 . 6 1 1 A 96 96 ASP N N 83 119.082 120.322 -1.240 1
1 826 . 6 1 1 A 97 97 SER H H 84 7.989 7.757 0.232 1
1 827 . 6 1 1 A 97 97 SER HA H 84 4.250 4.295 -0.045 1
1 830 . 6 1 1 A 97 97 SER C C 84 175.346 175.246 0.100 1
1 831 . 6 1 1 A 97 97 SER CA C 84 60.948 60.185 0.763 1
1 832 . 6 1 1 A 97 97 SER CB C 84 63.370 63.557 -0.187 1
1 833 . 6 1 1 A 97 97 SER N N 84 117.579 112.645 4.934 1
1 834 . 6 1 1 A 98 98 ILE H H 85 6.862 7.406 -0.544 1
1 835 . 6 1 1 A 98 98 ILE HA H 85 4.550 4.072 0.478 1
1 843 . 6 1 1 A 98 98 ILE C C 85 173.308 175.334 -2.026 1
1 844 . 6 1 1 A 98 98 ILE CA C 85 60.948 60.663 0.285 1
1 845 . 6 1 1 A 98 98 ILE CB C 85 37.760 37.633 0.127 1
1 848 . 6 1 1 A 98 98 ILE N N 85 113.733 117.640 -3.907 1
1 849 . 6 1 1 A 99 99 GLU H H 86 7.705 8.004 -0.299 1
1 850 . 6 1 1 A 99 99 GLU HA H 86 4.280 3.930 0.350 1
1 853 . 6 1 1 A 99 99 GLU C C 86 175.224 176.194 -0.970 1
1 854 . 6 1 1 A 99 99 GLU CA C 86 56.260 57.179 -0.919 1
1 855 . 6 1 1 A 99 99 GLU CB C 86 26.258 27.291 -1.033 1
1 857 . 6 1 1 A 99 99 GLU N N 86 115.493 120.354 -4.861 1
1 858 . 6 1 1 A 100 100 LEU H H 87 7.989 7.711 0.278 1
1 859 . 6 1 1 A 100 100 LEU HA H 87 4.220 4.573 -0.353 1
1 868 . 6 1 1 A 100 100 LEU C C 87 176.965 177.655 -0.690 1
1 869 . 6 1 1 A 100 100 LEU CA C 87 52.510 53.767 -1.257 1
1 870 . 6 1 1 A 100 100 LEU CB C 87 42.196 42.766 -0.570 1
1 873 . 6 1 1 A 100 100 LEU N N 87 117.579 121.354 -3.775 1
1 874 . 6 1 1 A 101 101 GLY H H 88 8.503 8.329 0.174 1
1 875 . 6 1 1 A 101 101 GLY CA C 88 46.884 47.485 -0.601 1
1 876 . 6 1 1 A 101 101 GLY N N 88 107.794 109.052 -1.258 1
1 877 . 6 1 1 A 102 102 ASP HA H 89 4.431 4.305 0.126 1
1 880 . 6 1 1 A 102 102 ASP C C 89 178.075 178.275 -0.200 1
1 881 . 6 1 1 A 102 102 ASP CA C 89 57.198 56.929 0.269 1
1 882 . 6 1 1 A 102 102 ASP CB C 89 40.321 40.474 -0.153 1
1 883 . 6 1 1 A 103 103 TYR H H 90 7.899 7.741 0.158 1
1 884 . 6 1 1 A 103 103 TYR HA H 90 4.940 4.399 0.541 1
1 889 . 6 1 1 A 103 103 TYR C C 90 175.527 178.531 -3.004 1
1 890 . 6 1 1 A 103 103 TYR CA C 90 58.135 60.509 -2.374 1
1 891 . 6 1 1 A 103 103 TYR CB C 90 38.446 37.523 0.923 1
1 894 . 6 1 1 A 103 103 TYR N N 90 115.595 119.627 -4.032 1
1 895 . 6 1 1 A 104 104 THR H H 91 7.971 8.331 -0.360 1
1 896 . 6 1 1 A 104 104 THR HA H 91 4.234 4.026 0.208 1
1 901 . 6 1 1 A 104 104 THR C C 91 175.905 176.490 -0.585 1
1 902 . 6 1 1 A 104 104 THR CA C 91 68.449 67.083 1.366 1
1 904 . 6 1 1 A 104 104 THR N N 91 118.867 116.705 2.162 1
1 905 . 6 1 1 A 105 105 LYS H H 92 8.555 7.839 0.716 1
1 906 . 6 1 1 A 105 105 LYS HA H 92 3.940 4.071 -0.131 1
1 912 . 6 1 1 A 105 105 LYS C C 92 177.310 178.645 -1.335 1
1 913 . 6 1 1 A 105 105 LYS CA C 92 60.948 59.475 1.473 1
1 914 . 6 1 1 A 105 105 LYS CB C 92 31.883 32.322 -0.439 1
1 917 . 6 1 1 A 105 105 LYS N N 92 119.259 120.994 -1.735 1
1 918 . 6 1 1 A 106 106 ALA H H 93 7.920 8.044 -0.124 1
1 919 . 6 1 1 A 106 106 ALA HA H 93 4.128 4.180 -0.052 1
1 923 . 6 1 1 A 106 106 ALA C C 93 180.972 180.349 0.623 1
1 924 . 6 1 1 A 106 106 ALA CA C 93 55.070 55.231 -0.161 1
1 925 . 6 1 1 A 106 106 ALA CB C 93 17.750 18.422 -0.672 1
1 926 . 6 1 1 A 106 106 ALA N N 93 120.398 121.948 -1.550 1
1 927 . 6 1 1 A 107 107 PHE H H 94 8.136 8.694 -0.558 1
1 928 . 6 1 1 A 107 107 PHE HA H 94 4.190 4.570 -0.380 1
1 934 . 6 1 1 A 107 107 PHE C C 94 177.955 178.321 -0.366 1
1 935 . 6 1 1 A 107 107 PHE CA C 94 63.761 61.532 2.229 1
1 936 . 6 1 1 A 107 107 PHE CB C 94 38.446 38.986 -0.540 1
1 940 . 6 1 1 A 107 107 PHE N N 94 117.119 116.270 0.849 1
1 941 . 6 1 1 A 108 108 LEU H H 95 8.351 8.606 -0.255 1
1 942 . 6 1 1 A 108 108 LEU HA H 95 3.889 4.006 -0.117 1
1 951 . 6 1 1 A 108 108 LEU C C 95 182.043 179.209 2.834 1
1 952 . 6 1 1 A 108 108 LEU CA C 95 59.073 58.575 0.498 1
1 953 . 6 1 1 A 108 108 LEU CB C 95 41.259 41.902 -0.643 1
1 956 . 6 1 1 A 108 108 LEU N N 95 118.450 119.805 -1.355 1
1 957 . 6 1 1 A 109 109 ILE H H 96 8.992 8.125 0.867 1
1 958 . 6 1 1 A 109 109 ILE HA H 96 4.069 3.858 0.211 1
1 968 . 6 1 1 A 109 109 ILE C C 96 177.094 177.936 -0.842 1
1 969 . 6 1 1 A 109 109 ILE CA C 96 63.761 64.376 -0.615 1
1 970 . 6 1 1 A 109 109 ILE CB C 96 37.509 37.743 -0.234 1
1 974 . 6 1 1 A 109 109 ILE N N 96 118.177 115.073 3.104 1
1 975 . 6 1 1 A 110 110 ASN H H 97 7.067 8.128 -1.061 1
1 976 . 6 1 1 A 110 110 ASN HA H 97 4.797 4.631 0.166 1
1 981 . 6 1 1 A 110 110 ASN C C 97 173.595 175.366 -1.771 1
1 982 . 6 1 1 A 110 110 ASN CA C 97 54.385 53.520 0.865 1
1 983 . 6 1 1 A 110 110 ASN CB C 97 40.321 38.797 1.524 1
1 984 . 6 1 1 A 110 110 ASN N N 97 116.407 119.794 -3.387 1
1 986 . 6 1 1 A 111 111 GLY H H 98 7.681 8.010 -0.329 1
1 987 . 6 1 1 A 111 111 GLY HA2 H 98 4.080 3.939 0.141 1
1 988 . 6 1 1 A 111 111 GLY HA3 H 98 3.640 4.033 -0.393 1
1 989 . 6 1 1 A 111 111 GLY C C 98 174.552 174.150 0.402 1
1 990 . 6 1 1 A 111 111 GLY CA C 98 45.947 44.908 1.039 1
1 991 . 6 1 1 A 111 111 GLY N N 98 104.440 105.745 -1.305 1
1 992 . 6 1 1 A 112 112 TYR H H 99 8.427 8.310 0.117 1
1 993 . 6 1 1 A 112 112 TYR HA H 99 4.661 4.774 -0.113 1
1 998 . 6 1 1 A 112 112 TYR C C 99 174.425 176.205 -1.780 1
1 999 . 6 1 1 A 112 112 TYR CA C 99 57.198 57.638 -0.440 1
1 1000 . 6 1 1 A 112 112 TYR CB C 99 36.571 38.140 -1.569 1
1 1003 . 6 1 1 A 112 112 TYR N N 99 122.830 120.209 2.621 1
1 1004 . 6 1 1 A 113 113 THR H H 100 7.166 8.726 -1.560 1
1 1005 . 6 1 1 A 113 113 THR HA H 100 4.248 4.564 -0.316 1
1 1009 . 6 1 1 A 113 113 THR C C 100 174.897 174.529 0.368 1
1 1010 . 6 1 1 A 113 113 THR CA C 100 62.290 62.548 -0.258 1
1 1011 . 6 1 1 A 113 113 THR CB C 100 68.970 69.367 -0.397 1
1 1013 . 6 1 1 A 113 113 THR N N 100 104.304 116.754 -12.450 1
1 1014 . 6 1 1 A 114 114 SER H H 101 7.695 8.159 -0.464 1
1 1015 . 6 1 1 A 114 114 SER C C 101 174.372 175.338 -0.966 1
1 1016 . 6 1 1 A 114 114 SER CA C 101 56.260 57.484 -1.224 1
1 1017 . 6 1 1 A 114 114 SER CB C 101 65.636 65.053 0.583 1
1 1018 . 6 1 1 A 114 114 SER N N 101 115.613 115.183 0.430 1
1 1023 . 6 1 1 A 116 116 ASP HA H 103 4.260 4.331 -0.071 1
1 1026 . 6 1 1 A 116 116 ASP CA C 103 57.198 57.673 -0.475 1
1 1027 . 6 1 1 A 116 116 ASP CB C 103 40.321 40.290 0.031 1
1 1028 . 6 1 1 A 117 117 LEU H H 104 7.345 8.239 -0.894 1
1 1029 . 6 1 1 A 117 117 LEU HA H 104 4.290 4.069 0.221 1
1 1038 . 6 1 1 A 117 117 LEU C C 104 178.488 179.556 -1.068 1
1 1039 . 6 1 1 A 117 117 LEU CA C 104 56.260 58.126 -1.866 1
1 1040 . 6 1 1 A 117 117 LEU CB C 104 42.196 41.044 1.152 1
1 1043 . 6 1 1 A 117 117 LEU N N 104 117.878 120.806 -2.928 1
1 1044 . 6 1 1 A 118 118 LEU H H 105 7.514 8.220 -0.706 1
1 1045 . 6 1 1 A 118 118 LEU HA H 105 4.210 4.250 -0.040 1
1 1054 . 6 1 1 A 118 118 LEU C C 105 177.002 177.850 -0.848 1
1 1055 . 6 1 1 A 118 118 LEU CA C 105 55.323 57.041 -1.718 1
1 1056 . 6 1 1 A 118 118 LEU CB C 105 42.196 41.465 0.731 1
1 1059 . 6 1 1 A 118 118 LEU N N 105 119.094 119.246 -0.152 1
1 1060 . 6 1 1 A 120 120 LYS HA H 107 4.340 4.460 -0.120 1
1 1063 . 6 1 1 A 120 120 LYS C C 107 176.603 175.549 1.054 1
1 1064 . 6 1 1 A 120 120 LYS CA C 107 55.323 55.834 -0.511 1
1 1065 . 6 1 1 A 120 120 LYS CB C 107 31.883 32.457 -0.574 1
1 1068 . 6 1 1 A 121 121 ILE H H 108 7.539 7.542 -0.003 1
1 1069 . 6 1 1 A 121 121 ILE HA H 108 3.987 5.163 -1.176 1
1 1079 . 6 1 1 A 121 121 ILE C C 108 173.247 175.290 -2.043 1
1 1080 . 6 1 1 A 121 121 ILE CA C 108 62.823 58.692 4.131 1
1 1081 . 6 1 1 A 121 121 ILE CB C 108 38.446 42.134 -3.688 1
1 1085 . 6 1 1 A 121 121 ILE N N 108 122.417 116.168 6.249 1
1 1086 . 6 1 1 A 122 122 ALA H H 109 8.290 8.388 -0.098 1
1 1087 . 6 1 1 A 122 122 ALA HA H 109 3.970 4.656 -0.686 1
1 1091 . 6 1 1 A 122 122 ALA C C 109 178.318 178.243 0.075 1
1 1092 . 6 1 1 A 122 122 ALA CA C 109 50.150 50.240 -0.090 1
1 1093 . 6 1 1 A 122 122 ALA CB C 109 21.630 20.471 1.159 1
1 1094 . 6 1 1 A 122 122 ALA N N 109 127.784 125.033 2.751 1
1 1095 . 6 1 1 A 123 123 GLU HA H 110 3.707 3.959 -0.252 1
1 1099 . 6 1 1 A 123 123 GLU C C 110 178.290 178.768 -0.478 1
1 1100 . 6 1 1 A 123 123 GLU CA C 110 60.948 59.847 1.101 1
1 1101 . 6 1 1 A 123 123 GLU CB C 110 29.070 29.446 -0.376 1
1 1102 . 6 1 1 A 124 124 VAL H H 111 8.333 8.318 0.015 1
1 1103 . 6 1 1 A 124 124 VAL HA H 111 3.850 3.782 0.068 1
1 1111 . 6 1 1 A 124 124 VAL C C 111 177.406 177.532 -0.126 1
1 1112 . 6 1 1 A 124 124 VAL CA C 111 65.636 65.000 0.636 1
1 1113 . 6 1 1 A 124 124 VAL CB C 111 30.730 31.263 -0.533 1
1 1116 . 6 1 1 A 124 124 VAL N N 111 114.438 120.152 -5.714 1
1 1117 . 6 1 1 A 125 125 GLU H H 112 7.442 8.384 -0.942 1
1 1118 . 6 1 1 A 125 125 GLU HA H 112 4.152 4.111 0.041 1
1 1123 . 6 1 1 A 125 125 GLU C C 112 179.982 179.221 0.761 1
1 1124 . 6 1 1 A 125 125 GLU CA C 112 60.010 59.574 0.436 1
1 1125 . 6 1 1 A 125 125 GLU CB C 112 30.008 29.296 0.712 1
1 1127 . 6 1 1 A 125 125 GLU N N 112 121.032 121.856 -0.824 1
1 1128 . 6 1 1 A 126 126 LEU H H 113 7.666 7.785 -0.119 1
1 1129 . 6 1 1 A 126 126 LEU HA H 113 3.846 4.063 -0.217 1
1 1138 . 6 1 1 A 126 126 LEU C C 113 176.991 178.394 -1.403 1
1 1139 . 6 1 1 A 126 126 LEU CA C 113 58.135 57.933 0.202 1
1 1140 . 6 1 1 A 126 126 LEU CB C 113 41.259 41.816 -0.557 1
1 1143 . 6 1 1 A 126 126 LEU N N 113 118.731 120.966 -2.235 1
1 1144 . 6 1 1 A 127 127 ILE H H 114 7.781 8.227 -0.446 1
1 1145 . 6 1 1 A 127 127 ILE HA H 114 3.502 3.863 -0.361 1
1 1153 . 6 1 1 A 127 127 ILE C C 114 178.195 178.146 0.049 1
1 1154 . 6 1 1 A 127 127 ILE CA C 114 65.636 64.092 1.544 1
1 1155 . 6 1 1 A 127 127 ILE CB C 114 40.321 37.278 3.043 1
1 1159 . 6 1 1 A 127 127 ILE N N 114 115.084 120.104 -5.020 1
1 1160 . 6 1 1 A 128 128 ASN H H 115 8.470 7.666 0.804 1
1 1161 . 6 1 1 A 128 128 ASN HA H 115 4.502 4.763 -0.261 1
1 1166 . 6 1 1 A 128 128 ASN C C 115 176.295 177.332 -1.037 1
1 1167 . 6 1 1 A 128 128 ASN CA C 115 56.260 54.969 1.291 1
1 1168 . 6 1 1 A 128 128 ASN CB C 115 39.384 39.472 -0.088 1
1 1169 . 6 1 1 A 128 128 ASN N N 115 115.158 120.358 -5.200 1
1 1171 . 6 1 1 A 129 129 VAL H H 116 8.116 8.226 -0.110 1
1 1172 . 6 1 1 A 129 129 VAL HA H 116 4.090 3.602 0.488 1
1 1180 . 6 1 1 A 129 129 VAL C C 116 176.740 177.799 -1.059 1
1 1181 . 6 1 1 A 129 129 VAL CA C 116 64.400 66.733 -2.333 1
1 1182 . 6 1 1 A 129 129 VAL CB C 116 32.050 31.845 0.205 1
1 1185 . 6 1 1 A 129 129 VAL N N 116 118.698 118.649 0.049 1
1 1186 . 6 1 1 A 130 130 LEU H H 117 7.294 7.785 -0.491 1
1 1187 . 6 1 1 A 130 130 LEU HA H 117 3.970 4.046 -0.076 1
1 1196 . 6 1 1 A 130 130 LEU C C 117 175.127 176.220 -1.093 1
1 1197 . 6 1 1 A 130 130 LEU CA C 117 56.260 55.172 1.088 1
1 1198 . 6 1 1 A 130 130 LEU CB C 117 41.259 41.386 -0.127 1
1 1201 . 6 1 1 A 130 130 LEU N N 117 116.201 118.507 -2.306 1
1 1202 . 6 1 1 A 131 131 LYS H H 118 6.594 7.846 -1.252 1
1 1203 . 6 1 1 A 131 131 LYS HA H 118 3.980 4.285 -0.305 1
1 1208 . 6 1 1 A 131 131 LYS C C 118 175.589 176.144 -0.555 1
1 1209 . 6 1 1 A 131 131 LYS CA C 118 56.260 57.302 -1.042 1
1 1210 . 6 1 1 A 131 131 LYS CB C 118 28.133 29.386 -1.253 1
1 1212 . 6 1 1 A 131 131 LYS N N 118 111.172 115.045 -3.873 1
1 1213 . 6 1 1 A 132 132 ILE H H 119 8.245 8.268 -0.023 1
1 1214 . 6 1 1 A 132 132 ILE HA H 119 4.090 4.046 0.044 1
1 1224 . 6 1 1 A 132 132 ILE C C 119 175.161 176.445 -1.284 1
1 1225 . 6 1 1 A 132 132 ILE CA C 119 60.010 64.929 -4.919 1
1 1226 . 6 1 1 A 132 132 ILE CB C 119 35.633 37.632 -1.999 1
1 1230 . 6 1 1 A 132 132 ILE N N 119 119.484 118.288 1.196 1
1 1231 . 6 1 1 A 133 133 ASN H H 120 8.054 8.292 -0.238 1
1 1232 . 6 1 1 A 133 133 ASN HA H 120 4.350 4.346 0.004 1
1 1235 . 6 1 1 A 133 133 ASN C C 120 175.136 174.466 0.670 1
1 1236 . 6 1 1 A 133 133 ASN CA C 120 54.385 54.314 0.071 1
1 1237 . 6 1 1 A 133 133 ASN CB C 120 39.384 37.690 1.694 1
1 1238 . 6 1 1 A 133 133 ASN N N 120 124.670 120.236 4.434 1
1 1239 . 6 1 1 A 134 134 LEU H H 121 7.517 7.809 -0.292 1
1 1240 . 6 1 1 A 134 134 LEU HA H 121 4.678 4.703 -0.025 1
1 1249 . 6 1 1 A 134 134 LEU C C 121 178.051 176.491 1.560 1
1 1250 . 6 1 1 A 134 134 LEU CA C 121 53.447 53.648 -0.201 1
1 1251 . 6 1 1 A 134 134 LEU CB C 121 41.259 45.401 -4.142 1
1 1254 . 6 1 1 A 134 134 LEU N N 121 119.918 118.906 1.012 1
1 1255 . 6 1 1 A 135 135 ILE H H 122 9.389 8.747 0.642 1
1 1256 . 6 1 1 A 135 135 ILE HA H 122 3.540 3.752 -0.212 1
1 1266 . 6 1 1 A 135 135 ILE C C 122 176.425 177.794 -1.369 1
1 1267 . 6 1 1 A 135 135 ILE CA C 122 65.636 65.411 0.225 1
1 1268 . 6 1 1 A 135 135 ILE CB C 122 38.446 38.206 0.240 1
1 1272 . 6 1 1 A 135 135 ILE N N 122 129.949 126.428 3.521 1
1 1273 . 6 1 1 A 136 136 GLY H H 123 8.675 8.385 0.290 1
1 1274 . 6 1 1 A 136 136 GLY HA2 H 123 2.650 3.330 -0.680 1
1 1275 . 6 1 1 A 136 136 GLY HA3 H 123 2.060 3.616 -1.556 1
1 1276 . 6 1 1 A 136 136 GLY C C 123 176.854 176.774 0.080 1
1 1277 . 6 1 1 A 136 136 GLY CA C 123 45.500 47.185 -1.685 1
1 1278 . 6 1 1 A 136 136 GLY N N 123 106.314 107.724 -1.410 1
1 1279 . 6 1 1 A 137 137 HIS H H 124 6.869 7.836 -0.967 1
1 1280 . 6 1 1 A 137 137 HIS HA H 124 4.558 4.636 -0.078 1
1 1285 . 6 1 1 A 137 137 HIS C C 124 176.977 177.830 -0.853 1
1 1286 . 6 1 1 A 137 137 HIS CA C 124 57.198 58.488 -1.290 1
1 1287 . 6 1 1 A 137 137 HIS CB C 124 30.945 29.420 1.525 1
1 1290 . 6 1 1 A 137 137 HIS N N 124 118.865 120.285 -1.420 1
1 1291 . 6 1 1 A 138 138 ARG H H 125 7.730 8.262 -0.532 1
1 1292 . 6 1 1 A 138 138 ARG HA H 125 3.770 4.022 -0.252 1
1 1299 . 6 1 1 A 138 138 ARG C C 125 178.288 178.543 -0.255 1
1 1300 . 6 1 1 A 138 138 ARG CA C 125 61.886 58.547 3.339 1
1 1301 . 6 1 1 A 138 138 ARG CB C 125 30.945 29.803 1.142 1
1 1304 . 6 1 1 A 138 138 ARG N N 125 118.149 118.130 0.019 1
1 1306 . 6 1 1 A 139 139 LYS H H 126 8.679 8.101 0.578 1
1 1307 . 6 1 1 A 139 139 LYS HA H 126 3.990 3.999 -0.009 1
1 1310 . 6 1 1 A 139 139 LYS C C 126 179.184 179.260 -0.076 1
1 1311 . 6 1 1 A 139 139 LYS CA C 126 58.135 59.330 -1.195 1
1 1312 . 6 1 1 A 139 139 LYS CB C 126 30.945 32.047 -1.102 1
1 1314 . 6 1 1 A 139 139 LYS N N 126 114.003 119.506 -5.503 1
1 1315 . 6 1 1 A 140 140 ARG H H 127 7.248 8.164 -0.916 1
1 1316 . 6 1 1 A 140 140 ARG HA H 127 3.870 4.038 -0.168 1
1 1324 . 6 1 1 A 140 140 ARG C C 127 177.772 178.666 -0.894 1
1 1325 . 6 1 1 A 140 140 ARG CA C 127 60.010 59.034 0.976 1
1 1326 . 6 1 1 A 140 140 ARG CB C 127 30.945 29.961 0.984 1
1 1329 . 6 1 1 A 140 140 ARG N N 127 120.072 118.314 1.758 1
1 1331 . 6 1 1 A 141 141 ILE H H 128 7.706 8.211 -0.505 1
1 1332 . 6 1 1 A 141 141 ILE HA H 128 3.530 3.874 -0.344 1
1 1340 . 6 1 1 A 141 141 ILE C C 128 177.669 178.175 -0.506 1
1 1341 . 6 1 1 A 141 141 ILE CA C 128 65.636 65.418 0.218 1
1 1342 . 6 1 1 A 141 141 ILE CB C 128 38.680 38.238 0.442 1
1 1345 . 6 1 1 A 141 141 ILE N N 128 118.730 120.834 -2.104 1
1 1346 . 6 1 1 A 142 142 LEU H H 129 8.194 8.384 -0.190 1
1 1347 . 6 1 1 A 142 142 LEU HA H 129 3.950 4.030 -0.080 1
1 1356 . 6 1 1 A 142 142 LEU C C 129 179.960 179.750 0.210 1
1 1357 . 6 1 1 A 142 142 LEU CA C 129 58.135 57.784 0.351 1
1 1358 . 6 1 1 A 142 142 LEU CB C 129 41.259 40.659 0.600 1
1 1361 . 6 1 1 A 142 142 LEU N N 129 117.675 118.250 -0.575 1
1 1362 . 6 1 1 A 143 143 ALA H H 130 8.294 8.438 -0.144 1
1 1363 . 6 1 1 A 143 143 ALA HA H 130 4.220 4.040 0.180 1
1 1367 . 6 1 1 A 143 143 ALA C C 130 179.899 179.553 0.346 1
1 1368 . 6 1 1 A 143 143 ALA CA C 130 54.385 55.225 -0.840 1
1 1369 . 6 1 1 A 143 143 ALA CB C 130 19.270 18.513 0.757 1
1 1370 . 6 1 1 A 143 143 ALA N N 130 121.096 122.975 -1.879 1
1 1371 . 6 1 1 A 144 144 SER H H 131 7.813 8.446 -0.633 1
1 1372 . 6 1 1 A 144 144 SER HA H 131 4.180 4.326 -0.146 1
1 1375 . 6 1 1 A 144 144 SER C C 131 175.457 177.647 -2.190 1
1 1376 . 6 1 1 A 144 144 SER CA C 131 60.948 61.862 -0.914 1
1 1377 . 6 1 1 A 144 144 SER CB C 131 63.761 62.617 1.144 1
1 1378 . 6 1 1 A 144 144 SER N N 131 112.102 113.410 -1.308 1
1 1379 . 6 1 1 A 145 145 LEU H H 132 7.747 7.954 -0.207 1
1 1380 . 6 1 1 A 145 145 LEU HA H 132 4.140 3.933 0.207 1
1 1389 . 6 1 1 A 145 145 LEU C C 132 178.589 177.357 1.232 1
1 1390 . 6 1 1 A 145 145 LEU CA C 132 56.260 56.593 -0.333 1
1 1391 . 6 1 1 A 145 145 LEU CB C 132 42.196 42.539 -0.343 1
1 1394 . 6 1 1 A 145 145 LEU N N 132 117.536 118.311 -0.775 1
1 1395 . 6 1 1 A 146 146 GLY H H 133 7.544 7.789 -0.245 1
1 1396 . 6 1 1 A 146 146 GLY HA2 H 133 3.950 4.031 -0.081 1
1 1397 . 6 1 1 A 146 146 GLY HA3 H 133 3.100 4.042 -0.942 1
1 1398 . 6 1 1 A 146 146 GLY C C 133 173.372 172.454 0.918 1
1 1399 . 6 1 1 A 146 146 GLY CA C 133 45.947 43.971 1.976 1
1 1400 . 6 1 1 A 146 146 GLY N N 133 105.351 105.045 0.306 1
1 1401 . 6 1 1 A 147 147 ASP H H 134 8.342 8.414 -0.072 1
1 1402 . 6 1 1 A 147 147 ASP HA H 134 4.650 4.949 -0.299 1
1 1405 . 6 1 1 A 147 147 ASP C C 134 175.462 176.542 -1.080 1
1 1406 . 6 1 1 A 147 147 ASP CA C 134 54.385 53.322 1.063 1
1 1407 . 6 1 1 A 147 147 ASP CB C 134 41.259 42.439 -1.180 1
1 1408 . 6 1 1 A 147 147 ASP N N 134 120.133 120.498 -0.365 1
1 14 . 7 1 1 A 15 15 GLN H H 2 8.439 7.862 0.577 1
1 15 . 7 1 1 A 15 15 GLN HA H 2 4.594 4.398 0.196 1
1 20 . 7 1 1 A 15 15 GLN C C 2 175.972 175.215 0.757 1
1 21 . 7 1 1 A 15 15 GLN CA C 2 56.260 56.128 0.132 1
1 22 . 7 1 1 A 15 15 GLN CB C 2 30.945 30.566 0.379 1
1 24 . 7 1 1 A 15 15 GLN N N 2 124.997 121.733 3.264 1
1 25 . 7 1 1 A 16 16 THR H H 3 8.347 8.518 -0.171 1
1 26 . 7 1 1 A 16 16 THR HA H 3 4.555 4.762 -0.207 1
1 31 . 7 1 1 A 16 16 THR C C 3 175.495 174.980 0.515 1
1 32 . 7 1 1 A 16 16 THR CA C 3 60.010 61.041 -1.031 1
1 33 . 7 1 1 A 16 16 THR CB C 3 71.261 72.452 -1.191 1
1 34 . 7 1 1 A 16 16 THR N N 3 113.011 114.426 -1.415 1
1 35 . 7 1 1 A 17 17 VAL H H 4 8.895 8.990 -0.095 1
1 36 . 7 1 1 A 17 17 VAL HA H 4 3.670 3.889 -0.219 1
1 44 . 7 1 1 A 17 17 VAL C C 4 178.449 177.940 0.509 1
1 45 . 7 1 1 A 17 17 VAL CA C 4 67.511 66.501 1.010 1
1 46 . 7 1 1 A 17 17 VAL CB C 4 31.883 31.974 -0.091 1
1 49 . 7 1 1 A 17 17 VAL N N 4 121.854 124.701 -2.847 1
1 50 . 7 1 1 A 18 18 GLY H H 5 9.017 8.239 0.778 1
1 51 . 7 1 1 A 18 18 GLY HA2 H 5 3.940 3.774 0.166 1
1 52 . 7 1 1 A 18 18 GLY HA3 H 5 3.610 3.775 -0.165 1
1 53 . 7 1 1 A 18 18 GLY C C 5 176.186 175.799 0.387 1
1 54 . 7 1 1 A 18 18 GLY CA C 5 47.822 47.088 0.734 1
1 55 . 7 1 1 A 18 18 GLY N N 5 106.966 108.037 -1.071 1
1 56 . 7 1 1 A 19 19 GLN H H 6 8.072 8.325 -0.253 1
1 57 . 7 1 1 A 19 19 GLN HA H 6 4.037 4.122 -0.085 1
1 62 . 7 1 1 A 19 19 GLN C C 6 179.488 177.994 1.494 1
1 63 . 7 1 1 A 19 19 GLN CA C 6 59.073 58.753 0.320 1
1 64 . 7 1 1 A 19 19 GLN CB C 6 28.489 28.850 -0.361 1
1 66 . 7 1 1 A 19 19 GLN N N 6 122.431 121.144 1.287 1
1 67 . 7 1 1 A 20 20 TRP H H 7 8.756 8.371 0.385 1
1 68 . 7 1 1 A 20 20 TRP HA H 7 4.160 4.261 -0.101 1
1 77 . 7 1 1 A 20 20 TRP C C 7 179.620 178.059 1.561 1
1 78 . 7 1 1 A 20 20 TRP CA C 7 61.886 61.091 0.795 1
1 79 . 7 1 1 A 20 20 TRP CB C 7 28.133 30.058 -1.925 1
1 85 . 7 1 1 A 20 20 TRP N N 7 124.265 122.184 2.081 1
1 87 . 7 1 1 A 21 21 LEU H H 8 9.148 8.507 0.641 1
1 88 . 7 1 1 A 21 21 LEU HA H 8 3.440 3.443 -0.003 1
1 97 . 7 1 1 A 21 21 LEU C C 8 180.521 178.524 1.997 1
1 98 . 7 1 1 A 21 21 LEU CA C 8 56.920 57.640 -0.720 1
1 99 . 7 1 1 A 21 21 LEU CB C 8 41.700 41.404 0.296 1
1 102 . 7 1 1 A 21 21 LEU N N 8 120.548 120.682 -0.134 1
1 103 . 7 1 1 A 22 22 GLU H H 9 8.284 8.388 -0.104 1
1 104 . 7 1 1 A 22 22 GLU HA H 9 3.740 4.010 -0.270 1
1 109 . 7 1 1 A 22 22 GLU C C 9 179.960 178.590 1.370 1
1 110 . 7 1 1 A 22 22 GLU CA C 9 60.010 59.694 0.316 1
1 111 . 7 1 1 A 22 22 GLU CB C 9 29.070 29.156 -0.086 1
1 113 . 7 1 1 A 22 22 GLU N N 9 120.133 119.214 0.919 1
1 114 . 7 1 1 A 23 23 SER H H 10 7.891 7.736 0.155 1
1 115 . 7 1 1 A 23 23 SER HA H 10 4.250 4.287 -0.037 1
1 118 . 7 1 1 A 23 23 SER C C 10 175.346 176.602 -1.256 1
1 119 . 7 1 1 A 23 23 SER CA C 10 60.948 61.323 -0.375 1
1 120 . 7 1 1 A 23 23 SER CB C 10 63.280 63.034 0.246 1
1 121 . 7 1 1 A 23 23 SER N N 10 117.044 114.332 2.712 1
1 122 . 7 1 1 A 24 24 ILE H H 11 6.862 7.890 -1.028 1
1 123 . 7 1 1 A 24 24 ILE HA H 11 4.487 3.917 0.570 1
1 133 . 7 1 1 A 24 24 ILE C C 11 175.812 175.665 0.147 1
1 134 . 7 1 1 A 24 24 ILE CA C 11 60.948 63.458 -2.510 1
1 135 . 7 1 1 A 24 24 ILE CB C 11 38.250 37.197 1.053 1
1 139 . 7 1 1 A 24 24 ILE N N 11 113.733 118.042 -4.309 1
1 140 . 7 1 1 A 25 25 GLY H H 12 7.628 7.636 -0.008 1
1 141 . 7 1 1 A 25 25 GLY HA2 H 12 3.990 4.059 -0.069 1
1 142 . 7 1 1 A 25 25 GLY HA3 H 12 3.800 4.135 -0.335 1
1 143 . 7 1 1 A 25 25 GLY C C 12 173.647 171.868 1.779 1
1 144 . 7 1 1 A 25 25 GLY CA C 12 45.947 45.867 0.080 1
1 145 . 7 1 1 A 25 25 GLY N N 12 109.763 109.815 -0.052 1
1 146 . 7 1 1 A 26 26 LEU H H 13 7.620 8.352 -0.732 1
1 147 . 7 1 1 A 26 26 LEU C C 13 176.186 174.061 2.125 1
1 148 . 7 1 1 A 26 26 LEU CA C 13 52.700 51.994 0.706 1
1 149 . 7 1 1 A 26 26 LEU CB C 13 43.134 45.761 -2.627 1
1 150 . 7 1 1 A 26 26 LEU N N 13 118.778 122.456 -3.678 1
1 151 . 7 1 1 A 27 27 PRO HA H 14 4.120 4.719 -0.599 1
1 154 . 7 1 1 A 27 27 PRO C C 14 177.955 175.670 2.285 1
1 155 . 7 1 1 A 27 27 PRO CA C 14 64.698 62.267 2.431 1
1 156 . 7 1 1 A 27 27 PRO CB C 14 31.883 29.878 2.005 1
1 158 . 7 1 1 A 28 28 GLN H H 15 9.838 8.469 1.369 1
1 159 . 7 1 1 A 28 28 GLN HA H 15 4.240 4.440 -0.200 1
1 162 . 7 1 1 A 28 28 GLN C C 15 176.836 176.750 0.086 1
1 163 . 7 1 1 A 28 28 GLN CA C 15 58.135 56.654 1.481 1
1 164 . 7 1 1 A 28 28 GLN CB C 15 27.195 31.538 -4.343 1
1 166 . 7 1 1 A 28 28 GLN N N 15 120.414 120.344 0.070 1
1 167 . 7 1 1 A 29 29 TYR H H 16 6.810 8.138 -1.328 1
1 168 . 7 1 1 A 29 29 TYR HA H 16 5.720 4.525 1.195 1
1 173 . 7 1 1 A 29 29 TYR C C 16 174.814 176.567 -1.753 1
1 174 . 7 1 1 A 29 29 TYR CA C 16 57.198 58.176 -0.978 1
1 175 . 7 1 1 A 29 29 TYR CB C 16 37.509 37.723 -0.214 1
1 178 . 7 1 1 A 29 29 TYR N N 16 119.718 117.766 1.952 1
1 179 . 7 1 1 A 30 30 GLU H H 17 7.509 8.219 -0.710 1
1 180 . 7 1 1 A 30 30 GLU HA H 17 3.650 4.008 -0.358 1
1 184 . 7 1 1 A 30 30 GLU C C 17 177.552 178.422 -0.870 1
1 185 . 7 1 1 A 30 30 GLU CA C 17 60.948 59.983 0.965 1
1 186 . 7 1 1 A 30 30 GLU CB C 17 30.008 29.478 0.530 1
1 188 . 7 1 1 A 30 30 GLU N N 17 122.417 122.869 -0.452 1
1 189 . 7 1 1 A 31 31 ASN H H 18 9.259 8.075 1.184 1
1 190 . 7 1 1 A 31 31 ASN HA H 18 4.451 4.468 -0.017 1
1 193 . 7 1 1 A 31 31 ASN C C 18 176.868 177.833 -0.965 1
1 194 . 7 1 1 A 31 31 ASN CA C 18 57.198 56.483 0.715 1
1 195 . 7 1 1 A 31 31 ASN CB C 18 38.446 39.536 -1.090 1
1 196 . 7 1 1 A 31 31 ASN N N 18 116.613 118.512 -1.899 1
1 197 . 7 1 1 A 32 32 HIS H H 19 8.898 8.048 0.850 1
1 198 . 7 1 1 A 32 32 HIS HA H 19 4.140 4.253 -0.113 1
1 202 . 7 1 1 A 32 32 HIS C C 19 178.269 177.832 0.437 1
1 203 . 7 1 1 A 32 32 HIS CA C 19 60.948 59.880 1.068 1
1 204 . 7 1 1 A 32 32 HIS CB C 19 30.008 30.414 -0.406 1
1 206 . 7 1 1 A 32 32 HIS N N 19 118.926 118.542 0.384 1
1 207 . 7 1 1 A 33 33 LEU H H 20 7.825 8.707 -0.882 1
1 208 . 7 1 1 A 33 33 LEU HA H 20 4.305 3.921 0.384 1
1 218 . 7 1 1 A 33 33 LEU C C 20 179.190 179.213 -0.023 1
1 219 . 7 1 1 A 33 33 LEU CA C 20 60.010 58.401 1.609 1
1 220 . 7 1 1 A 33 33 LEU CB C 20 40.321 42.016 -1.695 1
1 224 . 7 1 1 A 33 33 LEU N N 20 117.434 119.835 -2.401 1
1 225 . 7 1 1 A 34 34 MET H H 21 8.861 8.465 0.396 1
1 226 . 7 1 1 A 34 34 MET HA H 21 3.980 4.120 -0.140 1
1 234 . 7 1 1 A 34 34 MET C C 21 180.340 177.833 2.507 1
1 235 . 7 1 1 A 34 34 MET CA C 21 58.135 58.943 -0.808 1
1 236 . 7 1 1 A 34 34 MET CB C 21 30.945 32.208 -1.263 1
1 238 . 7 1 1 A 34 34 MET N N 21 118.111 118.320 -0.209 1
1 239 . 7 1 1 A 35 35 ALA H H 22 9.015 8.522 0.493 1
1 240 . 7 1 1 A 35 35 ALA HA H 22 4.239 4.154 0.085 1
1 244 . 7 1 1 A 35 35 ALA C C 22 178.058 178.834 -0.776 1
1 245 . 7 1 1 A 35 35 ALA CA C 22 53.800 54.607 -0.807 1
1 246 . 7 1 1 A 35 35 ALA CB C 22 18.397 18.263 0.134 1
1 247 . 7 1 1 A 35 35 ALA N N 22 120.068 121.448 -1.380 1
1 248 . 7 1 1 A 36 36 ASN H H 23 7.143 7.948 -0.805 1
1 249 . 7 1 1 A 36 36 ASN HA H 23 4.959 4.790 0.169 1
1 254 . 7 1 1 A 36 36 ASN C C 23 174.083 175.599 -1.516 1
1 255 . 7 1 1 A 36 36 ASN CA C 23 54.000 53.024 0.976 1
1 256 . 7 1 1 A 36 36 ASN CB C 23 41.300 38.981 2.319 1
1 257 . 7 1 1 A 36 36 ASN N N 23 111.560 115.190 -3.630 1
1 259 . 7 1 1 A 37 37 GLY H H 24 7.797 8.161 -0.364 1
1 260 . 7 1 1 A 37 37 GLY HA2 H 24 3.430 3.746 -0.316 1
1 261 . 7 1 1 A 37 37 GLY HA3 H 24 3.290 3.867 -0.577 1
1 262 . 7 1 1 A 37 37 GLY C C 24 173.163 175.188 -2.025 1
1 263 . 7 1 1 A 37 37 GLY CA C 24 45.947 45.462 0.485 1
1 264 . 7 1 1 A 37 37 GLY N N 24 106.170 107.876 -1.706 1
1 265 . 7 1 1 A 38 38 PHE H H 25 8.191 8.049 0.142 1
1 266 . 7 1 1 A 38 38 PHE HA H 25 4.910 4.749 0.161 1
1 271 . 7 1 1 A 38 38 PHE C C 25 173.496 176.076 -2.580 1
1 272 . 7 1 1 A 38 38 PHE CA C 25 56.550 56.309 0.241 1
1 273 . 7 1 1 A 38 38 PHE CB C 25 37.220 36.868 0.352 1
1 276 . 7 1 1 A 38 38 PHE N N 25 122.454 119.659 2.795 1
1 277 . 7 1 1 A 39 39 ASP H H 26 6.756 8.096 -1.340 1
1 278 . 7 1 1 A 39 39 ASP HA H 26 5.077 4.607 0.470 1
1 281 . 7 1 1 A 39 39 ASP C C 26 177.463 175.898 1.565 1
1 282 . 7 1 1 A 39 39 ASP CA C 26 53.447 55.463 -2.016 1
1 283 . 7 1 1 A 39 39 ASP CB C 26 42.580 40.819 1.761 1
1 284 . 7 1 1 A 39 39 ASP N N 26 111.309 118.195 -6.886 1
1 285 . 7 1 1 A 40 40 ASN H H 27 7.495 7.734 -0.239 1
1 286 . 7 1 1 A 40 40 ASN HA H 27 4.820 5.039 -0.219 1
1 289 . 7 1 1 A 40 40 ASN C C 27 176.228 175.185 1.043 1
1 290 . 7 1 1 A 40 40 ASN CA C 27 52.510 52.052 0.458 1
1 291 . 7 1 1 A 40 40 ASN CB C 27 40.321 39.815 0.506 1
1 292 . 7 1 1 A 40 40 ASN N N 27 118.385 117.943 0.442 1
1 293 . 7 1 1 A 41 41 VAL H H 28 9.192 8.824 0.368 1
1 294 . 7 1 1 A 41 41 VAL HA H 28 3.550 4.102 -0.552 1
1 302 . 7 1 1 A 41 41 VAL C C 28 176.429 176.745 -0.316 1
1 303 . 7 1 1 A 41 41 VAL CA C 28 65.636 64.983 0.653 1
1 304 . 7 1 1 A 41 41 VAL CB C 28 31.883 31.846 0.037 1
1 307 . 7 1 1 A 41 41 VAL N N 28 125.741 126.401 -0.660 1
1 308 . 7 1 1 A 42 42 GLN H H 29 8.203 8.324 -0.121 1
1 309 . 7 1 1 A 42 42 GLN HA H 29 4.129 4.066 0.063 1
1 314 . 7 1 1 A 42 42 GLN C C 29 176.591 178.381 -1.790 1
1 315 . 7 1 1 A 42 42 GLN CA C 29 57.198 58.476 -1.278 1
1 316 . 7 1 1 A 42 42 GLN CB C 29 28.133 28.798 -0.665 1
1 318 . 7 1 1 A 42 42 GLN N N 29 116.452 120.864 -4.412 1
1 319 . 7 1 1 A 43 43 ALA H H 30 7.781 8.806 -1.025 1
1 320 . 7 1 1 A 43 43 ALA HA H 30 4.650 4.000 0.650 1
1 324 . 7 1 1 A 43 43 ALA C C 30 175.976 180.238 -4.262 1
1 325 . 7 1 1 A 43 43 ALA CA C 30 50.840 54.789 -3.949 1
1 326 . 7 1 1 A 43 43 ALA CB C 30 19.150 18.305 0.845 1
1 327 . 7 1 1 A 43 43 ALA N N 30 122.150 121.687 0.463 1
1 328 . 7 1 1 A 44 44 MET H H 31 7.739 8.033 -0.294 1
1 332 . 7 1 1 A 44 44 MET C C 31 178.275 177.228 1.047 1
1 333 . 7 1 1 A 44 44 MET CA C 31 55.323 57.966 -2.643 1
1 334 . 7 1 1 A 44 44 MET CB C 31 34.696 32.302 2.394 1
1 336 . 7 1 1 A 44 44 MET N N 31 118.149 117.028 1.121 1
1 337 . 7 1 1 A 45 45 GLY H H 32 7.611 8.163 -0.552 1
1 338 . 7 1 1 A 45 45 GLY N N 32 101.530 108.492 -6.962 1
1 339 . 7 1 1 A 47 47 ASN HA H 34 4.480 4.817 -0.337 1
1 342 . 7 1 1 A 47 47 ASN CA C 34 56.260 53.465 2.795 1
1 343 . 7 1 1 A 47 47 ASN CB C 34 39.384 39.556 -0.172 1
1 344 . 7 1 1 A 49 49 MET HA H 36 4.646 4.401 0.245 1
1 350 . 7 1 1 A 49 49 MET C C 36 173.651 175.407 -1.756 1
1 351 . 7 1 1 A 49 49 MET CA C 36 55.323 56.471 -1.148 1
1 352 . 7 1 1 A 49 49 MET CB C 36 35.633 33.024 2.609 1
1 355 . 7 1 1 A 50 50 GLU H H 37 9.203 8.612 0.591 1
1 356 . 7 1 1 A 50 50 GLU HA H 37 4.650 4.699 -0.049 1
1 361 . 7 1 1 A 50 50 GLU C C 37 177.008 177.258 -0.250 1
1 362 . 7 1 1 A 50 50 GLU CA C 37 54.385 54.565 -0.180 1
1 363 . 7 1 1 A 50 50 GLU CB C 37 33.758 32.275 1.483 1
1 365 . 7 1 1 A 50 50 GLU N N 37 123.229 124.566 -1.337 1
1 366 . 7 1 1 A 51 51 ASP H H 38 9.032 8.915 0.117 1
1 367 . 7 1 1 A 51 51 ASP HA H 38 4.149 4.366 -0.217 1
1 370 . 7 1 1 A 51 51 ASP C C 38 177.994 178.333 -0.339 1
1 371 . 7 1 1 A 51 51 ASP CA C 38 59.073 56.988 2.085 1
1 372 . 7 1 1 A 51 51 ASP CB C 38 43.134 39.780 3.354 1
1 373 . 7 1 1 A 51 51 ASP N N 38 122.717 121.560 1.157 1
1 374 . 7 1 1 A 52 52 GLN H H 39 8.950 8.189 0.761 1
1 375 . 7 1 1 A 52 52 GLN HA H 39 3.940 4.057 -0.117 1
1 378 . 7 1 1 A 52 52 GLN C C 39 177.817 178.117 -0.300 1
1 379 . 7 1 1 A 52 52 GLN CA C 39 59.073 58.853 0.220 1
1 380 . 7 1 1 A 52 52 GLN CB C 39 28.133 28.903 -0.770 1
1 381 . 7 1 1 A 52 52 GLN N N 39 114.086 119.319 -5.233 1
1 382 . 7 1 1 A 53 53 ASP H H 40 7.214 8.213 -0.999 1
1 383 . 7 1 1 A 53 53 ASP HA H 40 4.370 4.522 -0.152 1
1 386 . 7 1 1 A 53 53 ASP C C 40 177.667 178.522 -0.855 1
1 387 . 7 1 1 A 53 53 ASP CA C 40 57.198 57.420 -0.222 1
1 388 . 7 1 1 A 53 53 ASP CB C 40 41.800 40.330 1.470 1
1 389 . 7 1 1 A 53 53 ASP N N 40 118.734 119.303 -0.569 1
1 390 . 7 1 1 A 54 54 LEU H H 41 7.180 8.087 -0.907 1
1 391 . 7 1 1 A 54 54 LEU HA H 41 3.990 3.962 0.028 1
1 400 . 7 1 1 A 54 54 LEU C C 41 178.204 178.101 0.103 1
1 401 . 7 1 1 A 54 54 LEU CA C 41 56.260 58.204 -1.944 1
1 402 . 7 1 1 A 54 54 LEU CB C 41 41.259 41.703 -0.444 1
1 405 . 7 1 1 A 54 54 LEU N N 41 115.795 122.608 -6.813 1
1 406 . 7 1 1 A 55 55 LEU H H 42 7.823 7.808 0.015 1
1 407 . 7 1 1 A 55 55 LEU HA H 42 3.920 4.194 -0.274 1
1 416 . 7 1 1 A 55 55 LEU C C 42 180.876 178.528 2.348 1
1 417 . 7 1 1 A 55 55 LEU CA C 42 58.135 56.355 1.780 1
1 418 . 7 1 1 A 55 55 LEU CB C 42 42.196 41.746 0.450 1
1 421 . 7 1 1 A 55 55 LEU N N 42 120.499 119.514 0.985 1
1 422 . 7 1 1 A 56 56 GLU H H 43 8.127 8.155 -0.028 1
1 423 . 7 1 1 A 56 56 GLU HA H 43 3.966 4.124 -0.158 1
1 428 . 7 1 1 A 56 56 GLU C C 43 178.801 179.418 -0.617 1
1 429 . 7 1 1 A 56 56 GLU CA C 43 60.010 59.156 0.854 1
1 430 . 7 1 1 A 56 56 GLU CB C 43 29.070 29.480 -0.410 1
1 432 . 7 1 1 A 56 56 GLU N N 43 120.955 119.323 1.632 1
1 433 . 7 1 1 A 57 57 ILE H H 44 7.504 7.636 -0.132 1
1 434 . 7 1 1 A 57 57 ILE HA H 44 4.524 4.135 0.389 1
1 444 . 7 1 1 A 57 57 ILE C C 44 175.691 177.129 -1.438 1
1 445 . 7 1 1 A 57 57 ILE CA C 44 61.886 64.400 -2.514 1
1 446 . 7 1 1 A 57 57 ILE CB C 44 37.300 38.470 -1.170 1
1 450 . 7 1 1 A 57 57 ILE N N 44 109.594 118.204 -8.610 1
1 451 . 7 1 1 A 58 58 GLY H H 45 7.724 7.685 0.039 1
1 452 . 7 1 1 A 58 58 GLY HA2 H 45 3.650 4.220 -0.570 1
1 453 . 7 1 1 A 58 58 GLY HA3 H 45 4.530 4.369 0.161 1
1 454 . 7 1 1 A 58 58 GLY C C 45 174.613 174.337 0.276 1
1 455 . 7 1 1 A 58 58 GLY CA C 45 45.947 45.321 0.626 1
1 456 . 7 1 1 A 58 58 GLY N N 45 106.680 106.664 0.016 1
1 457 . 7 1 1 A 59 59 ILE H H 46 8.180 7.928 0.252 1
1 458 . 7 1 1 A 59 59 ILE HA H 46 3.907 4.563 -0.656 1
1 468 . 7 1 1 A 59 59 ILE C C 46 174.235 175.526 -1.291 1
1 469 . 7 1 1 A 59 59 ILE CA C 46 60.948 60.244 0.704 1
1 470 . 7 1 1 A 59 59 ILE CB C 46 33.980 39.424 -5.444 1
1 474 . 7 1 1 A 59 59 ILE N N 46 122.454 121.264 1.190 1
1 475 . 7 1 1 A 60 60 LEU H H 47 7.367 8.837 -1.470 1
1 476 . 7 1 1 A 60 60 LEU HA H 47 3.900 4.777 -0.877 1
1 479 . 7 1 1 A 60 60 LEU C C 47 177.753 177.736 0.017 1
1 480 . 7 1 1 A 60 60 LEU CA C 47 56.260 53.472 2.788 1
1 481 . 7 1 1 A 60 60 LEU CB C 47 42.196 43.140 -0.944 1
1 482 . 7 1 1 A 60 60 LEU N N 47 125.835 126.588 -0.753 1
1 483 . 7 1 1 A 63 63 GLY HA2 H 50 3.980 4.026 -0.046 1
1 484 . 7 1 1 A 63 63 GLY HA3 H 50 3.950 4.046 -0.096 1
1 485 . 7 1 1 A 63 63 GLY C C 50 177.130 174.886 2.244 1
1 486 . 7 1 1 A 63 63 GLY CA C 50 46.884 45.510 1.374 1
1 487 . 7 1 1 A 64 64 HIS H H 51 7.926 8.082 -0.156 1
1 488 . 7 1 1 A 64 64 HIS HA H 51 4.451 3.978 0.473 1
1 493 . 7 1 1 A 64 64 HIS C C 51 177.613 177.161 0.452 1
1 494 . 7 1 1 A 64 64 HIS CA C 51 57.198 59.194 -1.996 1
1 495 . 7 1 1 A 64 64 HIS CB C 51 30.945 29.632 1.313 1
1 498 . 7 1 1 A 64 64 HIS N N 51 122.284 121.693 0.591 1
1 499 . 7 1 1 A 65 65 ARG H H 52 8.105 8.140 -0.035 1
1 500 . 7 1 1 A 65 65 ARG HA H 52 3.685 3.717 -0.032 1
1 507 . 7 1 1 A 65 65 ARG C C 52 177.769 178.586 -0.817 1
1 508 . 7 1 1 A 65 65 ARG CA C 52 61.886 59.811 2.075 1
1 509 . 7 1 1 A 65 65 ARG CB C 52 30.945 29.987 0.958 1
1 511 . 7 1 1 A 65 65 ARG N N 52 117.775 118.842 -1.067 1
1 513 . 7 1 1 A 66 66 GLN H H 53 8.090 7.917 0.173 1
1 514 . 7 1 1 A 66 66 GLN HA H 53 3.940 3.960 -0.020 1
1 519 . 7 1 1 A 66 66 GLN C C 53 178.583 178.025 0.558 1
1 520 . 7 1 1 A 66 66 GLN CA C 53 59.073 58.983 0.090 1
1 521 . 7 1 1 A 66 66 GLN CB C 53 28.133 28.413 -0.280 1
1 523 . 7 1 1 A 66 66 GLN N N 53 116.452 118.252 -1.800 1
1 524 . 7 1 1 A 67 67 ARG H H 54 7.845 7.710 0.135 1
1 525 . 7 1 1 A 67 67 ARG HA H 54 4.010 3.921 0.089 1
1 528 . 7 1 1 A 67 67 ARG C C 54 179.766 178.869 0.897 1
1 529 . 7 1 1 A 67 67 ARG CA C 54 59.073 58.980 0.093 1
1 530 . 7 1 1 A 67 67 ARG CB C 54 30.720 29.459 1.261 1
1 532 . 7 1 1 A 67 67 ARG N N 54 119.275 118.830 0.445 1
1 533 . 7 1 1 A 68 68 ILE H H 55 8.032 7.736 0.296 1
1 534 . 7 1 1 A 68 68 ILE HA H 55 3.495 3.436 0.059 1
1 544 . 7 1 1 A 68 68 ILE C C 55 177.108 178.592 -1.484 1
1 545 . 7 1 1 A 68 68 ILE CA C 55 66.230 64.972 1.258 1
1 546 . 7 1 1 A 68 68 ILE CB C 55 38.020 37.203 0.817 1
1 550 . 7 1 1 A 68 68 ILE N N 55 121.152 120.110 1.042 1
1 551 . 7 1 1 A 69 69 LEU H H 56 8.490 8.082 0.408 1
1 552 . 7 1 1 A 69 69 LEU HA H 56 4.010 3.767 0.243 1
1 561 . 7 1 1 A 69 69 LEU C C 56 179.917 178.956 0.961 1
1 562 . 7 1 1 A 69 69 LEU CA C 56 58.135 58.107 0.028 1
1 563 . 7 1 1 A 69 69 LEU CB C 56 41.259 41.626 -0.367 1
1 566 . 7 1 1 A 69 69 LEU N N 56 119.072 121.006 -1.934 1
1 567 . 7 1 1 A 70 70 GLN H H 57 8.327 8.599 -0.272 1
1 568 . 7 1 1 A 70 70 GLN HA H 57 4.100 3.907 0.193 1
1 573 . 7 1 1 A 70 70 GLN C C 57 178.798 177.919 0.879 1
1 574 . 7 1 1 A 70 70 GLN CA C 57 59.073 59.112 -0.039 1
1 575 . 7 1 1 A 70 70 GLN CB C 57 28.133 28.580 -0.447 1
1 577 . 7 1 1 A 70 70 GLN N N 57 118.172 117.961 0.211 1
1 578 . 7 1 1 A 71 71 ALA H H 58 7.810 7.833 -0.023 1
1 579 . 7 1 1 A 71 71 ALA HA H 58 4.320 4.112 0.208 1
1 583 . 7 1 1 A 71 71 ALA C C 58 172.232 179.688 -7.456 1
1 584 . 7 1 1 A 71 71 ALA CA C 58 55.323 55.229 0.094 1
1 585 . 7 1 1 A 71 71 ALA CB C 58 19.720 18.837 0.883 1
1 586 . 7 1 1 A 71 71 ALA N N 58 122.536 121.536 1.000 1
1 587 . 7 1 1 A 72 72 ILE H H 59 8.840 8.436 0.404 1
1 588 . 7 1 1 A 72 72 ILE HA H 59 4.030 3.917 0.113 1
1 598 . 7 1 1 A 72 72 ILE C C 59 178.678 177.304 1.374 1
1 599 . 7 1 1 A 72 72 ILE CA C 59 64.698 63.483 1.215 1
1 600 . 7 1 1 A 72 72 ILE CB C 59 37.850 37.676 0.174 1
1 604 . 7 1 1 A 72 72 ILE N N 59 118.111 118.558 -0.447 1
1 605 . 7 1 1 A 73 73 GLN H H 60 7.547 7.862 -0.315 1
1 606 . 7 1 1 A 73 73 GLN HA H 60 4.121 4.140 -0.019 1
1 611 . 7 1 1 A 73 73 GLN C C 60 176.556 177.316 -0.760 1
1 612 . 7 1 1 A 73 73 GLN CA C 60 58.135 58.175 -0.040 1
1 613 . 7 1 1 A 73 73 GLN CB C 60 28.300 28.686 -0.386 1
1 615 . 7 1 1 A 73 73 GLN N N 60 119.094 120.940 -1.846 1
1 616 . 7 1 1 A 74 74 LEU H H 61 7.350 7.835 -0.485 1
1 617 . 7 1 1 A 74 74 LEU HA H 61 4.408 4.550 -0.142 1
1 626 . 7 1 1 A 74 74 LEU C C 61 177.960 177.095 0.865 1
1 627 . 7 1 1 A 74 74 LEU CA C 61 54.900 55.093 -0.193 1
1 628 . 7 1 1 A 74 74 LEU CB C 61 42.196 42.252 -0.056 1
1 631 . 7 1 1 A 74 74 LEU N N 61 115.853 113.518 2.335 1
1 632 . 7 1 1 A 75 75 LEU H H 62 7.358 7.371 -0.013 1
1 633 . 7 1 1 A 75 75 LEU HA H 62 4.530 4.376 0.154 1
1 642 . 7 1 1 A 75 75 LEU C C 62 177.035 174.927 2.108 1
1 643 . 7 1 1 A 75 75 LEU CA C 62 53.200 53.825 -0.625 1
1 644 . 7 1 1 A 75 75 LEU CB C 62 40.700 41.391 -0.691 1
1 647 . 7 1 1 A 75 75 LEU N N 62 121.010 124.675 -3.665 1
1 648 . 7 1 1 A 76 76 PRO HA H 63 4.382 4.585 -0.203 1
1 655 . 7 1 1 A 76 76 PRO CB C 63 31.883 33.261 -1.378 1
1 657 . 7 1 1 A 77 77 LYS H H 64 8.418 8.575 -0.157 1
1 658 . 7 1 1 A 77 77 LYS HA H 64 4.140 4.793 -0.653 1
1 663 . 7 1 1 A 77 77 LYS C C 64 177.122 176.307 0.815 1
1 664 . 7 1 1 A 77 77 LYS CA C 64 56.260 55.078 1.182 1
1 665 . 7 1 1 A 77 77 LYS CB C 64 33.340 34.503 -1.163 1
1 668 . 7 1 1 A 77 77 LYS N N 64 121.932 120.500 1.432 1
1 669 . 7 1 1 A 78 78 MET H H 65 8.550 8.791 -0.241 1
1 670 . 7 1 1 A 78 78 MET HA H 65 4.304 4.134 0.170 1
1 676 . 7 1 1 A 78 78 MET C C 65 176.105 176.158 -0.053 1
1 677 . 7 1 1 A 78 78 MET CA C 65 56.260 58.021 -1.761 1
1 678 . 7 1 1 A 78 78 MET CB C 65 32.821 32.792 0.029 1
1 680 . 7 1 1 A 78 78 MET N N 65 123.498 123.996 -0.498 1
1 681 . 7 1 1 A 79 79 ARG H H 66 8.731 7.836 0.895 1
1 682 . 7 1 1 A 79 79 ARG C C 66 173.577 175.849 -2.272 1
1 683 . 7 1 1 A 79 79 ARG CA C 66 53.447 52.912 0.535 1
1 684 . 7 1 1 A 79 79 ARG CB C 66 30.008 33.554 -3.546 1
1 685 . 7 1 1 A 79 79 ARG N N 66 127.355 117.350 10.005 1
1 686 . 7 1 1 A 80 80 PRO HA H 67 4.780 4.451 0.329 1
1 693 . 7 1 1 A 80 80 PRO C C 67 177.043 176.358 0.685 1
1 694 . 7 1 1 A 80 80 PRO CA C 67 61.886 64.437 -2.551 1
1 695 . 7 1 1 A 80 80 PRO CB C 67 32.821 31.956 0.865 1
1 698 . 7 1 1 A 81 81 ILE H H 68 8.580 7.636 0.944 1
1 699 . 7 1 1 A 81 81 ILE HA H 68 4.040 4.008 0.032 1
1 709 . 7 1 1 A 81 81 ILE C C 68 176.831 176.425 0.406 1
1 710 . 7 1 1 A 81 81 ILE CA C 68 62.823 61.037 1.786 1
1 711 . 7 1 1 A 81 81 ILE CB C 68 38.580 37.759 0.821 1
1 715 . 7 1 1 A 81 81 ILE N N 68 118.491 119.723 -1.232 1
1 716 . 7 1 1 A 82 82 GLY H H 69 8.602 8.387 0.215 1
1 717 . 7 1 1 A 82 82 GLY CA C 69 45.009 45.681 -0.672 1
1 718 . 7 1 1 A 82 82 GLY N N 69 111.377 116.041 -4.664 1
1 721 . 7 1 1 A 84 84 ASP HA H 71 4.490 4.656 -0.166 1
1 724 . 7 1 1 A 84 84 ASP CA C 71 54.385 53.380 1.005 1
1 725 . 7 1 1 A 84 84 ASP CB C 71 40.321 41.939 -1.618 1
1 726 . 7 1 1 A 85 85 GLY H H 72 8.054 8.569 -0.515 1
1 727 . 7 1 1 A 85 85 GLY HA2 H 72 4.040 3.859 0.181 1
1 728 . 7 1 1 A 85 85 GLY HA3 H 72 3.750 3.866 -0.116 1
1 729 . 7 1 1 A 85 85 GLY C C 72 173.474 174.105 -0.631 1
1 730 . 7 1 1 A 85 85 GLY CA C 72 45.009 46.980 -1.971 1
1 731 . 7 1 1 A 85 85 GLY N N 72 108.038 108.648 -0.610 1
1 732 . 7 1 1 A 86 86 ALA H H 73 7.858 7.714 0.144 1
1 733 . 7 1 1 A 86 86 ALA HA H 73 4.370 4.690 -0.320 1
1 737 . 7 1 1 A 86 86 ALA CA C 73 51.990 50.811 1.179 1
1 738 . 7 1 1 A 86 86 ALA CB C 73 19.220 22.209 -2.989 1
1 739 . 7 1 1 A 86 86 ALA N N 73 123.819 122.561 1.258 1
1 742 . 7 1 1 A 90 90 SER H H 77 7.839 7.828 0.011 1
1 743 . 7 1 1 A 90 90 SER HA H 77 4.770 4.797 -0.027 1
1 746 . 7 1 1 A 90 90 SER N N 77 115.163 112.734 2.429 1
1 747 . 7 1 1 A 91 91 VAL H H 78 8.578 9.022 -0.444 1
1 748 . 7 1 1 A 91 91 VAL HA H 78 3.981 3.907 0.074 1
1 756 . 7 1 1 A 91 91 VAL C C 78 177.480 177.460 0.020 1
1 757 . 7 1 1 A 91 91 VAL CA C 78 67.060 66.192 0.868 1
1 758 . 7 1 1 A 91 91 VAL CB C 78 32.500 31.592 0.908 1
1 761 . 7 1 1 A 91 91 VAL N N 78 123.481 124.695 -1.214 1
1 762 . 7 1 1 A 92 92 ALA H H 79 8.607 8.262 0.345 1
1 763 . 7 1 1 A 92 92 ALA HA H 79 4.113 3.973 0.140 1
1 767 . 7 1 1 A 92 92 ALA C C 79 179.868 179.246 0.622 1
1 768 . 7 1 1 A 92 92 ALA CA C 79 54.890 55.727 -0.837 1
1 769 . 7 1 1 A 92 92 ALA CB C 79 18.790 18.592 0.198 1
1 770 . 7 1 1 A 92 92 ALA N N 79 120.334 122.097 -1.763 1
1 771 . 7 1 1 A 93 93 GLU H H 80 7.886 8.200 -0.314 1
1 772 . 7 1 1 A 93 93 GLU HA H 80 4.010 4.006 0.004 1
1 777 . 7 1 1 A 93 93 GLU C C 80 179.719 178.658 1.061 1
1 778 . 7 1 1 A 93 93 GLU CA C 80 59.073 59.233 -0.160 1
1 779 . 7 1 1 A 93 93 GLU CB C 80 30.630 29.506 1.124 1
1 781 . 7 1 1 A 93 93 GLU N N 80 117.643 118.519 -0.876 1
1 782 . 7 1 1 A 94 94 TRP H H 81 8.299 8.037 0.262 1
1 783 . 7 1 1 A 94 94 TRP HA H 81 4.251 4.281 -0.030 1
1 792 . 7 1 1 A 94 94 TRP C C 81 178.772 178.078 0.694 1
1 793 . 7 1 1 A 94 94 TRP CA C 81 60.010 61.456 -1.446 1
1 794 . 7 1 1 A 94 94 TRP CB C 81 27.650 29.906 -2.256 1
1 800 . 7 1 1 A 94 94 TRP N N 81 122.545 122.145 0.400 1
1 802 . 7 1 1 A 95 95 LEU H H 82 8.505 8.528 -0.023 1
1 803 . 7 1 1 A 95 95 LEU HA H 82 2.880 3.101 -0.221 1
1 812 . 7 1 1 A 95 95 LEU C C 82 180.235 178.881 1.354 1
1 813 . 7 1 1 A 95 95 LEU CA C 82 57.400 56.859 0.541 1
1 814 . 7 1 1 A 95 95 LEU CB C 82 40.321 40.871 -0.550 1
1 817 . 7 1 1 A 95 95 LEU N N 82 121.110 119.078 2.032 1
1 818 . 7 1 1 A 96 96 ASP H H 83 8.185 8.222 -0.037 1
1 819 . 7 1 1 A 96 96 ASP HA H 83 4.280 4.380 -0.100 1
1 822 . 7 1 1 A 96 96 ASP C C 83 175.224 177.378 -2.154 1
1 823 . 7 1 1 A 96 96 ASP CA C 83 57.310 56.627 0.683 1
1 824 . 7 1 1 A 96 96 ASP CB C 83 40.321 41.131 -0.810 1
1 825 . 7 1 1 A 96 96 ASP N N 83 119.082 119.933 -0.851 1
1 826 . 7 1 1 A 97 97 SER H H 84 7.989 7.909 0.080 1
1 827 . 7 1 1 A 97 97 SER HA H 84 4.250 4.360 -0.110 1
1 830 . 7 1 1 A 97 97 SER C C 84 175.346 174.680 0.666 1
1 831 . 7 1 1 A 97 97 SER CA C 84 60.948 59.895 1.053 1
1 832 . 7 1 1 A 97 97 SER CB C 84 63.370 63.987 -0.617 1
1 833 . 7 1 1 A 97 97 SER N N 84 117.579 114.568 3.011 1
1 834 . 7 1 1 A 98 98 ILE H H 85 6.862 7.407 -0.545 1
1 835 . 7 1 1 A 98 98 ILE HA H 85 4.550 4.062 0.488 1
1 843 . 7 1 1 A 98 98 ILE C C 85 173.308 174.857 -1.549 1
1 844 . 7 1 1 A 98 98 ILE CA C 85 60.948 60.678 0.270 1
1 845 . 7 1 1 A 98 98 ILE CB C 85 37.760 37.653 0.107 1
1 848 . 7 1 1 A 98 98 ILE N N 85 113.733 116.798 -3.065 1
1 849 . 7 1 1 A 99 99 GLU H H 86 7.705 7.896 -0.191 1
1 850 . 7 1 1 A 99 99 GLU HA H 86 4.280 3.841 0.439 1
1 853 . 7 1 1 A 99 99 GLU C C 86 175.224 174.676 0.548 1
1 854 . 7 1 1 A 99 99 GLU CA C 86 56.260 57.592 -1.332 1
1 855 . 7 1 1 A 99 99 GLU CB C 86 26.258 27.138 -0.880 1
1 857 . 7 1 1 A 99 99 GLU N N 86 115.493 118.680 -3.187 1
1 858 . 7 1 1 A 100 100 LEU H H 87 7.989 7.138 0.851 1
1 859 . 7 1 1 A 100 100 LEU HA H 87 4.220 4.757 -0.537 1
1 868 . 7 1 1 A 100 100 LEU C C 87 176.965 175.837 1.128 1
1 869 . 7 1 1 A 100 100 LEU CA C 87 52.510 53.197 -0.687 1
1 870 . 7 1 1 A 100 100 LEU CB C 87 42.196 44.571 -2.375 1
1 873 . 7 1 1 A 100 100 LEU N N 87 117.579 119.554 -1.975 1
1 874 . 7 1 1 A 101 101 GLY H H 88 8.503 8.142 0.361 1
1 875 . 7 1 1 A 101 101 GLY CA C 88 46.884 45.864 1.020 1
1 876 . 7 1 1 A 101 101 GLY N N 88 107.794 113.344 -5.550 1
1 877 . 7 1 1 A 102 102 ASP HA H 89 4.431 4.283 0.148 1
1 880 . 7 1 1 A 102 102 ASP C C 89 178.075 178.389 -0.314 1
1 881 . 7 1 1 A 102 102 ASP CA C 89 57.198 56.711 0.487 1
1 882 . 7 1 1 A 102 102 ASP CB C 89 40.321 40.092 0.229 1
1 883 . 7 1 1 A 103 103 TYR H H 90 7.899 7.999 -0.100 1
1 884 . 7 1 1 A 103 103 TYR HA H 90 4.940 4.389 0.551 1
1 889 . 7 1 1 A 103 103 TYR C C 90 175.527 178.413 -2.886 1
1 890 . 7 1 1 A 103 103 TYR CA C 90 58.135 60.460 -2.325 1
1 891 . 7 1 1 A 103 103 TYR CB C 90 38.446 37.527 0.919 1
1 894 . 7 1 1 A 103 103 TYR N N 90 115.595 119.120 -3.525 1
1 895 . 7 1 1 A 104 104 THR H H 91 7.971 8.373 -0.402 1
1 896 . 7 1 1 A 104 104 THR HA H 91 4.234 4.025 0.209 1
1 901 . 7 1 1 A 104 104 THR C C 91 175.905 176.625 -0.720 1
1 902 . 7 1 1 A 104 104 THR CA C 91 68.449 67.209 1.240 1
1 904 . 7 1 1 A 104 104 THR N N 91 118.867 116.777 2.090 1
1 905 . 7 1 1 A 105 105 LYS H H 92 8.555 8.223 0.332 1
1 906 . 7 1 1 A 105 105 LYS HA H 92 3.940 4.059 -0.119 1
1 912 . 7 1 1 A 105 105 LYS C C 92 177.310 178.892 -1.582 1
1 913 . 7 1 1 A 105 105 LYS CA C 92 60.948 59.615 1.333 1
1 914 . 7 1 1 A 105 105 LYS CB C 92 31.883 32.388 -0.505 1
1 917 . 7 1 1 A 105 105 LYS N N 92 119.259 120.240 -0.981 1
1 918 . 7 1 1 A 106 106 ALA H H 93 7.920 8.063 -0.143 1
1 919 . 7 1 1 A 106 106 ALA HA H 93 4.128 4.161 -0.033 1
1 923 . 7 1 1 A 106 106 ALA C C 93 180.972 180.365 0.607 1
1 924 . 7 1 1 A 106 106 ALA CA C 93 55.070 55.156 -0.086 1
1 925 . 7 1 1 A 106 106 ALA CB C 93 17.750 18.494 -0.744 1
1 926 . 7 1 1 A 106 106 ALA N N 93 120.398 121.953 -1.555 1
1 927 . 7 1 1 A 107 107 PHE H H 94 8.136 8.509 -0.373 1
1 928 . 7 1 1 A 107 107 PHE HA H 94 4.190 4.599 -0.409 1
1 934 . 7 1 1 A 107 107 PHE C C 94 177.955 178.274 -0.319 1
1 935 . 7 1 1 A 107 107 PHE CA C 94 63.761 61.562 2.199 1
1 936 . 7 1 1 A 107 107 PHE CB C 94 38.446 38.772 -0.326 1
1 940 . 7 1 1 A 107 107 PHE N N 94 117.119 116.273 0.846 1
1 941 . 7 1 1 A 108 108 LEU H H 95 8.351 8.635 -0.284 1
1 942 . 7 1 1 A 108 108 LEU HA H 95 3.889 3.976 -0.087 1
1 951 . 7 1 1 A 108 108 LEU C C 95 182.043 179.215 2.828 1
1 952 . 7 1 1 A 108 108 LEU CA C 95 59.073 58.558 0.515 1
1 953 . 7 1 1 A 108 108 LEU CB C 95 41.259 41.982 -0.723 1
1 956 . 7 1 1 A 108 108 LEU N N 95 118.450 119.846 -1.396 1
1 957 . 7 1 1 A 109 109 ILE H H 96 8.992 8.138 0.854 1
1 958 . 7 1 1 A 109 109 ILE HA H 96 4.069 3.861 0.208 1
1 968 . 7 1 1 A 109 109 ILE C C 96 177.094 177.740 -0.646 1
1 969 . 7 1 1 A 109 109 ILE CA C 96 63.761 64.476 -0.715 1
1 970 . 7 1 1 A 109 109 ILE CB C 96 37.509 37.713 -0.204 1
1 974 . 7 1 1 A 109 109 ILE N N 96 118.177 115.006 3.171 1
1 975 . 7 1 1 A 110 110 ASN H H 97 7.067 8.205 -1.138 1
1 976 . 7 1 1 A 110 110 ASN HA H 97 4.797 4.611 0.186 1
1 981 . 7 1 1 A 110 110 ASN C C 97 173.595 175.665 -2.070 1
1 982 . 7 1 1 A 110 110 ASN CA C 97 54.385 53.401 0.984 1
1 983 . 7 1 1 A 110 110 ASN CB C 97 40.321 39.024 1.297 1
1 984 . 7 1 1 A 110 110 ASN N N 97 116.407 119.678 -3.271 1
1 986 . 7 1 1 A 111 111 GLY H H 98 7.681 7.931 -0.250 1
1 987 . 7 1 1 A 111 111 GLY HA2 H 98 4.080 3.915 0.165 1
1 988 . 7 1 1 A 111 111 GLY HA3 H 98 3.640 3.997 -0.357 1
1 989 . 7 1 1 A 111 111 GLY C C 98 174.552 174.486 0.066 1
1 990 . 7 1 1 A 111 111 GLY CA C 98 45.947 45.478 0.469 1
1 991 . 7 1 1 A 111 111 GLY N N 98 104.440 106.359 -1.919 1
1 992 . 7 1 1 A 112 112 TYR H H 99 8.427 8.155 0.272 1
1 993 . 7 1 1 A 112 112 TYR HA H 99 4.661 4.745 -0.084 1
1 998 . 7 1 1 A 112 112 TYR C C 99 174.425 176.557 -2.132 1
1 999 . 7 1 1 A 112 112 TYR CA C 99 57.198 57.979 -0.781 1
1 1000 . 7 1 1 A 112 112 TYR CB C 99 36.571 38.002 -1.431 1
1 1003 . 7 1 1 A 112 112 TYR N N 99 122.830 119.573 3.257 1
1 1004 . 7 1 1 A 113 113 THR H H 100 7.166 8.185 -1.019 1
1 1005 . 7 1 1 A 113 113 THR HA H 100 4.248 4.222 0.026 1
1 1009 . 7 1 1 A 113 113 THR C C 100 174.897 174.667 0.230 1
1 1010 . 7 1 1 A 113 113 THR CA C 100 62.290 64.862 -2.572 1
1 1011 . 7 1 1 A 113 113 THR CB C 100 68.970 68.801 0.169 1
1 1013 . 7 1 1 A 113 113 THR N N 100 104.304 112.989 -8.685 1
1 1014 . 7 1 1 A 114 114 SER H H 101 7.695 7.842 -0.147 1
1 1015 . 7 1 1 A 114 114 SER C C 101 174.372 174.442 -0.070 1
1 1016 . 7 1 1 A 114 114 SER CA C 101 56.260 57.327 -1.067 1
1 1017 . 7 1 1 A 114 114 SER CB C 101 65.636 64.722 0.914 1
1 1018 . 7 1 1 A 114 114 SER N N 101 115.613 117.778 -2.165 1
1 1023 . 7 1 1 A 116 116 ASP HA H 103 4.260 4.357 -0.097 1
1 1026 . 7 1 1 A 116 116 ASP CA C 103 57.198 56.624 0.574 1
1 1027 . 7 1 1 A 116 116 ASP CB C 103 40.321 39.694 0.627 1
1 1028 . 7 1 1 A 117 117 LEU H H 104 7.345 7.753 -0.408 1
1 1029 . 7 1 1 A 117 117 LEU HA H 104 4.290 4.057 0.233 1
1 1038 . 7 1 1 A 117 117 LEU C C 104 178.488 178.582 -0.094 1
1 1039 . 7 1 1 A 117 117 LEU CA C 104 56.260 57.954 -1.694 1
1 1040 . 7 1 1 A 117 117 LEU CB C 104 42.196 41.630 0.566 1
1 1043 . 7 1 1 A 117 117 LEU N N 104 117.878 122.420 -4.542 1
1 1044 . 7 1 1 A 118 118 LEU H H 105 7.514 8.289 -0.775 1
1 1045 . 7 1 1 A 118 118 LEU HA H 105 4.210 4.120 0.090 1
1 1054 . 7 1 1 A 118 118 LEU C C 105 177.002 177.707 -0.705 1
1 1055 . 7 1 1 A 118 118 LEU CA C 105 55.323 57.059 -1.736 1
1 1056 . 7 1 1 A 118 118 LEU CB C 105 42.196 41.623 0.573 1
1 1059 . 7 1 1 A 118 118 LEU N N 105 119.094 118.746 0.348 1
1 1060 . 7 1 1 A 120 120 LYS HA H 107 4.340 4.498 -0.158 1
1 1063 . 7 1 1 A 120 120 LYS C C 107 176.603 175.397 1.206 1
1 1064 . 7 1 1 A 120 120 LYS CA C 107 55.323 55.623 -0.300 1
1 1065 . 7 1 1 A 120 120 LYS CB C 107 31.883 33.202 -1.319 1
1 1068 . 7 1 1 A 121 121 ILE H H 108 7.539 7.588 -0.049 1
1 1069 . 7 1 1 A 121 121 ILE HA H 108 3.987 4.984 -0.997 1
1 1079 . 7 1 1 A 121 121 ILE C C 108 173.247 175.104 -1.857 1
1 1080 . 7 1 1 A 121 121 ILE CA C 108 62.823 58.754 4.069 1
1 1081 . 7 1 1 A 121 121 ILE CB C 108 38.446 42.062 -3.616 1
1 1085 . 7 1 1 A 121 121 ILE N N 108 122.417 117.815 4.602 1
1 1086 . 7 1 1 A 122 122 ALA H H 109 8.290 8.385 -0.095 1
1 1087 . 7 1 1 A 122 122 ALA HA H 109 3.970 4.701 -0.731 1
1 1091 . 7 1 1 A 122 122 ALA C C 109 178.318 178.876 -0.558 1
1 1092 . 7 1 1 A 122 122 ALA CA C 109 50.150 50.306 -0.156 1
1 1093 . 7 1 1 A 122 122 ALA CB C 109 21.630 20.652 0.978 1
1 1094 . 7 1 1 A 122 122 ALA N N 109 127.784 125.266 2.518 1
1 1095 . 7 1 1 A 123 123 GLU HA H 110 3.707 4.102 -0.395 1
1 1099 . 7 1 1 A 123 123 GLU C C 110 178.290 178.723 -0.433 1
1 1100 . 7 1 1 A 123 123 GLU CA C 110 60.948 59.422 1.526 1
1 1101 . 7 1 1 A 123 123 GLU CB C 110 29.070 29.055 0.015 1
1 1102 . 7 1 1 A 124 124 VAL H H 111 8.333 8.090 0.243 1
1 1103 . 7 1 1 A 124 124 VAL HA H 111 3.850 3.865 -0.015 1
1 1111 . 7 1 1 A 124 124 VAL C C 111 177.406 177.745 -0.339 1
1 1112 . 7 1 1 A 124 124 VAL CA C 111 65.636 64.824 0.812 1
1 1113 . 7 1 1 A 124 124 VAL CB C 111 30.730 31.467 -0.737 1
1 1116 . 7 1 1 A 124 124 VAL N N 111 114.438 120.197 -5.759 1
1 1117 . 7 1 1 A 125 125 GLU H H 112 7.442 8.324 -0.882 1
1 1118 . 7 1 1 A 125 125 GLU HA H 112 4.152 4.107 0.045 1
1 1123 . 7 1 1 A 125 125 GLU C C 112 179.982 179.233 0.749 1
1 1124 . 7 1 1 A 125 125 GLU CA C 112 60.010 59.568 0.442 1
1 1125 . 7 1 1 A 125 125 GLU CB C 112 30.008 29.050 0.958 1
1 1127 . 7 1 1 A 125 125 GLU N N 112 121.032 121.989 -0.957 1
1 1128 . 7 1 1 A 126 126 LEU H H 113 7.666 7.783 -0.117 1
1 1129 . 7 1 1 A 126 126 LEU HA H 113 3.846 4.071 -0.225 1
1 1138 . 7 1 1 A 126 126 LEU C C 113 176.991 178.381 -1.390 1
1 1139 . 7 1 1 A 126 126 LEU CA C 113 58.135 57.991 0.144 1
1 1140 . 7 1 1 A 126 126 LEU CB C 113 41.259 41.797 -0.538 1
1 1143 . 7 1 1 A 126 126 LEU N N 113 118.731 121.006 -2.275 1
1 1144 . 7 1 1 A 127 127 ILE H H 114 7.781 8.056 -0.275 1
1 1145 . 7 1 1 A 127 127 ILE HA H 114 3.502 3.812 -0.310 1
1 1153 . 7 1 1 A 127 127 ILE C C 114 178.195 178.228 -0.033 1
1 1154 . 7 1 1 A 127 127 ILE CA C 114 65.636 64.269 1.367 1
1 1155 . 7 1 1 A 127 127 ILE CB C 114 40.321 37.470 2.851 1
1 1159 . 7 1 1 A 127 127 ILE N N 114 115.084 120.135 -5.051 1
1 1160 . 7 1 1 A 128 128 ASN H H 115 8.470 7.692 0.778 1
1 1161 . 7 1 1 A 128 128 ASN HA H 115 4.502 4.744 -0.242 1
1 1166 . 7 1 1 A 128 128 ASN C C 115 176.295 177.341 -1.046 1
1 1167 . 7 1 1 A 128 128 ASN CA C 115 56.260 55.213 1.047 1
1 1168 . 7 1 1 A 128 128 ASN CB C 115 39.384 39.442 -0.058 1
1 1169 . 7 1 1 A 128 128 ASN N N 115 115.158 120.211 -5.053 1
1 1171 . 7 1 1 A 129 129 VAL H H 116 8.116 8.213 -0.097 1
1 1172 . 7 1 1 A 129 129 VAL HA H 116 4.090 3.591 0.499 1
1 1180 . 7 1 1 A 129 129 VAL C C 116 176.740 177.795 -1.055 1
1 1181 . 7 1 1 A 129 129 VAL CA C 116 64.400 66.683 -2.283 1
1 1182 . 7 1 1 A 129 129 VAL CB C 116 32.050 31.761 0.289 1
1 1185 . 7 1 1 A 129 129 VAL N N 116 118.698 118.630 0.068 1
1 1186 . 7 1 1 A 130 130 LEU H H 117 7.294 7.781 -0.487 1
1 1187 . 7 1 1 A 130 130 LEU HA H 117 3.970 4.092 -0.122 1
1 1196 . 7 1 1 A 130 130 LEU C C 117 175.127 176.302 -1.175 1
1 1197 . 7 1 1 A 130 130 LEU CA C 117 56.260 55.342 0.918 1
1 1198 . 7 1 1 A 130 130 LEU CB C 117 41.259 41.398 -0.139 1
1 1201 . 7 1 1 A 130 130 LEU N N 117 116.201 118.688 -2.487 1
1 1202 . 7 1 1 A 131 131 LYS H H 118 6.594 7.851 -1.257 1
1 1203 . 7 1 1 A 131 131 LYS HA H 118 3.980 4.269 -0.289 1
1 1208 . 7 1 1 A 131 131 LYS C C 118 175.589 176.283 -0.694 1
1 1209 . 7 1 1 A 131 131 LYS CA C 118 56.260 57.302 -1.042 1
1 1210 . 7 1 1 A 131 131 LYS CB C 118 28.133 29.637 -1.504 1
1 1212 . 7 1 1 A 131 131 LYS N N 118 111.172 115.223 -4.051 1
1 1213 . 7 1 1 A 132 132 ILE H H 119 8.245 8.267 -0.022 1
1 1214 . 7 1 1 A 132 132 ILE HA H 119 4.090 4.055 0.035 1
1 1224 . 7 1 1 A 132 132 ILE C C 119 175.161 176.457 -1.296 1
1 1225 . 7 1 1 A 132 132 ILE CA C 119 60.010 65.026 -5.016 1
1 1226 . 7 1 1 A 132 132 ILE CB C 119 35.633 37.769 -2.136 1
1 1230 . 7 1 1 A 132 132 ILE N N 119 119.484 118.175 1.309 1
1 1231 . 7 1 1 A 133 133 ASN H H 120 8.054 8.194 -0.140 1
1 1232 . 7 1 1 A 133 133 ASN HA H 120 4.350 4.409 -0.059 1
1 1235 . 7 1 1 A 133 133 ASN C C 120 175.136 174.509 0.627 1
1 1236 . 7 1 1 A 133 133 ASN CA C 120 54.385 53.964 0.421 1
1 1237 . 7 1 1 A 133 133 ASN CB C 120 39.384 36.202 3.182 1
1 1238 . 7 1 1 A 133 133 ASN N N 120 124.670 119.724 4.946 1
1 1239 . 7 1 1 A 134 134 LEU H H 121 7.517 7.734 -0.217 1
1 1240 . 7 1 1 A 134 134 LEU HA H 121 4.678 4.644 0.034 1
1 1249 . 7 1 1 A 134 134 LEU C C 121 178.051 176.668 1.383 1
1 1250 . 7 1 1 A 134 134 LEU CA C 121 53.447 54.075 -0.628 1
1 1251 . 7 1 1 A 134 134 LEU CB C 121 41.259 44.760 -3.501 1
1 1254 . 7 1 1 A 134 134 LEU N N 121 119.918 121.384 -1.466 1
1 1255 . 7 1 1 A 135 135 ILE H H 122 9.389 8.660 0.729 1
1 1256 . 7 1 1 A 135 135 ILE HA H 122 3.540 3.676 -0.136 1
1 1266 . 7 1 1 A 135 135 ILE C C 122 176.425 177.471 -1.046 1
1 1267 . 7 1 1 A 135 135 ILE CA C 122 65.636 65.068 0.568 1
1 1268 . 7 1 1 A 135 135 ILE CB C 122 38.446 38.188 0.258 1
1 1272 . 7 1 1 A 135 135 ILE N N 122 129.949 127.130 2.819 1
1 1273 . 7 1 1 A 136 136 GLY H H 123 8.675 8.262 0.413 1
1 1274 . 7 1 1 A 136 136 GLY HA2 H 123 2.650 3.192 -0.542 1
1 1275 . 7 1 1 A 136 136 GLY HA3 H 123 2.060 3.563 -1.503 1
1 1276 . 7 1 1 A 136 136 GLY C C 123 176.854 176.290 0.564 1
1 1277 . 7 1 1 A 136 136 GLY CA C 123 45.500 47.011 -1.511 1
1 1278 . 7 1 1 A 136 136 GLY N N 123 106.314 108.014 -1.700 1
1 1279 . 7 1 1 A 137 137 HIS H H 124 6.869 7.771 -0.902 1
1 1280 . 7 1 1 A 137 137 HIS HA H 124 4.558 4.460 0.098 1
1 1285 . 7 1 1 A 137 137 HIS C C 124 176.977 177.301 -0.324 1
1 1286 . 7 1 1 A 137 137 HIS CA C 124 57.198 58.799 -1.601 1
1 1287 . 7 1 1 A 137 137 HIS CB C 124 30.945 30.015 0.930 1
1 1290 . 7 1 1 A 137 137 HIS N N 124 118.865 119.957 -1.092 1
1 1291 . 7 1 1 A 138 138 ARG H H 125 7.730 8.509 -0.779 1
1 1292 . 7 1 1 A 138 138 ARG HA H 125 3.770 3.892 -0.122 1
1 1299 . 7 1 1 A 138 138 ARG C C 125 178.288 178.395 -0.107 1
1 1300 . 7 1 1 A 138 138 ARG CA C 125 61.886 59.515 2.371 1
1 1301 . 7 1 1 A 138 138 ARG CB C 125 30.945 29.947 0.998 1
1 1304 . 7 1 1 A 138 138 ARG N N 125 118.149 119.191 -1.042 1
1 1306 . 7 1 1 A 139 139 LYS H H 126 8.679 8.266 0.413 1
1 1307 . 7 1 1 A 139 139 LYS HA H 126 3.990 3.958 0.032 1
1 1310 . 7 1 1 A 139 139 LYS C C 126 179.184 178.630 0.554 1
1 1311 . 7 1 1 A 139 139 LYS CA C 126 58.135 59.519 -1.384 1
1 1312 . 7 1 1 A 139 139 LYS CB C 126 30.945 32.438 -1.493 1
1 1314 . 7 1 1 A 139 139 LYS N N 126 114.003 119.052 -5.049 1
1 1315 . 7 1 1 A 140 140 ARG H H 127 7.248 7.747 -0.499 1
1 1316 . 7 1 1 A 140 140 ARG HA H 127 3.870 4.037 -0.167 1
1 1324 . 7 1 1 A 140 140 ARG C C 127 177.772 178.583 -0.811 1
1 1325 . 7 1 1 A 140 140 ARG CA C 127 60.010 58.860 1.150 1
1 1326 . 7 1 1 A 140 140 ARG CB C 127 30.945 29.778 1.167 1
1 1329 . 7 1 1 A 140 140 ARG N N 127 120.072 119.053 1.019 1
1 1331 . 7 1 1 A 141 141 ILE H H 128 7.706 8.288 -0.582 1
1 1332 . 7 1 1 A 141 141 ILE HA H 128 3.530 3.725 -0.195 1
1 1340 . 7 1 1 A 141 141 ILE C C 128 177.669 178.018 -0.349 1
1 1341 . 7 1 1 A 141 141 ILE CA C 128 65.636 65.670 -0.034 1
1 1342 . 7 1 1 A 141 141 ILE CB C 128 38.680 38.266 0.414 1
1 1345 . 7 1 1 A 141 141 ILE N N 128 118.730 119.600 -0.870 1
1 1346 . 7 1 1 A 142 142 LEU H H 129 8.194 8.615 -0.421 1
1 1347 . 7 1 1 A 142 142 LEU HA H 129 3.950 4.112 -0.162 1
1 1356 . 7 1 1 A 142 142 LEU C C 129 179.960 179.808 0.152 1
1 1357 . 7 1 1 A 142 142 LEU CA C 129 58.135 57.698 0.437 1
1 1358 . 7 1 1 A 142 142 LEU CB C 129 41.259 41.302 -0.043 1
1 1361 . 7 1 1 A 142 142 LEU N N 129 117.675 118.545 -0.870 1
1 1362 . 7 1 1 A 143 143 ALA H H 130 8.294 8.101 0.193 1
1 1363 . 7 1 1 A 143 143 ALA HA H 130 4.220 4.046 0.174 1
1 1367 . 7 1 1 A 143 143 ALA C C 130 179.899 179.586 0.313 1
1 1368 . 7 1 1 A 143 143 ALA CA C 130 54.385 55.246 -0.861 1
1 1369 . 7 1 1 A 143 143 ALA CB C 130 19.270 18.428 0.842 1
1 1370 . 7 1 1 A 143 143 ALA N N 130 121.096 122.881 -1.785 1
1 1371 . 7 1 1 A 144 144 SER H H 131 7.813 8.411 -0.598 1
1 1372 . 7 1 1 A 144 144 SER HA H 131 4.180 4.232 -0.052 1
1 1375 . 7 1 1 A 144 144 SER C C 131 175.457 177.660 -2.203 1
1 1376 . 7 1 1 A 144 144 SER CA C 131 60.948 61.757 -0.809 1
1 1377 . 7 1 1 A 144 144 SER CB C 131 63.761 62.471 1.290 1
1 1378 . 7 1 1 A 144 144 SER N N 131 112.102 113.444 -1.342 1
1 1379 . 7 1 1 A 145 145 LEU H H 132 7.747 7.921 -0.174 1
1 1380 . 7 1 1 A 145 145 LEU HA H 132 4.140 3.990 0.150 1
1 1389 . 7 1 1 A 145 145 LEU C C 132 178.589 177.624 0.965 1
1 1390 . 7 1 1 A 145 145 LEU CA C 132 56.260 56.518 -0.258 1
1 1391 . 7 1 1 A 145 145 LEU CB C 132 42.196 42.585 -0.389 1
1 1394 . 7 1 1 A 145 145 LEU N N 132 117.536 118.691 -1.155 1
1 1395 . 7 1 1 A 146 146 GLY H H 133 7.544 7.880 -0.336 1
1 1396 . 7 1 1 A 146 146 GLY HA2 H 133 3.950 4.078 -0.128 1
1 1397 . 7 1 1 A 146 146 GLY HA3 H 133 3.100 4.084 -0.984 1
1 1398 . 7 1 1 A 146 146 GLY C C 133 173.372 172.910 0.462 1
1 1399 . 7 1 1 A 146 146 GLY CA C 133 45.947 44.505 1.442 1
1 1400 . 7 1 1 A 146 146 GLY N N 133 105.351 105.450 -0.099 1
1 1401 . 7 1 1 A 147 147 ASP H H 134 8.342 8.602 -0.260 1
1 1402 . 7 1 1 A 147 147 ASP HA H 134 4.650 4.764 -0.114 1
1 1405 . 7 1 1 A 147 147 ASP C C 134 175.462 176.538 -1.076 1
1 1406 . 7 1 1 A 147 147 ASP CA C 134 54.385 54.383 0.002 1
1 1407 . 7 1 1 A 147 147 ASP CB C 134 41.259 42.503 -1.244 1
1 1408 . 7 1 1 A 147 147 ASP N N 134 120.133 122.597 -2.464 1
1 14 . 8 1 1 A 15 15 GLN H H 2 8.439 7.655 0.784 1
1 15 . 8 1 1 A 15 15 GLN HA H 2 4.594 4.738 -0.144 1
1 20 . 8 1 1 A 15 15 GLN C C 2 175.972 173.147 2.825 1
1 21 . 8 1 1 A 15 15 GLN CA C 2 56.260 54.669 1.591 1
1 22 . 8 1 1 A 15 15 GLN CB C 2 30.945 31.863 -0.918 1
1 24 . 8 1 1 A 15 15 GLN N N 2 124.997 118.243 6.754 1
1 25 . 8 1 1 A 16 16 THR H H 3 8.347 8.699 -0.352 1
1 26 . 8 1 1 A 16 16 THR HA H 3 4.555 4.812 -0.257 1
1 31 . 8 1 1 A 16 16 THR C C 3 175.495 174.919 0.576 1
1 32 . 8 1 1 A 16 16 THR CA C 3 60.010 61.370 -1.360 1
1 33 . 8 1 1 A 16 16 THR CB C 3 71.261 72.141 -0.880 1
1 34 . 8 1 1 A 16 16 THR N N 3 113.011 115.541 -2.530 1
1 35 . 8 1 1 A 17 17 VAL H H 4 8.895 8.970 -0.075 1
1 36 . 8 1 1 A 17 17 VAL HA H 4 3.670 3.842 -0.172 1
1 44 . 8 1 1 A 17 17 VAL C C 4 178.449 177.902 0.547 1
1 45 . 8 1 1 A 17 17 VAL CA C 4 67.511 66.398 1.113 1
1 46 . 8 1 1 A 17 17 VAL CB C 4 31.883 31.648 0.235 1
1 49 . 8 1 1 A 17 17 VAL N N 4 121.854 124.715 -2.861 1
1 50 . 8 1 1 A 18 18 GLY H H 5 9.017 8.289 0.728 1
1 51 . 8 1 1 A 18 18 GLY HA2 H 5 3.940 3.817 0.123 1
1 52 . 8 1 1 A 18 18 GLY HA3 H 5 3.610 3.833 -0.223 1
1 53 . 8 1 1 A 18 18 GLY C C 5 176.186 175.726 0.460 1
1 54 . 8 1 1 A 18 18 GLY CA C 5 47.822 47.239 0.583 1
1 55 . 8 1 1 A 18 18 GLY N N 5 106.966 107.908 -0.942 1
1 56 . 8 1 1 A 19 19 GLN H H 6 8.072 8.073 -0.001 1
1 57 . 8 1 1 A 19 19 GLN HA H 6 4.037 4.117 -0.080 1
1 62 . 8 1 1 A 19 19 GLN C C 6 179.488 178.570 0.918 1
1 63 . 8 1 1 A 19 19 GLN CA C 6 59.073 59.026 0.047 1
1 64 . 8 1 1 A 19 19 GLN CB C 6 28.489 28.718 -0.229 1
1 66 . 8 1 1 A 19 19 GLN N N 6 122.431 120.981 1.450 1
1 67 . 8 1 1 A 20 20 TRP H H 7 8.756 8.484 0.272 1
1 68 . 8 1 1 A 20 20 TRP HA H 7 4.160 4.239 -0.079 1
1 77 . 8 1 1 A 20 20 TRP C C 7 179.620 177.676 1.944 1
1 78 . 8 1 1 A 20 20 TRP CA C 7 61.886 61.073 0.813 1
1 79 . 8 1 1 A 20 20 TRP CB C 7 28.133 29.653 -1.520 1
1 85 . 8 1 1 A 20 20 TRP N N 7 124.265 122.535 1.730 1
1 87 . 8 1 1 A 21 21 LEU H H 8 9.148 8.709 0.439 1
1 88 . 8 1 1 A 21 21 LEU HA H 8 3.440 3.618 -0.178 1
1 97 . 8 1 1 A 21 21 LEU C C 8 180.521 178.423 2.098 1
1 98 . 8 1 1 A 21 21 LEU CA C 8 56.920 57.911 -0.991 1
1 99 . 8 1 1 A 21 21 LEU CB C 8 41.700 41.357 0.343 1
1 102 . 8 1 1 A 21 21 LEU N N 8 120.548 120.712 -0.164 1
1 103 . 8 1 1 A 22 22 GLU H H 9 8.284 8.208 0.076 1
1 104 . 8 1 1 A 22 22 GLU HA H 9 3.740 4.015 -0.275 1
1 109 . 8 1 1 A 22 22 GLU C C 9 179.960 178.615 1.345 1
1 110 . 8 1 1 A 22 22 GLU CA C 9 60.010 59.178 0.832 1
1 111 . 8 1 1 A 22 22 GLU CB C 9 29.070 29.004 0.066 1
1 113 . 8 1 1 A 22 22 GLU N N 9 120.133 119.631 0.502 1
1 114 . 8 1 1 A 23 23 SER H H 10 7.891 8.063 -0.172 1
1 115 . 8 1 1 A 23 23 SER HA H 10 4.250 4.234 0.016 1
1 118 . 8 1 1 A 23 23 SER C C 10 175.346 176.106 -0.760 1
1 119 . 8 1 1 A 23 23 SER CA C 10 60.948 62.357 -1.409 1
1 120 . 8 1 1 A 23 23 SER CB C 10 63.280 63.438 -0.158 1
1 121 . 8 1 1 A 23 23 SER N N 10 117.044 116.937 0.107 1
1 122 . 8 1 1 A 24 24 ILE H H 11 6.862 7.659 -0.797 1
1 123 . 8 1 1 A 24 24 ILE HA H 11 4.487 3.809 0.678 1
1 133 . 8 1 1 A 24 24 ILE C C 11 175.812 176.275 -0.463 1
1 134 . 8 1 1 A 24 24 ILE CA C 11 60.948 63.539 -2.591 1
1 135 . 8 1 1 A 24 24 ILE CB C 11 38.250 37.168 1.082 1
1 139 . 8 1 1 A 24 24 ILE N N 11 113.733 118.192 -4.459 1
1 140 . 8 1 1 A 25 25 GLY H H 12 7.628 7.704 -0.076 1
1 141 . 8 1 1 A 25 25 GLY HA2 H 12 3.990 4.098 -0.108 1
1 142 . 8 1 1 A 25 25 GLY HA3 H 12 3.800 4.201 -0.401 1
1 143 . 8 1 1 A 25 25 GLY C C 12 173.647 171.833 1.814 1
1 144 . 8 1 1 A 25 25 GLY CA C 12 45.947 45.774 0.173 1
1 145 . 8 1 1 A 25 25 GLY N N 12 109.763 110.237 -0.474 1
1 146 . 8 1 1 A 26 26 LEU H H 13 7.620 8.389 -0.769 1
1 147 . 8 1 1 A 26 26 LEU C C 13 176.186 177.020 -0.834 1
1 148 . 8 1 1 A 26 26 LEU CA C 13 52.700 51.904 0.796 1
1 149 . 8 1 1 A 26 26 LEU CB C 13 43.134 44.959 -1.825 1
1 150 . 8 1 1 A 26 26 LEU N N 13 118.778 122.515 -3.737 1
1 151 . 8 1 1 A 27 27 PRO HA H 14 4.120 4.527 -0.407 1
1 154 . 8 1 1 A 27 27 PRO C C 14 177.955 177.831 0.124 1
1 155 . 8 1 1 A 27 27 PRO CA C 14 64.698 64.429 0.269 1
1 156 . 8 1 1 A 27 27 PRO CB C 14 31.883 31.925 -0.042 1
1 158 . 8 1 1 A 28 28 GLN H H 15 9.838 8.499 1.339 1
1 159 . 8 1 1 A 28 28 GLN HA H 15 4.240 3.973 0.267 1
1 162 . 8 1 1 A 28 28 GLN C C 15 176.836 176.682 0.154 1
1 163 . 8 1 1 A 28 28 GLN CA C 15 58.135 58.300 -0.165 1
1 164 . 8 1 1 A 28 28 GLN CB C 15 27.195 27.934 -0.739 1
1 166 . 8 1 1 A 28 28 GLN N N 15 120.414 117.510 2.904 1
1 167 . 8 1 1 A 29 29 TYR H H 16 6.810 7.194 -0.384 1
1 168 . 8 1 1 A 29 29 TYR HA H 16 5.720 4.426 1.294 1
1 173 . 8 1 1 A 29 29 TYR C C 16 174.814 177.823 -3.009 1
1 174 . 8 1 1 A 29 29 TYR CA C 16 57.198 59.846 -2.648 1
1 175 . 8 1 1 A 29 29 TYR CB C 16 37.509 39.958 -2.449 1
1 178 . 8 1 1 A 29 29 TYR N N 16 119.718 117.644 2.074 1
1 179 . 8 1 1 A 30 30 GLU H H 17 7.509 8.411 -0.902 1
1 180 . 8 1 1 A 30 30 GLU HA H 17 3.650 4.100 -0.450 1
1 184 . 8 1 1 A 30 30 GLU C C 17 177.552 178.428 -0.876 1
1 185 . 8 1 1 A 30 30 GLU CA C 17 60.948 60.058 0.890 1
1 186 . 8 1 1 A 30 30 GLU CB C 17 30.008 29.483 0.525 1
1 188 . 8 1 1 A 30 30 GLU N N 17 122.417 121.853 0.564 1
1 189 . 8 1 1 A 31 31 ASN H H 18 9.259 7.690 1.569 1
1 190 . 8 1 1 A 31 31 ASN HA H 18 4.451 4.476 -0.025 1
1 193 . 8 1 1 A 31 31 ASN C C 18 176.868 178.040 -1.172 1
1 194 . 8 1 1 A 31 31 ASN CA C 18 57.198 56.339 0.859 1
1 195 . 8 1 1 A 31 31 ASN CB C 18 38.446 39.746 -1.300 1
1 196 . 8 1 1 A 31 31 ASN N N 18 116.613 118.170 -1.557 1
1 197 . 8 1 1 A 32 32 HIS H H 19 8.898 8.148 0.750 1
1 198 . 8 1 1 A 32 32 HIS HA H 19 4.140 4.336 -0.196 1
1 202 . 8 1 1 A 32 32 HIS C C 19 178.269 177.725 0.544 1
1 203 . 8 1 1 A 32 32 HIS CA C 19 60.948 59.382 1.566 1
1 204 . 8 1 1 A 32 32 HIS CB C 19 30.008 30.053 -0.045 1
1 206 . 8 1 1 A 32 32 HIS N N 19 118.926 118.426 0.500 1
1 207 . 8 1 1 A 33 33 LEU H H 20 7.825 8.855 -1.030 1
1 208 . 8 1 1 A 33 33 LEU HA H 20 4.305 3.960 0.345 1
1 218 . 8 1 1 A 33 33 LEU C C 20 179.190 179.228 -0.038 1
1 219 . 8 1 1 A 33 33 LEU CA C 20 60.010 58.429 1.581 1
1 220 . 8 1 1 A 33 33 LEU CB C 20 40.321 42.035 -1.714 1
1 224 . 8 1 1 A 33 33 LEU N N 20 117.434 119.905 -2.471 1
1 225 . 8 1 1 A 34 34 MET H H 21 8.861 8.530 0.331 1
1 226 . 8 1 1 A 34 34 MET HA H 21 3.980 4.137 -0.157 1
1 234 . 8 1 1 A 34 34 MET C C 21 180.340 177.851 2.489 1
1 235 . 8 1 1 A 34 34 MET CA C 21 58.135 58.980 -0.845 1
1 236 . 8 1 1 A 34 34 MET CB C 21 30.945 32.155 -1.210 1
1 238 . 8 1 1 A 34 34 MET N N 21 118.111 118.332 -0.221 1
1 239 . 8 1 1 A 35 35 ALA H H 22 9.015 8.306 0.709 1
1 240 . 8 1 1 A 35 35 ALA HA H 22 4.239 4.169 0.070 1
1 244 . 8 1 1 A 35 35 ALA C C 22 178.058 178.835 -0.777 1
1 245 . 8 1 1 A 35 35 ALA CA C 22 53.800 54.569 -0.769 1
1 246 . 8 1 1 A 35 35 ALA CB C 22 18.397 18.326 0.071 1
1 247 . 8 1 1 A 35 35 ALA N N 22 120.068 121.603 -1.535 1
1 248 . 8 1 1 A 36 36 ASN H H 23 7.143 7.949 -0.806 1
1 249 . 8 1 1 A 36 36 ASN HA H 23 4.959 4.816 0.143 1
1 254 . 8 1 1 A 36 36 ASN C C 23 174.083 175.478 -1.395 1
1 255 . 8 1 1 A 36 36 ASN CA C 23 54.000 52.993 1.007 1
1 256 . 8 1 1 A 36 36 ASN CB C 23 41.300 38.928 2.372 1
1 257 . 8 1 1 A 36 36 ASN N N 23 111.560 115.121 -3.561 1
1 259 . 8 1 1 A 37 37 GLY H H 24 7.797 8.270 -0.473 1
1 260 . 8 1 1 A 37 37 GLY HA2 H 24 3.430 3.846 -0.416 1
1 261 . 8 1 1 A 37 37 GLY HA3 H 24 3.290 3.943 -0.653 1
1 262 . 8 1 1 A 37 37 GLY C C 24 173.163 174.775 -1.612 1
1 263 . 8 1 1 A 37 37 GLY CA C 24 45.947 45.293 0.654 1
1 264 . 8 1 1 A 37 37 GLY N N 24 106.170 107.664 -1.494 1
1 265 . 8 1 1 A 38 38 PHE H H 25 8.191 7.964 0.227 1
1 266 . 8 1 1 A 38 38 PHE HA H 25 4.910 4.767 0.143 1
1 271 . 8 1 1 A 38 38 PHE C C 25 173.496 175.649 -2.153 1
1 272 . 8 1 1 A 38 38 PHE CA C 25 56.550 56.354 0.196 1
1 273 . 8 1 1 A 38 38 PHE CB C 25 37.220 37.126 0.094 1
1 276 . 8 1 1 A 38 38 PHE N N 25 122.454 119.736 2.718 1
1 277 . 8 1 1 A 39 39 ASP H H 26 6.756 8.526 -1.770 1
1 278 . 8 1 1 A 39 39 ASP HA H 26 5.077 4.919 0.158 1
1 281 . 8 1 1 A 39 39 ASP C C 26 177.463 175.342 2.121 1
1 282 . 8 1 1 A 39 39 ASP CA C 26 53.447 53.939 -0.492 1
1 283 . 8 1 1 A 39 39 ASP CB C 26 42.580 41.912 0.668 1
1 284 . 8 1 1 A 39 39 ASP N N 26 111.309 120.737 -9.428 1
1 285 . 8 1 1 A 40 40 ASN H H 27 7.495 7.964 -0.469 1
1 286 . 8 1 1 A 40 40 ASN HA H 27 4.820 4.945 -0.125 1
1 289 . 8 1 1 A 40 40 ASN C C 27 176.228 176.026 0.202 1
1 290 . 8 1 1 A 40 40 ASN CA C 27 52.510 51.979 0.531 1
1 291 . 8 1 1 A 40 40 ASN CB C 27 40.321 40.087 0.234 1
1 292 . 8 1 1 A 40 40 ASN N N 27 118.385 118.108 0.277 1
1 293 . 8 1 1 A 41 41 VAL H H 28 9.192 8.594 0.598 1
1 294 . 8 1 1 A 41 41 VAL HA H 28 3.550 3.536 0.014 1
1 302 . 8 1 1 A 41 41 VAL C C 28 176.429 177.684 -1.255 1
1 303 . 8 1 1 A 41 41 VAL CA C 28 65.636 65.954 -0.318 1
1 304 . 8 1 1 A 41 41 VAL CB C 28 31.883 31.379 0.504 1
1 307 . 8 1 1 A 41 41 VAL N N 28 125.741 125.633 0.108 1
1 308 . 8 1 1 A 42 42 GLN H H 29 8.203 8.398 -0.195 1
1 309 . 8 1 1 A 42 42 GLN HA H 29 4.129 4.016 0.113 1
1 314 . 8 1 1 A 42 42 GLN C C 29 176.591 178.412 -1.821 1
1 315 . 8 1 1 A 42 42 GLN CA C 29 57.198 58.447 -1.249 1
1 316 . 8 1 1 A 42 42 GLN CB C 29 28.133 28.819 -0.686 1
1 318 . 8 1 1 A 42 42 GLN N N 29 116.452 120.486 -4.034 1
1 319 . 8 1 1 A 43 43 ALA H H 30 7.781 8.183 -0.402 1
1 320 . 8 1 1 A 43 43 ALA HA H 30 4.650 4.072 0.578 1
1 324 . 8 1 1 A 43 43 ALA C C 30 175.976 177.982 -2.006 1
1 325 . 8 1 1 A 43 43 ALA CA C 30 50.840 54.425 -3.585 1
1 326 . 8 1 1 A 43 43 ALA CB C 30 19.150 18.394 0.756 1
1 327 . 8 1 1 A 43 43 ALA N N 30 122.150 121.603 0.547 1
1 328 . 8 1 1 A 44 44 MET H H 31 7.739 8.130 -0.391 1
1 332 . 8 1 1 A 44 44 MET C C 31 178.275 177.500 0.775 1
1 333 . 8 1 1 A 44 44 MET CA C 31 55.323 54.085 1.238 1
1 334 . 8 1 1 A 44 44 MET CB C 31 34.696 32.130 2.566 1
1 336 . 8 1 1 A 44 44 MET N N 31 118.149 113.961 4.188 1
1 337 . 8 1 1 A 45 45 GLY H H 32 7.611 8.605 -0.994 1
1 338 . 8 1 1 A 45 45 GLY N N 32 101.530 109.844 -8.314 1
1 339 . 8 1 1 A 47 47 ASN HA H 34 4.480 5.020 -0.540 1
1 342 . 8 1 1 A 47 47 ASN CA C 34 56.260 52.016 4.244 1
1 343 . 8 1 1 A 47 47 ASN CB C 34 39.384 39.246 0.138 1
1 344 . 8 1 1 A 49 49 MET HA H 36 4.646 4.314 0.332 1
1 350 . 8 1 1 A 49 49 MET C C 36 173.651 175.835 -2.184 1
1 351 . 8 1 1 A 49 49 MET CA C 36 55.323 56.448 -1.125 1
1 352 . 8 1 1 A 49 49 MET CB C 36 35.633 33.728 1.905 1
1 355 . 8 1 1 A 50 50 GLU H H 37 9.203 8.126 1.077 1
1 356 . 8 1 1 A 50 50 GLU HA H 37 4.650 4.577 0.073 1
1 361 . 8 1 1 A 50 50 GLU C C 37 177.008 177.413 -0.405 1
1 362 . 8 1 1 A 50 50 GLU CA C 37 54.385 55.262 -0.877 1
1 363 . 8 1 1 A 50 50 GLU CB C 37 33.758 31.989 1.769 1
1 365 . 8 1 1 A 50 50 GLU N N 37 123.229 125.650 -2.421 1
1 366 . 8 1 1 A 51 51 ASP H H 38 9.032 8.965 0.067 1
1 367 . 8 1 1 A 51 51 ASP HA H 38 4.149 4.293 -0.144 1
1 370 . 8 1 1 A 51 51 ASP C C 38 177.994 178.184 -0.190 1
1 371 . 8 1 1 A 51 51 ASP CA C 38 59.073 57.044 2.029 1
1 372 . 8 1 1 A 51 51 ASP CB C 38 43.134 39.726 3.408 1
1 373 . 8 1 1 A 51 51 ASP N N 38 122.717 123.752 -1.035 1
1 374 . 8 1 1 A 52 52 GLN H H 39 8.950 8.249 0.701 1
1 375 . 8 1 1 A 52 52 GLN HA H 39 3.940 3.941 -0.001 1
1 378 . 8 1 1 A 52 52 GLN C C 39 177.817 178.570 -0.753 1
1 379 . 8 1 1 A 52 52 GLN CA C 39 59.073 59.139 -0.066 1
1 380 . 8 1 1 A 52 52 GLN CB C 39 28.133 28.466 -0.333 1
1 381 . 8 1 1 A 52 52 GLN N N 39 114.086 119.661 -5.575 1
1 382 . 8 1 1 A 53 53 ASP H H 40 7.214 8.103 -0.889 1
1 383 . 8 1 1 A 53 53 ASP HA H 40 4.370 4.475 -0.105 1
1 386 . 8 1 1 A 53 53 ASP C C 40 177.667 178.552 -0.885 1
1 387 . 8 1 1 A 53 53 ASP CA C 40 57.198 57.279 -0.081 1
1 388 . 8 1 1 A 53 53 ASP CB C 40 41.800 40.889 0.911 1
1 389 . 8 1 1 A 53 53 ASP N N 40 118.734 120.391 -1.657 1
1 390 . 8 1 1 A 54 54 LEU H H 41 7.180 8.063 -0.883 1
1 391 . 8 1 1 A 54 54 LEU HA H 41 3.990 3.978 0.012 1
1 400 . 8 1 1 A 54 54 LEU C C 41 178.204 178.234 -0.030 1
1 401 . 8 1 1 A 54 54 LEU CA C 41 56.260 57.990 -1.730 1
1 402 . 8 1 1 A 54 54 LEU CB C 41 41.259 41.841 -0.582 1
1 405 . 8 1 1 A 54 54 LEU N N 41 115.795 121.984 -6.189 1
1 406 . 8 1 1 A 55 55 LEU H H 42 7.823 7.948 -0.125 1
1 407 . 8 1 1 A 55 55 LEU HA H 42 3.920 4.151 -0.231 1
1 416 . 8 1 1 A 55 55 LEU C C 42 180.876 178.329 2.547 1
1 417 . 8 1 1 A 55 55 LEU CA C 42 58.135 57.200 0.935 1
1 418 . 8 1 1 A 55 55 LEU CB C 42 42.196 41.796 0.400 1
1 421 . 8 1 1 A 55 55 LEU N N 42 120.499 119.523 0.976 1
1 422 . 8 1 1 A 56 56 GLU H H 43 8.127 8.163 -0.036 1
1 423 . 8 1 1 A 56 56 GLU HA H 43 3.966 4.195 -0.229 1
1 428 . 8 1 1 A 56 56 GLU C C 43 178.801 179.246 -0.445 1
1 429 . 8 1 1 A 56 56 GLU CA C 43 60.010 59.206 0.804 1
1 430 . 8 1 1 A 56 56 GLU CB C 43 29.070 29.229 -0.159 1
1 432 . 8 1 1 A 56 56 GLU N N 43 120.955 118.609 2.346 1
1 433 . 8 1 1 A 57 57 ILE H H 44 7.504 7.913 -0.409 1
1 434 . 8 1 1 A 57 57 ILE HA H 44 4.524 3.857 0.667 1
1 444 . 8 1 1 A 57 57 ILE C C 44 175.691 177.947 -2.256 1
1 445 . 8 1 1 A 57 57 ILE CA C 44 61.886 64.980 -3.094 1
1 446 . 8 1 1 A 57 57 ILE CB C 44 37.300 38.097 -0.797 1
1 450 . 8 1 1 A 57 57 ILE N N 44 109.594 119.679 -10.085 1
1 451 . 8 1 1 A 58 58 GLY H H 45 7.724 7.582 0.142 1
1 452 . 8 1 1 A 58 58 GLY HA2 H 45 3.650 4.097 -0.447 1
1 453 . 8 1 1 A 58 58 GLY HA3 H 45 4.530 4.216 0.314 1
1 454 . 8 1 1 A 58 58 GLY C C 45 174.613 174.917 -0.304 1
1 455 . 8 1 1 A 58 58 GLY CA C 45 45.947 45.647 0.300 1
1 456 . 8 1 1 A 58 58 GLY N N 45 106.680 106.665 0.015 1
1 457 . 8 1 1 A 59 59 ILE H H 46 8.180 7.863 0.317 1
1 458 . 8 1 1 A 59 59 ILE HA H 46 3.907 4.100 -0.193 1
1 468 . 8 1 1 A 59 59 ILE C C 46 174.235 175.421 -1.186 1
1 469 . 8 1 1 A 59 59 ILE CA C 46 60.948 62.271 -1.323 1
1 470 . 8 1 1 A 59 59 ILE CB C 46 33.980 37.746 -3.766 1
1 474 . 8 1 1 A 59 59 ILE N N 46 122.454 122.486 -0.032 1
1 475 . 8 1 1 A 60 60 LEU H H 47 7.367 8.894 -1.527 1
1 476 . 8 1 1 A 60 60 LEU HA H 47 3.900 4.701 -0.801 1
1 479 . 8 1 1 A 60 60 LEU C C 47 177.753 175.675 2.078 1
1 480 . 8 1 1 A 60 60 LEU CA C 47 56.260 54.079 2.181 1
1 481 . 8 1 1 A 60 60 LEU CB C 47 42.196 44.843 -2.647 1
1 482 . 8 1 1 A 60 60 LEU N N 47 125.835 128.599 -2.764 1
1 483 . 8 1 1 A 63 63 GLY HA2 H 50 3.980 3.903 0.077 1
1 484 . 8 1 1 A 63 63 GLY HA3 H 50 3.950 3.908 0.042 1
1 485 . 8 1 1 A 63 63 GLY C C 50 177.130 174.495 2.635 1
1 486 . 8 1 1 A 63 63 GLY CA C 50 46.884 46.682 0.202 1
1 487 . 8 1 1 A 64 64 HIS H H 51 7.926 7.971 -0.045 1
1 488 . 8 1 1 A 64 64 HIS HA H 51 4.451 4.440 0.011 1
1 493 . 8 1 1 A 64 64 HIS C C 51 177.613 177.012 0.601 1
1 494 . 8 1 1 A 64 64 HIS CA C 51 57.198 56.833 0.365 1
1 495 . 8 1 1 A 64 64 HIS CB C 51 30.945 30.968 -0.023 1
1 498 . 8 1 1 A 64 64 HIS N N 51 122.284 119.449 2.835 1
1 499 . 8 1 1 A 65 65 ARG H H 52 8.105 8.314 -0.209 1
1 500 . 8 1 1 A 65 65 ARG HA H 52 3.685 3.724 -0.039 1
1 507 . 8 1 1 A 65 65 ARG C C 52 177.769 179.388 -1.619 1
1 508 . 8 1 1 A 65 65 ARG CA C 52 61.886 59.726 2.160 1
1 509 . 8 1 1 A 65 65 ARG CB C 52 30.945 29.919 1.026 1
1 511 . 8 1 1 A 65 65 ARG N N 52 117.775 118.355 -0.580 1
1 513 . 8 1 1 A 66 66 GLN H H 53 8.090 8.279 -0.189 1
1 514 . 8 1 1 A 66 66 GLN HA H 53 3.940 3.927 0.013 1
1 519 . 8 1 1 A 66 66 GLN C C 53 178.583 178.000 0.583 1
1 520 . 8 1 1 A 66 66 GLN CA C 53 59.073 59.205 -0.132 1
1 521 . 8 1 1 A 66 66 GLN CB C 53 28.133 28.331 -0.198 1
1 523 . 8 1 1 A 66 66 GLN N N 53 116.452 119.092 -2.640 1
1 524 . 8 1 1 A 67 67 ARG H H 54 7.845 7.702 0.143 1
1 525 . 8 1 1 A 67 67 ARG HA H 54 4.010 3.952 0.058 1
1 528 . 8 1 1 A 67 67 ARG C C 54 179.766 178.853 0.913 1
1 529 . 8 1 1 A 67 67 ARG CA C 54 59.073 58.873 0.200 1
1 530 . 8 1 1 A 67 67 ARG CB C 54 30.720 29.820 0.900 1
1 532 . 8 1 1 A 67 67 ARG N N 54 119.275 119.379 -0.104 1
1 533 . 8 1 1 A 68 68 ILE H H 55 8.032 7.734 0.298 1
1 534 . 8 1 1 A 68 68 ILE HA H 55 3.495 3.439 0.056 1
1 544 . 8 1 1 A 68 68 ILE C C 55 177.108 178.751 -1.643 1
1 545 . 8 1 1 A 68 68 ILE CA C 55 66.230 64.596 1.634 1
1 546 . 8 1 1 A 68 68 ILE CB C 55 38.020 37.392 0.628 1
1 550 . 8 1 1 A 68 68 ILE N N 55 121.152 119.265 1.887 1
1 551 . 8 1 1 A 69 69 LEU H H 56 8.490 8.085 0.405 1
1 552 . 8 1 1 A 69 69 LEU HA H 56 4.010 3.797 0.213 1
1 561 . 8 1 1 A 69 69 LEU C C 56 179.917 178.561 1.356 1
1 562 . 8 1 1 A 69 69 LEU CA C 56 58.135 58.008 0.127 1
1 563 . 8 1 1 A 69 69 LEU CB C 56 41.259 41.638 -0.379 1
1 566 . 8 1 1 A 69 69 LEU N N 56 119.072 121.983 -2.911 1
1 567 . 8 1 1 A 70 70 GLN H H 57 8.327 8.368 -0.041 1
1 568 . 8 1 1 A 70 70 GLN HA H 57 4.100 4.100 0.000 1
1 573 . 8 1 1 A 70 70 GLN C C 57 178.798 178.759 0.039 1
1 574 . 8 1 1 A 70 70 GLN CA C 57 59.073 58.794 0.279 1
1 575 . 8 1 1 A 70 70 GLN CB C 57 28.133 28.089 0.044 1
1 577 . 8 1 1 A 70 70 GLN N N 57 118.172 117.010 1.162 1
1 578 . 8 1 1 A 71 71 ALA H H 58 7.810 7.810 0.000 1
1 579 . 8 1 1 A 71 71 ALA HA H 58 4.320 4.133 0.187 1
1 583 . 8 1 1 A 71 71 ALA C C 58 172.232 180.252 -8.020 1
1 584 . 8 1 1 A 71 71 ALA CA C 58 55.323 54.892 0.431 1
1 585 . 8 1 1 A 71 71 ALA CB C 58 19.720 18.210 1.510 1
1 586 . 8 1 1 A 71 71 ALA N N 58 122.536 121.908 0.628 1
1 587 . 8 1 1 A 72 72 ILE H H 59 8.840 8.329 0.511 1
1 588 . 8 1 1 A 72 72 ILE HA H 59 4.030 4.194 -0.164 1
1 598 . 8 1 1 A 72 72 ILE C C 59 178.678 177.271 1.407 1
1 599 . 8 1 1 A 72 72 ILE CA C 59 64.698 62.671 2.027 1
1 600 . 8 1 1 A 72 72 ILE CB C 59 37.850 38.508 -0.658 1
1 604 . 8 1 1 A 72 72 ILE N N 59 118.111 118.633 -0.522 1
1 605 . 8 1 1 A 73 73 GLN H H 60 7.547 7.880 -0.333 1
1 606 . 8 1 1 A 73 73 GLN HA H 60 4.121 4.389 -0.268 1
1 611 . 8 1 1 A 73 73 GLN C C 60 176.556 177.164 -0.608 1
1 612 . 8 1 1 A 73 73 GLN CA C 60 58.135 57.249 0.886 1
1 613 . 8 1 1 A 73 73 GLN CB C 60 28.300 29.511 -1.211 1
1 615 . 8 1 1 A 73 73 GLN N N 60 119.094 120.338 -1.244 1
1 616 . 8 1 1 A 74 74 LEU H H 61 7.350 7.933 -0.583 1
1 617 . 8 1 1 A 74 74 LEU HA H 61 4.408 4.468 -0.060 1
1 626 . 8 1 1 A 74 74 LEU C C 61 177.960 177.268 0.692 1
1 627 . 8 1 1 A 74 74 LEU CA C 61 54.900 55.273 -0.373 1
1 628 . 8 1 1 A 74 74 LEU CB C 61 42.196 43.563 -1.367 1
1 631 . 8 1 1 A 74 74 LEU N N 61 115.853 116.624 -0.771 1
1 632 . 8 1 1 A 75 75 LEU H H 62 7.358 7.968 -0.610 1
1 633 . 8 1 1 A 75 75 LEU HA H 62 4.530 4.925 -0.395 1
1 642 . 8 1 1 A 75 75 LEU C C 62 177.035 176.403 0.632 1
1 643 . 8 1 1 A 75 75 LEU CA C 62 53.200 56.609 -3.409 1
1 644 . 8 1 1 A 75 75 LEU CB C 62 40.700 40.939 -0.239 1
1 647 . 8 1 1 A 75 75 LEU N N 62 121.010 117.921 3.089 1
1 648 . 8 1 1 A 76 76 PRO HA H 63 4.382 4.553 -0.171 1
1 655 . 8 1 1 A 76 76 PRO CB C 63 31.883 32.170 -0.287 1
1 657 . 8 1 1 A 77 77 LYS H H 64 8.418 7.685 0.733 1
1 658 . 8 1 1 A 77 77 LYS HA H 64 4.140 4.397 -0.257 1
1 663 . 8 1 1 A 77 77 LYS C C 64 177.122 176.453 0.669 1
1 664 . 8 1 1 A 77 77 LYS CA C 64 56.260 55.977 0.283 1
1 665 . 8 1 1 A 77 77 LYS CB C 64 33.340 33.312 0.028 1
1 668 . 8 1 1 A 77 77 LYS N N 64 121.932 118.659 3.273 1
1 669 . 8 1 1 A 78 78 MET H H 65 8.550 8.961 -0.411 1
1 670 . 8 1 1 A 78 78 MET HA H 65 4.304 4.442 -0.138 1
1 676 . 8 1 1 A 78 78 MET C C 65 176.105 176.278 -0.173 1
1 677 . 8 1 1 A 78 78 MET CA C 65 56.260 57.090 -0.830 1
1 678 . 8 1 1 A 78 78 MET CB C 65 32.821 33.651 -0.830 1
1 680 . 8 1 1 A 78 78 MET N N 65 123.498 128.018 -4.520 1
1 681 . 8 1 1 A 79 79 ARG H H 66 8.731 7.721 1.010 1
1 682 . 8 1 1 A 79 79 ARG C C 66 173.577 174.137 -0.560 1
1 683 . 8 1 1 A 79 79 ARG CA C 66 53.447 53.074 0.373 1
1 684 . 8 1 1 A 79 79 ARG CB C 66 30.008 31.005 -0.997 1
1 685 . 8 1 1 A 79 79 ARG N N 66 127.355 118.662 8.693 1
1 686 . 8 1 1 A 80 80 PRO HA H 67 4.780 4.692 0.088 1
1 693 . 8 1 1 A 80 80 PRO C C 67 177.043 176.522 0.521 1
1 694 . 8 1 1 A 80 80 PRO CA C 67 61.886 62.464 -0.578 1
1 695 . 8 1 1 A 80 80 PRO CB C 67 32.821 33.527 -0.706 1
1 698 . 8 1 1 A 81 81 ILE H H 68 8.580 8.619 -0.039 1
1 699 . 8 1 1 A 81 81 ILE HA H 68 4.040 4.114 -0.074 1
1 709 . 8 1 1 A 81 81 ILE C C 68 176.831 176.015 0.816 1
1 710 . 8 1 1 A 81 81 ILE CA C 68 62.823 62.426 0.397 1
1 711 . 8 1 1 A 81 81 ILE CB C 68 38.580 39.640 -1.060 1
1 715 . 8 1 1 A 81 81 ILE N N 68 118.491 120.252 -1.761 1
1 716 . 8 1 1 A 82 82 GLY H H 69 8.602 7.939 0.663 1
1 717 . 8 1 1 A 82 82 GLY CA C 69 45.009 45.250 -0.241 1
1 718 . 8 1 1 A 82 82 GLY N N 69 111.377 109.747 1.630 1
1 721 . 8 1 1 A 84 84 ASP HA H 71 4.490 4.311 0.179 1
1 724 . 8 1 1 A 84 84 ASP CA C 71 54.385 55.856 -1.471 1
1 725 . 8 1 1 A 84 84 ASP CB C 71 40.321 41.666 -1.345 1
1 726 . 8 1 1 A 85 85 GLY H H 72 8.054 7.001 1.053 1
1 727 . 8 1 1 A 85 85 GLY HA2 H 72 4.040 4.002 0.038 1
1 728 . 8 1 1 A 85 85 GLY HA3 H 72 3.750 4.052 -0.302 1
1 729 . 8 1 1 A 85 85 GLY C C 72 173.474 171.978 1.496 1
1 730 . 8 1 1 A 85 85 GLY CA C 72 45.009 44.427 0.582 1
1 731 . 8 1 1 A 85 85 GLY N N 72 108.038 103.510 4.528 1
1 732 . 8 1 1 A 86 86 ALA H H 73 7.858 8.101 -0.243 1
1 733 . 8 1 1 A 86 86 ALA HA H 73 4.370 5.018 -0.648 1
1 737 . 8 1 1 A 86 86 ALA CA C 73 51.990 51.229 0.761 1
1 738 . 8 1 1 A 86 86 ALA CB C 73 19.220 21.044 -1.824 1
1 739 . 8 1 1 A 86 86 ALA N N 73 123.819 122.751 1.068 1
1 742 . 8 1 1 A 90 90 SER H H 77 7.839 8.454 -0.615 1
1 743 . 8 1 1 A 90 90 SER HA H 77 4.770 4.601 0.169 1
1 746 . 8 1 1 A 90 90 SER N N 77 115.163 119.373 -4.210 1
1 747 . 8 1 1 A 91 91 VAL H H 78 8.578 8.827 -0.249 1
1 748 . 8 1 1 A 91 91 VAL HA H 78 3.981 3.920 0.061 1
1 756 . 8 1 1 A 91 91 VAL C C 78 177.480 177.033 0.447 1
1 757 . 8 1 1 A 91 91 VAL CA C 78 67.060 66.489 0.571 1
1 758 . 8 1 1 A 91 91 VAL CB C 78 32.500 31.776 0.724 1
1 761 . 8 1 1 A 91 91 VAL N N 78 123.481 123.938 -0.457 1
1 762 . 8 1 1 A 92 92 ALA H H 79 8.607 8.399 0.208 1
1 763 . 8 1 1 A 92 92 ALA HA H 79 4.113 4.016 0.097 1
1 767 . 8 1 1 A 92 92 ALA C C 79 179.868 180.484 -0.616 1
1 768 . 8 1 1 A 92 92 ALA CA C 79 54.890 55.730 -0.840 1
1 769 . 8 1 1 A 92 92 ALA CB C 79 18.790 18.435 0.355 1
1 770 . 8 1 1 A 92 92 ALA N N 79 120.334 122.354 -2.020 1
1 771 . 8 1 1 A 93 93 GLU H H 80 7.886 8.111 -0.225 1
1 772 . 8 1 1 A 93 93 GLU HA H 80 4.010 4.058 -0.048 1
1 777 . 8 1 1 A 93 93 GLU C C 80 179.719 178.858 0.861 1
1 778 . 8 1 1 A 93 93 GLU CA C 80 59.073 58.992 0.081 1
1 779 . 8 1 1 A 93 93 GLU CB C 80 30.630 29.337 1.293 1
1 781 . 8 1 1 A 93 93 GLU N N 80 117.643 117.438 0.205 1
1 782 . 8 1 1 A 94 94 TRP H H 81 8.299 8.128 0.171 1
1 783 . 8 1 1 A 94 94 TRP HA H 81 4.251 4.341 -0.090 1
1 792 . 8 1 1 A 94 94 TRP C C 81 178.772 178.201 0.571 1
1 793 . 8 1 1 A 94 94 TRP CA C 81 60.010 61.490 -1.480 1
1 794 . 8 1 1 A 94 94 TRP CB C 81 27.650 29.933 -2.283 1
1 800 . 8 1 1 A 94 94 TRP N N 81 122.545 123.102 -0.557 1
1 802 . 8 1 1 A 95 95 LEU H H 82 8.505 8.659 -0.154 1
1 803 . 8 1 1 A 95 95 LEU HA H 82 2.880 3.140 -0.260 1
1 812 . 8 1 1 A 95 95 LEU C C 82 180.235 178.785 1.450 1
1 813 . 8 1 1 A 95 95 LEU CA C 82 57.400 56.877 0.523 1
1 814 . 8 1 1 A 95 95 LEU CB C 82 40.321 40.872 -0.551 1
1 817 . 8 1 1 A 95 95 LEU N N 82 121.110 119.109 2.001 1
1 818 . 8 1 1 A 96 96 ASP H H 83 8.185 8.162 0.023 1
1 819 . 8 1 1 A 96 96 ASP HA H 83 4.280 4.391 -0.111 1
1 822 . 8 1 1 A 96 96 ASP C C 83 175.224 177.196 -1.972 1
1 823 . 8 1 1 A 96 96 ASP CA C 83 57.310 56.172 1.138 1
1 824 . 8 1 1 A 96 96 ASP CB C 83 40.321 40.947 -0.626 1
1 825 . 8 1 1 A 96 96 ASP N N 83 119.082 119.821 -0.739 1
1 826 . 8 1 1 A 97 97 SER H H 84 7.989 7.834 0.155 1
1 827 . 8 1 1 A 97 97 SER HA H 84 4.250 4.471 -0.221 1
1 830 . 8 1 1 A 97 97 SER C C 84 175.346 175.160 0.186 1
1 831 . 8 1 1 A 97 97 SER CA C 84 60.948 58.805 2.143 1
1 832 . 8 1 1 A 97 97 SER CB C 84 63.370 64.506 -1.136 1
1 833 . 8 1 1 A 97 97 SER N N 84 117.579 111.517 6.062 1
1 834 . 8 1 1 A 98 98 ILE H H 85 6.862 7.212 -0.350 1
1 835 . 8 1 1 A 98 98 ILE HA H 85 4.550 4.103 0.447 1
1 843 . 8 1 1 A 98 98 ILE C C 85 173.308 175.021 -1.713 1
1 844 . 8 1 1 A 98 98 ILE CA C 85 60.948 60.837 0.111 1
1 845 . 8 1 1 A 98 98 ILE CB C 85 37.760 37.610 0.150 1
1 848 . 8 1 1 A 98 98 ILE N N 85 113.733 118.495 -4.762 1
1 849 . 8 1 1 A 99 99 GLU H H 86 7.705 7.956 -0.251 1
1 850 . 8 1 1 A 99 99 GLU HA H 86 4.280 3.858 0.422 1
1 853 . 8 1 1 A 99 99 GLU C C 86 175.224 174.988 0.236 1
1 854 . 8 1 1 A 99 99 GLU CA C 86 56.260 57.458 -1.198 1
1 855 . 8 1 1 A 99 99 GLU CB C 86 26.258 27.232 -0.974 1
1 857 . 8 1 1 A 99 99 GLU N N 86 115.493 118.700 -3.207 1
1 858 . 8 1 1 A 100 100 LEU H H 87 7.989 7.104 0.885 1
1 859 . 8 1 1 A 100 100 LEU HA H 87 4.220 4.708 -0.488 1
1 868 . 8 1 1 A 100 100 LEU C C 87 176.965 176.106 0.859 1
1 869 . 8 1 1 A 100 100 LEU CA C 87 52.510 53.124 -0.614 1
1 870 . 8 1 1 A 100 100 LEU CB C 87 42.196 44.418 -2.222 1
1 873 . 8 1 1 A 100 100 LEU N N 87 117.579 119.523 -1.944 1
1 874 . 8 1 1 A 101 101 GLY H H 88 8.503 8.019 0.484 1
1 875 . 8 1 1 A 101 101 GLY CA C 88 46.884 45.754 1.130 1
1 876 . 8 1 1 A 101 101 GLY N N 88 107.794 108.777 -0.983 1
1 877 . 8 1 1 A 102 102 ASP HA H 89 4.431 4.213 0.218 1
1 880 . 8 1 1 A 102 102 ASP C C 89 178.075 178.021 0.054 1
1 881 . 8 1 1 A 102 102 ASP CA C 89 57.198 57.214 -0.016 1
1 882 . 8 1 1 A 102 102 ASP CB C 89 40.321 41.217 -0.896 1
1 883 . 8 1 1 A 103 103 TYR H H 90 7.899 7.924 -0.025 1
1 884 . 8 1 1 A 103 103 TYR HA H 90 4.940 4.466 0.474 1
1 889 . 8 1 1 A 103 103 TYR C C 90 175.527 178.492 -2.965 1
1 890 . 8 1 1 A 103 103 TYR CA C 90 58.135 60.491 -2.356 1
1 891 . 8 1 1 A 103 103 TYR CB C 90 38.446 37.708 0.738 1
1 894 . 8 1 1 A 103 103 TYR N N 90 115.595 119.355 -3.760 1
1 895 . 8 1 1 A 104 104 THR H H 91 7.971 8.493 -0.522 1
1 896 . 8 1 1 A 104 104 THR HA H 91 4.234 4.003 0.231 1
1 901 . 8 1 1 A 104 104 THR C C 91 175.905 177.180 -1.275 1
1 902 . 8 1 1 A 104 104 THR CA C 91 68.449 67.024 1.425 1
1 904 . 8 1 1 A 104 104 THR N N 91 118.867 116.652 2.215 1
1 905 . 8 1 1 A 105 105 LYS H H 92 8.555 8.376 0.179 1
1 906 . 8 1 1 A 105 105 LYS HA H 92 3.940 4.112 -0.172 1
1 912 . 8 1 1 A 105 105 LYS C C 92 177.310 178.814 -1.504 1
1 913 . 8 1 1 A 105 105 LYS CA C 92 60.948 59.038 1.910 1
1 914 . 8 1 1 A 105 105 LYS CB C 92 31.883 32.266 -0.383 1
1 917 . 8 1 1 A 105 105 LYS N N 92 119.259 120.246 -0.987 1
1 918 . 8 1 1 A 106 106 ALA H H 93 7.920 7.744 0.176 1
1 919 . 8 1 1 A 106 106 ALA HA H 93 4.128 4.197 -0.069 1
1 923 . 8 1 1 A 106 106 ALA C C 93 180.972 180.227 0.745 1
1 924 . 8 1 1 A 106 106 ALA CA C 93 55.070 55.366 -0.296 1
1 925 . 8 1 1 A 106 106 ALA CB C 93 17.750 18.331 -0.581 1
1 926 . 8 1 1 A 106 106 ALA N N 93 120.398 121.870 -1.472 1
1 927 . 8 1 1 A 107 107 PHE H H 94 8.136 8.909 -0.773 1
1 928 . 8 1 1 A 107 107 PHE HA H 94 4.190 4.616 -0.426 1
1 934 . 8 1 1 A 107 107 PHE C C 94 177.955 178.323 -0.368 1
1 935 . 8 1 1 A 107 107 PHE CA C 94 63.761 61.464 2.297 1
1 936 . 8 1 1 A 107 107 PHE CB C 94 38.446 38.569 -0.123 1
1 940 . 8 1 1 A 107 107 PHE N N 94 117.119 116.155 0.964 1
1 941 . 8 1 1 A 108 108 LEU H H 95 8.351 8.605 -0.254 1
1 942 . 8 1 1 A 108 108 LEU HA H 95 3.889 4.006 -0.117 1
1 951 . 8 1 1 A 108 108 LEU C C 95 182.043 179.273 2.770 1
1 952 . 8 1 1 A 108 108 LEU CA C 95 59.073 58.562 0.511 1
1 953 . 8 1 1 A 108 108 LEU CB C 95 41.259 41.974 -0.715 1
1 956 . 8 1 1 A 108 108 LEU N N 95 118.450 119.947 -1.497 1
1 957 . 8 1 1 A 109 109 ILE H H 96 8.992 8.075 0.917 1
1 958 . 8 1 1 A 109 109 ILE HA H 96 4.069 3.868 0.201 1
1 968 . 8 1 1 A 109 109 ILE C C 96 177.094 177.720 -0.626 1
1 969 . 8 1 1 A 109 109 ILE CA C 96 63.761 64.016 -0.255 1
1 970 . 8 1 1 A 109 109 ILE CB C 96 37.509 37.553 -0.044 1
1 974 . 8 1 1 A 109 109 ILE N N 96 118.177 114.990 3.187 1
1 975 . 8 1 1 A 110 110 ASN H H 97 7.067 8.086 -1.019 1
1 976 . 8 1 1 A 110 110 ASN HA H 97 4.797 4.716 0.081 1
1 981 . 8 1 1 A 110 110 ASN C C 97 173.595 175.348 -1.753 1
1 982 . 8 1 1 A 110 110 ASN CA C 97 54.385 53.309 1.076 1
1 983 . 8 1 1 A 110 110 ASN CB C 97 40.321 39.108 1.213 1
1 984 . 8 1 1 A 110 110 ASN N N 97 116.407 119.079 -2.672 1
1 986 . 8 1 1 A 111 111 GLY H H 98 7.681 8.005 -0.324 1
1 987 . 8 1 1 A 111 111 GLY HA2 H 98 4.080 3.926 0.154 1
1 988 . 8 1 1 A 111 111 GLY HA3 H 98 3.640 4.016 -0.376 1
1 989 . 8 1 1 A 111 111 GLY C C 98 174.552 174.390 0.162 1
1 990 . 8 1 1 A 111 111 GLY CA C 98 45.947 44.867 1.080 1
1 991 . 8 1 1 A 111 111 GLY N N 98 104.440 105.709 -1.269 1
1 992 . 8 1 1 A 112 112 TYR H H 99 8.427 8.210 0.217 1
1 993 . 8 1 1 A 112 112 TYR HA H 99 4.661 4.682 -0.021 1
1 998 . 8 1 1 A 112 112 TYR C C 99 174.425 175.807 -1.382 1
1 999 . 8 1 1 A 112 112 TYR CA C 99 57.198 58.279 -1.081 1
1 1000 . 8 1 1 A 112 112 TYR CB C 99 36.571 38.075 -1.504 1
1 1003 . 8 1 1 A 112 112 TYR N N 99 122.830 120.235 2.595 1
1 1004 . 8 1 1 A 113 113 THR H H 100 7.166 8.408 -1.242 1
1 1005 . 8 1 1 A 113 113 THR HA H 100 4.248 4.582 -0.334 1
1 1009 . 8 1 1 A 113 113 THR C C 100 174.897 174.087 0.810 1
1 1010 . 8 1 1 A 113 113 THR CA C 100 62.290 62.688 -0.398 1
1 1011 . 8 1 1 A 113 113 THR CB C 100 68.970 70.012 -1.042 1
1 1013 . 8 1 1 A 113 113 THR N N 100 104.304 119.436 -15.132 1
1 1014 . 8 1 1 A 114 114 SER H H 101 7.695 7.891 -0.196 1
1 1015 . 8 1 1 A 114 114 SER C C 101 174.372 174.339 0.033 1
1 1016 . 8 1 1 A 114 114 SER CA C 101 56.260 57.792 -1.532 1
1 1017 . 8 1 1 A 114 114 SER CB C 101 65.636 65.055 0.581 1
1 1018 . 8 1 1 A 114 114 SER N N 101 115.613 116.709 -1.096 1
1 1023 . 8 1 1 A 116 116 ASP HA H 103 4.260 4.316 -0.056 1
1 1026 . 8 1 1 A 116 116 ASP CA C 103 57.198 57.683 -0.485 1
1 1027 . 8 1 1 A 116 116 ASP CB C 103 40.321 40.351 -0.030 1
1 1028 . 8 1 1 A 117 117 LEU H H 104 7.345 8.273 -0.928 1
1 1029 . 8 1 1 A 117 117 LEU HA H 104 4.290 4.031 0.259 1
1 1038 . 8 1 1 A 117 117 LEU C C 104 178.488 179.019 -0.531 1
1 1039 . 8 1 1 A 117 117 LEU CA C 104 56.260 58.355 -2.095 1
1 1040 . 8 1 1 A 117 117 LEU CB C 104 42.196 41.541 0.655 1
1 1043 . 8 1 1 A 117 117 LEU N N 104 117.878 121.126 -3.248 1
1 1044 . 8 1 1 A 118 118 LEU H H 105 7.514 8.335 -0.821 1
1 1045 . 8 1 1 A 118 118 LEU HA H 105 4.210 4.091 0.119 1
1 1054 . 8 1 1 A 118 118 LEU C C 105 177.002 179.079 -2.077 1
1 1055 . 8 1 1 A 118 118 LEU CA C 105 55.323 57.105 -1.782 1
1 1056 . 8 1 1 A 118 118 LEU CB C 105 42.196 41.056 1.140 1
1 1059 . 8 1 1 A 118 118 LEU N N 105 119.094 119.438 -0.344 1
1 1060 . 8 1 1 A 120 120 LYS HA H 107 4.340 4.429 -0.089 1
1 1063 . 8 1 1 A 120 120 LYS C C 107 176.603 175.088 1.515 1
1 1064 . 8 1 1 A 120 120 LYS CA C 107 55.323 55.573 -0.250 1
1 1065 . 8 1 1 A 120 120 LYS CB C 107 31.883 32.360 -0.477 1
1 1068 . 8 1 1 A 121 121 ILE H H 108 7.539 7.307 0.232 1
1 1069 . 8 1 1 A 121 121 ILE HA H 108 3.987 4.528 -0.541 1
1 1079 . 8 1 1 A 121 121 ILE C C 108 173.247 175.064 -1.817 1
1 1080 . 8 1 1 A 121 121 ILE CA C 108 62.823 60.222 2.601 1
1 1081 . 8 1 1 A 121 121 ILE CB C 108 38.446 39.229 -0.783 1
1 1085 . 8 1 1 A 121 121 ILE N N 108 122.417 121.434 0.983 1
1 1086 . 8 1 1 A 122 122 ALA H H 109 8.290 8.485 -0.195 1
1 1087 . 8 1 1 A 122 122 ALA HA H 109 3.970 4.750 -0.780 1
1 1091 . 8 1 1 A 122 122 ALA C C 109 178.318 177.595 0.723 1
1 1092 . 8 1 1 A 122 122 ALA CA C 109 50.150 50.011 0.139 1
1 1093 . 8 1 1 A 122 122 ALA CB C 109 21.630 20.997 0.633 1
1 1094 . 8 1 1 A 122 122 ALA N N 109 127.784 129.816 -2.032 1
1 1095 . 8 1 1 A 123 123 GLU HA H 110 3.707 3.895 -0.188 1
1 1099 . 8 1 1 A 123 123 GLU C C 110 178.290 178.515 -0.225 1
1 1100 . 8 1 1 A 123 123 GLU CA C 110 60.948 60.074 0.874 1
1 1101 . 8 1 1 A 123 123 GLU CB C 110 29.070 29.946 -0.876 1
1 1102 . 8 1 1 A 124 124 VAL H H 111 8.333 8.093 0.240 1
1 1103 . 8 1 1 A 124 124 VAL HA H 111 3.850 3.733 0.117 1
1 1111 . 8 1 1 A 124 124 VAL C C 111 177.406 177.461 -0.055 1
1 1112 . 8 1 1 A 124 124 VAL CA C 111 65.636 65.148 0.488 1
1 1113 . 8 1 1 A 124 124 VAL CB C 111 30.730 31.330 -0.600 1
1 1116 . 8 1 1 A 124 124 VAL N N 111 114.438 118.829 -4.391 1
1 1117 . 8 1 1 A 125 125 GLU H H 112 7.442 8.438 -0.996 1
1 1118 . 8 1 1 A 125 125 GLU HA H 112 4.152 4.110 0.042 1
1 1123 . 8 1 1 A 125 125 GLU C C 112 179.982 179.285 0.697 1
1 1124 . 8 1 1 A 125 125 GLU CA C 112 60.010 59.573 0.437 1
1 1125 . 8 1 1 A 125 125 GLU CB C 112 30.008 29.121 0.887 1
1 1127 . 8 1 1 A 125 125 GLU N N 112 121.032 121.552 -0.520 1
1 1128 . 8 1 1 A 126 126 LEU H H 113 7.666 7.846 -0.180 1
1 1129 . 8 1 1 A 126 126 LEU HA H 113 3.846 4.048 -0.202 1
1 1138 . 8 1 1 A 126 126 LEU C C 113 176.991 178.939 -1.948 1
1 1139 . 8 1 1 A 126 126 LEU CA C 113 58.135 57.980 0.155 1
1 1140 . 8 1 1 A 126 126 LEU CB C 113 41.259 41.784 -0.525 1
1 1143 . 8 1 1 A 126 126 LEU N N 113 118.731 121.080 -2.349 1
1 1144 . 8 1 1 A 127 127 ILE H H 114 7.781 7.993 -0.212 1
1 1145 . 8 1 1 A 127 127 ILE HA H 114 3.502 3.884 -0.382 1
1 1153 . 8 1 1 A 127 127 ILE C C 114 178.195 176.933 1.262 1
1 1154 . 8 1 1 A 127 127 ILE CA C 114 65.636 63.228 2.408 1
1 1155 . 8 1 1 A 127 127 ILE CB C 114 40.321 37.709 2.612 1
1 1159 . 8 1 1 A 127 127 ILE N N 114 115.084 119.057 -3.973 1
1 1160 . 8 1 1 A 128 128 ASN H H 115 8.470 8.022 0.448 1
1 1161 . 8 1 1 A 128 128 ASN HA H 115 4.502 4.707 -0.205 1
1 1166 . 8 1 1 A 128 128 ASN C C 115 176.295 176.509 -0.214 1
1 1167 . 8 1 1 A 128 128 ASN CA C 115 56.260 54.545 1.715 1
1 1168 . 8 1 1 A 128 128 ASN CB C 115 39.384 39.075 0.309 1
1 1169 . 8 1 1 A 128 128 ASN N N 115 115.158 119.177 -4.019 1
1 1171 . 8 1 1 A 129 129 VAL H H 116 8.116 7.820 0.296 1
1 1172 . 8 1 1 A 129 129 VAL HA H 116 4.090 3.972 0.118 1
1 1180 . 8 1 1 A 129 129 VAL C C 116 176.740 177.492 -0.752 1
1 1181 . 8 1 1 A 129 129 VAL CA C 116 64.400 64.505 -0.105 1
1 1182 . 8 1 1 A 129 129 VAL CB C 116 32.050 32.510 -0.460 1
1 1185 . 8 1 1 A 129 129 VAL N N 116 118.698 118.318 0.380 1
1 1186 . 8 1 1 A 130 130 LEU H H 117 7.294 7.941 -0.647 1
1 1187 . 8 1 1 A 130 130 LEU HA H 117 3.970 4.189 -0.219 1
1 1196 . 8 1 1 A 130 130 LEU C C 117 175.127 176.182 -1.055 1
1 1197 . 8 1 1 A 130 130 LEU CA C 117 56.260 55.094 1.166 1
1 1198 . 8 1 1 A 130 130 LEU CB C 117 41.259 42.216 -0.957 1
1 1201 . 8 1 1 A 130 130 LEU N N 117 116.201 119.036 -2.835 1
1 1202 . 8 1 1 A 131 131 LYS H H 118 6.594 7.885 -1.291 1
1 1203 . 8 1 1 A 131 131 LYS HA H 118 3.980 4.225 -0.245 1
1 1208 . 8 1 1 A 131 131 LYS C C 118 175.589 175.443 0.146 1
1 1209 . 8 1 1 A 131 131 LYS CA C 118 56.260 57.437 -1.177 1
1 1210 . 8 1 1 A 131 131 LYS CB C 118 28.133 29.314 -1.181 1
1 1212 . 8 1 1 A 131 131 LYS N N 118 111.172 115.897 -4.725 1
1 1213 . 8 1 1 A 132 132 ILE H H 119 8.245 7.988 0.257 1
1 1214 . 8 1 1 A 132 132 ILE HA H 119 4.090 4.342 -0.252 1
1 1224 . 8 1 1 A 132 132 ILE C C 119 175.161 176.492 -1.331 1
1 1225 . 8 1 1 A 132 132 ILE CA C 119 60.010 61.520 -1.510 1
1 1226 . 8 1 1 A 132 132 ILE CB C 119 35.633 37.024 -1.391 1
1 1230 . 8 1 1 A 132 132 ILE N N 119 119.484 120.418 -0.934 1
1 1231 . 8 1 1 A 133 133 ASN H H 120 8.054 8.808 -0.754 1
1 1232 . 8 1 1 A 133 133 ASN HA H 120 4.350 4.753 -0.403 1
1 1235 . 8 1 1 A 133 133 ASN C C 120 175.136 175.079 0.057 1
1 1236 . 8 1 1 A 133 133 ASN CA C 120 54.385 54.045 0.340 1
1 1237 . 8 1 1 A 133 133 ASN CB C 120 39.384 39.871 -0.487 1
1 1238 . 8 1 1 A 133 133 ASN N N 120 124.670 124.467 0.203 1
1 1239 . 8 1 1 A 134 134 LEU H H 121 7.517 7.344 0.173 1
1 1240 . 8 1 1 A 134 134 LEU HA H 121 4.678 4.090 0.588 1
1 1249 . 8 1 1 A 134 134 LEU C C 121 178.051 177.477 0.574 1
1 1250 . 8 1 1 A 134 134 LEU CA C 121 53.447 56.030 -2.583 1
1 1251 . 8 1 1 A 134 134 LEU CB C 121 41.259 43.041 -1.782 1
1 1254 . 8 1 1 A 134 134 LEU N N 121 119.918 119.421 0.497 1
1 1255 . 8 1 1 A 135 135 ILE H H 122 9.389 8.634 0.755 1
1 1256 . 8 1 1 A 135 135 ILE HA H 122 3.540 3.726 -0.186 1
1 1266 . 8 1 1 A 135 135 ILE C C 122 176.425 178.097 -1.672 1
1 1267 . 8 1 1 A 135 135 ILE CA C 122 65.636 65.289 0.347 1
1 1268 . 8 1 1 A 135 135 ILE CB C 122 38.446 37.684 0.762 1
1 1272 . 8 1 1 A 135 135 ILE N N 122 129.949 126.292 3.657 1
1 1273 . 8 1 1 A 136 136 GLY H H 123 8.675 8.203 0.472 1
1 1274 . 8 1 1 A 136 136 GLY HA2 H 123 2.650 3.007 -0.357 1
1 1275 . 8 1 1 A 136 136 GLY HA3 H 123 2.060 3.454 -1.394 1
1 1276 . 8 1 1 A 136 136 GLY C C 123 176.854 176.765 0.089 1
1 1277 . 8 1 1 A 136 136 GLY CA C 123 45.500 47.114 -1.614 1
1 1278 . 8 1 1 A 136 136 GLY N N 123 106.314 108.326 -2.012 1
1 1279 . 8 1 1 A 137 137 HIS H H 124 6.869 7.818 -0.949 1
1 1280 . 8 1 1 A 137 137 HIS HA H 124 4.558 4.700 -0.142 1
1 1285 . 8 1 1 A 137 137 HIS C C 124 176.977 177.993 -1.016 1
1 1286 . 8 1 1 A 137 137 HIS CA C 124 57.198 58.415 -1.217 1
1 1287 . 8 1 1 A 137 137 HIS CB C 124 30.945 29.057 1.888 1
1 1290 . 8 1 1 A 137 137 HIS N N 124 118.865 120.282 -1.417 1
1 1291 . 8 1 1 A 138 138 ARG H H 125 7.730 8.315 -0.585 1
1 1292 . 8 1 1 A 138 138 ARG HA H 125 3.770 3.940 -0.170 1
1 1299 . 8 1 1 A 138 138 ARG C C 125 178.288 178.551 -0.263 1
1 1300 . 8 1 1 A 138 138 ARG CA C 125 61.886 58.801 3.085 1
1 1301 . 8 1 1 A 138 138 ARG CB C 125 30.945 29.849 1.096 1
1 1304 . 8 1 1 A 138 138 ARG N N 125 118.149 117.779 0.370 1
1 1306 . 8 1 1 A 139 139 LYS H H 126 8.679 7.938 0.741 1
1 1307 . 8 1 1 A 139 139 LYS HA H 126 3.990 3.979 0.011 1
1 1310 . 8 1 1 A 139 139 LYS C C 126 179.184 179.055 0.129 1
1 1311 . 8 1 1 A 139 139 LYS CA C 126 58.135 59.409 -1.274 1
1 1312 . 8 1 1 A 139 139 LYS CB C 126 30.945 31.973 -1.028 1
1 1314 . 8 1 1 A 139 139 LYS N N 126 114.003 119.419 -5.416 1
1 1315 . 8 1 1 A 140 140 ARG H H 127 7.248 8.004 -0.756 1
1 1316 . 8 1 1 A 140 140 ARG HA H 127 3.870 3.949 -0.079 1
1 1324 . 8 1 1 A 140 140 ARG C C 127 177.772 178.710 -0.938 1
1 1325 . 8 1 1 A 140 140 ARG CA C 127 60.010 59.083 0.927 1
1 1326 . 8 1 1 A 140 140 ARG CB C 127 30.945 29.742 1.203 1
1 1329 . 8 1 1 A 140 140 ARG N N 127 120.072 118.431 1.641 1
1 1331 . 8 1 1 A 141 141 ILE H H 128 7.706 7.898 -0.192 1
1 1332 . 8 1 1 A 141 141 ILE HA H 128 3.530 3.822 -0.292 1
1 1340 . 8 1 1 A 141 141 ILE C C 128 177.669 178.183 -0.514 1
1 1341 . 8 1 1 A 141 141 ILE CA C 128 65.636 65.499 0.137 1
1 1342 . 8 1 1 A 141 141 ILE CB C 128 38.680 38.173 0.507 1
1 1345 . 8 1 1 A 141 141 ILE N N 128 118.730 120.495 -1.765 1
1 1346 . 8 1 1 A 142 142 LEU H H 129 8.194 8.047 0.147 1
1 1347 . 8 1 1 A 142 142 LEU HA H 129 3.950 3.976 -0.026 1
1 1356 . 8 1 1 A 142 142 LEU C C 129 179.960 178.562 1.398 1
1 1357 . 8 1 1 A 142 142 LEU CA C 129 58.135 57.944 0.191 1
1 1358 . 8 1 1 A 142 142 LEU CB C 129 41.259 41.148 0.111 1
1 1361 . 8 1 1 A 142 142 LEU N N 129 117.675 121.433 -3.758 1
1 1362 . 8 1 1 A 143 143 ALA H H 130 8.294 8.757 -0.463 1
1 1363 . 8 1 1 A 143 143 ALA HA H 130 4.220 4.069 0.151 1
1 1367 . 8 1 1 A 143 143 ALA C C 130 179.899 179.677 0.222 1
1 1368 . 8 1 1 A 143 143 ALA CA C 130 54.385 55.264 -0.879 1
1 1369 . 8 1 1 A 143 143 ALA CB C 130 19.270 18.319 0.951 1
1 1370 . 8 1 1 A 143 143 ALA N N 130 121.096 121.386 -0.290 1
1 1371 . 8 1 1 A 144 144 SER H H 131 7.813 8.262 -0.449 1
1 1372 . 8 1 1 A 144 144 SER HA H 131 4.180 4.240 -0.060 1
1 1375 . 8 1 1 A 144 144 SER C C 131 175.457 177.589 -2.132 1
1 1376 . 8 1 1 A 144 144 SER CA C 131 60.948 61.825 -0.877 1
1 1377 . 8 1 1 A 144 144 SER CB C 131 63.761 62.592 1.169 1
1 1378 . 8 1 1 A 144 144 SER N N 131 112.102 113.277 -1.175 1
1 1379 . 8 1 1 A 145 145 LEU H H 132 7.747 7.864 -0.117 1
1 1380 . 8 1 1 A 145 145 LEU HA H 132 4.140 3.943 0.197 1
1 1389 . 8 1 1 A 145 145 LEU C C 132 178.589 177.693 0.896 1
1 1390 . 8 1 1 A 145 145 LEU CA C 132 56.260 56.742 -0.482 1
1 1391 . 8 1 1 A 145 145 LEU CB C 132 42.196 42.595 -0.399 1
1 1394 . 8 1 1 A 145 145 LEU N N 132 117.536 118.591 -1.055 1
1 1395 . 8 1 1 A 146 146 GLY H H 133 7.544 7.916 -0.372 1
1 1396 . 8 1 1 A 146 146 GLY HA2 H 133 3.950 4.079 -0.129 1
1 1397 . 8 1 1 A 146 146 GLY HA3 H 133 3.100 4.079 -0.979 1
1 1398 . 8 1 1 A 146 146 GLY C C 133 173.372 172.875 0.497 1
1 1399 . 8 1 1 A 146 146 GLY CA C 133 45.947 44.741 1.206 1
1 1400 . 8 1 1 A 146 146 GLY N N 133 105.351 105.686 -0.335 1
1 1401 . 8 1 1 A 147 147 ASP H H 134 8.342 8.613 -0.271 1
1 1402 . 8 1 1 A 147 147 ASP HA H 134 4.650 4.692 -0.042 1
1 1405 . 8 1 1 A 147 147 ASP C C 134 175.462 175.869 -0.407 1
1 1406 . 8 1 1 A 147 147 ASP CA C 134 54.385 53.816 0.569 1
1 1407 . 8 1 1 A 147 147 ASP CB C 134 41.259 41.869 -0.610 1
1 1408 . 8 1 1 A 147 147 ASP N N 134 120.133 123.378 -3.245 1
1 14 . 9 1 1 A 15 15 GLN H H 2 8.439 7.592 0.847 1
1 15 . 9 1 1 A 15 15 GLN HA H 2 4.594 4.848 -0.254 1
1 20 . 9 1 1 A 15 15 GLN C C 2 175.972 174.481 1.491 1
1 21 . 9 1 1 A 15 15 GLN CA C 2 56.260 54.020 2.240 1
1 22 . 9 1 1 A 15 15 GLN CB C 2 30.945 32.233 -1.288 1
1 24 . 9 1 1 A 15 15 GLN N N 2 124.997 120.516 4.481 1
1 25 . 9 1 1 A 16 16 THR H H 3 8.347 8.507 -0.160 1
1 26 . 9 1 1 A 16 16 THR HA H 3 4.555 5.124 -0.569 1
1 31 . 9 1 1 A 16 16 THR C C 3 175.495 175.192 0.303 1
1 32 . 9 1 1 A 16 16 THR CA C 3 60.010 60.049 -0.039 1
1 33 . 9 1 1 A 16 16 THR CB C 3 71.261 72.118 -0.857 1
1 34 . 9 1 1 A 16 16 THR N N 3 113.011 114.660 -1.649 1
1 35 . 9 1 1 A 17 17 VAL H H 4 8.895 8.866 0.029 1
1 36 . 9 1 1 A 17 17 VAL HA H 4 3.670 3.747 -0.077 1
1 44 . 9 1 1 A 17 17 VAL C C 4 178.449 177.806 0.643 1
1 45 . 9 1 1 A 17 17 VAL CA C 4 67.511 66.377 1.134 1
1 46 . 9 1 1 A 17 17 VAL CB C 4 31.883 31.659 0.224 1
1 49 . 9 1 1 A 17 17 VAL N N 4 121.854 122.812 -0.958 1
1 50 . 9 1 1 A 18 18 GLY H H 5 9.017 8.290 0.727 1
1 51 . 9 1 1 A 18 18 GLY HA2 H 5 3.940 3.809 0.131 1
1 52 . 9 1 1 A 18 18 GLY HA3 H 5 3.610 3.817 -0.207 1
1 53 . 9 1 1 A 18 18 GLY C C 5 176.186 175.562 0.624 1
1 54 . 9 1 1 A 18 18 GLY CA C 5 47.822 47.194 0.628 1
1 55 . 9 1 1 A 18 18 GLY N N 5 106.966 107.445 -0.479 1
1 56 . 9 1 1 A 19 19 GLN H H 6 8.072 8.319 -0.247 1
1 57 . 9 1 1 A 19 19 GLN HA H 6 4.037 4.113 -0.076 1
1 62 . 9 1 1 A 19 19 GLN C C 6 179.488 177.903 1.585 1
1 63 . 9 1 1 A 19 19 GLN CA C 6 59.073 58.718 0.355 1
1 64 . 9 1 1 A 19 19 GLN CB C 6 28.489 28.808 -0.319 1
1 66 . 9 1 1 A 19 19 GLN N N 6 122.431 120.946 1.485 1
1 67 . 9 1 1 A 20 20 TRP H H 7 8.756 8.238 0.518 1
1 68 . 9 1 1 A 20 20 TRP HA H 7 4.160 4.266 -0.106 1
1 77 . 9 1 1 A 20 20 TRP C C 7 179.620 177.750 1.870 1
1 78 . 9 1 1 A 20 20 TRP CA C 7 61.886 61.192 0.694 1
1 79 . 9 1 1 A 20 20 TRP CB C 7 28.133 29.624 -1.491 1
1 85 . 9 1 1 A 20 20 TRP N N 7 124.265 121.939 2.326 1
1 87 . 9 1 1 A 21 21 LEU H H 8 9.148 8.550 0.598 1
1 88 . 9 1 1 A 21 21 LEU HA H 8 3.440 3.602 -0.162 1
1 97 . 9 1 1 A 21 21 LEU C C 8 180.521 178.322 2.199 1
1 98 . 9 1 1 A 21 21 LEU CA C 8 56.920 58.020 -1.100 1
1 99 . 9 1 1 A 21 21 LEU CB C 8 41.700 41.717 -0.017 1
1 102 . 9 1 1 A 21 21 LEU N N 8 120.548 120.640 -0.092 1
1 103 . 9 1 1 A 22 22 GLU H H 9 8.284 8.278 0.006 1
1 104 . 9 1 1 A 22 22 GLU HA H 9 3.740 3.964 -0.224 1
1 109 . 9 1 1 A 22 22 GLU C C 9 179.960 178.618 1.342 1
1 110 . 9 1 1 A 22 22 GLU CA C 9 60.010 59.210 0.800 1
1 111 . 9 1 1 A 22 22 GLU CB C 9 29.070 29.078 -0.008 1
1 113 . 9 1 1 A 22 22 GLU N N 9 120.133 119.481 0.652 1
1 114 . 9 1 1 A 23 23 SER H H 10 7.891 7.713 0.178 1
1 115 . 9 1 1 A 23 23 SER HA H 10 4.250 4.238 0.012 1
1 118 . 9 1 1 A 23 23 SER C C 10 175.346 176.435 -1.089 1
1 119 . 9 1 1 A 23 23 SER CA C 10 60.948 61.170 -0.222 1
1 120 . 9 1 1 A 23 23 SER CB C 10 63.280 62.725 0.555 1
1 121 . 9 1 1 A 23 23 SER N N 10 117.044 114.370 2.674 1
1 122 . 9 1 1 A 24 24 ILE H H 11 6.862 7.469 -0.607 1
1 123 . 9 1 1 A 24 24 ILE HA H 11 4.487 3.759 0.728 1
1 133 . 9 1 1 A 24 24 ILE C C 11 175.812 175.855 -0.043 1
1 134 . 9 1 1 A 24 24 ILE CA C 11 60.948 63.186 -2.238 1
1 135 . 9 1 1 A 24 24 ILE CB C 11 38.250 37.253 0.997 1
1 139 . 9 1 1 A 24 24 ILE N N 11 113.733 119.018 -5.285 1
1 140 . 9 1 1 A 25 25 GLY H H 12 7.628 7.645 -0.017 1
1 141 . 9 1 1 A 25 25 GLY HA2 H 12 3.990 3.974 0.016 1
1 142 . 9 1 1 A 25 25 GLY HA3 H 12 3.800 4.006 -0.206 1
1 143 . 9 1 1 A 25 25 GLY C C 12 173.647 171.780 1.867 1
1 144 . 9 1 1 A 25 25 GLY CA C 12 45.947 45.680 0.267 1
1 145 . 9 1 1 A 25 25 GLY N N 12 109.763 110.059 -0.296 1
1 146 . 9 1 1 A 26 26 LEU H H 13 7.620 8.288 -0.668 1
1 147 . 9 1 1 A 26 26 LEU C C 13 176.186 174.536 1.650 1
1 148 . 9 1 1 A 26 26 LEU CA C 13 52.700 51.684 1.016 1
1 149 . 9 1 1 A 26 26 LEU CB C 13 43.134 44.866 -1.732 1
1 150 . 9 1 1 A 26 26 LEU N N 13 118.778 122.618 -3.840 1
1 151 . 9 1 1 A 27 27 PRO HA H 14 4.120 4.588 -0.468 1
1 154 . 9 1 1 A 27 27 PRO C C 14 177.955 175.545 2.410 1
1 155 . 9 1 1 A 27 27 PRO CA C 14 64.698 62.278 2.420 1
1 156 . 9 1 1 A 27 27 PRO CB C 14 31.883 29.032 2.851 1
1 158 . 9 1 1 A 28 28 GLN H H 15 9.838 8.570 1.268 1
1 159 . 9 1 1 A 28 28 GLN HA H 15 4.240 4.323 -0.083 1
1 162 . 9 1 1 A 28 28 GLN C C 15 176.836 176.031 0.805 1
1 163 . 9 1 1 A 28 28 GLN CA C 15 58.135 55.973 2.162 1
1 164 . 9 1 1 A 28 28 GLN CB C 15 27.195 30.036 -2.841 1
1 166 . 9 1 1 A 28 28 GLN N N 15 120.414 121.951 -1.537 1
1 167 . 9 1 1 A 29 29 TYR H H 16 6.810 7.801 -0.991 1
1 168 . 9 1 1 A 29 29 TYR HA H 16 5.720 4.734 0.986 1
1 173 . 9 1 1 A 29 29 TYR C C 16 174.814 176.395 -1.581 1
1 174 . 9 1 1 A 29 29 TYR CA C 16 57.198 57.541 -0.343 1
1 175 . 9 1 1 A 29 29 TYR CB C 16 37.509 39.278 -1.769 1
1 178 . 9 1 1 A 29 29 TYR N N 16 119.718 117.701 2.017 1
1 179 . 9 1 1 A 30 30 GLU H H 17 7.509 8.202 -0.693 1
1 180 . 9 1 1 A 30 30 GLU HA H 17 3.650 4.009 -0.359 1
1 184 . 9 1 1 A 30 30 GLU C C 17 177.552 178.355 -0.803 1
1 185 . 9 1 1 A 30 30 GLU CA C 17 60.948 59.749 1.199 1
1 186 . 9 1 1 A 30 30 GLU CB C 17 30.008 29.370 0.638 1
1 188 . 9 1 1 A 30 30 GLU N N 17 122.417 123.072 -0.655 1
1 189 . 9 1 1 A 31 31 ASN H H 18 9.259 8.180 1.079 1
1 190 . 9 1 1 A 31 31 ASN HA H 18 4.451 4.472 -0.021 1
1 193 . 9 1 1 A 31 31 ASN C C 18 176.868 178.000 -1.132 1
1 194 . 9 1 1 A 31 31 ASN CA C 18 57.198 56.432 0.766 1
1 195 . 9 1 1 A 31 31 ASN CB C 18 38.446 39.902 -1.456 1
1 196 . 9 1 1 A 31 31 ASN N N 18 116.613 118.292 -1.679 1
1 197 . 9 1 1 A 32 32 HIS H H 19 8.898 8.332 0.566 1
1 198 . 9 1 1 A 32 32 HIS HA H 19 4.140 4.359 -0.219 1
1 202 . 9 1 1 A 32 32 HIS C C 19 178.269 177.792 0.477 1
1 203 . 9 1 1 A 32 32 HIS CA C 19 60.948 59.066 1.882 1
1 204 . 9 1 1 A 32 32 HIS CB C 19 30.008 30.347 -0.339 1
1 206 . 9 1 1 A 32 32 HIS N N 19 118.926 118.482 0.444 1
1 207 . 9 1 1 A 33 33 LEU H H 20 7.825 9.013 -1.188 1
1 208 . 9 1 1 A 33 33 LEU HA H 20 4.305 3.917 0.388 1
1 218 . 9 1 1 A 33 33 LEU C C 20 179.190 179.097 0.093 1
1 219 . 9 1 1 A 33 33 LEU CA C 20 60.010 58.343 1.667 1
1 220 . 9 1 1 A 33 33 LEU CB C 20 40.321 41.922 -1.601 1
1 224 . 9 1 1 A 33 33 LEU N N 20 117.434 119.861 -2.427 1
1 225 . 9 1 1 A 34 34 MET H H 21 8.861 8.483 0.378 1
1 226 . 9 1 1 A 34 34 MET HA H 21 3.980 4.218 -0.238 1
1 234 . 9 1 1 A 34 34 MET C C 21 180.340 178.840 1.500 1
1 235 . 9 1 1 A 34 34 MET CA C 21 58.135 58.760 -0.625 1
1 236 . 9 1 1 A 34 34 MET CB C 21 30.945 32.622 -1.677 1
1 238 . 9 1 1 A 34 34 MET N N 21 118.111 116.447 1.664 1
1 239 . 9 1 1 A 35 35 ALA H H 22 9.015 8.540 0.475 1
1 240 . 9 1 1 A 35 35 ALA HA H 22 4.239 4.169 0.070 1
1 244 . 9 1 1 A 35 35 ALA C C 22 178.058 178.836 -0.778 1
1 245 . 9 1 1 A 35 35 ALA CA C 22 53.800 54.544 -0.744 1
1 246 . 9 1 1 A 35 35 ALA CB C 22 18.397 18.255 0.142 1
1 247 . 9 1 1 A 35 35 ALA N N 22 120.068 121.699 -1.631 1
1 248 . 9 1 1 A 36 36 ASN H H 23 7.143 8.010 -0.867 1
1 249 . 9 1 1 A 36 36 ASN HA H 23 4.959 4.745 0.214 1
1 254 . 9 1 1 A 36 36 ASN C C 23 174.083 175.672 -1.589 1
1 255 . 9 1 1 A 36 36 ASN CA C 23 54.000 53.103 0.897 1
1 256 . 9 1 1 A 36 36 ASN CB C 23 41.300 39.090 2.210 1
1 257 . 9 1 1 A 36 36 ASN N N 23 111.560 115.043 -3.483 1
1 259 . 9 1 1 A 37 37 GLY H H 24 7.797 8.400 -0.603 1
1 260 . 9 1 1 A 37 37 GLY HA2 H 24 3.430 3.894 -0.464 1
1 261 . 9 1 1 A 37 37 GLY HA3 H 24 3.290 3.970 -0.680 1
1 262 . 9 1 1 A 37 37 GLY C C 24 173.163 175.048 -1.885 1
1 263 . 9 1 1 A 37 37 GLY CA C 24 45.947 45.219 0.728 1
1 264 . 9 1 1 A 37 37 GLY N N 24 106.170 107.261 -1.091 1
1 265 . 9 1 1 A 38 38 PHE H H 25 8.191 7.967 0.224 1
1 266 . 9 1 1 A 38 38 PHE HA H 25 4.910 4.766 0.144 1
1 271 . 9 1 1 A 38 38 PHE C C 25 173.496 175.741 -2.245 1
1 272 . 9 1 1 A 38 38 PHE CA C 25 56.550 56.207 0.343 1
1 273 . 9 1 1 A 38 38 PHE CB C 25 37.220 36.779 0.441 1
1 276 . 9 1 1 A 38 38 PHE N N 25 122.454 119.906 2.548 1
1 277 . 9 1 1 A 39 39 ASP H H 26 6.756 8.330 -1.574 1
1 278 . 9 1 1 A 39 39 ASP HA H 26 5.077 4.871 0.206 1
1 281 . 9 1 1 A 39 39 ASP C C 26 177.463 175.502 1.961 1
1 282 . 9 1 1 A 39 39 ASP CA C 26 53.447 54.267 -0.820 1
1 283 . 9 1 1 A 39 39 ASP CB C 26 42.580 41.831 0.749 1
1 284 . 9 1 1 A 39 39 ASP N N 26 111.309 120.431 -9.122 1
1 285 . 9 1 1 A 40 40 ASN H H 27 7.495 7.903 -0.408 1
1 286 . 9 1 1 A 40 40 ASN HA H 27 4.820 5.011 -0.191 1
1 289 . 9 1 1 A 40 40 ASN C C 27 176.228 175.888 0.340 1
1 290 . 9 1 1 A 40 40 ASN CA C 27 52.510 51.950 0.560 1
1 291 . 9 1 1 A 40 40 ASN CB C 27 40.321 40.136 0.185 1
1 292 . 9 1 1 A 40 40 ASN N N 27 118.385 118.128 0.257 1
1 293 . 9 1 1 A 41 41 VAL H H 28 9.192 8.623 0.569 1
1 294 . 9 1 1 A 41 41 VAL HA H 28 3.550 3.575 -0.025 1
1 302 . 9 1 1 A 41 41 VAL C C 28 176.429 177.640 -1.211 1
1 303 . 9 1 1 A 41 41 VAL CA C 28 65.636 66.201 -0.565 1
1 304 . 9 1 1 A 41 41 VAL CB C 28 31.883 31.507 0.376 1
1 307 . 9 1 1 A 41 41 VAL N N 28 125.741 125.717 0.024 1
1 308 . 9 1 1 A 42 42 GLN H H 29 8.203 8.344 -0.141 1
1 309 . 9 1 1 A 42 42 GLN HA H 29 4.129 3.920 0.209 1
1 314 . 9 1 1 A 42 42 GLN C C 29 176.591 178.276 -1.685 1
1 315 . 9 1 1 A 42 42 GLN CA C 29 57.198 58.725 -1.527 1
1 316 . 9 1 1 A 42 42 GLN CB C 29 28.133 28.616 -0.483 1
1 318 . 9 1 1 A 42 42 GLN N N 29 116.452 120.312 -3.860 1
1 319 . 9 1 1 A 43 43 ALA H H 30 7.781 8.559 -0.778 1
1 320 . 9 1 1 A 43 43 ALA HA H 30 4.650 4.009 0.641 1
1 324 . 9 1 1 A 43 43 ALA C C 30 175.976 179.880 -3.904 1
1 325 . 9 1 1 A 43 43 ALA CA C 30 50.840 54.602 -3.762 1
1 326 . 9 1 1 A 43 43 ALA CB C 30 19.150 18.363 0.787 1
1 327 . 9 1 1 A 43 43 ALA N N 30 122.150 121.470 0.680 1
1 328 . 9 1 1 A 44 44 MET H H 31 7.739 8.511 -0.772 1
1 332 . 9 1 1 A 44 44 MET C C 31 178.275 178.859 -0.584 1
1 333 . 9 1 1 A 44 44 MET CA C 31 55.323 58.281 -2.958 1
1 334 . 9 1 1 A 44 44 MET CB C 31 34.696 31.804 2.892 1
1 336 . 9 1 1 A 44 44 MET N N 31 118.149 116.897 1.252 1
1 337 . 9 1 1 A 45 45 GLY H H 32 7.611 8.394 -0.783 1
1 338 . 9 1 1 A 45 45 GLY N N 32 101.530 109.276 -7.746 1
1 339 . 9 1 1 A 47 47 ASN HA H 34 4.480 5.148 -0.668 1
1 342 . 9 1 1 A 47 47 ASN CA C 34 56.260 52.226 4.034 1
1 343 . 9 1 1 A 47 47 ASN CB C 34 39.384 41.742 -2.358 1
1 344 . 9 1 1 A 49 49 MET HA H 36 4.646 4.456 0.190 1
1 350 . 9 1 1 A 49 49 MET C C 36 173.651 176.336 -2.685 1
1 351 . 9 1 1 A 49 49 MET CA C 36 55.323 55.456 -0.133 1
1 352 . 9 1 1 A 49 49 MET CB C 36 35.633 32.188 3.445 1
1 355 . 9 1 1 A 50 50 GLU H H 37 9.203 9.158 0.045 1
1 356 . 9 1 1 A 50 50 GLU HA H 37 4.650 4.652 -0.002 1
1 361 . 9 1 1 A 50 50 GLU C C 37 177.008 177.949 -0.941 1
1 362 . 9 1 1 A 50 50 GLU CA C 37 54.385 55.029 -0.644 1
1 363 . 9 1 1 A 50 50 GLU CB C 37 33.758 31.574 2.184 1
1 365 . 9 1 1 A 50 50 GLU N N 37 123.229 123.139 0.090 1
1 366 . 9 1 1 A 51 51 ASP H H 38 9.032 8.934 0.098 1
1 367 . 9 1 1 A 51 51 ASP HA H 38 4.149 4.291 -0.142 1
1 370 . 9 1 1 A 51 51 ASP C C 38 177.994 177.851 0.143 1
1 371 . 9 1 1 A 51 51 ASP CA C 38 59.073 57.745 1.328 1
1 372 . 9 1 1 A 51 51 ASP CB C 38 43.134 40.581 2.553 1
1 373 . 9 1 1 A 51 51 ASP N N 38 122.717 123.888 -1.171 1
1 374 . 9 1 1 A 52 52 GLN H H 39 8.950 8.219 0.731 1
1 375 . 9 1 1 A 52 52 GLN HA H 39 3.940 3.956 -0.016 1
1 378 . 9 1 1 A 52 52 GLN C C 39 177.817 178.469 -0.652 1
1 379 . 9 1 1 A 52 52 GLN CA C 39 59.073 59.008 0.065 1
1 380 . 9 1 1 A 52 52 GLN CB C 39 28.133 28.515 -0.382 1
1 381 . 9 1 1 A 52 52 GLN N N 39 114.086 118.280 -4.194 1
1 382 . 9 1 1 A 53 53 ASP H H 40 7.214 8.168 -0.954 1
1 383 . 9 1 1 A 53 53 ASP HA H 40 4.370 4.513 -0.143 1
1 386 . 9 1 1 A 53 53 ASP C C 40 177.667 178.733 -1.066 1
1 387 . 9 1 1 A 53 53 ASP CA C 40 57.198 57.443 -0.245 1
1 388 . 9 1 1 A 53 53 ASP CB C 40 41.800 40.424 1.376 1
1 389 . 9 1 1 A 53 53 ASP N N 40 118.734 120.162 -1.428 1
1 390 . 9 1 1 A 54 54 LEU H H 41 7.180 7.998 -0.818 1
1 391 . 9 1 1 A 54 54 LEU HA H 41 3.990 4.076 -0.086 1
1 400 . 9 1 1 A 54 54 LEU C C 41 178.204 178.254 -0.050 1
1 401 . 9 1 1 A 54 54 LEU CA C 41 56.260 58.069 -1.809 1
1 402 . 9 1 1 A 54 54 LEU CB C 41 41.259 41.692 -0.433 1
1 405 . 9 1 1 A 54 54 LEU N N 41 115.795 122.275 -6.480 1
1 406 . 9 1 1 A 55 55 LEU H H 42 7.823 8.229 -0.406 1
1 407 . 9 1 1 A 55 55 LEU HA H 42 3.920 4.133 -0.213 1
1 416 . 9 1 1 A 55 55 LEU C C 42 180.876 178.450 2.426 1
1 417 . 9 1 1 A 55 55 LEU CA C 42 58.135 57.236 0.899 1
1 418 . 9 1 1 A 55 55 LEU CB C 42 42.196 41.561 0.635 1
1 421 . 9 1 1 A 55 55 LEU N N 42 120.499 119.335 1.164 1
1 422 . 9 1 1 A 56 56 GLU H H 43 8.127 8.117 0.010 1
1 423 . 9 1 1 A 56 56 GLU HA H 43 3.966 4.150 -0.184 1
1 428 . 9 1 1 A 56 56 GLU C C 43 178.801 179.350 -0.549 1
1 429 . 9 1 1 A 56 56 GLU CA C 43 60.010 59.040 0.970 1
1 430 . 9 1 1 A 56 56 GLU CB C 43 29.070 29.251 -0.181 1
1 432 . 9 1 1 A 56 56 GLU N N 43 120.955 118.543 2.412 1
1 433 . 9 1 1 A 57 57 ILE H H 44 7.504 7.657 -0.153 1
1 434 . 9 1 1 A 57 57 ILE HA H 44 4.524 3.865 0.659 1
1 444 . 9 1 1 A 57 57 ILE C C 44 175.691 177.308 -1.617 1
1 445 . 9 1 1 A 57 57 ILE CA C 44 61.886 65.202 -3.316 1
1 446 . 9 1 1 A 57 57 ILE CB C 44 37.300 38.228 -0.928 1
1 450 . 9 1 1 A 57 57 ILE N N 44 109.594 119.431 -9.837 1
1 451 . 9 1 1 A 58 58 GLY H H 45 7.724 7.429 0.295 1
1 452 . 9 1 1 A 58 58 GLY HA2 H 45 3.650 4.226 -0.576 1
1 453 . 9 1 1 A 58 58 GLY HA3 H 45 4.530 4.371 0.159 1
1 454 . 9 1 1 A 58 58 GLY C C 45 174.613 173.990 0.623 1
1 455 . 9 1 1 A 58 58 GLY CA C 45 45.947 45.634 0.313 1
1 456 . 9 1 1 A 58 58 GLY N N 45 106.680 106.601 0.079 1
1 457 . 9 1 1 A 59 59 ILE H H 46 8.180 7.947 0.233 1
1 458 . 9 1 1 A 59 59 ILE HA H 46 3.907 4.387 -0.480 1
1 468 . 9 1 1 A 59 59 ILE C C 46 174.235 176.464 -2.229 1
1 469 . 9 1 1 A 59 59 ILE CA C 46 60.948 59.926 1.022 1
1 470 . 9 1 1 A 59 59 ILE CB C 46 33.980 38.091 -4.111 1
1 474 . 9 1 1 A 59 59 ILE N N 46 122.454 120.494 1.960 1
1 475 . 9 1 1 A 60 60 LEU H H 47 7.367 7.948 -0.581 1
1 476 . 9 1 1 A 60 60 LEU HA H 47 3.900 4.112 -0.212 1
1 479 . 9 1 1 A 60 60 LEU C C 47 177.753 177.682 0.071 1
1 480 . 9 1 1 A 60 60 LEU CA C 47 56.260 57.351 -1.091 1
1 481 . 9 1 1 A 60 60 LEU CB C 47 42.196 41.856 0.340 1
1 482 . 9 1 1 A 60 60 LEU N N 47 125.835 123.147 2.688 1
1 483 . 9 1 1 A 63 63 GLY HA2 H 50 3.980 3.671 0.309 1
1 484 . 9 1 1 A 63 63 GLY HA3 H 50 3.950 3.842 0.108 1
1 485 . 9 1 1 A 63 63 GLY C C 50 177.130 175.016 2.114 1
1 486 . 9 1 1 A 63 63 GLY CA C 50 46.884 45.324 1.560 1
1 487 . 9 1 1 A 64 64 HIS H H 51 7.926 7.624 0.302 1
1 488 . 9 1 1 A 64 64 HIS HA H 51 4.451 4.635 -0.184 1
1 493 . 9 1 1 A 64 64 HIS C C 51 177.613 175.729 1.884 1
1 494 . 9 1 1 A 64 64 HIS CA C 51 57.198 56.951 0.247 1
1 495 . 9 1 1 A 64 64 HIS CB C 51 30.945 31.573 -0.628 1
1 498 . 9 1 1 A 64 64 HIS N N 51 122.284 118.534 3.750 1
1 499 . 9 1 1 A 65 65 ARG H H 52 8.105 8.109 -0.004 1
1 500 . 9 1 1 A 65 65 ARG HA H 52 3.685 3.789 -0.104 1
1 507 . 9 1 1 A 65 65 ARG C C 52 177.769 178.572 -0.803 1
1 508 . 9 1 1 A 65 65 ARG CA C 52 61.886 59.742 2.144 1
1 509 . 9 1 1 A 65 65 ARG CB C 52 30.945 30.110 0.835 1
1 511 . 9 1 1 A 65 65 ARG N N 52 117.775 121.099 -3.324 1
1 513 . 9 1 1 A 66 66 GLN H H 53 8.090 8.180 -0.090 1
1 514 . 9 1 1 A 66 66 GLN HA H 53 3.940 3.941 -0.001 1
1 519 . 9 1 1 A 66 66 GLN C C 53 178.583 178.040 0.543 1
1 520 . 9 1 1 A 66 66 GLN CA C 53 59.073 59.199 -0.126 1
1 521 . 9 1 1 A 66 66 GLN CB C 53 28.133 28.509 -0.376 1
1 523 . 9 1 1 A 66 66 GLN N N 53 116.452 118.098 -1.646 1
1 524 . 9 1 1 A 67 67 ARG H H 54 7.845 7.712 0.133 1
1 525 . 9 1 1 A 67 67 ARG HA H 54 4.010 4.029 -0.019 1
1 528 . 9 1 1 A 67 67 ARG C C 54 179.766 178.884 0.882 1
1 529 . 9 1 1 A 67 67 ARG CA C 54 59.073 58.989 0.084 1
1 530 . 9 1 1 A 67 67 ARG CB C 54 30.720 29.917 0.803 1
1 532 . 9 1 1 A 67 67 ARG N N 54 119.275 119.390 -0.115 1
1 533 . 9 1 1 A 68 68 ILE H H 55 8.032 8.385 -0.353 1
1 534 . 9 1 1 A 68 68 ILE HA H 55 3.495 3.598 -0.103 1
1 544 . 9 1 1 A 68 68 ILE C C 55 177.108 178.688 -1.580 1
1 545 . 9 1 1 A 68 68 ILE CA C 55 66.230 65.192 1.038 1
1 546 . 9 1 1 A 68 68 ILE CB C 55 38.020 37.620 0.400 1
1 550 . 9 1 1 A 68 68 ILE N N 55 121.152 119.609 1.543 1
1 551 . 9 1 1 A 69 69 LEU H H 56 8.490 8.179 0.311 1
1 552 . 9 1 1 A 69 69 LEU HA H 56 4.010 3.865 0.145 1
1 561 . 9 1 1 A 69 69 LEU C C 56 179.917 179.313 0.604 1
1 562 . 9 1 1 A 69 69 LEU CA C 56 58.135 58.188 -0.053 1
1 563 . 9 1 1 A 69 69 LEU CB C 56 41.259 41.537 -0.278 1
1 566 . 9 1 1 A 69 69 LEU N N 56 119.072 120.836 -1.764 1
1 567 . 9 1 1 A 70 70 GLN H H 57 8.327 8.718 -0.391 1
1 568 . 9 1 1 A 70 70 GLN HA H 57 4.100 4.066 0.034 1
1 573 . 9 1 1 A 70 70 GLN C C 57 178.798 178.526 0.272 1
1 574 . 9 1 1 A 70 70 GLN CA C 57 59.073 58.771 0.302 1
1 575 . 9 1 1 A 70 70 GLN CB C 57 28.133 28.460 -0.327 1
1 577 . 9 1 1 A 70 70 GLN N N 57 118.172 117.526 0.646 1
1 578 . 9 1 1 A 71 71 ALA H H 58 7.810 8.014 -0.204 1
1 579 . 9 1 1 A 71 71 ALA HA H 58 4.320 4.115 0.205 1
1 583 . 9 1 1 A 71 71 ALA C C 58 172.232 179.629 -7.397 1
1 584 . 9 1 1 A 71 71 ALA CA C 58 55.323 55.212 0.111 1
1 585 . 9 1 1 A 71 71 ALA CB C 58 19.720 18.712 1.008 1
1 586 . 9 1 1 A 71 71 ALA N N 58 122.536 122.189 0.347 1
1 587 . 9 1 1 A 72 72 ILE H H 59 8.840 8.335 0.505 1
1 588 . 9 1 1 A 72 72 ILE HA H 59 4.030 4.009 0.021 1
1 598 . 9 1 1 A 72 72 ILE C C 59 178.678 177.666 1.012 1
1 599 . 9 1 1 A 72 72 ILE CA C 59 64.698 63.678 1.020 1
1 600 . 9 1 1 A 72 72 ILE CB C 59 37.850 37.458 0.392 1
1 604 . 9 1 1 A 72 72 ILE N N 59 118.111 118.914 -0.803 1
1 605 . 9 1 1 A 73 73 GLN H H 60 7.547 8.070 -0.523 1
1 606 . 9 1 1 A 73 73 GLN HA H 60 4.121 4.073 0.048 1
1 611 . 9 1 1 A 73 73 GLN C C 60 176.556 177.972 -1.416 1
1 612 . 9 1 1 A 73 73 GLN CA C 60 58.135 58.556 -0.421 1
1 613 . 9 1 1 A 73 73 GLN CB C 60 28.300 28.778 -0.478 1
1 615 . 9 1 1 A 73 73 GLN N N 60 119.094 121.058 -1.964 1
1 616 . 9 1 1 A 74 74 LEU H H 61 7.350 7.901 -0.551 1
1 617 . 9 1 1 A 74 74 LEU HA H 61 4.408 4.213 0.195 1
1 626 . 9 1 1 A 74 74 LEU C C 61 177.960 178.809 -0.849 1
1 627 . 9 1 1 A 74 74 LEU CA C 61 54.900 56.491 -1.591 1
1 628 . 9 1 1 A 74 74 LEU CB C 61 42.196 41.860 0.336 1
1 631 . 9 1 1 A 74 74 LEU N N 61 115.853 120.113 -4.260 1
1 632 . 9 1 1 A 75 75 LEU H H 62 7.358 7.605 -0.247 1
1 633 . 9 1 1 A 75 75 LEU HA H 62 4.530 4.097 0.433 1
1 642 . 9 1 1 A 75 75 LEU C C 62 177.035 178.088 -1.053 1
1 643 . 9 1 1 A 75 75 LEU CA C 62 53.200 60.043 -6.843 1
1 644 . 9 1 1 A 75 75 LEU CB C 62 40.700 40.329 0.371 1
1 647 . 9 1 1 A 75 75 LEU N N 62 121.010 120.405 0.605 1
1 648 . 9 1 1 A 76 76 PRO HA H 63 4.382 4.653 -0.271 1
1 655 . 9 1 1 A 76 76 PRO CB C 63 31.883 29.295 2.588 1
1 657 . 9 1 1 A 77 77 LYS H H 64 8.418 8.642 -0.224 1
1 658 . 9 1 1 A 77 77 LYS HA H 64 4.140 4.404 -0.264 1
1 663 . 9 1 1 A 77 77 LYS C C 64 177.122 178.470 -1.348 1
1 664 . 9 1 1 A 77 77 LYS CA C 64 56.260 58.663 -2.403 1
1 665 . 9 1 1 A 77 77 LYS CB C 64 33.340 33.436 -0.096 1
1 668 . 9 1 1 A 77 77 LYS N N 64 121.932 125.411 -3.479 1
1 669 . 9 1 1 A 78 78 MET H H 65 8.550 8.024 0.526 1
1 670 . 9 1 1 A 78 78 MET HA H 65 4.304 4.470 -0.166 1
1 676 . 9 1 1 A 78 78 MET C C 65 176.105 177.148 -1.043 1
1 677 . 9 1 1 A 78 78 MET CA C 65 56.260 57.388 -1.128 1
1 678 . 9 1 1 A 78 78 MET CB C 65 32.821 33.153 -0.332 1
1 680 . 9 1 1 A 78 78 MET N N 65 123.498 117.632 5.866 1
1 681 . 9 1 1 A 79 79 ARG H H 66 8.731 7.756 0.975 1
1 682 . 9 1 1 A 79 79 ARG C C 66 173.577 174.334 -0.757 1
1 683 . 9 1 1 A 79 79 ARG CA C 66 53.447 54.569 -1.122 1
1 684 . 9 1 1 A 79 79 ARG CB C 66 30.008 29.667 0.341 1
1 685 . 9 1 1 A 79 79 ARG N N 66 127.355 118.936 8.419 1
1 686 . 9 1 1 A 80 80 PRO HA H 67 4.780 4.599 0.181 1
1 693 . 9 1 1 A 80 80 PRO C C 67 177.043 176.304 0.739 1
1 694 . 9 1 1 A 80 80 PRO CA C 67 61.886 62.170 -0.284 1
1 695 . 9 1 1 A 80 80 PRO CB C 67 32.821 32.700 0.121 1
1 698 . 9 1 1 A 81 81 ILE H H 68 8.580 8.351 0.229 1
1 699 . 9 1 1 A 81 81 ILE HA H 68 4.040 4.493 -0.453 1
1 709 . 9 1 1 A 81 81 ILE C C 68 176.831 175.963 0.868 1
1 710 . 9 1 1 A 81 81 ILE CA C 68 62.823 59.051 3.772 1
1 711 . 9 1 1 A 81 81 ILE CB C 68 38.580 40.554 -1.974 1
1 715 . 9 1 1 A 81 81 ILE N N 68 118.491 116.261 2.230 1
1 716 . 9 1 1 A 82 82 GLY H H 69 8.602 8.592 0.010 1
1 717 . 9 1 1 A 82 82 GLY CA C 69 45.009 45.870 -0.861 1
1 718 . 9 1 1 A 82 82 GLY N N 69 111.377 109.545 1.832 1
1 721 . 9 1 1 A 84 84 ASP HA H 71 4.490 4.675 -0.185 1
1 724 . 9 1 1 A 84 84 ASP CA C 71 54.385 52.561 1.824 1
1 725 . 9 1 1 A 84 84 ASP CB C 71 40.321 41.891 -1.570 1
1 726 . 9 1 1 A 85 85 GLY H H 72 8.054 8.310 -0.256 1
1 727 . 9 1 1 A 85 85 GLY HA2 H 72 4.040 3.908 0.132 1
1 728 . 9 1 1 A 85 85 GLY HA3 H 72 3.750 3.966 -0.216 1
1 729 . 9 1 1 A 85 85 GLY C C 72 173.474 174.568 -1.094 1
1 730 . 9 1 1 A 85 85 GLY CA C 72 45.009 45.314 -0.305 1
1 731 . 9 1 1 A 85 85 GLY N N 72 108.038 106.919 1.119 1
1 732 . 9 1 1 A 86 86 ALA H H 73 7.858 7.836 0.022 1
1 733 . 9 1 1 A 86 86 ALA HA H 73 4.370 4.275 0.095 1
1 737 . 9 1 1 A 86 86 ALA CA C 73 51.990 52.281 -0.291 1
1 738 . 9 1 1 A 86 86 ALA CB C 73 19.220 19.794 -0.574 1
1 739 . 9 1 1 A 86 86 ALA N N 73 123.819 123.946 -0.127 1
1 742 . 9 1 1 A 90 90 SER H H 77 7.839 7.849 -0.010 1
1 743 . 9 1 1 A 90 90 SER HA H 77 4.770 4.808 -0.038 1
1 746 . 9 1 1 A 90 90 SER N N 77 115.163 116.275 -1.112 1
1 747 . 9 1 1 A 91 91 VAL H H 78 8.578 9.046 -0.468 1
1 748 . 9 1 1 A 91 91 VAL HA H 78 3.981 3.958 0.023 1
1 756 . 9 1 1 A 91 91 VAL C C 78 177.480 177.435 0.045 1
1 757 . 9 1 1 A 91 91 VAL CA C 78 67.060 66.291 0.769 1
1 758 . 9 1 1 A 91 91 VAL CB C 78 32.500 31.624 0.876 1
1 761 . 9 1 1 A 91 91 VAL N N 78 123.481 122.823 0.658 1
1 762 . 9 1 1 A 92 92 ALA H H 79 8.607 8.406 0.201 1
1 763 . 9 1 1 A 92 92 ALA HA H 79 4.113 4.274 -0.161 1
1 767 . 9 1 1 A 92 92 ALA C C 79 179.868 180.224 -0.356 1
1 768 . 9 1 1 A 92 92 ALA CA C 79 54.890 55.836 -0.946 1
1 769 . 9 1 1 A 92 92 ALA CB C 79 18.790 18.219 0.571 1
1 770 . 9 1 1 A 92 92 ALA N N 79 120.334 122.063 -1.729 1
1 771 . 9 1 1 A 93 93 GLU H H 80 7.886 8.320 -0.434 1
1 772 . 9 1 1 A 93 93 GLU HA H 80 4.010 4.135 -0.125 1
1 777 . 9 1 1 A 93 93 GLU C C 80 179.719 178.534 1.185 1
1 778 . 9 1 1 A 93 93 GLU CA C 80 59.073 58.459 0.614 1
1 779 . 9 1 1 A 93 93 GLU CB C 80 30.630 29.312 1.318 1
1 781 . 9 1 1 A 93 93 GLU N N 80 117.643 117.256 0.387 1
1 782 . 9 1 1 A 94 94 TRP H H 81 8.299 8.084 0.215 1
1 783 . 9 1 1 A 94 94 TRP HA H 81 4.251 4.300 -0.049 1
1 792 . 9 1 1 A 94 94 TRP C C 81 178.772 177.745 1.027 1
1 793 . 9 1 1 A 94 94 TRP CA C 81 60.010 60.718 -0.708 1
1 794 . 9 1 1 A 94 94 TRP CB C 81 27.650 29.310 -1.660 1
1 800 . 9 1 1 A 94 94 TRP N N 81 122.545 124.216 -1.671 1
1 802 . 9 1 1 A 95 95 LEU H H 82 8.505 7.732 0.773 1
1 803 . 9 1 1 A 95 95 LEU HA H 82 2.880 3.535 -0.655 1
1 812 . 9 1 1 A 95 95 LEU C C 82 180.235 178.502 1.733 1
1 813 . 9 1 1 A 95 95 LEU CA C 82 57.400 56.770 0.630 1
1 814 . 9 1 1 A 95 95 LEU CB C 82 40.321 41.495 -1.174 1
1 817 . 9 1 1 A 95 95 LEU N N 82 121.110 119.090 2.020 1
1 818 . 9 1 1 A 96 96 ASP H H 83 8.185 8.417 -0.232 1
1 819 . 9 1 1 A 96 96 ASP HA H 83 4.280 4.418 -0.138 1
1 822 . 9 1 1 A 96 96 ASP C C 83 175.224 177.476 -2.252 1
1 823 . 9 1 1 A 96 96 ASP CA C 83 57.310 56.347 0.963 1
1 824 . 9 1 1 A 96 96 ASP CB C 83 40.321 41.103 -0.782 1
1 825 . 9 1 1 A 96 96 ASP N N 83 119.082 119.215 -0.133 1
1 826 . 9 1 1 A 97 97 SER H H 84 7.989 7.918 0.071 1
1 827 . 9 1 1 A 97 97 SER HA H 84 4.250 4.457 -0.207 1
1 830 . 9 1 1 A 97 97 SER C C 84 175.346 175.259 0.087 1
1 831 . 9 1 1 A 97 97 SER CA C 84 60.948 58.264 2.684 1
1 832 . 9 1 1 A 97 97 SER CB C 84 63.370 63.585 -0.215 1
1 833 . 9 1 1 A 97 97 SER N N 84 117.579 113.349 4.230 1
1 834 . 9 1 1 A 98 98 ILE H H 85 6.862 7.833 -0.971 1
1 835 . 9 1 1 A 98 98 ILE HA H 85 4.550 4.051 0.499 1
1 843 . 9 1 1 A 98 98 ILE C C 85 173.308 177.292 -3.984 1
1 844 . 9 1 1 A 98 98 ILE CA C 85 60.948 62.645 -1.697 1
1 845 . 9 1 1 A 98 98 ILE CB C 85 37.760 38.199 -0.439 1
1 848 . 9 1 1 A 98 98 ILE N N 85 113.733 119.884 -6.151 1
1 849 . 9 1 1 A 99 99 GLU H H 86 7.705 7.891 -0.186 1
1 850 . 9 1 1 A 99 99 GLU HA H 86 4.280 4.484 -0.204 1
1 853 . 9 1 1 A 99 99 GLU C C 86 175.224 176.051 -0.827 1
1 854 . 9 1 1 A 99 99 GLU CA C 86 56.260 57.470 -1.210 1
1 855 . 9 1 1 A 99 99 GLU CB C 86 26.258 32.558 -6.300 1
1 857 . 9 1 1 A 99 99 GLU N N 86 115.493 116.892 -1.399 1
1 858 . 9 1 1 A 100 100 LEU H H 87 7.989 7.690 0.299 1
1 859 . 9 1 1 A 100 100 LEU HA H 87 4.220 4.666 -0.446 1
1 868 . 9 1 1 A 100 100 LEU C C 87 176.965 177.025 -0.060 1
1 869 . 9 1 1 A 100 100 LEU CA C 87 52.510 53.185 -0.675 1
1 870 . 9 1 1 A 100 100 LEU CB C 87 42.196 44.224 -2.028 1
1 873 . 9 1 1 A 100 100 LEU N N 87 117.579 116.914 0.665 1
1 874 . 9 1 1 A 101 101 GLY H H 88 8.503 8.684 -0.181 1
1 875 . 9 1 1 A 101 101 GLY CA C 88 46.884 45.443 1.441 1
1 876 . 9 1 1 A 101 101 GLY N N 88 107.794 109.002 -1.208 1
1 877 . 9 1 1 A 102 102 ASP HA H 89 4.431 4.259 0.172 1
1 880 . 9 1 1 A 102 102 ASP C C 89 178.075 178.461 -0.386 1
1 881 . 9 1 1 A 102 102 ASP CA C 89 57.198 56.882 0.316 1
1 882 . 9 1 1 A 102 102 ASP CB C 89 40.321 40.474 -0.153 1
1 883 . 9 1 1 A 103 103 TYR H H 90 7.899 8.117 -0.218 1
1 884 . 9 1 1 A 103 103 TYR HA H 90 4.940 4.407 0.533 1
1 889 . 9 1 1 A 103 103 TYR C C 90 175.527 178.474 -2.947 1
1 890 . 9 1 1 A 103 103 TYR CA C 90 58.135 60.487 -2.352 1
1 891 . 9 1 1 A 103 103 TYR CB C 90 38.446 37.822 0.624 1
1 894 . 9 1 1 A 103 103 TYR N N 90 115.595 119.557 -3.962 1
1 895 . 9 1 1 A 104 104 THR H H 91 7.971 8.359 -0.388 1
1 896 . 9 1 1 A 104 104 THR HA H 91 4.234 4.086 0.148 1
1 901 . 9 1 1 A 104 104 THR C C 91 175.905 176.640 -0.735 1
1 902 . 9 1 1 A 104 104 THR CA C 91 68.449 67.010 1.439 1
1 904 . 9 1 1 A 104 104 THR N N 91 118.867 116.459 2.408 1
1 905 . 9 1 1 A 105 105 LYS H H 92 8.555 7.883 0.672 1
1 906 . 9 1 1 A 105 105 LYS HA H 92 3.940 4.074 -0.134 1
1 912 . 9 1 1 A 105 105 LYS C C 92 177.310 178.682 -1.372 1
1 913 . 9 1 1 A 105 105 LYS CA C 92 60.948 59.470 1.478 1
1 914 . 9 1 1 A 105 105 LYS CB C 92 31.883 32.413 -0.530 1
1 917 . 9 1 1 A 105 105 LYS N N 92 119.259 120.951 -1.692 1
1 918 . 9 1 1 A 106 106 ALA H H 93 7.920 8.140 -0.220 1
1 919 . 9 1 1 A 106 106 ALA HA H 93 4.128 4.166 -0.038 1
1 923 . 9 1 1 A 106 106 ALA C C 93 180.972 180.466 0.506 1
1 924 . 9 1 1 A 106 106 ALA CA C 93 55.070 55.105 -0.035 1
1 925 . 9 1 1 A 106 106 ALA CB C 93 17.750 18.557 -0.807 1
1 926 . 9 1 1 A 106 106 ALA N N 93 120.398 121.871 -1.473 1
1 927 . 9 1 1 A 107 107 PHE H H 94 8.136 8.516 -0.380 1
1 928 . 9 1 1 A 107 107 PHE HA H 94 4.190 4.601 -0.411 1
1 934 . 9 1 1 A 107 107 PHE C C 94 177.955 178.305 -0.350 1
1 935 . 9 1 1 A 107 107 PHE CA C 94 63.761 61.611 2.150 1
1 936 . 9 1 1 A 107 107 PHE CB C 94 38.446 39.305 -0.859 1
1 940 . 9 1 1 A 107 107 PHE N N 94 117.119 116.201 0.918 1
1 941 . 9 1 1 A 108 108 LEU H H 95 8.351 8.686 -0.335 1
1 942 . 9 1 1 A 108 108 LEU HA H 95 3.889 3.982 -0.093 1
1 951 . 9 1 1 A 108 108 LEU C C 95 182.043 179.202 2.841 1
1 952 . 9 1 1 A 108 108 LEU CA C 95 59.073 58.557 0.516 1
1 953 . 9 1 1 A 108 108 LEU CB C 95 41.259 41.976 -0.717 1
1 956 . 9 1 1 A 108 108 LEU N N 95 118.450 119.790 -1.340 1
1 957 . 9 1 1 A 109 109 ILE H H 96 8.992 8.150 0.842 1
1 958 . 9 1 1 A 109 109 ILE HA H 96 4.069 3.843 0.226 1
1 968 . 9 1 1 A 109 109 ILE C C 96 177.094 177.719 -0.625 1
1 969 . 9 1 1 A 109 109 ILE CA C 96 63.761 64.422 -0.661 1
1 970 . 9 1 1 A 109 109 ILE CB C 96 37.509 37.675 -0.166 1
1 974 . 9 1 1 A 109 109 ILE N N 96 118.177 115.157 3.020 1
1 975 . 9 1 1 A 110 110 ASN H H 97 7.067 8.047 -0.980 1
1 976 . 9 1 1 A 110 110 ASN HA H 97 4.797 4.623 0.174 1
1 981 . 9 1 1 A 110 110 ASN C C 97 173.595 175.280 -1.685 1
1 982 . 9 1 1 A 110 110 ASN CA C 97 54.385 53.524 0.861 1
1 983 . 9 1 1 A 110 110 ASN CB C 97 40.321 38.767 1.554 1
1 984 . 9 1 1 A 110 110 ASN N N 97 116.407 119.884 -3.477 1
1 986 . 9 1 1 A 111 111 GLY H H 98 7.681 7.984 -0.303 1
1 987 . 9 1 1 A 111 111 GLY HA2 H 98 4.080 3.934 0.146 1
1 988 . 9 1 1 A 111 111 GLY HA3 H 98 3.640 4.026 -0.386 1
1 989 . 9 1 1 A 111 111 GLY C C 98 174.552 174.310 0.242 1
1 990 . 9 1 1 A 111 111 GLY CA C 98 45.947 44.941 1.006 1
1 991 . 9 1 1 A 111 111 GLY N N 98 104.440 105.743 -1.303 1
1 992 . 9 1 1 A 112 112 TYR H H 99 8.427 8.176 0.251 1
1 993 . 9 1 1 A 112 112 TYR HA H 99 4.661 4.648 0.013 1
1 998 . 9 1 1 A 112 112 TYR C C 99 174.425 175.890 -1.465 1
1 999 . 9 1 1 A 112 112 TYR CA C 99 57.198 58.266 -1.068 1
1 1000 . 9 1 1 A 112 112 TYR CB C 99 36.571 38.223 -1.652 1
1 1003 . 9 1 1 A 112 112 TYR N N 99 122.830 120.206 2.624 1
1 1004 . 9 1 1 A 113 113 THR H H 100 7.166 8.410 -1.244 1
1 1005 . 9 1 1 A 113 113 THR HA H 100 4.248 4.650 -0.402 1
1 1009 . 9 1 1 A 113 113 THR C C 100 174.897 174.522 0.375 1
1 1010 . 9 1 1 A 113 113 THR CA C 100 62.290 62.048 0.242 1
1 1011 . 9 1 1 A 113 113 THR CB C 100 68.970 70.392 -1.422 1
1 1013 . 9 1 1 A 113 113 THR N N 100 104.304 116.054 -11.750 1
1 1014 . 9 1 1 A 114 114 SER H H 101 7.695 7.982 -0.287 1
1 1015 . 9 1 1 A 114 114 SER C C 101 174.372 174.232 0.140 1
1 1016 . 9 1 1 A 114 114 SER CA C 101 56.260 57.557 -1.297 1
1 1017 . 9 1 1 A 114 114 SER CB C 101 65.636 64.861 0.775 1
1 1018 . 9 1 1 A 114 114 SER N N 101 115.613 116.502 -0.889 1
1 1023 . 9 1 1 A 116 116 ASP HA H 103 4.260 4.277 -0.017 1
1 1026 . 9 1 1 A 116 116 ASP CA C 103 57.198 57.508 -0.310 1
1 1027 . 9 1 1 A 116 116 ASP CB C 103 40.321 42.194 -1.873 1
1 1028 . 9 1 1 A 117 117 LEU H H 104 7.345 7.987 -0.642 1
1 1029 . 9 1 1 A 117 117 LEU HA H 104 4.290 4.083 0.207 1
1 1038 . 9 1 1 A 117 117 LEU C C 104 178.488 178.571 -0.083 1
1 1039 . 9 1 1 A 117 117 LEU CA C 104 56.260 57.877 -1.617 1
1 1040 . 9 1 1 A 117 117 LEU CB C 104 42.196 41.603 0.593 1
1 1043 . 9 1 1 A 117 117 LEU N N 104 117.878 120.606 -2.728 1
1 1044 . 9 1 1 A 118 118 LEU H H 105 7.514 8.378 -0.864 1
1 1045 . 9 1 1 A 118 118 LEU HA H 105 4.210 4.114 0.096 1
1 1054 . 9 1 1 A 118 118 LEU C C 105 177.002 178.385 -1.383 1
1 1055 . 9 1 1 A 118 118 LEU CA C 105 55.323 57.019 -1.696 1
1 1056 . 9 1 1 A 118 118 LEU CB C 105 42.196 41.026 1.170 1
1 1059 . 9 1 1 A 118 118 LEU N N 105 119.094 118.538 0.556 1
1 1060 . 9 1 1 A 120 120 LYS HA H 107 4.340 4.090 0.250 1
1 1063 . 9 1 1 A 120 120 LYS C C 107 176.603 176.253 0.350 1
1 1064 . 9 1 1 A 120 120 LYS CA C 107 55.323 58.831 -3.508 1
1 1065 . 9 1 1 A 120 120 LYS CB C 107 31.883 32.440 -0.557 1
1 1068 . 9 1 1 A 121 121 ILE H H 108 7.539 7.020 0.519 1
1 1069 . 9 1 1 A 121 121 ILE HA H 108 3.987 4.364 -0.377 1
1 1079 . 9 1 1 A 121 121 ILE C C 108 173.247 175.940 -2.693 1
1 1080 . 9 1 1 A 121 121 ILE CA C 108 62.823 60.095 2.728 1
1 1081 . 9 1 1 A 121 121 ILE CB C 108 38.446 39.446 -1.000 1
1 1085 . 9 1 1 A 121 121 ILE N N 108 122.417 116.129 6.288 1
1 1086 . 9 1 1 A 122 122 ALA H H 109 8.290 8.364 -0.074 1
1 1087 . 9 1 1 A 122 122 ALA HA H 109 3.970 4.726 -0.756 1
1 1091 . 9 1 1 A 122 122 ALA C C 109 178.318 177.826 0.492 1
1 1092 . 9 1 1 A 122 122 ALA CA C 109 50.150 49.802 0.348 1
1 1093 . 9 1 1 A 122 122 ALA CB C 109 21.630 21.013 0.617 1
1 1094 . 9 1 1 A 122 122 ALA N N 109 127.784 125.287 2.497 1
1 1095 . 9 1 1 A 123 123 GLU HA H 110 3.707 3.908 -0.201 1
1 1099 . 9 1 1 A 123 123 GLU C C 110 178.290 178.397 -0.107 1
1 1100 . 9 1 1 A 123 123 GLU CA C 110 60.948 60.378 0.570 1
1 1101 . 9 1 1 A 123 123 GLU CB C 110 29.070 29.885 -0.815 1
1 1102 . 9 1 1 A 124 124 VAL H H 111 8.333 8.177 0.156 1
1 1103 . 9 1 1 A 124 124 VAL HA H 111 3.850 3.752 0.098 1
1 1111 . 9 1 1 A 124 124 VAL C C 111 177.406 177.606 -0.200 1
1 1112 . 9 1 1 A 124 124 VAL CA C 111 65.636 65.091 0.545 1
1 1113 . 9 1 1 A 124 124 VAL CB C 111 30.730 31.257 -0.527 1
1 1116 . 9 1 1 A 124 124 VAL N N 111 114.438 119.157 -4.719 1
1 1117 . 9 1 1 A 125 125 GLU H H 112 7.442 8.405 -0.963 1
1 1118 . 9 1 1 A 125 125 GLU HA H 112 4.152 4.043 0.109 1
1 1123 . 9 1 1 A 125 125 GLU C C 112 179.982 178.992 0.990 1
1 1124 . 9 1 1 A 125 125 GLU CA C 112 60.010 59.386 0.624 1
1 1125 . 9 1 1 A 125 125 GLU CB C 112 30.008 29.175 0.833 1
1 1127 . 9 1 1 A 125 125 GLU N N 112 121.032 121.945 -0.913 1
1 1128 . 9 1 1 A 126 126 LEU H H 113 7.666 7.939 -0.273 1
1 1129 . 9 1 1 A 126 126 LEU HA H 113 3.846 3.959 -0.113 1
1 1138 . 9 1 1 A 126 126 LEU C C 113 176.991 178.499 -1.508 1
1 1139 . 9 1 1 A 126 126 LEU CA C 113 58.135 57.772 0.363 1
1 1140 . 9 1 1 A 126 126 LEU CB C 113 41.259 41.028 0.231 1
1 1143 . 9 1 1 A 126 126 LEU N N 113 118.731 118.426 0.305 1
1 1144 . 9 1 1 A 127 127 ILE H H 114 7.781 7.874 -0.093 1
1 1145 . 9 1 1 A 127 127 ILE HA H 114 3.502 3.835 -0.333 1
1 1153 . 9 1 1 A 127 127 ILE C C 114 178.195 177.100 1.095 1
1 1154 . 9 1 1 A 127 127 ILE CA C 114 65.636 63.678 1.958 1
1 1155 . 9 1 1 A 127 127 ILE CB C 114 40.321 37.267 3.054 1
1 1159 . 9 1 1 A 127 127 ILE N N 114 115.084 119.111 -4.027 1
1 1160 . 9 1 1 A 128 128 ASN H H 115 8.470 8.045 0.425 1
1 1161 . 9 1 1 A 128 128 ASN HA H 115 4.502 4.835 -0.333 1
1 1166 . 9 1 1 A 128 128 ASN C C 115 176.295 176.207 0.088 1
1 1167 . 9 1 1 A 128 128 ASN CA C 115 56.260 54.109 2.151 1
1 1168 . 9 1 1 A 128 128 ASN CB C 115 39.384 39.400 -0.016 1
1 1169 . 9 1 1 A 128 128 ASN N N 115 115.158 118.186 -3.028 1
1 1171 . 9 1 1 A 129 129 VAL H H 116 8.116 7.727 0.389 1
1 1172 . 9 1 1 A 129 129 VAL HA H 116 4.090 3.882 0.208 1
1 1180 . 9 1 1 A 129 129 VAL C C 116 176.740 177.715 -0.975 1
1 1181 . 9 1 1 A 129 129 VAL CA C 116 64.400 64.834 -0.434 1
1 1182 . 9 1 1 A 129 129 VAL CB C 116 32.050 32.311 -0.261 1
1 1185 . 9 1 1 A 129 129 VAL N N 116 118.698 118.910 -0.212 1
1 1186 . 9 1 1 A 130 130 LEU H H 117 7.294 7.936 -0.642 1
1 1187 . 9 1 1 A 130 130 LEU HA H 117 3.970 4.158 -0.188 1
1 1196 . 9 1 1 A 130 130 LEU C C 117 175.127 175.959 -0.832 1
1 1197 . 9 1 1 A 130 130 LEU CA C 117 56.260 54.765 1.495 1
1 1198 . 9 1 1 A 130 130 LEU CB C 117 41.259 42.162 -0.903 1
1 1201 . 9 1 1 A 130 130 LEU N N 117 116.201 118.979 -2.778 1
1 1202 . 9 1 1 A 131 131 LYS H H 118 6.594 7.845 -1.251 1
1 1203 . 9 1 1 A 131 131 LYS HA H 118 3.980 4.189 -0.209 1
1 1208 . 9 1 1 A 131 131 LYS C C 118 175.589 175.296 0.293 1
1 1209 . 9 1 1 A 131 131 LYS CA C 118 56.260 57.551 -1.291 1
1 1210 . 9 1 1 A 131 131 LYS CB C 118 28.133 29.477 -1.344 1
1 1212 . 9 1 1 A 131 131 LYS N N 118 111.172 115.796 -4.624 1
1 1213 . 9 1 1 A 132 132 ILE H H 119 8.245 7.902 0.343 1
1 1214 . 9 1 1 A 132 132 ILE HA H 119 4.090 4.332 -0.242 1
1 1224 . 9 1 1 A 132 132 ILE C C 119 175.161 175.767 -0.606 1
1 1225 . 9 1 1 A 132 132 ILE CA C 119 60.010 60.979 -0.969 1
1 1226 . 9 1 1 A 132 132 ILE CB C 119 35.633 37.609 -1.976 1
1 1230 . 9 1 1 A 132 132 ILE N N 119 119.484 120.336 -0.852 1
1 1231 . 9 1 1 A 133 133 ASN H H 120 8.054 8.772 -0.718 1
1 1232 . 9 1 1 A 133 133 ASN HA H 120 4.350 4.986 -0.636 1
1 1235 . 9 1 1 A 133 133 ASN C C 120 175.136 175.416 -0.280 1
1 1236 . 9 1 1 A 133 133 ASN CA C 120 54.385 52.895 1.490 1
1 1237 . 9 1 1 A 133 133 ASN CB C 120 39.384 40.462 -1.078 1
1 1238 . 9 1 1 A 133 133 ASN N N 120 124.670 121.738 2.932 1
1 1239 . 9 1 1 A 134 134 LEU H H 121 7.517 7.254 0.263 1
1 1240 . 9 1 1 A 134 134 LEU HA H 121 4.678 4.057 0.621 1
1 1249 . 9 1 1 A 134 134 LEU C C 121 178.051 177.585 0.466 1
1 1250 . 9 1 1 A 134 134 LEU CA C 121 53.447 56.099 -2.652 1
1 1251 . 9 1 1 A 134 134 LEU CB C 121 41.259 43.447 -2.188 1
1 1254 . 9 1 1 A 134 134 LEU N N 121 119.918 120.041 -0.123 1
1 1255 . 9 1 1 A 135 135 ILE H H 122 9.389 8.701 0.688 1
1 1256 . 9 1 1 A 135 135 ILE HA H 122 3.540 3.724 -0.184 1
1 1266 . 9 1 1 A 135 135 ILE C C 122 176.425 177.693 -1.268 1
1 1267 . 9 1 1 A 135 135 ILE CA C 122 65.636 65.227 0.409 1
1 1268 . 9 1 1 A 135 135 ILE CB C 122 38.446 38.349 0.097 1
1 1272 . 9 1 1 A 135 135 ILE N N 122 129.949 125.832 4.117 1
1 1273 . 9 1 1 A 136 136 GLY H H 123 8.675 8.673 0.002 1
1 1274 . 9 1 1 A 136 136 GLY HA2 H 123 2.650 3.134 -0.484 1
1 1275 . 9 1 1 A 136 136 GLY HA3 H 123 2.060 3.556 -1.496 1
1 1276 . 9 1 1 A 136 136 GLY C C 123 176.854 176.267 0.587 1
1 1277 . 9 1 1 A 136 136 GLY CA C 123 45.500 47.131 -1.631 1
1 1278 . 9 1 1 A 136 136 GLY N N 123 106.314 108.065 -1.751 1
1 1279 . 9 1 1 A 137 137 HIS H H 124 6.869 7.942 -1.073 1
1 1280 . 9 1 1 A 137 137 HIS HA H 124 4.558 4.436 0.122 1
1 1285 . 9 1 1 A 137 137 HIS C C 124 176.977 177.275 -0.298 1
1 1286 . 9 1 1 A 137 137 HIS CA C 124 57.198 58.830 -1.632 1
1 1287 . 9 1 1 A 137 137 HIS CB C 124 30.945 29.949 0.996 1
1 1290 . 9 1 1 A 137 137 HIS N N 124 118.865 120.105 -1.240 1
1 1291 . 9 1 1 A 138 138 ARG H H 125 7.730 8.280 -0.550 1
1 1292 . 9 1 1 A 138 138 ARG HA H 125 3.770 3.864 -0.094 1
1 1299 . 9 1 1 A 138 138 ARG C C 125 178.288 178.349 -0.061 1
1 1300 . 9 1 1 A 138 138 ARG CA C 125 61.886 59.471 2.415 1
1 1301 . 9 1 1 A 138 138 ARG CB C 125 30.945 29.995 0.950 1
1 1304 . 9 1 1 A 138 138 ARG N N 125 118.149 119.461 -1.312 1
1 1306 . 9 1 1 A 139 139 LYS H H 126 8.679 8.306 0.373 1
1 1307 . 9 1 1 A 139 139 LYS HA H 126 3.990 3.914 0.076 1
1 1310 . 9 1 1 A 139 139 LYS C C 126 179.184 178.745 0.439 1
1 1311 . 9 1 1 A 139 139 LYS CA C 126 58.135 59.355 -1.220 1
1 1312 . 9 1 1 A 139 139 LYS CB C 126 30.945 32.161 -1.216 1
1 1314 . 9 1 1 A 139 139 LYS N N 126 114.003 119.001 -4.998 1
1 1315 . 9 1 1 A 140 140 ARG H H 127 7.248 8.021 -0.773 1
1 1316 . 9 1 1 A 140 140 ARG HA H 127 3.870 3.954 -0.084 1
1 1324 . 9 1 1 A 140 140 ARG C C 127 177.772 178.919 -1.147 1
1 1325 . 9 1 1 A 140 140 ARG CA C 127 60.010 59.022 0.988 1
1 1326 . 9 1 1 A 140 140 ARG CB C 127 30.945 29.892 1.053 1
1 1329 . 9 1 1 A 140 140 ARG N N 127 120.072 119.224 0.848 1
1 1331 . 9 1 1 A 141 141 ILE H H 128 7.706 8.024 -0.318 1
1 1332 . 9 1 1 A 141 141 ILE HA H 128 3.530 3.586 -0.056 1
1 1340 . 9 1 1 A 141 141 ILE C C 128 177.669 178.041 -0.372 1
1 1341 . 9 1 1 A 141 141 ILE CA C 128 65.636 65.725 -0.089 1
1 1342 . 9 1 1 A 141 141 ILE CB C 128 38.680 37.864 0.816 1
1 1345 . 9 1 1 A 141 141 ILE N N 128 118.730 119.651 -0.921 1
1 1346 . 9 1 1 A 142 142 LEU H H 129 8.194 8.348 -0.154 1
1 1347 . 9 1 1 A 142 142 LEU HA H 129 3.950 3.995 -0.045 1
1 1356 . 9 1 1 A 142 142 LEU C C 129 179.960 178.055 1.905 1
1 1357 . 9 1 1 A 142 142 LEU CA C 129 58.135 58.234 -0.099 1
1 1358 . 9 1 1 A 142 142 LEU CB C 129 41.259 41.487 -0.228 1
1 1361 . 9 1 1 A 142 142 LEU N N 129 117.675 121.323 -3.648 1
1 1362 . 9 1 1 A 143 143 ALA H H 130 8.294 8.565 -0.271 1
1 1363 . 9 1 1 A 143 143 ALA HA H 130 4.220 4.055 0.165 1
1 1367 . 9 1 1 A 143 143 ALA C C 130 179.899 179.652 0.247 1
1 1368 . 9 1 1 A 143 143 ALA CA C 130 54.385 55.105 -0.720 1
1 1369 . 9 1 1 A 143 143 ALA CB C 130 19.270 18.201 1.069 1
1 1370 . 9 1 1 A 143 143 ALA N N 130 121.096 120.814 0.282 1
1 1371 . 9 1 1 A 144 144 SER H H 131 7.813 7.900 -0.087 1
1 1372 . 9 1 1 A 144 144 SER HA H 131 4.180 4.240 -0.060 1
1 1375 . 9 1 1 A 144 144 SER C C 131 175.457 176.694 -1.237 1
1 1376 . 9 1 1 A 144 144 SER CA C 131 60.948 61.462 -0.514 1
1 1377 . 9 1 1 A 144 144 SER CB C 131 63.761 62.983 0.778 1
1 1378 . 9 1 1 A 144 144 SER N N 131 112.102 114.080 -1.978 1
1 1379 . 9 1 1 A 145 145 LEU H H 132 7.747 8.181 -0.434 1
1 1380 . 9 1 1 A 145 145 LEU HA H 132 4.140 4.204 -0.064 1
1 1389 . 9 1 1 A 145 145 LEU C C 132 178.589 177.392 1.197 1
1 1390 . 9 1 1 A 145 145 LEU CA C 132 56.260 56.861 -0.601 1
1 1391 . 9 1 1 A 145 145 LEU CB C 132 42.196 42.545 -0.349 1
1 1394 . 9 1 1 A 145 145 LEU N N 132 117.536 118.763 -1.227 1
1 1395 . 9 1 1 A 146 146 GLY H H 133 7.544 7.828 -0.284 1
1 1396 . 9 1 1 A 146 146 GLY HA2 H 133 3.950 4.047 -0.097 1
1 1397 . 9 1 1 A 146 146 GLY HA3 H 133 3.100 4.057 -0.957 1
1 1398 . 9 1 1 A 146 146 GLY C C 133 173.372 172.202 1.170 1
1 1399 . 9 1 1 A 146 146 GLY CA C 133 45.947 43.910 2.037 1
1 1400 . 9 1 1 A 146 146 GLY N N 133 105.351 105.176 0.175 1
1 1401 . 9 1 1 A 147 147 ASP H H 134 8.342 8.322 0.020 1
1 1402 . 9 1 1 A 147 147 ASP HA H 134 4.650 5.276 -0.626 1
1 1405 . 9 1 1 A 147 147 ASP C C 134 175.462 176.286 -0.824 1
1 1406 . 9 1 1 A 147 147 ASP CA C 134 54.385 53.153 1.232 1
1 1407 . 9 1 1 A 147 147 ASP CB C 134 41.259 43.171 -1.912 1
1 1408 . 9 1 1 A 147 147 ASP N N 134 120.133 119.262 0.871 1
1 14 . 10 1 1 A 15 15 GLN H H 2 8.439 8.718 -0.279 1
1 15 . 10 1 1 A 15 15 GLN HA H 2 4.594 5.154 -0.560 1
1 20 . 10 1 1 A 15 15 GLN C C 2 175.972 174.384 1.588 1
1 21 . 10 1 1 A 15 15 GLN CA C 2 56.260 54.288 1.972 1
1 22 . 10 1 1 A 15 15 GLN CB C 2 30.945 31.532 -0.587 1
1 24 . 10 1 1 A 15 15 GLN N N 2 124.997 121.842 3.155 1
1 25 . 10 1 1 A 16 16 THR H H 3 8.347 8.780 -0.433 1
1 26 . 10 1 1 A 16 16 THR HA H 3 4.555 4.884 -0.329 1
1 31 . 10 1 1 A 16 16 THR C C 3 175.495 175.000 0.495 1
1 32 . 10 1 1 A 16 16 THR CA C 3 60.010 61.682 -1.672 1
1 33 . 10 1 1 A 16 16 THR CB C 3 71.261 71.442 -0.181 1
1 34 . 10 1 1 A 16 16 THR N N 3 113.011 118.771 -5.760 1
1 35 . 10 1 1 A 17 17 VAL H H 4 8.895 8.790 0.105 1
1 36 . 10 1 1 A 17 17 VAL HA H 4 3.670 3.808 -0.138 1
1 44 . 10 1 1 A 17 17 VAL C C 4 178.449 177.925 0.524 1
1 45 . 10 1 1 A 17 17 VAL CA C 4 67.511 66.462 1.049 1
1 46 . 10 1 1 A 17 17 VAL CB C 4 31.883 31.978 -0.095 1
1 49 . 10 1 1 A 17 17 VAL N N 4 121.854 125.310 -3.456 1
1 50 . 10 1 1 A 18 18 GLY H H 5 9.017 8.217 0.800 1
1 51 . 10 1 1 A 18 18 GLY HA2 H 5 3.940 3.782 0.158 1
1 52 . 10 1 1 A 18 18 GLY HA3 H 5 3.610 3.792 -0.182 1
1 53 . 10 1 1 A 18 18 GLY C C 5 176.186 175.594 0.592 1
1 54 . 10 1 1 A 18 18 GLY CA C 5 47.822 47.270 0.552 1
1 55 . 10 1 1 A 18 18 GLY N N 5 106.966 108.058 -1.092 1
1 56 . 10 1 1 A 19 19 GLN H H 6 8.072 8.023 0.049 1
1 57 . 10 1 1 A 19 19 GLN HA H 6 4.037 4.136 -0.099 1
1 62 . 10 1 1 A 19 19 GLN C C 6 179.488 178.084 1.404 1
1 63 . 10 1 1 A 19 19 GLN CA C 6 59.073 58.560 0.513 1
1 64 . 10 1 1 A 19 19 GLN CB C 6 28.489 28.724 -0.235 1
1 66 . 10 1 1 A 19 19 GLN N N 6 122.431 120.931 1.500 1
1 67 . 10 1 1 A 20 20 TRP H H 7 8.756 8.257 0.499 1
1 68 . 10 1 1 A 20 20 TRP HA H 7 4.160 4.326 -0.166 1
1 77 . 10 1 1 A 20 20 TRP C C 7 179.620 178.047 1.573 1
1 78 . 10 1 1 A 20 20 TRP CA C 7 61.886 61.203 0.683 1
1 79 . 10 1 1 A 20 20 TRP CB C 7 28.133 29.543 -1.410 1
1 85 . 10 1 1 A 20 20 TRP N N 7 124.265 121.934 2.331 1
1 87 . 10 1 1 A 21 21 LEU H H 8 9.148 8.886 0.262 1
1 88 . 10 1 1 A 21 21 LEU HA H 8 3.440 3.511 -0.071 1
1 97 . 10 1 1 A 21 21 LEU C C 8 180.521 178.452 2.069 1
1 98 . 10 1 1 A 21 21 LEU CA C 8 56.920 58.054 -1.134 1
1 99 . 10 1 1 A 21 21 LEU CB C 8 41.700 41.633 0.067 1
1 102 . 10 1 1 A 21 21 LEU N N 8 120.548 120.636 -0.088 1
1 103 . 10 1 1 A 22 22 GLU H H 9 8.284 8.493 -0.209 1
1 104 . 10 1 1 A 22 22 GLU HA H 9 3.740 3.932 -0.192 1
1 109 . 10 1 1 A 22 22 GLU C C 9 179.960 178.466 1.494 1
1 110 . 10 1 1 A 22 22 GLU CA C 9 60.010 59.897 0.113 1
1 111 . 10 1 1 A 22 22 GLU CB C 9 29.070 29.262 -0.192 1
1 113 . 10 1 1 A 22 22 GLU N N 9 120.133 118.957 1.176 1
1 114 . 10 1 1 A 23 23 SER H H 10 7.891 7.797 0.094 1
1 115 . 10 1 1 A 23 23 SER HA H 10 4.250 4.184 0.066 1
1 118 . 10 1 1 A 23 23 SER C C 10 175.346 176.529 -1.183 1
1 119 . 10 1 1 A 23 23 SER CA C 10 60.948 61.474 -0.526 1
1 120 . 10 1 1 A 23 23 SER CB C 10 63.280 63.089 0.191 1
1 121 . 10 1 1 A 23 23 SER N N 10 117.044 114.270 2.774 1
1 122 . 10 1 1 A 24 24 ILE H H 11 6.862 7.779 -0.917 1
1 123 . 10 1 1 A 24 24 ILE HA H 11 4.487 3.803 0.684 1
1 133 . 10 1 1 A 24 24 ILE C C 11 175.812 176.081 -0.269 1
1 134 . 10 1 1 A 24 24 ILE CA C 11 60.948 63.664 -2.716 1
1 135 . 10 1 1 A 24 24 ILE CB C 11 38.250 37.279 0.971 1
1 139 . 10 1 1 A 24 24 ILE N N 11 113.733 117.388 -3.655 1
1 140 . 10 1 1 A 25 25 GLY H H 12 7.628 7.626 0.002 1
1 141 . 10 1 1 A 25 25 GLY HA2 H 12 3.990 4.155 -0.165 1
1 142 . 10 1 1 A 25 25 GLY HA3 H 12 3.800 4.267 -0.467 1
1 143 . 10 1 1 A 25 25 GLY C C 12 173.647 172.155 1.492 1
1 144 . 10 1 1 A 25 25 GLY CA C 12 45.947 45.998 -0.051 1
1 145 . 10 1 1 A 25 25 GLY N N 12 109.763 109.906 -0.143 1
1 146 . 10 1 1 A 26 26 LEU H H 13 7.620 8.453 -0.833 1
1 147 . 10 1 1 A 26 26 LEU C C 13 176.186 173.897 2.289 1
1 148 . 10 1 1 A 26 26 LEU CA C 13 52.700 51.447 1.253 1
1 149 . 10 1 1 A 26 26 LEU CB C 13 43.134 44.700 -1.566 1
1 150 . 10 1 1 A 26 26 LEU N N 13 118.778 120.772 -1.994 1
1 151 . 10 1 1 A 27 27 PRO HA H 14 4.120 4.719 -0.599 1
1 154 . 10 1 1 A 27 27 PRO C C 14 177.955 175.346 2.609 1
1 155 . 10 1 1 A 27 27 PRO CA C 14 64.698 62.213 2.485 1
1 156 . 10 1 1 A 27 27 PRO CB C 14 31.883 29.459 2.424 1
1 158 . 10 1 1 A 28 28 GLN H H 15 9.838 8.344 1.494 1
1 159 . 10 1 1 A 28 28 GLN HA H 15 4.240 4.387 -0.147 1
1 162 . 10 1 1 A 28 28 GLN C C 15 176.836 176.390 0.446 1
1 163 . 10 1 1 A 28 28 GLN CA C 15 58.135 56.637 1.498 1
1 164 . 10 1 1 A 28 28 GLN CB C 15 27.195 31.273 -4.078 1
1 166 . 10 1 1 A 28 28 GLN N N 15 120.414 120.501 -0.087 1
1 167 . 10 1 1 A 29 29 TYR H H 16 6.810 8.200 -1.390 1
1 168 . 10 1 1 A 29 29 TYR HA H 16 5.720 4.308 1.412 1
1 173 . 10 1 1 A 29 29 TYR C C 16 174.814 177.715 -2.901 1
1 174 . 10 1 1 A 29 29 TYR CA C 16 57.198 60.634 -3.436 1
1 175 . 10 1 1 A 29 29 TYR CB C 16 37.509 37.954 -0.445 1
1 178 . 10 1 1 A 29 29 TYR N N 16 119.718 118.607 1.111 1
1 179 . 10 1 1 A 30 30 GLU H H 17 7.509 8.453 -0.944 1
1 180 . 10 1 1 A 30 30 GLU HA H 17 3.650 4.169 -0.519 1
1 184 . 10 1 1 A 30 30 GLU C C 17 177.552 178.501 -0.949 1
1 185 . 10 1 1 A 30 30 GLU CA C 17 60.948 59.204 1.744 1
1 186 . 10 1 1 A 30 30 GLU CB C 17 30.008 29.376 0.632 1
1 188 . 10 1 1 A 30 30 GLU N N 17 122.417 118.881 3.536 1
1 189 . 10 1 1 A 31 31 ASN H H 18 9.259 8.180 1.079 1
1 190 . 10 1 1 A 31 31 ASN HA H 18 4.451 4.491 -0.040 1
1 193 . 10 1 1 A 31 31 ASN C C 18 176.868 178.283 -1.415 1
1 194 . 10 1 1 A 31 31 ASN CA C 18 57.198 56.195 1.003 1
1 195 . 10 1 1 A 31 31 ASN CB C 18 38.446 38.337 0.109 1
1 196 . 10 1 1 A 31 31 ASN N N 18 116.613 118.687 -2.074 1
1 197 . 10 1 1 A 32 32 HIS H H 19 8.898 8.246 0.652 1
1 198 . 10 1 1 A 32 32 HIS HA H 19 4.140 4.415 -0.275 1
1 202 . 10 1 1 A 32 32 HIS C C 19 178.269 177.788 0.481 1
1 203 . 10 1 1 A 32 32 HIS CA C 19 60.948 58.994 1.954 1
1 204 . 10 1 1 A 32 32 HIS CB C 19 30.008 30.393 -0.385 1
1 206 . 10 1 1 A 32 32 HIS N N 19 118.926 118.132 0.794 1
1 207 . 10 1 1 A 33 33 LEU H H 20 7.825 8.745 -0.920 1
1 208 . 10 1 1 A 33 33 LEU HA H 20 4.305 3.944 0.361 1
1 218 . 10 1 1 A 33 33 LEU C C 20 179.190 178.995 0.195 1
1 219 . 10 1 1 A 33 33 LEU CA C 20 60.010 58.416 1.594 1
1 220 . 10 1 1 A 33 33 LEU CB C 20 40.321 42.024 -1.703 1
1 224 . 10 1 1 A 33 33 LEU N N 20 117.434 119.850 -2.416 1
1 225 . 10 1 1 A 34 34 MET H H 21 8.861 8.602 0.259 1
1 226 . 10 1 1 A 34 34 MET HA H 21 3.980 4.174 -0.194 1
1 234 . 10 1 1 A 34 34 MET C C 21 180.340 178.973 1.367 1
1 235 . 10 1 1 A 34 34 MET CA C 21 58.135 58.583 -0.448 1
1 236 . 10 1 1 A 34 34 MET CB C 21 30.945 32.528 -1.583 1
1 238 . 10 1 1 A 34 34 MET N N 21 118.111 116.743 1.368 1
1 239 . 10 1 1 A 35 35 ALA H H 22 9.015 8.534 0.481 1
1 240 . 10 1 1 A 35 35 ALA HA H 22 4.239 4.147 0.092 1
1 244 . 10 1 1 A 35 35 ALA C C 22 178.058 178.805 -0.747 1
1 245 . 10 1 1 A 35 35 ALA CA C 22 53.800 54.585 -0.785 1
1 246 . 10 1 1 A 35 35 ALA CB C 22 18.397 18.406 -0.009 1
1 247 . 10 1 1 A 35 35 ALA N N 22 120.068 122.015 -1.947 1
1 248 . 10 1 1 A 36 36 ASN H H 23 7.143 8.010 -0.867 1
1 249 . 10 1 1 A 36 36 ASN HA H 23 4.959 4.800 0.159 1
1 254 . 10 1 1 A 36 36 ASN C C 23 174.083 175.532 -1.449 1
1 255 . 10 1 1 A 36 36 ASN CA C 23 54.000 52.952 1.048 1
1 256 . 10 1 1 A 36 36 ASN CB C 23 41.300 39.069 2.231 1
1 257 . 10 1 1 A 36 36 ASN N N 23 111.560 115.071 -3.511 1
1 259 . 10 1 1 A 37 37 GLY H H 24 7.797 8.368 -0.571 1
1 260 . 10 1 1 A 37 37 GLY HA2 H 24 3.430 3.808 -0.378 1
1 261 . 10 1 1 A 37 37 GLY HA3 H 24 3.290 3.909 -0.619 1
1 262 . 10 1 1 A 37 37 GLY C C 24 173.163 174.764 -1.601 1
1 263 . 10 1 1 A 37 37 GLY CA C 24 45.947 45.177 0.770 1
1 264 . 10 1 1 A 37 37 GLY N N 24 106.170 107.720 -1.550 1
1 265 . 10 1 1 A 38 38 PHE H H 25 8.191 7.906 0.285 1
1 266 . 10 1 1 A 38 38 PHE HA H 25 4.910 4.754 0.156 1
1 271 . 10 1 1 A 38 38 PHE C C 25 173.496 175.571 -2.075 1
1 272 . 10 1 1 A 38 38 PHE CA C 25 56.550 56.518 0.032 1
1 273 . 10 1 1 A 38 38 PHE CB C 25 37.220 37.208 0.012 1
1 276 . 10 1 1 A 38 38 PHE N N 25 122.454 119.839 2.615 1
1 277 . 10 1 1 A 39 39 ASP H H 26 6.756 8.542 -1.786 1
1 278 . 10 1 1 A 39 39 ASP HA H 26 5.077 5.002 0.075 1
1 281 . 10 1 1 A 39 39 ASP C C 26 177.463 175.381 2.082 1
1 282 . 10 1 1 A 39 39 ASP CA C 26 53.447 53.873 -0.426 1
1 283 . 10 1 1 A 39 39 ASP CB C 26 42.580 42.082 0.498 1
1 284 . 10 1 1 A 39 39 ASP N N 26 111.309 121.233 -9.924 1
1 285 . 10 1 1 A 40 40 ASN H H 27 7.495 7.921 -0.426 1
1 286 . 10 1 1 A 40 40 ASN HA H 27 4.820 5.010 -0.190 1
1 289 . 10 1 1 A 40 40 ASN C C 27 176.228 175.926 0.302 1
1 290 . 10 1 1 A 40 40 ASN CA C 27 52.510 51.839 0.671 1
1 291 . 10 1 1 A 40 40 ASN CB C 27 40.321 40.538 -0.217 1
1 292 . 10 1 1 A 40 40 ASN N N 27 118.385 118.088 0.297 1
1 293 . 10 1 1 A 41 41 VAL H H 28 9.192 8.653 0.539 1
1 294 . 10 1 1 A 41 41 VAL HA H 28 3.550 3.608 -0.058 1
1 302 . 10 1 1 A 41 41 VAL C C 28 176.429 177.678 -1.249 1
1 303 . 10 1 1 A 41 41 VAL CA C 28 65.636 66.203 -0.567 1
1 304 . 10 1 1 A 41 41 VAL CB C 28 31.883 31.404 0.479 1
1 307 . 10 1 1 A 41 41 VAL N N 28 125.741 125.683 0.058 1
1 308 . 10 1 1 A 42 42 GLN H H 29 8.203 8.378 -0.175 1
1 309 . 10 1 1 A 42 42 GLN HA H 29 4.129 4.010 0.119 1
1 314 . 10 1 1 A 42 42 GLN C C 29 176.591 178.204 -1.613 1
1 315 . 10 1 1 A 42 42 GLN CA C 29 57.198 58.488 -1.290 1
1 316 . 10 1 1 A 42 42 GLN CB C 29 28.133 28.787 -0.654 1
1 318 . 10 1 1 A 42 42 GLN N N 29 116.452 120.384 -3.932 1
1 319 . 10 1 1 A 43 43 ALA H H 30 7.781 8.208 -0.427 1
1 320 . 10 1 1 A 43 43 ALA HA H 30 4.650 4.039 0.611 1
1 324 . 10 1 1 A 43 43 ALA C C 30 175.976 178.115 -2.139 1
1 325 . 10 1 1 A 43 43 ALA CA C 30 50.840 54.681 -3.841 1
1 326 . 10 1 1 A 43 43 ALA CB C 30 19.150 18.495 0.655 1
1 327 . 10 1 1 A 43 43 ALA N N 30 122.150 121.744 0.406 1
1 328 . 10 1 1 A 44 44 MET H H 31 7.739 8.138 -0.399 1
1 332 . 10 1 1 A 44 44 MET C C 31 178.275 177.486 0.789 1
1 333 . 10 1 1 A 44 44 MET CA C 31 55.323 53.984 1.339 1
1 334 . 10 1 1 A 44 44 MET CB C 31 34.696 31.727 2.969 1
1 336 . 10 1 1 A 44 44 MET N N 31 118.149 113.810 4.339 1
1 337 . 10 1 1 A 45 45 GLY H H 32 7.611 8.557 -0.946 1
1 338 . 10 1 1 A 45 45 GLY N N 32 101.530 109.972 -8.442 1
1 339 . 10 1 1 A 47 47 ASN HA H 34 4.480 4.899 -0.419 1
1 342 . 10 1 1 A 47 47 ASN CA C 34 56.260 52.247 4.013 1
1 343 . 10 1 1 A 47 47 ASN CB C 34 39.384 38.791 0.593 1
1 344 . 10 1 1 A 49 49 MET HA H 36 4.646 4.460 0.186 1
1 350 . 10 1 1 A 49 49 MET C C 36 173.651 175.241 -1.590 1
1 351 . 10 1 1 A 49 49 MET CA C 36 55.323 56.173 -0.850 1
1 352 . 10 1 1 A 49 49 MET CB C 36 35.633 33.525 2.108 1
1 355 . 10 1 1 A 50 50 GLU H H 37 9.203 8.876 0.327 1
1 356 . 10 1 1 A 50 50 GLU HA H 37 4.650 4.793 -0.143 1
1 361 . 10 1 1 A 50 50 GLU C C 37 177.008 176.458 0.550 1
1 362 . 10 1 1 A 50 50 GLU CA C 37 54.385 54.375 0.010 1
1 363 . 10 1 1 A 50 50 GLU CB C 37 33.758 33.233 0.525 1
1 365 . 10 1 1 A 50 50 GLU N N 37 123.229 119.816 3.413 1
1 366 . 10 1 1 A 51 51 ASP H H 38 9.032 9.044 -0.012 1
1 367 . 10 1 1 A 51 51 ASP HA H 38 4.149 4.388 -0.239 1
1 370 . 10 1 1 A 51 51 ASP C C 38 177.994 178.360 -0.366 1
1 371 . 10 1 1 A 51 51 ASP CA C 38 59.073 57.111 1.962 1
1 372 . 10 1 1 A 51 51 ASP CB C 38 43.134 39.710 3.424 1
1 373 . 10 1 1 A 51 51 ASP N N 38 122.717 121.789 0.928 1
1 374 . 10 1 1 A 52 52 GLN H H 39 8.950 8.183 0.767 1
1 375 . 10 1 1 A 52 52 GLN HA H 39 3.940 4.046 -0.106 1
1 378 . 10 1 1 A 52 52 GLN C C 39 177.817 178.016 -0.199 1
1 379 . 10 1 1 A 52 52 GLN CA C 39 59.073 59.060 0.013 1
1 380 . 10 1 1 A 52 52 GLN CB C 39 28.133 28.613 -0.480 1
1 381 . 10 1 1 A 52 52 GLN N N 39 114.086 119.066 -4.980 1
1 382 . 10 1 1 A 53 53 ASP H H 40 7.214 8.260 -1.046 1
1 383 . 10 1 1 A 53 53 ASP HA H 40 4.370 4.502 -0.132 1
1 386 . 10 1 1 A 53 53 ASP C C 40 177.667 178.534 -0.867 1
1 387 . 10 1 1 A 53 53 ASP CA C 40 57.198 57.474 -0.276 1
1 388 . 10 1 1 A 53 53 ASP CB C 40 41.800 40.599 1.201 1
1 389 . 10 1 1 A 53 53 ASP N N 40 118.734 119.419 -0.685 1
1 390 . 10 1 1 A 54 54 LEU H H 41 7.180 7.997 -0.817 1
1 391 . 10 1 1 A 54 54 LEU HA H 41 3.990 4.032 -0.042 1
1 400 . 10 1 1 A 54 54 LEU C C 41 178.204 178.352 -0.148 1
1 401 . 10 1 1 A 54 54 LEU CA C 41 56.260 57.999 -1.739 1
1 402 . 10 1 1 A 54 54 LEU CB C 41 41.259 41.844 -0.585 1
1 405 . 10 1 1 A 54 54 LEU N N 41 115.795 122.184 -6.389 1
1 406 . 10 1 1 A 55 55 LEU H H 42 7.823 7.777 0.046 1
1 407 . 10 1 1 A 55 55 LEU HA H 42 3.920 4.149 -0.229 1
1 416 . 10 1 1 A 55 55 LEU C C 42 180.876 178.407 2.469 1
1 417 . 10 1 1 A 55 55 LEU CA C 42 58.135 56.701 1.434 1
1 418 . 10 1 1 A 55 55 LEU CB C 42 42.196 42.521 -0.325 1
1 421 . 10 1 1 A 55 55 LEU N N 42 120.499 119.348 1.151 1
1 422 . 10 1 1 A 56 56 GLU H H 43 8.127 8.267 -0.140 1
1 423 . 10 1 1 A 56 56 GLU HA H 43 3.966 4.113 -0.147 1
1 428 . 10 1 1 A 56 56 GLU C C 43 178.801 178.482 0.319 1
1 429 . 10 1 1 A 56 56 GLU CA C 43 60.010 59.106 0.904 1
1 430 . 10 1 1 A 56 56 GLU CB C 43 29.070 29.692 -0.622 1
1 432 . 10 1 1 A 56 56 GLU N N 43 120.955 118.830 2.125 1
1 433 . 10 1 1 A 57 57 ILE H H 44 7.504 7.738 -0.234 1
1 434 . 10 1 1 A 57 57 ILE HA H 44 4.524 3.979 0.545 1
1 444 . 10 1 1 A 57 57 ILE C C 44 175.691 176.980 -1.289 1
1 445 . 10 1 1 A 57 57 ILE CA C 44 61.886 63.730 -1.844 1
1 446 . 10 1 1 A 57 57 ILE CB C 44 37.300 38.403 -1.103 1
1 450 . 10 1 1 A 57 57 ILE N N 44 109.594 117.748 -8.154 1
1 451 . 10 1 1 A 58 58 GLY H H 45 7.724 7.019 0.705 1
1 452 . 10 1 1 A 58 58 GLY HA2 H 45 3.650 4.238 -0.588 1
1 453 . 10 1 1 A 58 58 GLY HA3 H 45 4.530 4.380 0.150 1
1 454 . 10 1 1 A 58 58 GLY C C 45 174.613 173.070 1.543 1
1 455 . 10 1 1 A 58 58 GLY CA C 45 45.947 45.793 0.154 1
1 456 . 10 1 1 A 58 58 GLY N N 45 106.680 105.969 0.711 1
1 457 . 10 1 1 A 59 59 ILE H H 46 8.180 8.876 -0.696 1
1 458 . 10 1 1 A 59 59 ILE HA H 46 3.907 4.747 -0.840 1
1 468 . 10 1 1 A 59 59 ILE C C 46 174.235 174.956 -0.721 1
1 469 . 10 1 1 A 59 59 ILE CA C 46 60.948 60.701 0.247 1
1 470 . 10 1 1 A 59 59 ILE CB C 46 33.980 40.016 -6.036 1
1 474 . 10 1 1 A 59 59 ILE N N 46 122.454 125.531 -3.077 1
1 475 . 10 1 1 A 60 60 LEU H H 47 7.367 9.018 -1.651 1
1 476 . 10 1 1 A 60 60 LEU HA H 47 3.900 4.628 -0.728 1
1 479 . 10 1 1 A 60 60 LEU C C 47 177.753 176.822 0.931 1
1 480 . 10 1 1 A 60 60 LEU CA C 47 56.260 54.462 1.798 1
1 481 . 10 1 1 A 60 60 LEU CB C 47 42.196 43.971 -1.775 1
1 482 . 10 1 1 A 60 60 LEU N N 47 125.835 129.649 -3.814 1
1 483 . 10 1 1 A 63 63 GLY HA2 H 50 3.980 3.914 0.066 1
1 484 . 10 1 1 A 63 63 GLY HA3 H 50 3.950 3.920 0.030 1
1 485 . 10 1 1 A 63 63 GLY C C 50 177.130 175.073 2.057 1
1 486 . 10 1 1 A 63 63 GLY CA C 50 46.884 46.992 -0.108 1
1 487 . 10 1 1 A 64 64 HIS H H 51 7.926 8.127 -0.201 1
1 488 . 10 1 1 A 64 64 HIS HA H 51 4.451 4.323 0.128 1
1 493 . 10 1 1 A 64 64 HIS C C 51 177.613 176.690 0.923 1
1 494 . 10 1 1 A 64 64 HIS CA C 51 57.198 58.170 -0.972 1
1 495 . 10 1 1 A 64 64 HIS CB C 51 30.945 29.771 1.174 1
1 498 . 10 1 1 A 64 64 HIS N N 51 122.284 118.599 3.685 1
1 499 . 10 1 1 A 65 65 ARG H H 52 8.105 8.092 0.013 1
1 500 . 10 1 1 A 65 65 ARG HA H 52 3.685 3.790 -0.105 1
1 507 . 10 1 1 A 65 65 ARG C C 52 177.769 178.854 -1.085 1
1 508 . 10 1 1 A 65 65 ARG CA C 52 61.886 59.688 2.198 1
1 509 . 10 1 1 A 65 65 ARG CB C 52 30.945 30.077 0.868 1
1 511 . 10 1 1 A 65 65 ARG N N 52 117.775 120.199 -2.424 1
1 513 . 10 1 1 A 66 66 GLN H H 53 8.090 7.888 0.202 1
1 514 . 10 1 1 A 66 66 GLN HA H 53 3.940 3.980 -0.040 1
1 519 . 10 1 1 A 66 66 GLN C C 53 178.583 177.981 0.602 1
1 520 . 10 1 1 A 66 66 GLN CA C 53 59.073 59.052 0.021 1
1 521 . 10 1 1 A 66 66 GLN CB C 53 28.133 28.237 -0.104 1
1 523 . 10 1 1 A 66 66 GLN N N 53 116.452 118.962 -2.510 1
1 524 . 10 1 1 A 67 67 ARG H H 54 7.845 7.604 0.241 1
1 525 . 10 1 1 A 67 67 ARG HA H 54 4.010 3.884 0.126 1
1 528 . 10 1 1 A 67 67 ARG C C 54 179.766 178.740 1.026 1
1 529 . 10 1 1 A 67 67 ARG CA C 54 59.073 58.715 0.358 1
1 530 . 10 1 1 A 67 67 ARG CB C 54 30.720 29.438 1.282 1
1 532 . 10 1 1 A 67 67 ARG N N 54 119.275 119.284 -0.009 1
1 533 . 10 1 1 A 68 68 ILE H H 55 8.032 7.713 0.319 1
1 534 . 10 1 1 A 68 68 ILE HA H 55 3.495 3.500 -0.005 1
1 544 . 10 1 1 A 68 68 ILE C C 55 177.108 178.583 -1.475 1
1 545 . 10 1 1 A 68 68 ILE CA C 55 66.230 65.331 0.899 1
1 546 . 10 1 1 A 68 68 ILE CB C 55 38.020 37.747 0.273 1
1 550 . 10 1 1 A 68 68 ILE N N 55 121.152 119.360 1.792 1
1 551 . 10 1 1 A 69 69 LEU H H 56 8.490 8.135 0.355 1
1 552 . 10 1 1 A 69 69 LEU HA H 56 4.010 3.817 0.193 1
1 561 . 10 1 1 A 69 69 LEU C C 56 179.917 178.838 1.079 1
1 562 . 10 1 1 A 69 69 LEU CA C 56 58.135 58.005 0.130 1
1 563 . 10 1 1 A 69 69 LEU CB C 56 41.259 41.743 -0.484 1
1 566 . 10 1 1 A 69 69 LEU N N 56 119.072 120.364 -1.292 1
1 567 . 10 1 1 A 70 70 GLN H H 57 8.327 8.485 -0.158 1
1 568 . 10 1 1 A 70 70 GLN HA H 57 4.100 3.943 0.157 1
1 573 . 10 1 1 A 70 70 GLN C C 57 178.798 178.113 0.685 1
1 574 . 10 1 1 A 70 70 GLN CA C 57 59.073 58.761 0.312 1
1 575 . 10 1 1 A 70 70 GLN CB C 57 28.133 28.779 -0.646 1
1 577 . 10 1 1 A 70 70 GLN N N 57 118.172 118.137 0.035 1
1 578 . 10 1 1 A 71 71 ALA H H 58 7.810 7.933 -0.123 1
1 579 . 10 1 1 A 71 71 ALA HA H 58 4.320 4.111 0.209 1
1 583 . 10 1 1 A 71 71 ALA C C 58 172.232 179.287 -7.055 1
1 584 . 10 1 1 A 71 71 ALA CA C 58 55.323 55.222 0.101 1
1 585 . 10 1 1 A 71 71 ALA CB C 58 19.720 18.984 0.736 1
1 586 . 10 1 1 A 71 71 ALA N N 58 122.536 122.427 0.109 1
1 587 . 10 1 1 A 72 72 ILE H H 59 8.840 8.545 0.295 1
1 588 . 10 1 1 A 72 72 ILE HA H 59 4.030 4.007 0.023 1
1 598 . 10 1 1 A 72 72 ILE C C 59 178.678 177.536 1.142 1
1 599 . 10 1 1 A 72 72 ILE CA C 59 64.698 63.864 0.834 1
1 600 . 10 1 1 A 72 72 ILE CB C 59 37.850 37.477 0.373 1
1 604 . 10 1 1 A 72 72 ILE N N 59 118.111 118.987 -0.876 1
1 605 . 10 1 1 A 73 73 GLN H H 60 7.547 8.070 -0.523 1
1 606 . 10 1 1 A 73 73 GLN HA H 60 4.121 4.091 0.030 1
1 611 . 10 1 1 A 73 73 GLN C C 60 176.556 177.989 -1.433 1
1 612 . 10 1 1 A 73 73 GLN CA C 60 58.135 58.500 -0.365 1
1 613 . 10 1 1 A 73 73 GLN CB C 60 28.300 28.554 -0.254 1
1 615 . 10 1 1 A 73 73 GLN N N 60 119.094 120.940 -1.846 1
1 616 . 10 1 1 A 74 74 LEU H H 61 7.350 7.730 -0.380 1
1 617 . 10 1 1 A 74 74 LEU HA H 61 4.408 4.313 0.095 1
1 626 . 10 1 1 A 74 74 LEU C C 61 177.960 177.212 0.748 1
1 627 . 10 1 1 A 74 74 LEU CA C 61 54.900 55.179 -0.279 1
1 628 . 10 1 1 A 74 74 LEU CB C 61 42.196 42.627 -0.431 1
1 631 . 10 1 1 A 74 74 LEU N N 61 115.853 118.359 -2.506 1
1 632 . 10 1 1 A 75 75 LEU H H 62 7.358 7.612 -0.254 1
1 633 . 10 1 1 A 75 75 LEU HA H 62 4.530 4.432 0.098 1
1 642 . 10 1 1 A 75 75 LEU C C 62 177.035 174.810 2.225 1
1 643 . 10 1 1 A 75 75 LEU CA C 62 53.200 53.882 -0.682 1
1 644 . 10 1 1 A 75 75 LEU CB C 62 40.700 41.153 -0.453 1
1 647 . 10 1 1 A 75 75 LEU N N 62 121.010 120.852 0.158 1
1 648 . 10 1 1 A 76 76 PRO HA H 63 4.382 4.597 -0.215 1
1 655 . 10 1 1 A 76 76 PRO CB C 63 31.883 32.933 -1.050 1
1 657 . 10 1 1 A 77 77 LYS H H 64 8.418 8.476 -0.058 1
1 658 . 10 1 1 A 77 77 LYS HA H 64 4.140 4.786 -0.646 1
1 663 . 10 1 1 A 77 77 LYS C C 64 177.122 174.903 2.219 1
1 664 . 10 1 1 A 77 77 LYS CA C 64 56.260 55.086 1.174 1
1 665 . 10 1 1 A 77 77 LYS CB C 64 33.340 34.410 -1.070 1
1 668 . 10 1 1 A 77 77 LYS N N 64 121.932 120.143 1.789 1
1 669 . 10 1 1 A 78 78 MET H H 65 8.550 8.672 -0.122 1
1 670 . 10 1 1 A 78 78 MET HA H 65 4.304 4.874 -0.570 1
1 676 . 10 1 1 A 78 78 MET C C 65 176.105 175.631 0.474 1
1 677 . 10 1 1 A 78 78 MET CA C 65 56.260 53.853 2.407 1
1 678 . 10 1 1 A 78 78 MET CB C 65 32.821 33.673 -0.852 1
1 680 . 10 1 1 A 78 78 MET N N 65 123.498 124.195 -0.697 1
1 681 . 10 1 1 A 79 79 ARG H H 66 8.731 8.569 0.162 1
1 682 . 10 1 1 A 79 79 ARG C C 66 173.577 175.539 -1.962 1
1 683 . 10 1 1 A 79 79 ARG CA C 66 53.447 57.895 -4.448 1
1 684 . 10 1 1 A 79 79 ARG CB C 66 30.008 29.602 0.406 1
1 685 . 10 1 1 A 79 79 ARG N N 66 127.355 125.966 1.389 1
1 686 . 10 1 1 A 80 80 PRO HA H 67 4.780 4.532 0.248 1
1 693 . 10 1 1 A 80 80 PRO C C 67 177.043 175.781 1.262 1
1 694 . 10 1 1 A 80 80 PRO CA C 67 61.886 62.190 -0.304 1
1 695 . 10 1 1 A 80 80 PRO CB C 67 32.821 33.293 -0.472 1
1 698 . 10 1 1 A 81 81 ILE H H 68 8.580 8.362 0.218 1
1 699 . 10 1 1 A 81 81 ILE HA H 68 4.040 4.521 -0.481 1
1 709 . 10 1 1 A 81 81 ILE C C 68 176.831 175.850 0.981 1
1 710 . 10 1 1 A 81 81 ILE CA C 68 62.823 60.662 2.161 1
1 711 . 10 1 1 A 81 81 ILE CB C 68 38.580 39.277 -0.697 1
1 715 . 10 1 1 A 81 81 ILE N N 68 118.491 121.949 -3.458 1
1 716 . 10 1 1 A 82 82 GLY H H 69 8.602 8.572 0.030 1
1 717 . 10 1 1 A 82 82 GLY CA C 69 45.009 46.025 -1.016 1
1 718 . 10 1 1 A 82 82 GLY N N 69 111.377 115.824 -4.447 1
1 721 . 10 1 1 A 84 84 ASP HA H 71 4.490 4.898 -0.408 1
1 724 . 10 1 1 A 84 84 ASP CA C 71 54.385 53.577 0.808 1
1 725 . 10 1 1 A 84 84 ASP CB C 71 40.321 44.520 -4.199 1
1 726 . 10 1 1 A 85 85 GLY H H 72 8.054 8.278 -0.224 1
1 727 . 10 1 1 A 85 85 GLY HA2 H 72 4.040 4.124 -0.084 1
1 728 . 10 1 1 A 85 85 GLY HA3 H 72 3.750 4.134 -0.384 1
1 729 . 10 1 1 A 85 85 GLY C C 72 173.474 172.366 1.108 1
1 730 . 10 1 1 A 85 85 GLY CA C 72 45.009 46.050 -1.041 1
1 731 . 10 1 1 A 85 85 GLY N N 72 108.038 110.519 -2.481 1
1 732 . 10 1 1 A 86 86 ALA H H 73 7.858 8.176 -0.318 1
1 733 . 10 1 1 A 86 86 ALA HA H 73 4.370 4.566 -0.196 1
1 737 . 10 1 1 A 86 86 ALA CA C 73 51.990 50.665 1.325 1
1 738 . 10 1 1 A 86 86 ALA CB C 73 19.220 22.020 -2.800 1
1 739 . 10 1 1 A 86 86 ALA N N 73 123.819 121.697 2.122 1
1 742 . 10 1 1 A 90 90 SER H H 77 7.839 7.696 0.143 1
1 743 . 10 1 1 A 90 90 SER HA H 77 4.770 4.957 -0.187 1
1 746 . 10 1 1 A 90 90 SER N N 77 115.163 116.259 -1.096 1
1 747 . 10 1 1 A 91 91 VAL H H 78 8.578 9.126 -0.548 1
1 748 . 10 1 1 A 91 91 VAL HA H 78 3.981 3.924 0.057 1
1 756 . 10 1 1 A 91 91 VAL C C 78 177.480 177.256 0.224 1
1 757 . 10 1 1 A 91 91 VAL CA C 78 67.060 66.424 0.636 1
1 758 . 10 1 1 A 91 91 VAL CB C 78 32.500 31.907 0.593 1
1 761 . 10 1 1 A 91 91 VAL N N 78 123.481 124.417 -0.936 1
1 762 . 10 1 1 A 92 92 ALA H H 79 8.607 8.335 0.272 1
1 763 . 10 1 1 A 92 92 ALA HA H 79 4.113 4.211 -0.098 1
1 767 . 10 1 1 A 92 92 ALA C C 79 179.868 179.511 0.357 1
1 768 . 10 1 1 A 92 92 ALA CA C 79 54.890 55.308 -0.418 1
1 769 . 10 1 1 A 92 92 ALA CB C 79 18.790 18.065 0.725 1
1 770 . 10 1 1 A 92 92 ALA N N 79 120.334 121.585 -1.251 1
1 771 . 10 1 1 A 93 93 GLU H H 80 7.886 7.984 -0.098 1
1 772 . 10 1 1 A 93 93 GLU HA H 80 4.010 4.111 -0.101 1
1 777 . 10 1 1 A 93 93 GLU C C 80 179.719 178.910 0.809 1
1 778 . 10 1 1 A 93 93 GLU CA C 80 59.073 59.125 -0.052 1
1 779 . 10 1 1 A 93 93 GLU CB C 80 30.630 29.439 1.191 1
1 781 . 10 1 1 A 93 93 GLU N N 80 117.643 119.034 -1.391 1
1 782 . 10 1 1 A 94 94 TRP H H 81 8.299 8.115 0.184 1
1 783 . 10 1 1 A 94 94 TRP HA H 81 4.251 4.338 -0.087 1
1 792 . 10 1 1 A 94 94 TRP C C 81 178.772 177.762 1.010 1
1 793 . 10 1 1 A 94 94 TRP CA C 81 60.010 60.687 -0.677 1
1 794 . 10 1 1 A 94 94 TRP CB C 81 27.650 29.269 -1.619 1
1 800 . 10 1 1 A 94 94 TRP N N 81 122.545 122.502 0.043 1
1 802 . 10 1 1 A 95 95 LEU H H 82 8.505 8.379 0.126 1
1 803 . 10 1 1 A 95 95 LEU HA H 82 2.880 3.158 -0.278 1
1 812 . 10 1 1 A 95 95 LEU C C 82 180.235 178.399 1.836 1
1 813 . 10 1 1 A 95 95 LEU CA C 82 57.400 56.749 0.651 1
1 814 . 10 1 1 A 95 95 LEU CB C 82 40.321 41.183 -0.862 1
1 817 . 10 1 1 A 95 95 LEU N N 82 121.110 119.186 1.924 1
1 818 . 10 1 1 A 96 96 ASP H H 83 8.185 8.483 -0.298 1
1 819 . 10 1 1 A 96 96 ASP HA H 83 4.280 4.182 0.098 1
1 822 . 10 1 1 A 96 96 ASP C C 83 175.224 178.010 -2.786 1
1 823 . 10 1 1 A 96 96 ASP CA C 83 57.310 57.657 -0.347 1
1 824 . 10 1 1 A 96 96 ASP CB C 83 40.321 41.962 -1.641 1
1 825 . 10 1 1 A 96 96 ASP N N 83 119.082 120.601 -1.519 1
1 826 . 10 1 1 A 97 97 SER H H 84 7.989 8.052 -0.063 1
1 827 . 10 1 1 A 97 97 SER HA H 84 4.250 4.233 0.017 1
1 830 . 10 1 1 A 97 97 SER C C 84 175.346 175.285 0.061 1
1 831 . 10 1 1 A 97 97 SER CA C 84 60.948 60.881 0.067 1
1 832 . 10 1 1 A 97 97 SER CB C 84 63.370 62.713 0.657 1
1 833 . 10 1 1 A 97 97 SER N N 84 117.579 113.478 4.101 1
1 834 . 10 1 1 A 98 98 ILE H H 85 6.862 7.435 -0.573 1
1 835 . 10 1 1 A 98 98 ILE HA H 85 4.550 4.130 0.420 1
1 843 . 10 1 1 A 98 98 ILE C C 85 173.308 174.939 -1.631 1
1 844 . 10 1 1 A 98 98 ILE CA C 85 60.948 60.654 0.294 1
1 845 . 10 1 1 A 98 98 ILE CB C 85 37.760 37.641 0.119 1
1 848 . 10 1 1 A 98 98 ILE N N 85 113.733 117.526 -3.793 1
1 849 . 10 1 1 A 99 99 GLU H H 86 7.705 7.641 0.064 1
1 850 . 10 1 1 A 99 99 GLU HA H 86 4.280 3.830 0.450 1
1 853 . 10 1 1 A 99 99 GLU C C 86 175.224 174.644 0.580 1
1 854 . 10 1 1 A 99 99 GLU CA C 86 56.260 57.554 -1.294 1
1 855 . 10 1 1 A 99 99 GLU CB C 86 26.258 26.810 -0.552 1
1 857 . 10 1 1 A 99 99 GLU N N 86 115.493 118.403 -2.910 1
1 858 . 10 1 1 A 100 100 LEU H H 87 7.989 7.401 0.588 1
1 859 . 10 1 1 A 100 100 LEU HA H 87 4.220 4.620 -0.400 1
1 868 . 10 1 1 A 100 100 LEU C C 87 176.965 175.796 1.169 1
1 869 . 10 1 1 A 100 100 LEU CA C 87 52.510 53.285 -0.775 1
1 870 . 10 1 1 A 100 100 LEU CB C 87 42.196 44.744 -2.548 1
1 873 . 10 1 1 A 100 100 LEU N N 87 117.579 118.973 -1.394 1
1 874 . 10 1 1 A 101 101 GLY H H 88 8.503 8.135 0.368 1
1 875 . 10 1 1 A 101 101 GLY CA C 88 46.884 45.923 0.961 1
1 876 . 10 1 1 A 101 101 GLY N N 88 107.794 114.316 -6.522 1
1 877 . 10 1 1 A 102 102 ASP HA H 89 4.431 4.276 0.155 1
1 880 . 10 1 1 A 102 102 ASP C C 89 178.075 178.344 -0.269 1
1 881 . 10 1 1 A 102 102 ASP CA C 89 57.198 56.904 0.294 1
1 882 . 10 1 1 A 102 102 ASP CB C 89 40.321 40.533 -0.212 1
1 883 . 10 1 1 A 103 103 TYR H H 90 7.899 7.948 -0.049 1
1 884 . 10 1 1 A 103 103 TYR HA H 90 4.940 4.438 0.502 1
1 889 . 10 1 1 A 103 103 TYR C C 90 175.527 178.492 -2.965 1
1 890 . 10 1 1 A 103 103 TYR CA C 90 58.135 60.324 -2.189 1
1 891 . 10 1 1 A 103 103 TYR CB C 90 38.446 37.750 0.696 1
1 894 . 10 1 1 A 103 103 TYR N N 90 115.595 119.616 -4.021 1
1 895 . 10 1 1 A 104 104 THR H H 91 7.971 8.330 -0.359 1
1 896 . 10 1 1 A 104 104 THR HA H 91 4.234 3.998 0.236 1
1 901 . 10 1 1 A 104 104 THR C C 91 175.905 176.465 -0.560 1
1 902 . 10 1 1 A 104 104 THR CA C 91 68.449 67.053 1.396 1
1 904 . 10 1 1 A 104 104 THR N N 91 118.867 116.520 2.347 1
1 905 . 10 1 1 A 105 105 LYS H H 92 8.555 8.009 0.546 1
1 906 . 10 1 1 A 105 105 LYS HA H 92 3.940 4.023 -0.083 1
1 912 . 10 1 1 A 105 105 LYS C C 92 177.310 178.773 -1.463 1
1 913 . 10 1 1 A 105 105 LYS CA C 92 60.948 59.479 1.469 1
1 914 . 10 1 1 A 105 105 LYS CB C 92 31.883 32.408 -0.525 1
1 917 . 10 1 1 A 105 105 LYS N N 92 119.259 121.615 -2.356 1
1 918 . 10 1 1 A 106 106 ALA H H 93 7.920 7.683 0.237 1
1 919 . 10 1 1 A 106 106 ALA HA H 93 4.128 4.195 -0.067 1
1 923 . 10 1 1 A 106 106 ALA C C 93 180.972 180.188 0.784 1
1 924 . 10 1 1 A 106 106 ALA CA C 93 55.070 55.273 -0.203 1
1 925 . 10 1 1 A 106 106 ALA CB C 93 17.750 18.298 -0.548 1
1 926 . 10 1 1 A 106 106 ALA N N 93 120.398 122.153 -1.755 1
1 927 . 10 1 1 A 107 107 PHE H H 94 8.136 8.773 -0.637 1
1 928 . 10 1 1 A 107 107 PHE HA H 94 4.190 4.630 -0.440 1
1 934 . 10 1 1 A 107 107 PHE C C 94 177.955 178.217 -0.262 1
1 935 . 10 1 1 A 107 107 PHE CA C 94 63.761 61.547 2.214 1
1 936 . 10 1 1 A 107 107 PHE CB C 94 38.446 38.610 -0.164 1
1 940 . 10 1 1 A 107 107 PHE N N 94 117.119 116.309 0.810 1
1 941 . 10 1 1 A 108 108 LEU H H 95 8.351 8.747 -0.396 1
1 942 . 10 1 1 A 108 108 LEU HA H 95 3.889 4.035 -0.146 1
1 951 . 10 1 1 A 108 108 LEU C C 95 182.043 179.133 2.910 1
1 952 . 10 1 1 A 108 108 LEU CA C 95 59.073 58.556 0.517 1
1 953 . 10 1 1 A 108 108 LEU CB C 95 41.259 41.643 -0.384 1
1 956 . 10 1 1 A 108 108 LEU N N 95 118.450 119.825 -1.375 1
1 957 . 10 1 1 A 109 109 ILE H H 96 8.992 8.166 0.826 1
1 958 . 10 1 1 A 109 109 ILE HA H 96 4.069 3.896 0.173 1
1 968 . 10 1 1 A 109 109 ILE C C 96 177.094 177.846 -0.752 1
1 969 . 10 1 1 A 109 109 ILE CA C 96 63.761 64.312 -0.551 1
1 970 . 10 1 1 A 109 109 ILE CB C 96 37.509 37.727 -0.218 1
1 974 . 10 1 1 A 109 109 ILE N N 96 118.177 115.343 2.834 1
1 975 . 10 1 1 A 110 110 ASN H H 97 7.067 7.802 -0.735 1
1 976 . 10 1 1 A 110 110 ASN HA H 97 4.797 4.747 0.050 1
1 981 . 10 1 1 A 110 110 ASN C C 97 173.595 175.472 -1.877 1
1 982 . 10 1 1 A 110 110 ASN CA C 97 54.385 53.422 0.963 1
1 983 . 10 1 1 A 110 110 ASN CB C 97 40.321 39.048 1.273 1
1 984 . 10 1 1 A 110 110 ASN N N 97 116.407 119.370 -2.963 1
1 986 . 10 1 1 A 111 111 GLY H H 98 7.681 7.876 -0.195 1
1 987 . 10 1 1 A 111 111 GLY HA2 H 98 4.080 3.918 0.162 1
1 988 . 10 1 1 A 111 111 GLY HA3 H 98 3.640 4.010 -0.370 1
1 989 . 10 1 1 A 111 111 GLY C C 98 174.552 174.554 -0.002 1
1 990 . 10 1 1 A 111 111 GLY CA C 98 45.947 45.739 0.208 1
1 991 . 10 1 1 A 111 111 GLY N N 98 104.440 106.716 -2.276 1
1 992 . 10 1 1 A 112 112 TYR H H 99 8.427 8.304 0.123 1
1 993 . 10 1 1 A 112 112 TYR HA H 99 4.661 4.881 -0.220 1
1 998 . 10 1 1 A 112 112 TYR C C 99 174.425 176.330 -1.905 1
1 999 . 10 1 1 A 112 112 TYR CA C 99 57.198 57.833 -0.635 1
1 1000 . 10 1 1 A 112 112 TYR CB C 99 36.571 38.642 -2.071 1
1 1003 . 10 1 1 A 112 112 TYR N N 99 122.830 119.299 3.531 1
1 1004 . 10 1 1 A 113 113 THR H H 100 7.166 8.236 -1.070 1
1 1005 . 10 1 1 A 113 113 THR HA H 100 4.248 4.093 0.155 1
1 1009 . 10 1 1 A 113 113 THR C C 100 174.897 175.244 -0.347 1
1 1010 . 10 1 1 A 113 113 THR CA C 100 62.290 65.661 -3.371 1
1 1011 . 10 1 1 A 113 113 THR CB C 100 68.970 68.180 0.790 1
1 1013 . 10 1 1 A 113 113 THR N N 100 104.304 114.545 -10.241 1
1 1014 . 10 1 1 A 114 114 SER H H 101 7.695 7.769 -0.074 1
1 1015 . 10 1 1 A 114 114 SER C C 101 174.372 173.877 0.495 1
1 1016 . 10 1 1 A 114 114 SER CA C 101 56.260 59.040 -2.780 1
1 1017 . 10 1 1 A 114 114 SER CB C 101 65.636 63.961 1.675 1
1 1018 . 10 1 1 A 114 114 SER N N 101 115.613 117.197 -1.584 1
1 1023 . 10 1 1 A 116 116 ASP HA H 103 4.260 4.228 0.032 1
1 1026 . 10 1 1 A 116 116 ASP CA C 103 57.198 57.476 -0.278 1
1 1027 . 10 1 1 A 116 116 ASP CB C 103 40.321 40.130 0.191 1
1 1028 . 10 1 1 A 117 117 LEU H H 104 7.345 8.011 -0.666 1
1 1029 . 10 1 1 A 117 117 LEU HA H 104 4.290 4.014 0.276 1
1 1038 . 10 1 1 A 117 117 LEU C C 104 178.488 178.617 -0.129 1
1 1039 . 10 1 1 A 117 117 LEU CA C 104 56.260 58.125 -1.865 1
1 1040 . 10 1 1 A 117 117 LEU CB C 104 42.196 41.459 0.737 1
1 1043 . 10 1 1 A 117 117 LEU N N 104 117.878 117.927 -0.049 1
1 1044 . 10 1 1 A 118 118 LEU H H 105 7.514 7.970 -0.456 1
1 1045 . 10 1 1 A 118 118 LEU HA H 105 4.210 4.215 -0.005 1
1 1054 . 10 1 1 A 118 118 LEU C C 105 177.002 177.292 -0.290 1
1 1055 . 10 1 1 A 118 118 LEU CA C 105 55.323 56.505 -1.182 1
1 1056 . 10 1 1 A 118 118 LEU CB C 105 42.196 41.666 0.530 1
1 1059 . 10 1 1 A 118 118 LEU N N 105 119.094 119.106 -0.012 1
1 1060 . 10 1 1 A 120 120 LYS HA H 107 4.340 4.586 -0.246 1
1 1063 . 10 1 1 A 120 120 LYS C C 107 176.603 176.027 0.576 1
1 1064 . 10 1 1 A 120 120 LYS CA C 107 55.323 56.174 -0.851 1
1 1065 . 10 1 1 A 120 120 LYS CB C 107 31.883 33.427 -1.544 1
1 1068 . 10 1 1 A 121 121 ILE H H 108 7.539 7.484 0.055 1
1 1069 . 10 1 1 A 121 121 ILE HA H 108 3.987 4.432 -0.445 1
1 1079 . 10 1 1 A 121 121 ILE C C 108 173.247 174.551 -1.304 1
1 1080 . 10 1 1 A 121 121 ILE CA C 108 62.823 60.108 2.715 1
1 1081 . 10 1 1 A 121 121 ILE CB C 108 38.446 39.920 -1.474 1
1 1085 . 10 1 1 A 121 121 ILE N N 108 122.417 122.660 -0.243 1
1 1086 . 10 1 1 A 122 122 ALA H H 109 8.290 8.124 0.166 1
1 1087 . 10 1 1 A 122 122 ALA HA H 109 3.970 4.699 -0.729 1
1 1091 . 10 1 1 A 122 122 ALA C C 109 178.318 177.965 0.353 1
1 1092 . 10 1 1 A 122 122 ALA CA C 109 50.150 49.844 0.306 1
1 1093 . 10 1 1 A 122 122 ALA CB C 109 21.630 22.275 -0.645 1
1 1094 . 10 1 1 A 122 122 ALA N N 109 127.784 128.288 -0.504 1
1 1095 . 10 1 1 A 123 123 GLU HA H 110 3.707 3.893 -0.186 1
1 1099 . 10 1 1 A 123 123 GLU C C 110 178.290 178.277 0.013 1
1 1100 . 10 1 1 A 123 123 GLU CA C 110 60.948 60.383 0.565 1
1 1101 . 10 1 1 A 123 123 GLU CB C 110 29.070 29.782 -0.712 1
1 1102 . 10 1 1 A 124 124 VAL H H 111 8.333 8.291 0.042 1
1 1103 . 10 1 1 A 124 124 VAL HA H 111 3.850 3.793 0.057 1
1 1111 . 10 1 1 A 124 124 VAL C C 111 177.406 177.529 -0.123 1
1 1112 . 10 1 1 A 124 124 VAL CA C 111 65.636 65.111 0.525 1
1 1113 . 10 1 1 A 124 124 VAL CB C 111 30.730 31.086 -0.356 1
1 1116 . 10 1 1 A 124 124 VAL N N 111 114.438 118.747 -4.309 1
1 1117 . 10 1 1 A 125 125 GLU H H 112 7.442 8.334 -0.892 1
1 1118 . 10 1 1 A 125 125 GLU HA H 112 4.152 4.061 0.091 1
1 1123 . 10 1 1 A 125 125 GLU C C 112 179.982 179.466 0.516 1
1 1124 . 10 1 1 A 125 125 GLU CA C 112 60.010 59.487 0.523 1
1 1125 . 10 1 1 A 125 125 GLU CB C 112 30.008 29.316 0.692 1
1 1127 . 10 1 1 A 125 125 GLU N N 112 121.032 121.901 -0.869 1
1 1128 . 10 1 1 A 126 126 LEU H H 113 7.666 7.859 -0.193 1
1 1129 . 10 1 1 A 126 126 LEU HA H 113 3.846 3.985 -0.139 1
1 1138 . 10 1 1 A 126 126 LEU C C 113 176.991 179.062 -2.071 1
1 1139 . 10 1 1 A 126 126 LEU CA C 113 58.135 57.871 0.264 1
1 1140 . 10 1 1 A 126 126 LEU CB C 113 41.259 41.784 -0.525 1
1 1143 . 10 1 1 A 126 126 LEU N N 113 118.731 120.694 -1.963 1
1 1144 . 10 1 1 A 127 127 ILE H H 114 7.781 8.096 -0.315 1
1 1145 . 10 1 1 A 127 127 ILE HA H 114 3.502 3.884 -0.382 1
1 1153 . 10 1 1 A 127 127 ILE C C 114 178.195 176.890 1.305 1
1 1154 . 10 1 1 A 127 127 ILE CA C 114 65.636 63.583 2.053 1
1 1155 . 10 1 1 A 127 127 ILE CB C 114 40.321 37.605 2.716 1
1 1159 . 10 1 1 A 127 127 ILE N N 114 115.084 119.916 -4.832 1
1 1160 . 10 1 1 A 128 128 ASN H H 115 8.470 8.152 0.318 1
1 1161 . 10 1 1 A 128 128 ASN HA H 115 4.502 4.657 -0.155 1
1 1166 . 10 1 1 A 128 128 ASN C C 115 176.295 176.049 0.246 1
1 1167 . 10 1 1 A 128 128 ASN CA C 115 56.260 54.909 1.351 1
1 1168 . 10 1 1 A 128 128 ASN CB C 115 39.384 39.155 0.229 1
1 1169 . 10 1 1 A 128 128 ASN N N 115 115.158 119.216 -4.058 1
1 1171 . 10 1 1 A 129 129 VAL H H 116 8.116 7.762 0.354 1
1 1172 . 10 1 1 A 129 129 VAL HA H 116 4.090 3.972 0.118 1
1 1180 . 10 1 1 A 129 129 VAL C C 116 176.740 177.896 -1.156 1
1 1181 . 10 1 1 A 129 129 VAL CA C 116 64.400 64.705 -0.305 1
1 1182 . 10 1 1 A 129 129 VAL CB C 116 32.050 32.230 -0.180 1
1 1185 . 10 1 1 A 129 129 VAL N N 116 118.698 118.078 0.620 1
1 1186 . 10 1 1 A 130 130 LEU H H 117 7.294 7.878 -0.584 1
1 1187 . 10 1 1 A 130 130 LEU HA H 117 3.970 4.127 -0.157 1
1 1196 . 10 1 1 A 130 130 LEU C C 117 175.127 176.131 -1.004 1
1 1197 . 10 1 1 A 130 130 LEU CA C 117 56.260 55.111 1.149 1
1 1198 . 10 1 1 A 130 130 LEU CB C 117 41.259 41.722 -0.463 1
1 1201 . 10 1 1 A 130 130 LEU N N 117 116.201 119.129 -2.928 1
1 1202 . 10 1 1 A 131 131 LYS H H 118 6.594 7.356 -0.762 1
1 1203 . 10 1 1 A 131 131 LYS HA H 118 3.980 4.214 -0.234 1
1 1208 . 10 1 1 A 131 131 LYS C C 118 175.589 175.574 0.015 1
1 1209 . 10 1 1 A 131 131 LYS CA C 118 56.260 57.371 -1.111 1
1 1210 . 10 1 1 A 131 131 LYS CB C 118 28.133 29.176 -1.043 1
1 1212 . 10 1 1 A 131 131 LYS N N 118 111.172 115.657 -4.485 1
1 1213 . 10 1 1 A 132 132 ILE H H 119 8.245 7.940 0.305 1
1 1214 . 10 1 1 A 132 132 ILE HA H 119 4.090 4.295 -0.205 1
1 1224 . 10 1 1 A 132 132 ILE C C 119 175.161 175.799 -0.638 1
1 1225 . 10 1 1 A 132 132 ILE CA C 119 60.010 61.610 -1.600 1
1 1226 . 10 1 1 A 132 132 ILE CB C 119 35.633 36.960 -1.327 1
1 1230 . 10 1 1 A 132 132 ILE N N 119 119.484 120.350 -0.866 1
1 1231 . 10 1 1 A 133 133 ASN H H 120 8.054 8.690 -0.636 1
1 1232 . 10 1 1 A 133 133 ASN HA H 120 4.350 4.743 -0.393 1
1 1235 . 10 1 1 A 133 133 ASN C C 120 175.136 175.353 -0.217 1
1 1236 . 10 1 1 A 133 133 ASN CA C 120 54.385 55.190 -0.805 1
1 1237 . 10 1 1 A 133 133 ASN CB C 120 39.384 39.467 -0.083 1
1 1238 . 10 1 1 A 133 133 ASN N N 120 124.670 126.119 -1.449 1
1 1239 . 10 1 1 A 134 134 LEU H H 121 7.517 7.186 0.331 1
1 1240 . 10 1 1 A 134 134 LEU HA H 121 4.678 4.180 0.498 1
1 1249 . 10 1 1 A 134 134 LEU C C 121 178.051 176.632 1.419 1
1 1250 . 10 1 1 A 134 134 LEU CA C 121 53.447 55.439 -1.992 1
1 1251 . 10 1 1 A 134 134 LEU CB C 121 41.259 42.845 -1.586 1
1 1254 . 10 1 1 A 134 134 LEU N N 121 119.918 119.412 0.506 1
1 1255 . 10 1 1 A 135 135 ILE H H 122 9.389 8.579 0.810 1
1 1256 . 10 1 1 A 135 135 ILE HA H 122 3.540 3.769 -0.229 1
1 1266 . 10 1 1 A 135 135 ILE C C 122 176.425 177.922 -1.497 1
1 1267 . 10 1 1 A 135 135 ILE CA C 122 65.636 65.212 0.424 1
1 1268 . 10 1 1 A 135 135 ILE CB C 122 38.446 37.673 0.773 1
1 1272 . 10 1 1 A 135 135 ILE N N 122 129.949 127.012 2.937 1
1 1273 . 10 1 1 A 136 136 GLY H H 123 8.675 7.979 0.696 1
1 1274 . 10 1 1 A 136 136 GLY HA2 H 123 2.650 3.028 -0.378 1
1 1275 . 10 1 1 A 136 136 GLY HA3 H 123 2.060 3.449 -1.389 1
1 1276 . 10 1 1 A 136 136 GLY C C 123 176.854 176.697 0.157 1
1 1277 . 10 1 1 A 136 136 GLY CA C 123 45.500 47.125 -1.625 1
1 1278 . 10 1 1 A 136 136 GLY N N 123 106.314 108.782 -2.468 1
1 1279 . 10 1 1 A 137 137 HIS H H 124 6.869 7.779 -0.910 1
1 1280 . 10 1 1 A 137 137 HIS HA H 124 4.558 4.629 -0.071 1
1 1285 . 10 1 1 A 137 137 HIS C C 124 176.977 177.876 -0.899 1
1 1286 . 10 1 1 A 137 137 HIS CA C 124 57.198 58.379 -1.181 1
1 1287 . 10 1 1 A 137 137 HIS CB C 124 30.945 29.048 1.897 1
1 1290 . 10 1 1 A 137 137 HIS N N 124 118.865 120.261 -1.396 1
1 1291 . 10 1 1 A 138 138 ARG H H 125 7.730 8.131 -0.401 1
1 1292 . 10 1 1 A 138 138 ARG HA H 125 3.770 3.950 -0.180 1
1 1299 . 10 1 1 A 138 138 ARG C C 125 178.288 178.414 -0.126 1
1 1300 . 10 1 1 A 138 138 ARG CA C 125 61.886 58.729 3.157 1
1 1301 . 10 1 1 A 138 138 ARG CB C 125 30.945 30.204 0.741 1
1 1304 . 10 1 1 A 138 138 ARG N N 125 118.149 118.092 0.057 1
1 1306 . 10 1 1 A 139 139 LYS H H 126 8.679 7.927 0.752 1
1 1307 . 10 1 1 A 139 139 LYS HA H 126 3.990 4.006 -0.016 1
1 1310 . 10 1 1 A 139 139 LYS C C 126 179.184 178.749 0.435 1
1 1311 . 10 1 1 A 139 139 LYS CA C 126 58.135 59.602 -1.467 1
1 1312 . 10 1 1 A 139 139 LYS CB C 126 30.945 32.066 -1.121 1
1 1314 . 10 1 1 A 139 139 LYS N N 126 114.003 119.443 -5.440 1
1 1315 . 10 1 1 A 140 140 ARG H H 127 7.248 8.014 -0.766 1
1 1316 . 10 1 1 A 140 140 ARG HA H 127 3.870 3.926 -0.056 1
1 1324 . 10 1 1 A 140 140 ARG C C 127 177.772 178.934 -1.162 1
1 1325 . 10 1 1 A 140 140 ARG CA C 127 60.010 59.226 0.784 1
1 1326 . 10 1 1 A 140 140 ARG CB C 127 30.945 29.816 1.129 1
1 1329 . 10 1 1 A 140 140 ARG N N 127 120.072 118.663 1.409 1
1 1331 . 10 1 1 A 141 141 ILE H H 128 7.706 7.691 0.015 1
1 1332 . 10 1 1 A 141 141 ILE HA H 128 3.530 4.000 -0.470 1
1 1340 . 10 1 1 A 141 141 ILE C C 128 177.669 178.103 -0.434 1
1 1341 . 10 1 1 A 141 141 ILE CA C 128 65.636 64.599 1.037 1
1 1342 . 10 1 1 A 141 141 ILE CB C 128 38.680 37.563 1.117 1
1 1345 . 10 1 1 A 141 141 ILE N N 128 118.730 117.431 1.299 1
1 1346 . 10 1 1 A 142 142 LEU H H 129 8.194 8.101 0.093 1
1 1347 . 10 1 1 A 142 142 LEU HA H 129 3.950 4.063 -0.113 1
1 1356 . 10 1 1 A 142 142 LEU C C 129 179.960 178.174 1.786 1
1 1357 . 10 1 1 A 142 142 LEU CA C 129 58.135 58.047 0.088 1
1 1358 . 10 1 1 A 142 142 LEU CB C 129 41.259 41.437 -0.178 1
1 1361 . 10 1 1 A 142 142 LEU N N 129 117.675 124.167 -6.492 1
1 1362 . 10 1 1 A 143 143 ALA H H 130 8.294 8.793 -0.499 1
1 1363 . 10 1 1 A 143 143 ALA HA H 130 4.220 4.053 0.167 1
1 1367 . 10 1 1 A 143 143 ALA C C 130 179.899 179.654 0.245 1
1 1368 . 10 1 1 A 143 143 ALA CA C 130 54.385 55.128 -0.743 1
1 1369 . 10 1 1 A 143 143 ALA CB C 130 19.270 18.067 1.203 1
1 1370 . 10 1 1 A 143 143 ALA N N 130 121.096 120.951 0.145 1
1 1371 . 10 1 1 A 144 144 SER H H 131 7.813 7.907 -0.094 1
1 1372 . 10 1 1 A 144 144 SER HA H 131 4.180 4.289 -0.109 1
1 1375 . 10 1 1 A 144 144 SER C C 131 175.457 177.458 -2.001 1
1 1376 . 10 1 1 A 144 144 SER CA C 131 60.948 61.588 -0.640 1
1 1377 . 10 1 1 A 144 144 SER CB C 131 63.761 63.226 0.535 1
1 1378 . 10 1 1 A 144 144 SER N N 131 112.102 114.158 -2.056 1
1 1379 . 10 1 1 A 145 145 LEU H H 132 7.747 8.204 -0.457 1
1 1380 . 10 1 1 A 145 145 LEU HA H 132 4.140 3.975 0.165 1
1 1389 . 10 1 1 A 145 145 LEU C C 132 178.589 176.939 1.650 1
1 1390 . 10 1 1 A 145 145 LEU CA C 132 56.260 56.637 -0.377 1
1 1391 . 10 1 1 A 145 145 LEU CB C 132 42.196 42.644 -0.448 1
1 1394 . 10 1 1 A 145 145 LEU N N 132 117.536 118.917 -1.381 1
1 1395 . 10 1 1 A 146 146 GLY H H 133 7.544 7.331 0.213 1
1 1396 . 10 1 1 A 146 146 GLY HA2 H 133 3.950 3.956 -0.006 1
1 1397 . 10 1 1 A 146 146 GLY HA3 H 133 3.100 4.010 -0.910 1
1 1398 . 10 1 1 A 146 146 GLY C C 133 173.372 174.460 -1.088 1
1 1399 . 10 1 1 A 146 146 GLY CA C 133 45.947 44.104 1.843 1
1 1400 . 10 1 1 A 146 146 GLY N N 133 105.351 105.309 0.042 1
1 1401 . 10 1 1 A 147 147 ASP H H 134 8.342 8.820 -0.478 1
1 1402 . 10 1 1 A 147 147 ASP HA H 134 4.650 4.570 0.080 1
1 1405 . 10 1 1 A 147 147 ASP C C 134 175.462 177.346 -1.884 1
1 1406 . 10 1 1 A 147 147 ASP CA C 134 54.385 56.559 -2.174 1
1 1407 . 10 1 1 A 147 147 ASP CB C 134 41.259 41.019 0.240 1
1 1408 . 10 1 1 A 147 147 ASP N N 134 120.133 120.830 -0.697 1
1 14 . 11 1 1 A 15 15 GLN H H 2 8.439 8.540 -0.101 1
1 15 . 11 1 1 A 15 15 GLN HA H 2 4.594 4.428 0.166 1
1 20 . 11 1 1 A 15 15 GLN C C 2 175.972 175.290 0.682 1
1 21 . 11 1 1 A 15 15 GLN CA C 2 56.260 56.614 -0.354 1
1 22 . 11 1 1 A 15 15 GLN CB C 2 30.945 29.736 1.209 1
1 24 . 11 1 1 A 15 15 GLN N N 2 124.997 126.382 -1.385 1
1 25 . 11 1 1 A 16 16 THR H H 3 8.347 8.532 -0.185 1
1 26 . 11 1 1 A 16 16 THR HA H 3 4.555 4.767 -0.212 1
1 31 . 11 1 1 A 16 16 THR C C 3 175.495 174.878 0.617 1
1 32 . 11 1 1 A 16 16 THR CA C 3 60.010 61.615 -1.605 1
1 33 . 11 1 1 A 16 16 THR CB C 3 71.261 72.203 -0.942 1
1 34 . 11 1 1 A 16 16 THR N N 3 113.011 116.588 -3.577 1
1 35 . 11 1 1 A 17 17 VAL H H 4 8.895 8.904 -0.009 1
1 36 . 11 1 1 A 17 17 VAL HA H 4 3.670 3.802 -0.132 1
1 44 . 11 1 1 A 17 17 VAL C C 4 178.449 177.816 0.633 1
1 45 . 11 1 1 A 17 17 VAL CA C 4 67.511 66.450 1.061 1
1 46 . 11 1 1 A 17 17 VAL CB C 4 31.883 31.640 0.243 1
1 49 . 11 1 1 A 17 17 VAL N N 4 121.854 125.198 -3.344 1
1 50 . 11 1 1 A 18 18 GLY H H 5 9.017 8.299 0.718 1
1 51 . 11 1 1 A 18 18 GLY HA2 H 5 3.940 3.820 0.120 1
1 52 . 11 1 1 A 18 18 GLY HA3 H 5 3.610 3.840 -0.230 1
1 53 . 11 1 1 A 18 18 GLY C C 5 176.186 175.716 0.470 1
1 54 . 11 1 1 A 18 18 GLY CA C 5 47.822 47.223 0.599 1
1 55 . 11 1 1 A 18 18 GLY N N 5 106.966 107.771 -0.805 1
1 56 . 11 1 1 A 19 19 GLN H H 6 8.072 8.342 -0.270 1
1 57 . 11 1 1 A 19 19 GLN HA H 6 4.037 4.100 -0.063 1
1 62 . 11 1 1 A 19 19 GLN C C 6 179.488 177.822 1.666 1
1 63 . 11 1 1 A 19 19 GLN CA C 6 59.073 58.738 0.335 1
1 64 . 11 1 1 A 19 19 GLN CB C 6 28.489 28.592 -0.103 1
1 66 . 11 1 1 A 19 19 GLN N N 6 122.431 121.121 1.310 1
1 67 . 11 1 1 A 20 20 TRP H H 7 8.756 8.208 0.548 1
1 68 . 11 1 1 A 20 20 TRP HA H 7 4.160 4.307 -0.147 1
1 77 . 11 1 1 A 20 20 TRP C C 7 179.620 177.919 1.701 1
1 78 . 11 1 1 A 20 20 TRP CA C 7 61.886 61.092 0.794 1
1 79 . 11 1 1 A 20 20 TRP CB C 7 28.133 30.070 -1.937 1
1 85 . 11 1 1 A 20 20 TRP N N 7 124.265 122.400 1.865 1
1 87 . 11 1 1 A 21 21 LEU H H 8 9.148 8.757 0.391 1
1 88 . 11 1 1 A 21 21 LEU HA H 8 3.440 3.372 0.068 1
1 97 . 11 1 1 A 21 21 LEU C C 8 180.521 178.418 2.103 1
1 98 . 11 1 1 A 21 21 LEU CA C 8 56.920 57.639 -0.719 1
1 99 . 11 1 1 A 21 21 LEU CB C 8 41.700 41.725 -0.025 1
1 102 . 11 1 1 A 21 21 LEU N N 8 120.548 120.677 -0.129 1
1 103 . 11 1 1 A 22 22 GLU H H 9 8.284 8.327 -0.043 1
1 104 . 11 1 1 A 22 22 GLU HA H 9 3.740 3.999 -0.259 1
1 109 . 11 1 1 A 22 22 GLU C C 9 179.960 178.584 1.376 1
1 110 . 11 1 1 A 22 22 GLU CA C 9 60.010 59.219 0.791 1
1 111 . 11 1 1 A 22 22 GLU CB C 9 29.070 29.066 0.004 1
1 113 . 11 1 1 A 22 22 GLU N N 9 120.133 119.589 0.544 1
1 114 . 11 1 1 A 23 23 SER H H 10 7.891 7.767 0.124 1
1 115 . 11 1 1 A 23 23 SER HA H 10 4.250 4.240 0.010 1
1 118 . 11 1 1 A 23 23 SER C C 10 175.346 176.427 -1.081 1
1 119 . 11 1 1 A 23 23 SER CA C 10 60.948 61.215 -0.267 1
1 120 . 11 1 1 A 23 23 SER CB C 10 63.280 62.785 0.495 1
1 121 . 11 1 1 A 23 23 SER N N 10 117.044 114.240 2.804 1
1 122 . 11 1 1 A 24 24 ILE H H 11 6.862 7.395 -0.533 1
1 123 . 11 1 1 A 24 24 ILE HA H 11 4.487 4.014 0.473 1
1 133 . 11 1 1 A 24 24 ILE C C 11 175.812 175.642 0.170 1
1 134 . 11 1 1 A 24 24 ILE CA C 11 60.948 62.245 -1.297 1
1 135 . 11 1 1 A 24 24 ILE CB C 11 38.250 37.931 0.319 1
1 139 . 11 1 1 A 24 24 ILE N N 11 113.733 117.266 -3.533 1
1 140 . 11 1 1 A 25 25 GLY H H 12 7.628 7.558 0.070 1
1 141 . 11 1 1 A 25 25 GLY HA2 H 12 3.990 3.994 -0.004 1
1 142 . 11 1 1 A 25 25 GLY HA3 H 12 3.800 4.078 -0.278 1
1 143 . 11 1 1 A 25 25 GLY C C 12 173.647 171.722 1.925 1
1 144 . 11 1 1 A 25 25 GLY CA C 12 45.947 45.927 0.020 1
1 145 . 11 1 1 A 25 25 GLY N N 12 109.763 110.054 -0.291 1
1 146 . 11 1 1 A 26 26 LEU H H 13 7.620 8.397 -0.777 1
1 147 . 11 1 1 A 26 26 LEU C C 13 176.186 176.901 -0.715 1
1 148 . 11 1 1 A 26 26 LEU CA C 13 52.700 51.662 1.038 1
1 149 . 11 1 1 A 26 26 LEU CB C 13 43.134 45.139 -2.005 1
1 150 . 11 1 1 A 26 26 LEU N N 13 118.778 122.458 -3.680 1
1 151 . 11 1 1 A 27 27 PRO HA H 14 4.120 4.512 -0.392 1
1 154 . 11 1 1 A 27 27 PRO C C 14 177.955 177.676 0.279 1
1 155 . 11 1 1 A 27 27 PRO CA C 14 64.698 64.323 0.375 1
1 156 . 11 1 1 A 27 27 PRO CB C 14 31.883 31.879 0.004 1
1 158 . 11 1 1 A 28 28 GLN H H 15 9.838 8.496 1.342 1
1 159 . 11 1 1 A 28 28 GLN HA H 15 4.240 3.941 0.299 1
1 162 . 11 1 1 A 28 28 GLN C C 15 176.836 176.524 0.312 1
1 163 . 11 1 1 A 28 28 GLN CA C 15 58.135 58.278 -0.143 1
1 164 . 11 1 1 A 28 28 GLN CB C 15 27.195 27.684 -0.489 1
1 166 . 11 1 1 A 28 28 GLN N N 15 120.414 117.447 2.967 1
1 167 . 11 1 1 A 29 29 TYR H H 16 6.810 7.157 -0.347 1
1 168 . 11 1 1 A 29 29 TYR HA H 16 5.720 4.540 1.180 1
1 173 . 11 1 1 A 29 29 TYR C C 16 174.814 177.280 -2.466 1
1 174 . 11 1 1 A 29 29 TYR CA C 16 57.198 58.319 -1.121 1
1 175 . 11 1 1 A 29 29 TYR CB C 16 37.509 40.072 -2.563 1
1 178 . 11 1 1 A 29 29 TYR N N 16 119.718 117.290 2.428 1
1 179 . 11 1 1 A 30 30 GLU H H 17 7.509 8.332 -0.823 1
1 180 . 11 1 1 A 30 30 GLU HA H 17 3.650 4.096 -0.446 1
1 184 . 11 1 1 A 30 30 GLU C C 17 177.552 178.658 -1.106 1
1 185 . 11 1 1 A 30 30 GLU CA C 17 60.948 59.727 1.221 1
1 186 . 11 1 1 A 30 30 GLU CB C 17 30.008 29.181 0.827 1
1 188 . 11 1 1 A 30 30 GLU N N 17 122.417 121.960 0.457 1
1 189 . 11 1 1 A 31 31 ASN H H 18 9.259 7.751 1.508 1
1 190 . 11 1 1 A 31 31 ASN HA H 18 4.451 4.407 0.044 1
1 193 . 11 1 1 A 31 31 ASN C C 18 176.868 178.218 -1.350 1
1 194 . 11 1 1 A 31 31 ASN CA C 18 57.198 56.593 0.605 1
1 195 . 11 1 1 A 31 31 ASN CB C 18 38.446 38.278 0.168 1
1 196 . 11 1 1 A 31 31 ASN N N 18 116.613 117.553 -0.940 1
1 197 . 11 1 1 A 32 32 HIS H H 19 8.898 8.163 0.735 1
1 198 . 11 1 1 A 32 32 HIS HA H 19 4.140 4.406 -0.266 1
1 202 . 11 1 1 A 32 32 HIS C C 19 178.269 177.754 0.515 1
1 203 . 11 1 1 A 32 32 HIS CA C 19 60.948 59.116 1.832 1
1 204 . 11 1 1 A 32 32 HIS CB C 19 30.008 30.192 -0.184 1
1 206 . 11 1 1 A 32 32 HIS N N 19 118.926 118.474 0.452 1
1 207 . 11 1 1 A 33 33 LEU H H 20 7.825 8.869 -1.044 1
1 208 . 11 1 1 A 33 33 LEU HA H 20 4.305 3.938 0.367 1
1 218 . 11 1 1 A 33 33 LEU C C 20 179.190 179.107 0.083 1
1 219 . 11 1 1 A 33 33 LEU CA C 20 60.010 58.324 1.686 1
1 220 . 11 1 1 A 33 33 LEU CB C 20 40.321 41.909 -1.588 1
1 224 . 11 1 1 A 33 33 LEU N N 20 117.434 119.887 -2.453 1
1 225 . 11 1 1 A 34 34 MET H H 21 8.861 8.568 0.293 1
1 226 . 11 1 1 A 34 34 MET HA H 21 3.980 4.163 -0.183 1
1 234 . 11 1 1 A 34 34 MET C C 21 180.340 178.818 1.522 1
1 235 . 11 1 1 A 34 34 MET CA C 21 58.135 58.351 -0.216 1
1 236 . 11 1 1 A 34 34 MET CB C 21 30.945 32.604 -1.659 1
1 238 . 11 1 1 A 34 34 MET N N 21 118.111 116.451 1.660 1
1 239 . 11 1 1 A 35 35 ALA H H 22 9.015 8.334 0.681 1
1 240 . 11 1 1 A 35 35 ALA HA H 22 4.239 4.162 0.077 1
1 244 . 11 1 1 A 35 35 ALA C C 22 178.058 178.572 -0.514 1
1 245 . 11 1 1 A 35 35 ALA CA C 22 53.800 54.188 -0.388 1
1 246 . 11 1 1 A 35 35 ALA CB C 22 18.397 18.248 0.149 1
1 247 . 11 1 1 A 35 35 ALA N N 22 120.068 122.148 -2.080 1
1 248 . 11 1 1 A 36 36 ASN H H 23 7.143 7.990 -0.847 1
1 249 . 11 1 1 A 36 36 ASN HA H 23 4.959 4.787 0.172 1
1 254 . 11 1 1 A 36 36 ASN C C 23 174.083 175.603 -1.520 1
1 255 . 11 1 1 A 36 36 ASN CA C 23 54.000 53.026 0.974 1
1 256 . 11 1 1 A 36 36 ASN CB C 23 41.300 39.062 2.238 1
1 257 . 11 1 1 A 36 36 ASN N N 23 111.560 114.946 -3.386 1
1 259 . 11 1 1 A 37 37 GLY H H 24 7.797 8.262 -0.465 1
1 260 . 11 1 1 A 37 37 GLY HA2 H 24 3.430 3.793 -0.363 1
1 261 . 11 1 1 A 37 37 GLY HA3 H 24 3.290 3.899 -0.609 1
1 262 . 11 1 1 A 37 37 GLY C C 24 173.163 174.997 -1.834 1
1 263 . 11 1 1 A 37 37 GLY CA C 24 45.947 45.198 0.749 1
1 264 . 11 1 1 A 37 37 GLY N N 24 106.170 107.643 -1.473 1
1 265 . 11 1 1 A 38 38 PHE H H 25 8.191 7.967 0.224 1
1 266 . 11 1 1 A 38 38 PHE HA H 25 4.910 4.740 0.170 1
1 271 . 11 1 1 A 38 38 PHE C C 25 173.496 175.751 -2.255 1
1 272 . 11 1 1 A 38 38 PHE CA C 25 56.550 56.263 0.287 1
1 273 . 11 1 1 A 38 38 PHE CB C 25 37.220 36.829 0.391 1
1 276 . 11 1 1 A 38 38 PHE N N 25 122.454 119.820 2.634 1
1 277 . 11 1 1 A 39 39 ASP H H 26 6.756 8.174 -1.418 1
1 278 . 11 1 1 A 39 39 ASP HA H 26 5.077 4.823 0.254 1
1 281 . 11 1 1 A 39 39 ASP C C 26 177.463 175.333 2.130 1
1 282 . 11 1 1 A 39 39 ASP CA C 26 53.447 54.499 -1.052 1
1 283 . 11 1 1 A 39 39 ASP CB C 26 42.580 42.123 0.457 1
1 284 . 11 1 1 A 39 39 ASP N N 26 111.309 119.808 -8.499 1
1 285 . 11 1 1 A 40 40 ASN H H 27 7.495 7.846 -0.351 1
1 286 . 11 1 1 A 40 40 ASN HA H 27 4.820 4.941 -0.121 1
1 289 . 11 1 1 A 40 40 ASN C C 27 176.228 175.998 0.230 1
1 290 . 11 1 1 A 40 40 ASN CA C 27 52.510 52.157 0.353 1
1 291 . 11 1 1 A 40 40 ASN CB C 27 40.321 39.803 0.518 1
1 292 . 11 1 1 A 40 40 ASN N N 27 118.385 118.000 0.385 1
1 293 . 11 1 1 A 41 41 VAL H H 28 9.192 8.551 0.641 1
1 294 . 11 1 1 A 41 41 VAL HA H 28 3.550 3.618 -0.068 1
1 302 . 11 1 1 A 41 41 VAL C C 28 176.429 177.408 -0.979 1
1 303 . 11 1 1 A 41 41 VAL CA C 28 65.636 66.001 -0.365 1
1 304 . 11 1 1 A 41 41 VAL CB C 28 31.883 31.515 0.368 1
1 307 . 11 1 1 A 41 41 VAL N N 28 125.741 125.704 0.037 1
1 308 . 11 1 1 A 42 42 GLN H H 29 8.203 8.540 -0.337 1
1 309 . 11 1 1 A 42 42 GLN HA H 29 4.129 3.972 0.157 1
1 314 . 11 1 1 A 42 42 GLN C C 29 176.591 179.021 -2.430 1
1 315 . 11 1 1 A 42 42 GLN CA C 29 57.198 58.932 -1.734 1
1 316 . 11 1 1 A 42 42 GLN CB C 29 28.133 28.197 -0.064 1
1 318 . 11 1 1 A 42 42 GLN N N 29 116.452 118.716 -2.264 1
1 319 . 11 1 1 A 43 43 ALA H H 30 7.781 8.091 -0.310 1
1 320 . 11 1 1 A 43 43 ALA HA H 30 4.650 4.134 0.516 1
1 324 . 11 1 1 A 43 43 ALA C C 30 175.976 178.414 -2.438 1
1 325 . 11 1 1 A 43 43 ALA CA C 30 50.840 54.131 -3.291 1
1 326 . 11 1 1 A 43 43 ALA CB C 30 19.150 18.242 0.908 1
1 327 . 11 1 1 A 43 43 ALA N N 30 122.150 120.595 1.555 1
1 328 . 11 1 1 A 44 44 MET H H 31 7.739 7.998 -0.259 1
1 332 . 11 1 1 A 44 44 MET C C 31 178.275 177.585 0.690 1
1 333 . 11 1 1 A 44 44 MET CA C 31 55.323 55.357 -0.034 1
1 334 . 11 1 1 A 44 44 MET CB C 31 34.696 33.340 1.356 1
1 336 . 11 1 1 A 44 44 MET N N 31 118.149 115.514 2.635 1
1 337 . 11 1 1 A 45 45 GLY H H 32 7.611 8.292 -0.681 1
1 338 . 11 1 1 A 45 45 GLY N N 32 101.530 108.264 -6.734 1
1 339 . 11 1 1 A 47 47 ASN HA H 34 4.480 4.935 -0.455 1
1 342 . 11 1 1 A 47 47 ASN CA C 34 56.260 53.311 2.949 1
1 343 . 11 1 1 A 47 47 ASN CB C 34 39.384 38.697 0.687 1
1 344 . 11 1 1 A 49 49 MET HA H 36 4.646 4.659 -0.013 1
1 350 . 11 1 1 A 49 49 MET C C 36 173.651 176.298 -2.647 1
1 351 . 11 1 1 A 49 49 MET CA C 36 55.323 55.861 -0.538 1
1 352 . 11 1 1 A 49 49 MET CB C 36 35.633 33.148 2.485 1
1 355 . 11 1 1 A 50 50 GLU H H 37 9.203 8.304 0.899 1
1 356 . 11 1 1 A 50 50 GLU HA H 37 4.650 4.607 0.043 1
1 361 . 11 1 1 A 50 50 GLU C C 37 177.008 175.917 1.091 1
1 362 . 11 1 1 A 50 50 GLU CA C 37 54.385 55.700 -1.315 1
1 363 . 11 1 1 A 50 50 GLU CB C 37 33.758 33.288 0.470 1
1 365 . 11 1 1 A 50 50 GLU N N 37 123.229 120.756 2.473 1
1 366 . 11 1 1 A 51 51 ASP H H 38 9.032 8.803 0.229 1
1 367 . 11 1 1 A 51 51 ASP HA H 38 4.149 4.231 -0.082 1
1 370 . 11 1 1 A 51 51 ASP C C 38 177.994 177.866 0.128 1
1 371 . 11 1 1 A 51 51 ASP CA C 38 59.073 58.014 1.059 1
1 372 . 11 1 1 A 51 51 ASP CB C 38 43.134 40.759 2.375 1
1 373 . 11 1 1 A 51 51 ASP N N 38 122.717 125.295 -2.578 1
1 374 . 11 1 1 A 52 52 GLN H H 39 8.950 8.287 0.663 1
1 375 . 11 1 1 A 52 52 GLN HA H 39 3.940 3.938 0.002 1
1 378 . 11 1 1 A 52 52 GLN C C 39 177.817 178.693 -0.876 1
1 379 . 11 1 1 A 52 52 GLN CA C 39 59.073 59.203 -0.130 1
1 380 . 11 1 1 A 52 52 GLN CB C 39 28.133 28.186 -0.053 1
1 381 . 11 1 1 A 52 52 GLN N N 39 114.086 118.077 -3.991 1
1 382 . 11 1 1 A 53 53 ASP H H 40 7.214 7.983 -0.769 1
1 383 . 11 1 1 A 53 53 ASP HA H 40 4.370 4.504 -0.134 1
1 386 . 11 1 1 A 53 53 ASP C C 40 177.667 178.959 -1.292 1
1 387 . 11 1 1 A 53 53 ASP CA C 40 57.198 56.900 0.298 1
1 388 . 11 1 1 A 53 53 ASP CB C 40 41.800 40.860 0.940 1
1 389 . 11 1 1 A 53 53 ASP N N 40 118.734 120.101 -1.367 1
1 390 . 11 1 1 A 54 54 LEU H H 41 7.180 7.984 -0.804 1
1 391 . 11 1 1 A 54 54 LEU HA H 41 3.990 3.974 0.016 1
1 400 . 11 1 1 A 54 54 LEU C C 41 178.204 178.102 0.102 1
1 401 . 11 1 1 A 54 54 LEU CA C 41 56.260 57.967 -1.707 1
1 402 . 11 1 1 A 54 54 LEU CB C 41 41.259 41.518 -0.259 1
1 405 . 11 1 1 A 54 54 LEU N N 41 115.795 118.849 -3.054 1
1 406 . 11 1 1 A 55 55 LEU H H 42 7.823 7.753 0.070 1
1 407 . 11 1 1 A 55 55 LEU HA H 42 3.920 4.135 -0.215 1
1 416 . 11 1 1 A 55 55 LEU C C 42 180.876 178.289 2.587 1
1 417 . 11 1 1 A 55 55 LEU CA C 42 58.135 56.704 1.431 1
1 418 . 11 1 1 A 55 55 LEU CB C 42 42.196 42.738 -0.542 1
1 421 . 11 1 1 A 55 55 LEU N N 42 120.499 121.480 -0.981 1
1 422 . 11 1 1 A 56 56 GLU H H 43 8.127 8.302 -0.175 1
1 423 . 11 1 1 A 56 56 GLU HA H 43 3.966 4.117 -0.151 1
1 428 . 11 1 1 A 56 56 GLU C C 43 178.801 179.369 -0.568 1
1 429 . 11 1 1 A 56 56 GLU CA C 43 60.010 59.107 0.903 1
1 430 . 11 1 1 A 56 56 GLU CB C 43 29.070 29.361 -0.291 1
1 432 . 11 1 1 A 56 56 GLU N N 43 120.955 118.555 2.400 1
1 433 . 11 1 1 A 57 57 ILE H H 44 7.504 7.638 -0.134 1
1 434 . 11 1 1 A 57 57 ILE HA H 44 4.524 3.910 0.614 1
1 444 . 11 1 1 A 57 57 ILE C C 44 175.691 177.254 -1.563 1
1 445 . 11 1 1 A 57 57 ILE CA C 44 61.886 64.681 -2.795 1
1 446 . 11 1 1 A 57 57 ILE CB C 44 37.300 38.377 -1.077 1
1 450 . 11 1 1 A 57 57 ILE N N 44 109.594 118.422 -8.828 1
1 451 . 11 1 1 A 58 58 GLY H H 45 7.724 7.540 0.184 1
1 452 . 11 1 1 A 58 58 GLY HA2 H 45 3.650 4.201 -0.551 1
1 453 . 11 1 1 A 58 58 GLY HA3 H 45 4.530 4.330 0.200 1
1 454 . 11 1 1 A 58 58 GLY C C 45 174.613 174.533 0.080 1
1 455 . 11 1 1 A 58 58 GLY CA C 45 45.947 45.371 0.576 1
1 456 . 11 1 1 A 58 58 GLY N N 45 106.680 106.713 -0.033 1
1 457 . 11 1 1 A 59 59 ILE H H 46 8.180 8.053 0.127 1
1 458 . 11 1 1 A 59 59 ILE HA H 46 3.907 4.546 -0.639 1
1 468 . 11 1 1 A 59 59 ILE C C 46 174.235 176.475 -2.240 1
1 469 . 11 1 1 A 59 59 ILE CA C 46 60.948 60.026 0.922 1
1 470 . 11 1 1 A 59 59 ILE CB C 46 33.980 38.581 -4.601 1
1 474 . 11 1 1 A 59 59 ILE N N 46 122.454 120.032 2.422 1
1 475 . 11 1 1 A 60 60 LEU H H 47 7.367 7.742 -0.375 1
1 476 . 11 1 1 A 60 60 LEU HA H 47 3.900 3.984 -0.084 1
1 479 . 11 1 1 A 60 60 LEU C C 47 177.753 177.135 0.618 1
1 480 . 11 1 1 A 60 60 LEU CA C 47 56.260 57.950 -1.690 1
1 481 . 11 1 1 A 60 60 LEU CB C 47 42.196 41.801 0.395 1
1 482 . 11 1 1 A 60 60 LEU N N 47 125.835 124.485 1.350 1
1 483 . 11 1 1 A 63 63 GLY HA2 H 50 3.980 3.976 0.004 1
1 484 . 11 1 1 A 63 63 GLY HA3 H 50 3.950 3.984 -0.034 1
1 485 . 11 1 1 A 63 63 GLY C C 50 177.130 174.225 2.905 1
1 486 . 11 1 1 A 63 63 GLY CA C 50 46.884 45.469 1.415 1
1 487 . 11 1 1 A 64 64 HIS H H 51 7.926 7.339 0.587 1
1 488 . 11 1 1 A 64 64 HIS HA H 51 4.451 4.539 -0.088 1
1 493 . 11 1 1 A 64 64 HIS C C 51 177.613 176.930 0.683 1
1 494 . 11 1 1 A 64 64 HIS CA C 51 57.198 57.260 -0.062 1
1 495 . 11 1 1 A 64 64 HIS CB C 51 30.945 31.469 -0.524 1
1 498 . 11 1 1 A 64 64 HIS N N 51 122.284 120.216 2.068 1
1 499 . 11 1 1 A 65 65 ARG H H 52 8.105 8.395 -0.290 1
1 500 . 11 1 1 A 65 65 ARG HA H 52 3.685 3.679 0.006 1
1 507 . 11 1 1 A 65 65 ARG C C 52 177.769 179.142 -1.373 1
1 508 . 11 1 1 A 65 65 ARG CA C 52 61.886 59.645 2.241 1
1 509 . 11 1 1 A 65 65 ARG CB C 52 30.945 29.955 0.990 1
1 511 . 11 1 1 A 65 65 ARG N N 52 117.775 118.460 -0.685 1
1 513 . 11 1 1 A 66 66 GLN H H 53 8.090 8.180 -0.090 1
1 514 . 11 1 1 A 66 66 GLN HA H 53 3.940 4.027 -0.087 1
1 519 . 11 1 1 A 66 66 GLN C C 53 178.583 178.109 0.474 1
1 520 . 11 1 1 A 66 66 GLN CA C 53 59.073 58.971 0.102 1
1 521 . 11 1 1 A 66 66 GLN CB C 53 28.133 28.229 -0.096 1
1 523 . 11 1 1 A 66 66 GLN N N 53 116.452 119.010 -2.558 1
1 524 . 11 1 1 A 67 67 ARG H H 54 7.845 7.755 0.090 1
1 525 . 11 1 1 A 67 67 ARG HA H 54 4.010 3.997 0.013 1
1 528 . 11 1 1 A 67 67 ARG C C 54 179.766 178.784 0.982 1
1 529 . 11 1 1 A 67 67 ARG CA C 54 59.073 58.921 0.152 1
1 530 . 11 1 1 A 67 67 ARG CB C 54 30.720 29.896 0.824 1
1 532 . 11 1 1 A 67 67 ARG N N 54 119.275 119.816 -0.541 1
1 533 . 11 1 1 A 68 68 ILE H H 55 8.032 7.864 0.168 1
1 534 . 11 1 1 A 68 68 ILE HA H 55 3.495 3.458 0.037 1
1 544 . 11 1 1 A 68 68 ILE C C 55 177.108 178.015 -0.907 1
1 545 . 11 1 1 A 68 68 ILE CA C 55 66.230 65.595 0.635 1
1 546 . 11 1 1 A 68 68 ILE CB C 55 38.020 37.866 0.154 1
1 550 . 11 1 1 A 68 68 ILE N N 55 121.152 119.310 1.842 1
1 551 . 11 1 1 A 69 69 LEU H H 56 8.490 8.105 0.385 1
1 552 . 11 1 1 A 69 69 LEU HA H 56 4.010 3.802 0.208 1
1 561 . 11 1 1 A 69 69 LEU C C 56 179.917 178.940 0.977 1
1 562 . 11 1 1 A 69 69 LEU CA C 56 58.135 57.937 0.198 1
1 563 . 11 1 1 A 69 69 LEU CB C 56 41.259 41.751 -0.492 1
1 566 . 11 1 1 A 69 69 LEU N N 56 119.072 119.660 -0.588 1
1 567 . 11 1 1 A 70 70 GLN H H 57 8.327 8.560 -0.233 1
1 568 . 11 1 1 A 70 70 GLN HA H 57 4.100 3.924 0.176 1
1 573 . 11 1 1 A 70 70 GLN C C 57 178.798 177.927 0.871 1
1 574 . 11 1 1 A 70 70 GLN CA C 57 59.073 59.075 -0.002 1
1 575 . 11 1 1 A 70 70 GLN CB C 57 28.133 28.528 -0.395 1
1 577 . 11 1 1 A 70 70 GLN N N 57 118.172 118.250 -0.078 1
1 578 . 11 1 1 A 71 71 ALA H H 58 7.810 7.796 0.014 1
1 579 . 11 1 1 A 71 71 ALA HA H 58 4.320 4.086 0.234 1
1 583 . 11 1 1 A 71 71 ALA C C 58 172.232 180.013 -7.781 1
1 584 . 11 1 1 A 71 71 ALA CA C 58 55.323 55.178 0.145 1
1 585 . 11 1 1 A 71 71 ALA CB C 58 19.720 18.660 1.060 1
1 586 . 11 1 1 A 71 71 ALA N N 58 122.536 121.719 0.817 1
1 587 . 11 1 1 A 72 72 ILE H H 59 8.840 8.695 0.145 1
1 588 . 11 1 1 A 72 72 ILE HA H 59 4.030 3.698 0.332 1
1 598 . 11 1 1 A 72 72 ILE C C 59 178.678 178.248 0.430 1
1 599 . 11 1 1 A 72 72 ILE CA C 59 64.698 65.171 -0.473 1
1 600 . 11 1 1 A 72 72 ILE CB C 59 37.850 37.665 0.185 1
1 604 . 11 1 1 A 72 72 ILE N N 59 118.111 117.700 0.411 1
1 605 . 11 1 1 A 73 73 GLN H H 60 7.547 8.807 -1.260 1
1 606 . 11 1 1 A 73 73 GLN HA H 60 4.121 4.165 -0.044 1
1 611 . 11 1 1 A 73 73 GLN C C 60 176.556 177.928 -1.372 1
1 612 . 11 1 1 A 73 73 GLN CA C 60 58.135 58.310 -0.175 1
1 613 . 11 1 1 A 73 73 GLN CB C 60 28.300 27.650 0.650 1
1 615 . 11 1 1 A 73 73 GLN N N 60 119.094 120.620 -1.526 1
1 616 . 11 1 1 A 74 74 LEU H H 61 7.350 7.799 -0.449 1
1 617 . 11 1 1 A 74 74 LEU HA H 61 4.408 4.192 0.216 1
1 626 . 11 1 1 A 74 74 LEU C C 61 177.960 177.245 0.715 1
1 627 . 11 1 1 A 74 74 LEU CA C 61 54.900 56.823 -1.923 1
1 628 . 11 1 1 A 74 74 LEU CB C 61 42.196 42.229 -0.033 1
1 631 . 11 1 1 A 74 74 LEU N N 61 115.853 120.515 -4.662 1
1 632 . 11 1 1 A 75 75 LEU H H 62 7.358 7.517 -0.159 1
1 633 . 11 1 1 A 75 75 LEU HA H 62 4.530 4.439 0.091 1
1 642 . 11 1 1 A 75 75 LEU C C 62 177.035 174.828 2.207 1
1 643 . 11 1 1 A 75 75 LEU CA C 62 53.200 53.932 -0.732 1
1 644 . 11 1 1 A 75 75 LEU CB C 62 40.700 41.241 -0.541 1
1 647 . 11 1 1 A 75 75 LEU N N 62 121.010 122.584 -1.574 1
1 648 . 11 1 1 A 76 76 PRO HA H 63 4.382 4.637 -0.255 1
1 655 . 11 1 1 A 76 76 PRO CB C 63 31.883 33.253 -1.370 1
1 657 . 11 1 1 A 77 77 LYS H H 64 8.418 8.623 -0.205 1
1 658 . 11 1 1 A 77 77 LYS HA H 64 4.140 4.871 -0.731 1
1 663 . 11 1 1 A 77 77 LYS C C 64 177.122 175.150 1.972 1
1 664 . 11 1 1 A 77 77 LYS CA C 64 56.260 55.304 0.956 1
1 665 . 11 1 1 A 77 77 LYS CB C 64 33.340 34.083 -0.743 1
1 668 . 11 1 1 A 77 77 LYS N N 64 121.932 120.583 1.349 1
1 669 . 11 1 1 A 78 78 MET H H 65 8.550 8.723 -0.173 1
1 670 . 11 1 1 A 78 78 MET HA H 65 4.304 5.236 -0.932 1
1 676 . 11 1 1 A 78 78 MET C C 65 176.105 175.546 0.559 1
1 677 . 11 1 1 A 78 78 MET CA C 65 56.260 54.025 2.235 1
1 678 . 11 1 1 A 78 78 MET CB C 65 32.821 37.356 -4.535 1
1 680 . 11 1 1 A 78 78 MET N N 65 123.498 123.500 -0.002 1
1 681 . 11 1 1 A 79 79 ARG H H 66 8.731 8.320 0.411 1
1 682 . 11 1 1 A 79 79 ARG C C 66 173.577 175.568 -1.991 1
1 683 . 11 1 1 A 79 79 ARG CA C 66 53.447 55.251 -1.804 1
1 684 . 11 1 1 A 79 79 ARG CB C 66 30.008 30.427 -0.419 1
1 685 . 11 1 1 A 79 79 ARG N N 66 127.355 121.808 5.547 1
1 686 . 11 1 1 A 80 80 PRO HA H 67 4.780 4.642 0.138 1
1 693 . 11 1 1 A 80 80 PRO C C 67 177.043 176.108 0.935 1
1 694 . 11 1 1 A 80 80 PRO CA C 67 61.886 62.262 -0.376 1
1 695 . 11 1 1 A 80 80 PRO CB C 67 32.821 32.843 -0.022 1
1 698 . 11 1 1 A 81 81 ILE H H 68 8.580 8.288 0.292 1
1 699 . 11 1 1 A 81 81 ILE HA H 68 4.040 4.665 -0.625 1
1 709 . 11 1 1 A 81 81 ILE C C 68 176.831 175.590 1.241 1
1 710 . 11 1 1 A 81 81 ILE CA C 68 62.823 58.735 4.088 1
1 711 . 11 1 1 A 81 81 ILE CB C 68 38.580 40.927 -2.347 1
1 715 . 11 1 1 A 81 81 ILE N N 68 118.491 116.959 1.532 1
1 716 . 11 1 1 A 82 82 GLY H H 69 8.602 8.107 0.495 1
1 717 . 11 1 1 A 82 82 GLY CA C 69 45.009 44.451 0.558 1
1 718 . 11 1 1 A 82 82 GLY N N 69 111.377 110.345 1.032 1
1 721 . 11 1 1 A 84 84 ASP HA H 71 4.490 5.432 -0.942 1
1 724 . 11 1 1 A 84 84 ASP CA C 71 54.385 52.927 1.458 1
1 725 . 11 1 1 A 84 84 ASP CB C 71 40.321 45.117 -4.796 1
1 726 . 11 1 1 A 85 85 GLY H H 72 8.054 8.574 -0.520 1
1 727 . 11 1 1 A 85 85 GLY HA2 H 72 4.040 4.221 -0.181 1
1 728 . 11 1 1 A 85 85 GLY HA3 H 72 3.750 4.227 -0.477 1
1 729 . 11 1 1 A 85 85 GLY C C 72 173.474 172.311 1.163 1
1 730 . 11 1 1 A 85 85 GLY CA C 72 45.009 45.600 -0.591 1
1 731 . 11 1 1 A 85 85 GLY N N 72 108.038 106.493 1.545 1
1 732 . 11 1 1 A 86 86 ALA H H 73 7.858 8.851 -0.993 1
1 733 . 11 1 1 A 86 86 ALA HA H 73 4.370 5.205 -0.835 1
1 737 . 11 1 1 A 86 86 ALA CA C 73 51.990 51.148 0.842 1
1 738 . 11 1 1 A 86 86 ALA CB C 73 19.220 22.893 -3.673 1
1 739 . 11 1 1 A 86 86 ALA N N 73 123.819 125.544 -1.725 1
1 742 . 11 1 1 A 90 90 SER H H 77 7.839 7.935 -0.096 1
1 743 . 11 1 1 A 90 90 SER HA H 77 4.770 4.903 -0.133 1
1 746 . 11 1 1 A 90 90 SER N N 77 115.163 114.391 0.772 1
1 747 . 11 1 1 A 91 91 VAL H H 78 8.578 9.026 -0.448 1
1 748 . 11 1 1 A 91 91 VAL HA H 78 3.981 3.891 0.090 1
1 756 . 11 1 1 A 91 91 VAL C C 78 177.480 177.490 -0.010 1
1 757 . 11 1 1 A 91 91 VAL CA C 78 67.060 66.118 0.942 1
1 758 . 11 1 1 A 91 91 VAL CB C 78 32.500 31.789 0.711 1
1 761 . 11 1 1 A 91 91 VAL N N 78 123.481 123.293 0.188 1
1 762 . 11 1 1 A 92 92 ALA H H 79 8.607 8.354 0.253 1
1 763 . 11 1 1 A 92 92 ALA HA H 79 4.113 4.238 -0.125 1
1 767 . 11 1 1 A 92 92 ALA C C 79 179.868 180.092 -0.224 1
1 768 . 11 1 1 A 92 92 ALA CA C 79 54.890 55.782 -0.892 1
1 769 . 11 1 1 A 92 92 ALA CB C 79 18.790 18.208 0.582 1
1 770 . 11 1 1 A 92 92 ALA N N 79 120.334 121.617 -1.283 1
1 771 . 11 1 1 A 93 93 GLU H H 80 7.886 8.210 -0.324 1
1 772 . 11 1 1 A 93 93 GLU HA H 80 4.010 4.146 -0.136 1
1 777 . 11 1 1 A 93 93 GLU C C 80 179.719 178.278 1.441 1
1 778 . 11 1 1 A 93 93 GLU CA C 80 59.073 58.330 0.743 1
1 779 . 11 1 1 A 93 93 GLU CB C 80 30.630 29.264 1.366 1
1 781 . 11 1 1 A 93 93 GLU N N 80 117.643 117.520 0.123 1
1 782 . 11 1 1 A 94 94 TRP H H 81 8.299 8.012 0.287 1
1 783 . 11 1 1 A 94 94 TRP HA H 81 4.251 4.228 0.023 1
1 792 . 11 1 1 A 94 94 TRP C C 81 178.772 177.737 1.035 1
1 793 . 11 1 1 A 94 94 TRP CA C 81 60.010 60.484 -0.474 1
1 794 . 11 1 1 A 94 94 TRP CB C 81 27.650 29.458 -1.808 1
1 800 . 11 1 1 A 94 94 TRP N N 81 122.545 123.649 -1.104 1
1 802 . 11 1 1 A 95 95 LEU H H 82 8.505 8.002 0.503 1
1 803 . 11 1 1 A 95 95 LEU HA H 82 2.880 3.555 -0.675 1
1 812 . 11 1 1 A 95 95 LEU C C 82 180.235 177.839 2.396 1
1 813 . 11 1 1 A 95 95 LEU CA C 82 57.400 56.254 1.146 1
1 814 . 11 1 1 A 95 95 LEU CB C 82 40.321 41.841 -1.520 1
1 817 . 11 1 1 A 95 95 LEU N N 82 121.110 119.195 1.915 1
1 818 . 11 1 1 A 96 96 ASP H H 83 8.185 8.124 0.061 1
1 819 . 11 1 1 A 96 96 ASP HA H 83 4.280 4.441 -0.161 1
1 822 . 11 1 1 A 96 96 ASP C C 83 175.224 176.858 -1.634 1
1 823 . 11 1 1 A 96 96 ASP CA C 83 57.310 55.480 1.830 1
1 824 . 11 1 1 A 96 96 ASP CB C 83 40.321 40.596 -0.275 1
1 825 . 11 1 1 A 96 96 ASP N N 83 119.082 119.799 -0.717 1
1 826 . 11 1 1 A 97 97 SER H H 84 7.989 8.073 -0.084 1
1 827 . 11 1 1 A 97 97 SER HA H 84 4.250 4.619 -0.369 1
1 830 . 11 1 1 A 97 97 SER C C 84 175.346 175.164 0.182 1
1 831 . 11 1 1 A 97 97 SER CA C 84 60.948 57.481 3.467 1
1 832 . 11 1 1 A 97 97 SER CB C 84 63.370 63.519 -0.149 1
1 833 . 11 1 1 A 97 97 SER N N 84 117.579 113.891 3.688 1
1 834 . 11 1 1 A 98 98 ILE H H 85 6.862 7.098 -0.236 1
1 835 . 11 1 1 A 98 98 ILE HA H 85 4.550 3.997 0.553 1
1 843 . 11 1 1 A 98 98 ILE C C 85 173.308 176.108 -2.800 1
1 844 . 11 1 1 A 98 98 ILE CA C 85 60.948 62.538 -1.590 1
1 845 . 11 1 1 A 98 98 ILE CB C 85 37.760 38.801 -1.041 1
1 848 . 11 1 1 A 98 98 ILE N N 85 113.733 120.142 -6.409 1
1 849 . 11 1 1 A 99 99 GLU H H 86 7.705 7.207 0.498 1
1 850 . 11 1 1 A 99 99 GLU HA H 86 4.280 4.574 -0.294 1
1 853 . 11 1 1 A 99 99 GLU C C 86 175.224 175.512 -0.288 1
1 854 . 11 1 1 A 99 99 GLU CA C 86 56.260 57.860 -1.600 1
1 855 . 11 1 1 A 99 99 GLU CB C 86 26.258 32.319 -6.061 1
1 857 . 11 1 1 A 99 99 GLU N N 86 115.493 116.374 -0.881 1
1 858 . 11 1 1 A 100 100 LEU H H 87 7.989 7.490 0.499 1
1 859 . 11 1 1 A 100 100 LEU HA H 87 4.220 4.708 -0.488 1
1 868 . 11 1 1 A 100 100 LEU C C 87 176.965 176.603 0.362 1
1 869 . 11 1 1 A 100 100 LEU CA C 87 52.510 52.886 -0.376 1
1 870 . 11 1 1 A 100 100 LEU CB C 87 42.196 44.953 -2.757 1
1 873 . 11 1 1 A 100 100 LEU N N 87 117.579 115.784 1.795 1
1 874 . 11 1 1 A 101 101 GLY H H 88 8.503 8.639 -0.136 1
1 875 . 11 1 1 A 101 101 GLY CA C 88 46.884 45.390 1.494 1
1 876 . 11 1 1 A 101 101 GLY N N 88 107.794 108.876 -1.082 1
1 877 . 11 1 1 A 102 102 ASP HA H 89 4.431 4.263 0.168 1
1 880 . 11 1 1 A 102 102 ASP C C 89 178.075 178.172 -0.097 1
1 881 . 11 1 1 A 102 102 ASP CA C 89 57.198 57.117 0.081 1
1 882 . 11 1 1 A 102 102 ASP CB C 89 40.321 41.403 -1.082 1
1 883 . 11 1 1 A 103 103 TYR H H 90 7.899 8.171 -0.272 1
1 884 . 11 1 1 A 103 103 TYR HA H 90 4.940 4.416 0.524 1
1 889 . 11 1 1 A 103 103 TYR C C 90 175.527 178.464 -2.937 1
1 890 . 11 1 1 A 103 103 TYR CA C 90 58.135 60.486 -2.351 1
1 891 . 11 1 1 A 103 103 TYR CB C 90 38.446 37.795 0.651 1
1 894 . 11 1 1 A 103 103 TYR N N 90 115.595 119.510 -3.915 1
1 895 . 11 1 1 A 104 104 THR H H 91 7.971 8.342 -0.371 1
1 896 . 11 1 1 A 104 104 THR HA H 91 4.234 4.078 0.156 1
1 901 . 11 1 1 A 104 104 THR C C 91 175.905 176.623 -0.718 1
1 902 . 11 1 1 A 104 104 THR CA C 91 68.449 67.010 1.439 1
1 904 . 11 1 1 A 104 104 THR N N 91 118.867 116.442 2.425 1
1 905 . 11 1 1 A 105 105 LYS H H 92 8.555 8.010 0.545 1
1 906 . 11 1 1 A 105 105 LYS HA H 92 3.940 4.070 -0.130 1
1 912 . 11 1 1 A 105 105 LYS C C 92 177.310 178.613 -1.303 1
1 913 . 11 1 1 A 105 105 LYS CA C 92 60.948 59.463 1.485 1
1 914 . 11 1 1 A 105 105 LYS CB C 92 31.883 32.562 -0.679 1
1 917 . 11 1 1 A 105 105 LYS N N 92 119.259 121.023 -1.764 1
1 918 . 11 1 1 A 106 106 ALA H H 93 7.920 8.145 -0.225 1
1 919 . 11 1 1 A 106 106 ALA HA H 93 4.128 4.164 -0.036 1
1 923 . 11 1 1 A 106 106 ALA C C 93 180.972 180.485 0.487 1
1 924 . 11 1 1 A 106 106 ALA CA C 93 55.070 55.096 -0.026 1
1 925 . 11 1 1 A 106 106 ALA CB C 93 17.750 18.648 -0.898 1
1 926 . 11 1 1 A 106 106 ALA N N 93 120.398 121.817 -1.419 1
1 927 . 11 1 1 A 107 107 PHE H H 94 8.136 8.512 -0.376 1
1 928 . 11 1 1 A 107 107 PHE HA H 94 4.190 4.641 -0.451 1
1 934 . 11 1 1 A 107 107 PHE C C 94 177.955 178.308 -0.353 1
1 935 . 11 1 1 A 107 107 PHE CA C 94 63.761 61.609 2.152 1
1 936 . 11 1 1 A 107 107 PHE CB C 94 38.446 39.217 -0.771 1
1 940 . 11 1 1 A 107 107 PHE N N 94 117.119 116.210 0.909 1
1 941 . 11 1 1 A 108 108 LEU H H 95 8.351 8.686 -0.335 1
1 942 . 11 1 1 A 108 108 LEU HA H 95 3.889 3.980 -0.091 1
1 951 . 11 1 1 A 108 108 LEU C C 95 182.043 179.185 2.858 1
1 952 . 11 1 1 A 108 108 LEU CA C 95 59.073 58.557 0.516 1
1 953 . 11 1 1 A 108 108 LEU CB C 95 41.259 41.995 -0.736 1
1 956 . 11 1 1 A 108 108 LEU N N 95 118.450 119.795 -1.345 1
1 957 . 11 1 1 A 109 109 ILE H H 96 8.992 8.124 0.868 1
1 958 . 11 1 1 A 109 109 ILE HA H 96 4.069 3.855 0.214 1
1 968 . 11 1 1 A 109 109 ILE C C 96 177.094 177.820 -0.726 1
1 969 . 11 1 1 A 109 109 ILE CA C 96 63.761 64.291 -0.530 1
1 970 . 11 1 1 A 109 109 ILE CB C 96 37.509 37.700 -0.191 1
1 974 . 11 1 1 A 109 109 ILE N N 96 118.177 115.023 3.154 1
1 975 . 11 1 1 A 110 110 ASN H H 97 7.067 8.092 -1.025 1
1 976 . 11 1 1 A 110 110 ASN HA H 97 4.797 4.641 0.156 1
1 981 . 11 1 1 A 110 110 ASN C C 97 173.595 175.375 -1.780 1
1 982 . 11 1 1 A 110 110 ASN CA C 97 54.385 53.617 0.768 1
1 983 . 11 1 1 A 110 110 ASN CB C 97 40.321 38.832 1.489 1
1 984 . 11 1 1 A 110 110 ASN N N 97 116.407 119.740 -3.333 1
1 986 . 11 1 1 A 111 111 GLY H H 98 7.681 7.986 -0.305 1
1 987 . 11 1 1 A 111 111 GLY HA2 H 98 4.080 3.938 0.142 1
1 988 . 11 1 1 A 111 111 GLY HA3 H 98 3.640 4.033 -0.393 1
1 989 . 11 1 1 A 111 111 GLY C C 98 174.552 174.079 0.473 1
1 990 . 11 1 1 A 111 111 GLY CA C 98 45.947 44.940 1.007 1
1 991 . 11 1 1 A 111 111 GLY N N 98 104.440 105.739 -1.299 1
1 992 . 11 1 1 A 112 112 TYR H H 99 8.427 8.332 0.095 1
1 993 . 11 1 1 A 112 112 TYR HA H 99 4.661 4.760 -0.099 1
1 998 . 11 1 1 A 112 112 TYR C C 99 174.425 175.380 -0.955 1
1 999 . 11 1 1 A 112 112 TYR CA C 99 57.198 57.580 -0.382 1
1 1000 . 11 1 1 A 112 112 TYR CB C 99 36.571 37.959 -1.388 1
1 1003 . 11 1 1 A 112 112 TYR N N 99 122.830 120.097 2.733 1
1 1004 . 11 1 1 A 113 113 THR H H 100 7.166 8.727 -1.561 1
1 1005 . 11 1 1 A 113 113 THR HA H 100 4.248 4.595 -0.347 1
1 1009 . 11 1 1 A 113 113 THR C C 100 174.897 174.419 0.478 1
1 1010 . 11 1 1 A 113 113 THR CA C 100 62.290 63.242 -0.952 1
1 1011 . 11 1 1 A 113 113 THR CB C 100 68.970 70.556 -1.586 1
1 1013 . 11 1 1 A 113 113 THR N N 100 104.304 119.905 -15.601 1
1 1014 . 11 1 1 A 114 114 SER H H 101 7.695 7.885 -0.190 1
1 1015 . 11 1 1 A 114 114 SER C C 101 174.372 173.888 0.484 1
1 1016 . 11 1 1 A 114 114 SER CA C 101 56.260 57.346 -1.086 1
1 1017 . 11 1 1 A 114 114 SER CB C 101 65.636 65.559 0.077 1
1 1018 . 11 1 1 A 114 114 SER N N 101 115.613 115.744 -0.131 1
1 1023 . 11 1 1 A 116 116 ASP HA H 103 4.260 4.297 -0.037 1
1 1026 . 11 1 1 A 116 116 ASP CA C 103 57.198 57.448 -0.250 1
1 1027 . 11 1 1 A 116 116 ASP CB C 103 40.321 42.171 -1.850 1
1 1028 . 11 1 1 A 117 117 LEU H H 104 7.345 8.111 -0.766 1
1 1029 . 11 1 1 A 117 117 LEU HA H 104 4.290 3.923 0.367 1
1 1038 . 11 1 1 A 117 117 LEU C C 104 178.488 178.842 -0.354 1
1 1039 . 11 1 1 A 117 117 LEU CA C 104 56.260 58.312 -2.052 1
1 1040 . 11 1 1 A 117 117 LEU CB C 104 42.196 41.411 0.785 1
1 1043 . 11 1 1 A 117 117 LEU N N 104 117.878 119.459 -1.581 1
1 1044 . 11 1 1 A 118 118 LEU H H 105 7.514 8.314 -0.800 1
1 1045 . 11 1 1 A 118 118 LEU HA H 105 4.210 4.113 0.097 1
1 1054 . 11 1 1 A 118 118 LEU C C 105 177.002 177.471 -0.469 1
1 1055 . 11 1 1 A 118 118 LEU CA C 105 55.323 57.018 -1.695 1
1 1056 . 11 1 1 A 118 118 LEU CB C 105 42.196 41.244 0.952 1
1 1059 . 11 1 1 A 118 118 LEU N N 105 119.094 119.595 -0.501 1
1 1060 . 11 1 1 A 120 120 LYS HA H 107 4.340 4.292 0.048 1
1 1063 . 11 1 1 A 120 120 LYS C C 107 176.603 176.049 0.554 1
1 1064 . 11 1 1 A 120 120 LYS CA C 107 55.323 58.145 -2.822 1
1 1065 . 11 1 1 A 120 120 LYS CB C 107 31.883 32.926 -1.043 1
1 1068 . 11 1 1 A 121 121 ILE H H 108 7.539 7.494 0.045 1
1 1069 . 11 1 1 A 121 121 ILE HA H 108 3.987 4.381 -0.394 1
1 1079 . 11 1 1 A 121 121 ILE C C 108 173.247 176.049 -2.802 1
1 1080 . 11 1 1 A 121 121 ILE CA C 108 62.823 60.053 2.770 1
1 1081 . 11 1 1 A 121 121 ILE CB C 108 38.446 39.492 -1.046 1
1 1085 . 11 1 1 A 121 121 ILE N N 108 122.417 116.203 6.214 1
1 1086 . 11 1 1 A 122 122 ALA H H 109 8.290 8.366 -0.076 1
1 1087 . 11 1 1 A 122 122 ALA HA H 109 3.970 4.637 -0.667 1
1 1091 . 11 1 1 A 122 122 ALA C C 109 178.318 177.742 0.576 1
1 1092 . 11 1 1 A 122 122 ALA CA C 109 50.150 49.807 0.343 1
1 1093 . 11 1 1 A 122 122 ALA CB C 109 21.630 20.831 0.799 1
1 1094 . 11 1 1 A 122 122 ALA N N 109 127.784 125.482 2.302 1
1 1095 . 11 1 1 A 123 123 GLU HA H 110 3.707 3.945 -0.238 1
1 1099 . 11 1 1 A 123 123 GLU C C 110 178.290 178.393 -0.103 1
1 1100 . 11 1 1 A 123 123 GLU CA C 110 60.948 60.299 0.649 1
1 1101 . 11 1 1 A 123 123 GLU CB C 110 29.070 29.917 -0.847 1
1 1102 . 11 1 1 A 124 124 VAL H H 111 8.333 8.319 0.014 1
1 1103 . 11 1 1 A 124 124 VAL HA H 111 3.850 3.759 0.091 1
1 1111 . 11 1 1 A 124 124 VAL C C 111 177.406 177.553 -0.147 1
1 1112 . 11 1 1 A 124 124 VAL CA C 111 65.636 65.093 0.543 1
1 1113 . 11 1 1 A 124 124 VAL CB C 111 30.730 31.205 -0.475 1
1 1116 . 11 1 1 A 124 124 VAL N N 111 114.438 118.739 -4.301 1
1 1117 . 11 1 1 A 125 125 GLU H H 112 7.442 8.346 -0.904 1
1 1118 . 11 1 1 A 125 125 GLU HA H 112 4.152 4.088 0.064 1
1 1123 . 11 1 1 A 125 125 GLU C C 112 179.982 179.303 0.679 1
1 1124 . 11 1 1 A 125 125 GLU CA C 112 60.010 59.502 0.508 1
1 1125 . 11 1 1 A 125 125 GLU CB C 112 30.008 29.201 0.807 1
1 1127 . 11 1 1 A 125 125 GLU N N 112 121.032 121.932 -0.900 1
1 1128 . 11 1 1 A 126 126 LEU H H 113 7.666 7.859 -0.193 1
1 1129 . 11 1 1 A 126 126 LEU HA H 113 3.846 4.038 -0.192 1
1 1138 . 11 1 1 A 126 126 LEU C C 113 176.991 178.933 -1.942 1
1 1139 . 11 1 1 A 126 126 LEU CA C 113 58.135 57.910 0.225 1
1 1140 . 11 1 1 A 126 126 LEU CB C 113 41.259 41.758 -0.499 1
1 1143 . 11 1 1 A 126 126 LEU N N 113 118.731 121.125 -2.394 1
1 1144 . 11 1 1 A 127 127 ILE H H 114 7.781 8.081 -0.300 1
1 1145 . 11 1 1 A 127 127 ILE HA H 114 3.502 3.872 -0.370 1
1 1153 . 11 1 1 A 127 127 ILE C C 114 178.195 176.882 1.313 1
1 1154 . 11 1 1 A 127 127 ILE CA C 114 65.636 63.267 2.369 1
1 1155 . 11 1 1 A 127 127 ILE CB C 114 40.321 37.622 2.699 1
1 1159 . 11 1 1 A 127 127 ILE N N 114 115.084 119.615 -4.531 1
1 1160 . 11 1 1 A 128 128 ASN H H 115 8.470 8.033 0.437 1
1 1161 . 11 1 1 A 128 128 ASN HA H 115 4.502 4.749 -0.247 1
1 1166 . 11 1 1 A 128 128 ASN C C 115 176.295 175.964 0.331 1
1 1167 . 11 1 1 A 128 128 ASN CA C 115 56.260 54.656 1.604 1
1 1168 . 11 1 1 A 128 128 ASN CB C 115 39.384 39.188 0.196 1
1 1169 . 11 1 1 A 128 128 ASN N N 115 115.158 119.161 -4.003 1
1 1171 . 11 1 1 A 129 129 VAL H H 116 8.116 7.822 0.294 1
1 1172 . 11 1 1 A 129 129 VAL HA H 116 4.090 3.975 0.115 1
1 1180 . 11 1 1 A 129 129 VAL C C 116 176.740 177.506 -0.766 1
1 1181 . 11 1 1 A 129 129 VAL CA C 116 64.400 64.627 -0.227 1
1 1182 . 11 1 1 A 129 129 VAL CB C 116 32.050 32.376 -0.326 1
1 1185 . 11 1 1 A 129 129 VAL N N 116 118.698 118.013 0.685 1
1 1186 . 11 1 1 A 130 130 LEU H H 117 7.294 7.910 -0.616 1
1 1187 . 11 1 1 A 130 130 LEU HA H 117 3.970 4.123 -0.153 1
1 1196 . 11 1 1 A 130 130 LEU C C 117 175.127 176.192 -1.065 1
1 1197 . 11 1 1 A 130 130 LEU CA C 117 56.260 55.116 1.144 1
1 1198 . 11 1 1 A 130 130 LEU CB C 117 41.259 42.060 -0.801 1
1 1201 . 11 1 1 A 130 130 LEU N N 117 116.201 118.884 -2.683 1
1 1202 . 11 1 1 A 131 131 LYS H H 118 6.594 7.868 -1.274 1
1 1203 . 11 1 1 A 131 131 LYS HA H 118 3.980 4.177 -0.197 1
1 1208 . 11 1 1 A 131 131 LYS C C 118 175.589 175.316 0.273 1
1 1209 . 11 1 1 A 131 131 LYS CA C 118 56.260 57.522 -1.262 1
1 1210 . 11 1 1 A 131 131 LYS CB C 118 28.133 29.512 -1.379 1
1 1212 . 11 1 1 A 131 131 LYS N N 118 111.172 115.847 -4.675 1
1 1213 . 11 1 1 A 132 132 ILE H H 119 8.245 7.952 0.293 1
1 1214 . 11 1 1 A 132 132 ILE HA H 119 4.090 4.508 -0.418 1
1 1224 . 11 1 1 A 132 132 ILE C C 119 175.161 175.467 -0.306 1
1 1225 . 11 1 1 A 132 132 ILE CA C 119 60.010 60.989 -0.979 1
1 1226 . 11 1 1 A 132 132 ILE CB C 119 35.633 37.159 -1.526 1
1 1230 . 11 1 1 A 132 132 ILE N N 119 119.484 119.999 -0.515 1
1 1231 . 11 1 1 A 133 133 ASN H H 120 8.054 8.687 -0.633 1
1 1232 . 11 1 1 A 133 133 ASN HA H 120 4.350 4.895 -0.545 1
1 1235 . 11 1 1 A 133 133 ASN C C 120 175.136 175.588 -0.452 1
1 1236 . 11 1 1 A 133 133 ASN CA C 120 54.385 54.482 -0.097 1
1 1237 . 11 1 1 A 133 133 ASN CB C 120 39.384 39.783 -0.399 1
1 1238 . 11 1 1 A 133 133 ASN N N 120 124.670 126.269 -1.599 1
1 1239 . 11 1 1 A 134 134 LEU H H 121 7.517 7.371 0.146 1
1 1240 . 11 1 1 A 134 134 LEU HA H 121 4.678 4.087 0.591 1
1 1249 . 11 1 1 A 134 134 LEU C C 121 178.051 177.641 0.410 1
1 1250 . 11 1 1 A 134 134 LEU CA C 121 53.447 55.999 -2.552 1
1 1251 . 11 1 1 A 134 134 LEU CB C 121 41.259 42.864 -1.605 1
1 1254 . 11 1 1 A 134 134 LEU N N 121 119.918 119.471 0.447 1
1 1255 . 11 1 1 A 135 135 ILE H H 122 9.389 8.611 0.778 1
1 1256 . 11 1 1 A 135 135 ILE HA H 122 3.540 3.705 -0.165 1
1 1266 . 11 1 1 A 135 135 ILE C C 122 176.425 177.610 -1.185 1
1 1267 . 11 1 1 A 135 135 ILE CA C 122 65.636 65.255 0.381 1
1 1268 . 11 1 1 A 135 135 ILE CB C 122 38.446 38.054 0.392 1
1 1272 . 11 1 1 A 135 135 ILE N N 122 129.949 126.584 3.365 1
1 1273 . 11 1 1 A 136 136 GLY H H 123 8.675 8.254 0.421 1
1 1274 . 11 1 1 A 136 136 GLY HA2 H 123 2.650 3.168 -0.518 1
1 1275 . 11 1 1 A 136 136 GLY HA3 H 123 2.060 3.549 -1.489 1
1 1276 . 11 1 1 A 136 136 GLY C C 123 176.854 176.307 0.547 1
1 1277 . 11 1 1 A 136 136 GLY CA C 123 45.500 47.078 -1.578 1
1 1278 . 11 1 1 A 136 136 GLY N N 123 106.314 108.039 -1.725 1
1 1279 . 11 1 1 A 137 137 HIS H H 124 6.869 7.777 -0.908 1
1 1280 . 11 1 1 A 137 137 HIS HA H 124 4.558 4.495 0.063 1
1 1285 . 11 1 1 A 137 137 HIS C C 124 176.977 177.376 -0.399 1
1 1286 . 11 1 1 A 137 137 HIS CA C 124 57.198 58.532 -1.334 1
1 1287 . 11 1 1 A 137 137 HIS CB C 124 30.945 29.738 1.207 1
1 1290 . 11 1 1 A 137 137 HIS N N 124 118.865 120.159 -1.294 1
1 1291 . 11 1 1 A 138 138 ARG H H 125 7.730 8.200 -0.470 1
1 1292 . 11 1 1 A 138 138 ARG HA H 125 3.770 3.871 -0.101 1
1 1299 . 11 1 1 A 138 138 ARG C C 125 178.288 178.396 -0.108 1
1 1300 . 11 1 1 A 138 138 ARG CA C 125 61.886 59.455 2.431 1
1 1301 . 11 1 1 A 138 138 ARG CB C 125 30.945 29.978 0.967 1
1 1304 . 11 1 1 A 138 138 ARG N N 125 118.149 119.462 -1.313 1
1 1306 . 11 1 1 A 139 139 LYS H H 126 8.679 8.308 0.371 1
1 1307 . 11 1 1 A 139 139 LYS HA H 126 3.990 3.947 0.043 1
1 1310 . 11 1 1 A 139 139 LYS C C 126 179.184 178.243 0.941 1
1 1311 . 11 1 1 A 139 139 LYS CA C 126 58.135 59.461 -1.326 1
1 1312 . 11 1 1 A 139 139 LYS CB C 126 30.945 32.182 -1.237 1
1 1314 . 11 1 1 A 139 139 LYS N N 126 114.003 119.012 -5.009 1
1 1315 . 11 1 1 A 140 140 ARG H H 127 7.248 8.123 -0.875 1
1 1316 . 11 1 1 A 140 140 ARG HA H 127 3.870 3.904 -0.034 1
1 1324 . 11 1 1 A 140 140 ARG C C 127 177.772 178.700 -0.928 1
1 1325 . 11 1 1 A 140 140 ARG CA C 127 60.010 59.290 0.720 1
1 1326 . 11 1 1 A 140 140 ARG CB C 127 30.945 29.904 1.041 1
1 1329 . 11 1 1 A 140 140 ARG N N 127 120.072 118.059 2.013 1
1 1331 . 11 1 1 A 141 141 ILE H H 128 7.706 7.791 -0.085 1
1 1332 . 11 1 1 A 141 141 ILE HA H 128 3.530 3.800 -0.270 1
1 1340 . 11 1 1 A 141 141 ILE C C 128 177.669 178.328 -0.659 1
1 1341 . 11 1 1 A 141 141 ILE CA C 128 65.636 64.380 1.256 1
1 1342 . 11 1 1 A 141 141 ILE CB C 128 38.680 37.346 1.334 1
1 1345 . 11 1 1 A 141 141 ILE N N 128 118.730 116.760 1.970 1
1 1346 . 11 1 1 A 142 142 LEU H H 129 8.194 8.243 -0.049 1
1 1347 . 11 1 1 A 142 142 LEU HA H 129 3.950 3.975 -0.025 1
1 1356 . 11 1 1 A 142 142 LEU C C 129 179.960 179.048 0.912 1
1 1357 . 11 1 1 A 142 142 LEU CA C 129 58.135 57.997 0.138 1
1 1358 . 11 1 1 A 142 142 LEU CB C 129 41.259 41.543 -0.284 1
1 1361 . 11 1 1 A 142 142 LEU N N 129 117.675 121.405 -3.730 1
1 1362 . 11 1 1 A 143 143 ALA H H 130 8.294 8.774 -0.480 1
1 1363 . 11 1 1 A 143 143 ALA HA H 130 4.220 3.999 0.221 1
1 1367 . 11 1 1 A 143 143 ALA C C 130 179.899 179.661 0.238 1
1 1368 . 11 1 1 A 143 143 ALA CA C 130 54.385 55.168 -0.783 1
1 1369 . 11 1 1 A 143 143 ALA CB C 130 19.270 17.823 1.447 1
1 1370 . 11 1 1 A 143 143 ALA N N 130 121.096 122.014 -0.918 1
1 1371 . 11 1 1 A 144 144 SER H H 131 7.813 8.256 -0.443 1
1 1372 . 11 1 1 A 144 144 SER HA H 131 4.180 4.216 -0.036 1
1 1375 . 11 1 1 A 144 144 SER C C 131 175.457 177.746 -2.289 1
1 1376 . 11 1 1 A 144 144 SER CA C 131 60.948 61.560 -0.612 1
1 1377 . 11 1 1 A 144 144 SER CB C 131 63.761 62.389 1.372 1
1 1378 . 11 1 1 A 144 144 SER N N 131 112.102 113.287 -1.185 1
1 1379 . 11 1 1 A 145 145 LEU H H 132 7.747 8.100 -0.353 1
1 1380 . 11 1 1 A 145 145 LEU HA H 132 4.140 4.037 0.103 1
1 1389 . 11 1 1 A 145 145 LEU C C 132 178.589 177.192 1.397 1
1 1390 . 11 1 1 A 145 145 LEU CA C 132 56.260 56.696 -0.436 1
1 1391 . 11 1 1 A 145 145 LEU CB C 132 42.196 42.737 -0.541 1
1 1394 . 11 1 1 A 145 145 LEU N N 132 117.536 119.005 -1.469 1
1 1395 . 11 1 1 A 146 146 GLY H H 133 7.544 7.455 0.089 1
1 1396 . 11 1 1 A 146 146 GLY HA2 H 133 3.950 4.032 -0.082 1
1 1397 . 11 1 1 A 146 146 GLY HA3 H 133 3.100 4.041 -0.941 1
1 1398 . 11 1 1 A 146 146 GLY C C 133 173.372 171.942 1.430 1
1 1399 . 11 1 1 A 146 146 GLY CA C 133 45.947 45.345 0.602 1
1 1400 . 11 1 1 A 146 146 GLY N N 133 105.351 104.219 1.132 1
1 1401 . 11 1 1 A 147 147 ASP H H 134 8.342 8.676 -0.334 1
1 1402 . 11 1 1 A 147 147 ASP HA H 134 4.650 5.243 -0.593 1
1 1405 . 11 1 1 A 147 147 ASP C C 134 175.462 176.116 -0.654 1
1 1406 . 11 1 1 A 147 147 ASP CA C 134 54.385 53.279 1.106 1
1 1407 . 11 1 1 A 147 147 ASP CB C 134 41.259 42.708 -1.449 1
1 1408 . 11 1 1 A 147 147 ASP N N 134 120.133 123.135 -3.002 1
1 14 . 12 1 1 A 15 15 GLN H H 2 8.439 8.786 -0.347 1
1 15 . 12 1 1 A 15 15 GLN HA H 2 4.594 5.080 -0.486 1
1 20 . 12 1 1 A 15 15 GLN C C 2 175.972 174.015 1.957 1
1 21 . 12 1 1 A 15 15 GLN CA C 2 56.260 53.990 2.270 1
1 22 . 12 1 1 A 15 15 GLN CB C 2 30.945 32.417 -1.472 1
1 24 . 12 1 1 A 15 15 GLN N N 2 124.997 122.345 2.652 1
1 25 . 12 1 1 A 16 16 THR H H 3 8.347 8.680 -0.333 1
1 26 . 12 1 1 A 16 16 THR HA H 3 4.555 4.802 -0.247 1
1 31 . 12 1 1 A 16 16 THR C C 3 175.495 175.104 0.391 1
1 32 . 12 1 1 A 16 16 THR CA C 3 60.010 61.756 -1.746 1
1 33 . 12 1 1 A 16 16 THR CB C 3 71.261 71.507 -0.246 1
1 34 . 12 1 1 A 16 16 THR N N 3 113.011 117.706 -4.695 1
1 35 . 12 1 1 A 17 17 VAL H H 4 8.895 8.844 0.051 1
1 36 . 12 1 1 A 17 17 VAL HA H 4 3.670 3.779 -0.109 1
1 44 . 12 1 1 A 17 17 VAL C C 4 178.449 177.900 0.549 1
1 45 . 12 1 1 A 17 17 VAL CA C 4 67.511 66.445 1.066 1
1 46 . 12 1 1 A 17 17 VAL CB C 4 31.883 31.896 -0.013 1
1 49 . 12 1 1 A 17 17 VAL N N 4 121.854 124.995 -3.141 1
1 50 . 12 1 1 A 18 18 GLY H H 5 9.017 8.290 0.727 1
1 51 . 12 1 1 A 18 18 GLY HA2 H 5 3.940 3.772 0.168 1
1 52 . 12 1 1 A 18 18 GLY HA3 H 5 3.610 3.783 -0.173 1
1 53 . 12 1 1 A 18 18 GLY C C 5 176.186 175.733 0.453 1
1 54 . 12 1 1 A 18 18 GLY CA C 5 47.822 47.245 0.577 1
1 55 . 12 1 1 A 18 18 GLY N N 5 106.966 108.023 -1.057 1
1 56 . 12 1 1 A 19 19 GLN H H 6 8.072 8.027 0.045 1
1 57 . 12 1 1 A 19 19 GLN HA H 6 4.037 4.142 -0.105 1
1 62 . 12 1 1 A 19 19 GLN C C 6 179.488 177.968 1.520 1
1 63 . 12 1 1 A 19 19 GLN CA C 6 59.073 58.539 0.534 1
1 64 . 12 1 1 A 19 19 GLN CB C 6 28.489 28.805 -0.316 1
1 66 . 12 1 1 A 19 19 GLN N N 6 122.431 120.942 1.489 1
1 67 . 12 1 1 A 20 20 TRP H H 7 8.756 8.201 0.555 1
1 68 . 12 1 1 A 20 20 TRP HA H 7 4.160 4.221 -0.061 1
1 77 . 12 1 1 A 20 20 TRP C C 7 179.620 177.663 1.957 1
1 78 . 12 1 1 A 20 20 TRP CA C 7 61.886 61.254 0.632 1
1 79 . 12 1 1 A 20 20 TRP CB C 7 28.133 29.498 -1.365 1
1 85 . 12 1 1 A 20 20 TRP N N 7 124.265 122.078 2.187 1
1 87 . 12 1 1 A 21 21 LEU H H 8 9.148 8.727 0.421 1
1 88 . 12 1 1 A 21 21 LEU HA H 8 3.440 3.541 -0.101 1
1 97 . 12 1 1 A 21 21 LEU C C 8 180.521 178.645 1.876 1
1 98 . 12 1 1 A 21 21 LEU CA C 8 56.920 58.012 -1.092 1
1 99 . 12 1 1 A 21 21 LEU CB C 8 41.700 41.668 0.032 1
1 102 . 12 1 1 A 21 21 LEU N N 8 120.548 120.739 -0.191 1
1 103 . 12 1 1 A 22 22 GLU H H 9 8.284 8.232 0.052 1
1 104 . 12 1 1 A 22 22 GLU HA H 9 3.740 3.915 -0.175 1
1 109 . 12 1 1 A 22 22 GLU C C 9 179.960 178.841 1.119 1
1 110 . 12 1 1 A 22 22 GLU CA C 9 60.010 59.504 0.506 1
1 111 . 12 1 1 A 22 22 GLU CB C 9 29.070 29.207 -0.137 1
1 113 . 12 1 1 A 22 22 GLU N N 9 120.133 119.026 1.107 1
1 114 . 12 1 1 A 23 23 SER H H 10 7.891 7.730 0.161 1
1 115 . 12 1 1 A 23 23 SER HA H 10 4.250 4.224 0.026 1
1 118 . 12 1 1 A 23 23 SER C C 10 175.346 176.435 -1.089 1
1 119 . 12 1 1 A 23 23 SER CA C 10 60.948 61.298 -0.350 1
1 120 . 12 1 1 A 23 23 SER CB C 10 63.280 62.851 0.429 1
1 121 . 12 1 1 A 23 23 SER N N 10 117.044 115.396 1.648 1
1 122 . 12 1 1 A 24 24 ILE H H 11 6.862 7.753 -0.891 1
1 123 . 12 1 1 A 24 24 ILE HA H 11 4.487 3.723 0.764 1
1 133 . 12 1 1 A 24 24 ILE C C 11 175.812 175.917 -0.105 1
1 134 . 12 1 1 A 24 24 ILE CA C 11 60.948 63.759 -2.811 1
1 135 . 12 1 1 A 24 24 ILE CB C 11 38.250 37.145 1.105 1
1 139 . 12 1 1 A 24 24 ILE N N 11 113.733 117.875 -4.142 1
1 140 . 12 1 1 A 25 25 GLY H H 12 7.628 7.460 0.168 1
1 141 . 12 1 1 A 25 25 GLY HA2 H 12 3.990 3.970 0.020 1
1 142 . 12 1 1 A 25 25 GLY HA3 H 12 3.800 3.971 -0.171 1
1 143 . 12 1 1 A 25 25 GLY C C 12 173.647 171.765 1.882 1
1 144 . 12 1 1 A 25 25 GLY CA C 12 45.947 45.988 -0.041 1
1 145 . 12 1 1 A 25 25 GLY N N 12 109.763 109.656 0.107 1
1 146 . 12 1 1 A 26 26 LEU H H 13 7.620 8.274 -0.654 1
1 147 . 12 1 1 A 26 26 LEU C C 13 176.186 174.323 1.863 1
1 148 . 12 1 1 A 26 26 LEU CA C 13 52.700 51.767 0.933 1
1 149 . 12 1 1 A 26 26 LEU CB C 13 43.134 44.758 -1.624 1
1 150 . 12 1 1 A 26 26 LEU N N 13 118.778 122.470 -3.692 1
1 151 . 12 1 1 A 27 27 PRO HA H 14 4.120 4.655 -0.535 1
1 154 . 12 1 1 A 27 27 PRO C C 14 177.955 175.423 2.532 1
1 155 . 12 1 1 A 27 27 PRO CA C 14 64.698 62.185 2.513 1
1 156 . 12 1 1 A 27 27 PRO CB C 14 31.883 29.110 2.773 1
1 158 . 12 1 1 A 28 28 GLN H H 15 9.838 8.404 1.434 1
1 159 . 12 1 1 A 28 28 GLN HA H 15 4.240 4.275 -0.035 1
1 162 . 12 1 1 A 28 28 GLN C C 15 176.836 176.460 0.376 1
1 163 . 12 1 1 A 28 28 GLN CA C 15 58.135 56.295 1.840 1
1 164 . 12 1 1 A 28 28 GLN CB C 15 27.195 30.580 -3.385 1
1 166 . 12 1 1 A 28 28 GLN N N 15 120.414 121.174 -0.760 1
1 167 . 12 1 1 A 29 29 TYR H H 16 6.810 7.610 -0.800 1
1 168 . 12 1 1 A 29 29 TYR HA H 16 5.720 4.496 1.224 1
1 173 . 12 1 1 A 29 29 TYR C C 16 174.814 176.637 -1.823 1
1 174 . 12 1 1 A 29 29 TYR CA C 16 57.198 57.872 -0.674 1
1 175 . 12 1 1 A 29 29 TYR CB C 16 37.509 38.738 -1.229 1
1 178 . 12 1 1 A 29 29 TYR N N 16 119.718 117.237 2.481 1
1 179 . 12 1 1 A 30 30 GLU H H 17 7.509 8.245 -0.736 1
1 180 . 12 1 1 A 30 30 GLU HA H 17 3.650 4.005 -0.355 1
1 184 . 12 1 1 A 30 30 GLU C C 17 177.552 178.538 -0.986 1
1 185 . 12 1 1 A 30 30 GLU CA C 17 60.948 59.719 1.229 1
1 186 . 12 1 1 A 30 30 GLU CB C 17 30.008 29.345 0.663 1
1 188 . 12 1 1 A 30 30 GLU N N 17 122.417 123.074 -0.657 1
1 189 . 12 1 1 A 31 31 ASN H H 18 9.259 8.300 0.959 1
1 190 . 12 1 1 A 31 31 ASN HA H 18 4.451 4.461 -0.010 1
1 193 . 12 1 1 A 31 31 ASN C C 18 176.868 177.956 -1.088 1
1 194 . 12 1 1 A 31 31 ASN CA C 18 57.198 56.419 0.779 1
1 195 . 12 1 1 A 31 31 ASN CB C 18 38.446 39.738 -1.292 1
1 196 . 12 1 1 A 31 31 ASN N N 18 116.613 117.859 -1.246 1
1 197 . 12 1 1 A 32 32 HIS H H 19 8.898 8.334 0.564 1
1 198 . 12 1 1 A 32 32 HIS HA H 19 4.140 4.302 -0.162 1
1 202 . 12 1 1 A 32 32 HIS C C 19 178.269 177.812 0.457 1
1 203 . 12 1 1 A 32 32 HIS CA C 19 60.948 59.166 1.782 1
1 204 . 12 1 1 A 32 32 HIS CB C 19 30.008 29.956 0.052 1
1 206 . 12 1 1 A 32 32 HIS N N 19 118.926 118.171 0.755 1
1 207 . 12 1 1 A 33 33 LEU H H 20 7.825 9.020 -1.195 1
1 208 . 12 1 1 A 33 33 LEU HA H 20 4.305 3.969 0.336 1
1 218 . 12 1 1 A 33 33 LEU C C 20 179.190 179.097 0.093 1
1 219 . 12 1 1 A 33 33 LEU CA C 20 60.010 58.428 1.582 1
1 220 . 12 1 1 A 33 33 LEU CB C 20 40.321 41.706 -1.385 1
1 224 . 12 1 1 A 33 33 LEU N N 20 117.434 120.268 -2.834 1
1 225 . 12 1 1 A 34 34 MET H H 21 8.861 8.769 0.092 1
1 226 . 12 1 1 A 34 34 MET HA H 21 3.980 4.164 -0.184 1
1 234 . 12 1 1 A 34 34 MET C C 21 180.340 178.666 1.674 1
1 235 . 12 1 1 A 34 34 MET CA C 21 58.135 58.345 -0.210 1
1 236 . 12 1 1 A 34 34 MET CB C 21 30.945 32.384 -1.439 1
1 238 . 12 1 1 A 34 34 MET N N 21 118.111 116.505 1.606 1
1 239 . 12 1 1 A 35 35 ALA H H 22 9.015 8.523 0.492 1
1 240 . 12 1 1 A 35 35 ALA HA H 22 4.239 4.156 0.083 1
1 244 . 12 1 1 A 35 35 ALA C C 22 178.058 178.665 -0.607 1
1 245 . 12 1 1 A 35 35 ALA CA C 22 53.800 54.484 -0.684 1
1 246 . 12 1 1 A 35 35 ALA CB C 22 18.397 18.197 0.200 1
1 247 . 12 1 1 A 35 35 ALA N N 22 120.068 122.172 -2.104 1
1 248 . 12 1 1 A 36 36 ASN H H 23 7.143 8.013 -0.870 1
1 249 . 12 1 1 A 36 36 ASN HA H 23 4.959 4.796 0.163 1
1 254 . 12 1 1 A 36 36 ASN C C 23 174.083 175.620 -1.537 1
1 255 . 12 1 1 A 36 36 ASN CA C 23 54.000 53.097 0.903 1
1 256 . 12 1 1 A 36 36 ASN CB C 23 41.300 39.131 2.169 1
1 257 . 12 1 1 A 36 36 ASN N N 23 111.560 115.026 -3.466 1
1 259 . 12 1 1 A 37 37 GLY H H 24 7.797 8.338 -0.541 1
1 260 . 12 1 1 A 37 37 GLY HA2 H 24 3.430 3.834 -0.404 1
1 261 . 12 1 1 A 37 37 GLY HA3 H 24 3.290 3.925 -0.635 1
1 262 . 12 1 1 A 37 37 GLY C C 24 173.163 174.889 -1.726 1
1 263 . 12 1 1 A 37 37 GLY CA C 24 45.947 45.192 0.755 1
1 264 . 12 1 1 A 37 37 GLY N N 24 106.170 107.696 -1.526 1
1 265 . 12 1 1 A 38 38 PHE H H 25 8.191 7.941 0.250 1
1 266 . 12 1 1 A 38 38 PHE HA H 25 4.910 4.771 0.139 1
1 271 . 12 1 1 A 38 38 PHE C C 25 173.496 175.812 -2.316 1
1 272 . 12 1 1 A 38 38 PHE CA C 25 56.550 56.416 0.134 1
1 273 . 12 1 1 A 38 38 PHE CB C 25 37.220 37.080 0.140 1
1 276 . 12 1 1 A 38 38 PHE N N 25 122.454 119.740 2.714 1
1 277 . 12 1 1 A 39 39 ASP H H 26 6.756 8.470 -1.714 1
1 278 . 12 1 1 A 39 39 ASP HA H 26 5.077 4.908 0.169 1
1 281 . 12 1 1 A 39 39 ASP C C 26 177.463 175.698 1.765 1
1 282 . 12 1 1 A 39 39 ASP CA C 26 53.447 54.377 -0.930 1
1 283 . 12 1 1 A 39 39 ASP CB C 26 42.580 41.893 0.687 1
1 284 . 12 1 1 A 39 39 ASP N N 26 111.309 120.894 -9.585 1
1 285 . 12 1 1 A 40 40 ASN H H 27 7.495 7.766 -0.271 1
1 286 . 12 1 1 A 40 40 ASN HA H 27 4.820 5.026 -0.206 1
1 289 . 12 1 1 A 40 40 ASN C C 27 176.228 175.640 0.588 1
1 290 . 12 1 1 A 40 40 ASN CA C 27 52.510 52.127 0.383 1
1 291 . 12 1 1 A 40 40 ASN CB C 27 40.321 40.632 -0.311 1
1 292 . 12 1 1 A 40 40 ASN N N 27 118.385 117.870 0.515 1
1 293 . 12 1 1 A 41 41 VAL H H 28 9.192 8.636 0.556 1
1 294 . 12 1 1 A 41 41 VAL HA H 28 3.550 3.602 -0.052 1
1 302 . 12 1 1 A 41 41 VAL C C 28 176.429 177.431 -1.002 1
1 303 . 12 1 1 A 41 41 VAL CA C 28 65.636 66.069 -0.433 1
1 304 . 12 1 1 A 41 41 VAL CB C 28 31.883 31.640 0.243 1
1 307 . 12 1 1 A 41 41 VAL N N 28 125.741 124.198 1.543 1
1 308 . 12 1 1 A 42 42 GLN H H 29 8.203 8.163 0.040 1
1 309 . 12 1 1 A 42 42 GLN HA H 29 4.129 3.985 0.144 1
1 314 . 12 1 1 A 42 42 GLN C C 29 176.591 178.653 -2.062 1
1 315 . 12 1 1 A 42 42 GLN CA C 29 57.198 59.097 -1.899 1
1 316 . 12 1 1 A 42 42 GLN CB C 29 28.133 27.973 0.160 1
1 318 . 12 1 1 A 42 42 GLN N N 29 116.452 118.856 -2.404 1
1 319 . 12 1 1 A 43 43 ALA H H 30 7.781 8.664 -0.883 1
1 320 . 12 1 1 A 43 43 ALA HA H 30 4.650 4.009 0.641 1
1 324 . 12 1 1 A 43 43 ALA C C 30 175.976 179.900 -3.924 1
1 325 . 12 1 1 A 43 43 ALA CA C 30 50.840 54.677 -3.837 1
1 326 . 12 1 1 A 43 43 ALA CB C 30 19.150 18.407 0.743 1
1 327 . 12 1 1 A 43 43 ALA N N 30 122.150 121.319 0.831 1
1 328 . 12 1 1 A 44 44 MET H H 31 7.739 8.145 -0.406 1
1 332 . 12 1 1 A 44 44 MET C C 31 178.275 176.750 1.525 1
1 333 . 12 1 1 A 44 44 MET CA C 31 55.323 57.694 -2.371 1
1 334 . 12 1 1 A 44 44 MET CB C 31 34.696 32.272 2.424 1
1 336 . 12 1 1 A 44 44 MET N N 31 118.149 116.497 1.652 1
1 337 . 12 1 1 A 45 45 GLY H H 32 7.611 7.902 -0.291 1
1 338 . 12 1 1 A 45 45 GLY N N 32 101.530 108.351 -6.821 1
1 339 . 12 1 1 A 47 47 ASN HA H 34 4.480 4.375 0.105 1
1 342 . 12 1 1 A 47 47 ASN CA C 34 56.260 54.269 1.991 1
1 343 . 12 1 1 A 47 47 ASN CB C 34 39.384 36.407 2.977 1
1 344 . 12 1 1 A 49 49 MET HA H 36 4.646 4.383 0.263 1
1 350 . 12 1 1 A 49 49 MET C C 36 173.651 175.683 -2.032 1
1 351 . 12 1 1 A 49 49 MET CA C 36 55.323 56.438 -1.115 1
1 352 . 12 1 1 A 49 49 MET CB C 36 35.633 32.957 2.676 1
1 355 . 12 1 1 A 50 50 GLU H H 37 9.203 8.642 0.561 1
1 356 . 12 1 1 A 50 50 GLU HA H 37 4.650 4.776 -0.126 1
1 361 . 12 1 1 A 50 50 GLU C C 37 177.008 176.538 0.470 1
1 362 . 12 1 1 A 50 50 GLU CA C 37 54.385 54.275 0.110 1
1 363 . 12 1 1 A 50 50 GLU CB C 37 33.758 32.904 0.854 1
1 365 . 12 1 1 A 50 50 GLU N N 37 123.229 123.606 -0.377 1
1 366 . 12 1 1 A 51 51 ASP H H 38 9.032 9.019 0.013 1
1 367 . 12 1 1 A 51 51 ASP HA H 38 4.149 4.409 -0.260 1
1 370 . 12 1 1 A 51 51 ASP C C 38 177.994 178.611 -0.617 1
1 371 . 12 1 1 A 51 51 ASP CA C 38 59.073 57.253 1.820 1
1 372 . 12 1 1 A 51 51 ASP CB C 38 43.134 39.904 3.230 1
1 373 . 12 1 1 A 51 51 ASP N N 38 122.717 121.369 1.348 1
1 374 . 12 1 1 A 52 52 GLN H H 39 8.950 8.367 0.583 1
1 375 . 12 1 1 A 52 52 GLN HA H 39 3.940 4.096 -0.156 1
1 378 . 12 1 1 A 52 52 GLN C C 39 177.817 177.758 0.059 1
1 379 . 12 1 1 A 52 52 GLN CA C 39 59.073 58.760 0.313 1
1 380 . 12 1 1 A 52 52 GLN CB C 39 28.133 28.705 -0.572 1
1 381 . 12 1 1 A 52 52 GLN N N 39 114.086 118.279 -4.193 1
1 382 . 12 1 1 A 53 53 ASP H H 40 7.214 7.898 -0.684 1
1 383 . 12 1 1 A 53 53 ASP HA H 40 4.370 4.518 -0.148 1
1 386 . 12 1 1 A 53 53 ASP C C 40 177.667 178.524 -0.857 1
1 387 . 12 1 1 A 53 53 ASP CA C 40 57.198 56.948 0.250 1
1 388 . 12 1 1 A 53 53 ASP CB C 40 41.800 40.804 0.996 1
1 389 . 12 1 1 A 53 53 ASP N N 40 118.734 120.029 -1.295 1
1 390 . 12 1 1 A 54 54 LEU H H 41 7.180 8.116 -0.936 1
1 391 . 12 1 1 A 54 54 LEU HA H 41 3.990 4.004 -0.014 1
1 400 . 12 1 1 A 54 54 LEU C C 41 178.204 178.506 -0.302 1
1 401 . 12 1 1 A 54 54 LEU CA C 41 56.260 57.959 -1.699 1
1 402 . 12 1 1 A 54 54 LEU CB C 41 41.259 41.555 -0.296 1
1 405 . 12 1 1 A 54 54 LEU N N 41 115.795 116.799 -1.004 1
1 406 . 12 1 1 A 55 55 LEU H H 42 7.823 8.251 -0.428 1
1 407 . 12 1 1 A 55 55 LEU HA H 42 3.920 4.153 -0.233 1
1 416 . 12 1 1 A 55 55 LEU C C 42 180.876 178.313 2.563 1
1 417 . 12 1 1 A 55 55 LEU CA C 42 58.135 57.507 0.628 1
1 418 . 12 1 1 A 55 55 LEU CB C 42 42.196 41.794 0.402 1
1 421 . 12 1 1 A 55 55 LEU N N 42 120.499 121.680 -1.181 1
1 422 . 12 1 1 A 56 56 GLU H H 43 8.127 8.357 -0.230 1
1 423 . 12 1 1 A 56 56 GLU HA H 43 3.966 3.960 0.006 1
1 428 . 12 1 1 A 56 56 GLU C C 43 178.801 179.150 -0.349 1
1 429 . 12 1 1 A 56 56 GLU CA C 43 60.010 59.445 0.565 1
1 430 . 12 1 1 A 56 56 GLU CB C 43 29.070 29.319 -0.249 1
1 432 . 12 1 1 A 56 56 GLU N N 43 120.955 118.663 2.292 1
1 433 . 12 1 1 A 57 57 ILE H H 44 7.504 7.527 -0.023 1
1 434 . 12 1 1 A 57 57 ILE HA H 44 4.524 3.859 0.665 1
1 444 . 12 1 1 A 57 57 ILE C C 44 175.691 177.265 -1.574 1
1 445 . 12 1 1 A 57 57 ILE CA C 44 61.886 65.041 -3.155 1
1 446 . 12 1 1 A 57 57 ILE CB C 44 37.300 38.418 -1.118 1
1 450 . 12 1 1 A 57 57 ILE N N 44 109.594 118.557 -8.963 1
1 451 . 12 1 1 A 58 58 GLY H H 45 7.724 7.488 0.236 1
1 452 . 12 1 1 A 58 58 GLY HA2 H 45 3.650 4.217 -0.567 1
1 453 . 12 1 1 A 58 58 GLY HA3 H 45 4.530 4.322 0.208 1
1 454 . 12 1 1 A 58 58 GLY C C 45 174.613 172.885 1.728 1
1 455 . 12 1 1 A 58 58 GLY CA C 45 45.947 45.910 0.037 1
1 456 . 12 1 1 A 58 58 GLY N N 45 106.680 105.362 1.318 1
1 457 . 12 1 1 A 59 59 ILE H H 46 8.180 8.902 -0.722 1
1 458 . 12 1 1 A 59 59 ILE HA H 46 3.907 4.616 -0.709 1
1 468 . 12 1 1 A 59 59 ILE C C 46 174.235 175.197 -0.962 1
1 469 . 12 1 1 A 59 59 ILE CA C 46 60.948 60.453 0.495 1
1 470 . 12 1 1 A 59 59 ILE CB C 46 33.980 39.577 -5.597 1
1 474 . 12 1 1 A 59 59 ILE N N 46 122.454 122.435 0.019 1
1 475 . 12 1 1 A 60 60 LEU H H 47 7.367 8.556 -1.189 1
1 476 . 12 1 1 A 60 60 LEU HA H 47 3.900 4.268 -0.368 1
1 479 . 12 1 1 A 60 60 LEU C C 47 177.753 177.517 0.236 1
1 480 . 12 1 1 A 60 60 LEU CA C 47 56.260 57.029 -0.769 1
1 481 . 12 1 1 A 60 60 LEU CB C 47 42.196 41.970 0.226 1
1 482 . 12 1 1 A 60 60 LEU N N 47 125.835 129.273 -3.438 1
1 483 . 12 1 1 A 63 63 GLY HA2 H 50 3.980 4.006 -0.026 1
1 484 . 12 1 1 A 63 63 GLY HA3 H 50 3.950 4.052 -0.102 1
1 485 . 12 1 1 A 63 63 GLY C C 50 177.130 175.802 1.328 1
1 486 . 12 1 1 A 63 63 GLY CA C 50 46.884 45.992 0.892 1
1 487 . 12 1 1 A 64 64 HIS H H 51 7.926 7.914 0.012 1
1 488 . 12 1 1 A 64 64 HIS HA H 51 4.451 4.730 -0.279 1
1 493 . 12 1 1 A 64 64 HIS C C 51 177.613 177.975 -0.362 1
1 494 . 12 1 1 A 64 64 HIS CA C 51 57.198 58.566 -1.368 1
1 495 . 12 1 1 A 64 64 HIS CB C 51 30.945 30.805 0.140 1
1 498 . 12 1 1 A 64 64 HIS N N 51 122.284 119.566 2.718 1
1 499 . 12 1 1 A 65 65 ARG H H 52 8.105 8.192 -0.087 1
1 500 . 12 1 1 A 65 65 ARG HA H 52 3.685 3.941 -0.256 1
1 507 . 12 1 1 A 65 65 ARG C C 52 177.769 178.164 -0.395 1
1 508 . 12 1 1 A 65 65 ARG CA C 52 61.886 58.758 3.128 1
1 509 . 12 1 1 A 65 65 ARG CB C 52 30.945 30.242 0.703 1
1 511 . 12 1 1 A 65 65 ARG N N 52 117.775 117.782 -0.007 1
1 513 . 12 1 1 A 66 66 GLN H H 53 8.090 7.948 0.142 1
1 514 . 12 1 1 A 66 66 GLN HA H 53 3.940 4.061 -0.121 1
1 519 . 12 1 1 A 66 66 GLN C C 53 178.583 178.136 0.447 1
1 520 . 12 1 1 A 66 66 GLN CA C 53 59.073 59.199 -0.126 1
1 521 . 12 1 1 A 66 66 GLN CB C 53 28.133 28.407 -0.274 1
1 523 . 12 1 1 A 66 66 GLN N N 53 116.452 118.933 -2.481 1
1 524 . 12 1 1 A 67 67 ARG H H 54 7.845 7.735 0.110 1
1 525 . 12 1 1 A 67 67 ARG HA H 54 4.010 4.034 -0.024 1
1 528 . 12 1 1 A 67 67 ARG C C 54 179.766 178.965 0.801 1
1 529 . 12 1 1 A 67 67 ARG CA C 54 59.073 58.797 0.276 1
1 530 . 12 1 1 A 67 67 ARG CB C 54 30.720 29.660 1.060 1
1 532 . 12 1 1 A 67 67 ARG N N 54 119.275 119.922 -0.647 1
1 533 . 12 1 1 A 68 68 ILE H H 55 8.032 7.945 0.087 1
1 534 . 12 1 1 A 68 68 ILE HA H 55 3.495 3.525 -0.030 1
1 544 . 12 1 1 A 68 68 ILE C C 55 177.108 178.863 -1.755 1
1 545 . 12 1 1 A 68 68 ILE CA C 55 66.230 64.656 1.574 1
1 546 . 12 1 1 A 68 68 ILE CB C 55 38.020 36.949 1.071 1
1 550 . 12 1 1 A 68 68 ILE N N 55 121.152 118.905 2.247 1
1 551 . 12 1 1 A 69 69 LEU H H 56 8.490 8.221 0.269 1
1 552 . 12 1 1 A 69 69 LEU HA H 56 4.010 3.789 0.221 1
1 561 . 12 1 1 A 69 69 LEU C C 56 179.917 178.931 0.986 1
1 562 . 12 1 1 A 69 69 LEU CA C 56 58.135 58.209 -0.074 1
1 563 . 12 1 1 A 69 69 LEU CB C 56 41.259 41.637 -0.378 1
1 566 . 12 1 1 A 69 69 LEU N N 56 119.072 121.119 -2.047 1
1 567 . 12 1 1 A 70 70 GLN H H 57 8.327 8.394 -0.067 1
1 568 . 12 1 1 A 70 70 GLN HA H 57 4.100 3.995 0.105 1
1 573 . 12 1 1 A 70 70 GLN C C 57 178.798 177.789 1.009 1
1 574 . 12 1 1 A 70 70 GLN CA C 57 59.073 58.100 0.973 1
1 575 . 12 1 1 A 70 70 GLN CB C 57 28.133 29.025 -0.892 1
1 577 . 12 1 1 A 70 70 GLN N N 57 118.172 118.242 -0.070 1
1 578 . 12 1 1 A 71 71 ALA H H 58 7.810 7.828 -0.018 1
1 579 . 12 1 1 A 71 71 ALA HA H 58 4.320 4.152 0.168 1
1 583 . 12 1 1 A 71 71 ALA C C 58 172.232 180.182 -7.950 1
1 584 . 12 1 1 A 71 71 ALA CA C 58 55.323 54.987 0.336 1
1 585 . 12 1 1 A 71 71 ALA CB C 58 19.720 18.403 1.317 1
1 586 . 12 1 1 A 71 71 ALA N N 58 122.536 121.692 0.844 1
1 587 . 12 1 1 A 72 72 ILE H H 59 8.840 8.417 0.423 1
1 588 . 12 1 1 A 72 72 ILE HA H 59 4.030 4.102 -0.072 1
1 598 . 12 1 1 A 72 72 ILE C C 59 178.678 177.407 1.271 1
1 599 . 12 1 1 A 72 72 ILE CA C 59 64.698 62.942 1.756 1
1 600 . 12 1 1 A 72 72 ILE CB C 59 37.850 38.323 -0.473 1
1 604 . 12 1 1 A 72 72 ILE N N 59 118.111 118.827 -0.716 1
1 605 . 12 1 1 A 73 73 GLN H H 60 7.547 8.109 -0.562 1
1 606 . 12 1 1 A 73 73 GLN HA H 60 4.121 4.217 -0.096 1
1 611 . 12 1 1 A 73 73 GLN C C 60 176.556 177.684 -1.128 1
1 612 . 12 1 1 A 73 73 GLN CA C 60 58.135 57.752 0.383 1
1 613 . 12 1 1 A 73 73 GLN CB C 60 28.300 28.959 -0.659 1
1 615 . 12 1 1 A 73 73 GLN N N 60 119.094 121.107 -2.013 1
1 616 . 12 1 1 A 74 74 LEU H H 61 7.350 7.968 -0.618 1
1 617 . 12 1 1 A 74 74 LEU HA H 61 4.408 4.516 -0.108 1
1 626 . 12 1 1 A 74 74 LEU C C 61 177.960 176.367 1.593 1
1 627 . 12 1 1 A 74 74 LEU CA C 61 54.900 56.337 -1.437 1
1 628 . 12 1 1 A 74 74 LEU CB C 61 42.196 44.557 -2.361 1
1 631 . 12 1 1 A 74 74 LEU N N 61 115.853 119.402 -3.549 1
1 632 . 12 1 1 A 75 75 LEU H H 62 7.358 8.183 -0.825 1
1 633 . 12 1 1 A 75 75 LEU HA H 62 4.530 4.999 -0.469 1
1 642 . 12 1 1 A 75 75 LEU C C 62 177.035 176.061 0.974 1
1 643 . 12 1 1 A 75 75 LEU CA C 62 53.200 56.619 -3.419 1
1 644 . 12 1 1 A 75 75 LEU CB C 62 40.700 40.990 -0.290 1
1 647 . 12 1 1 A 75 75 LEU N N 62 121.010 119.087 1.923 1
1 648 . 12 1 1 A 76 76 PRO HA H 63 4.382 4.592 -0.210 1
1 655 . 12 1 1 A 76 76 PRO CB C 63 31.883 32.443 -0.560 1
1 657 . 12 1 1 A 77 77 LYS H H 64 8.418 8.666 -0.248 1
1 658 . 12 1 1 A 77 77 LYS HA H 64 4.140 4.042 0.098 1
1 663 . 12 1 1 A 77 77 LYS C C 64 177.122 176.771 0.351 1
1 664 . 12 1 1 A 77 77 LYS CA C 64 56.260 58.953 -2.693 1
1 665 . 12 1 1 A 77 77 LYS CB C 64 33.340 32.205 1.135 1
1 668 . 12 1 1 A 77 77 LYS N N 64 121.932 121.047 0.885 1
1 669 . 12 1 1 A 78 78 MET H H 65 8.550 7.744 0.806 1
1 670 . 12 1 1 A 78 78 MET HA H 65 4.304 4.280 0.024 1
1 676 . 12 1 1 A 78 78 MET C C 65 176.105 177.033 -0.928 1
1 677 . 12 1 1 A 78 78 MET CA C 65 56.260 55.749 0.511 1
1 678 . 12 1 1 A 78 78 MET CB C 65 32.821 33.781 -0.960 1
1 680 . 12 1 1 A 78 78 MET N N 65 123.498 119.777 3.721 1
1 681 . 12 1 1 A 79 79 ARG H H 66 8.731 8.895 -0.164 1
1 682 . 12 1 1 A 79 79 ARG C C 66 173.577 176.834 -3.257 1
1 683 . 12 1 1 A 79 79 ARG CA C 66 53.447 56.879 -3.432 1
1 684 . 12 1 1 A 79 79 ARG CB C 66 30.008 27.965 2.043 1
1 685 . 12 1 1 A 79 79 ARG N N 66 127.355 125.021 2.334 1
1 686 . 12 1 1 A 80 80 PRO HA H 67 4.780 4.526 0.254 1
1 693 . 12 1 1 A 80 80 PRO C C 67 177.043 176.500 0.543 1
1 694 . 12 1 1 A 80 80 PRO CA C 67 61.886 64.870 -2.984 1
1 695 . 12 1 1 A 80 80 PRO CB C 67 32.821 32.073 0.748 1
1 698 . 12 1 1 A 81 81 ILE H H 68 8.580 7.521 1.059 1
1 699 . 12 1 1 A 81 81 ILE HA H 68 4.040 4.620 -0.580 1
1 709 . 12 1 1 A 81 81 ILE C C 68 176.831 173.943 2.888 1
1 710 . 12 1 1 A 81 81 ILE CA C 68 62.823 59.648 3.175 1
1 711 . 12 1 1 A 81 81 ILE CB C 68 38.580 41.414 -2.834 1
1 715 . 12 1 1 A 81 81 ILE N N 68 118.491 116.327 2.164 1
1 716 . 12 1 1 A 82 82 GLY H H 69 8.602 8.706 -0.104 1
1 717 . 12 1 1 A 82 82 GLY CA C 69 45.009 44.298 0.711 1
1 718 . 12 1 1 A 82 82 GLY N N 69 111.377 115.701 -4.324 1
1 721 . 12 1 1 A 84 84 ASP HA H 71 4.490 4.500 -0.010 1
1 724 . 12 1 1 A 84 84 ASP CA C 71 54.385 55.583 -1.198 1
1 725 . 12 1 1 A 84 84 ASP CB C 71 40.321 42.126 -1.805 1
1 726 . 12 1 1 A 85 85 GLY H H 72 8.054 7.974 0.080 1
1 727 . 12 1 1 A 85 85 GLY HA2 H 72 4.040 4.044 -0.004 1
1 728 . 12 1 1 A 85 85 GLY HA3 H 72 3.750 4.048 -0.298 1
1 729 . 12 1 1 A 85 85 GLY C C 72 173.474 172.805 0.669 1
1 730 . 12 1 1 A 85 85 GLY CA C 72 45.009 44.720 0.289 1
1 731 . 12 1 1 A 85 85 GLY N N 72 108.038 106.110 1.928 1
1 732 . 12 1 1 A 86 86 ALA H H 73 7.858 8.602 -0.744 1
1 733 . 12 1 1 A 86 86 ALA HA H 73 4.370 5.027 -0.657 1
1 737 . 12 1 1 A 86 86 ALA CA C 73 51.990 51.025 0.965 1
1 738 . 12 1 1 A 86 86 ALA CB C 73 19.220 23.214 -3.994 1
1 739 . 12 1 1 A 86 86 ALA N N 73 123.819 125.855 -2.036 1
1 742 . 12 1 1 A 90 90 SER H H 77 7.839 8.584 -0.745 1
1 743 . 12 1 1 A 90 90 SER HA H 77 4.770 4.635 0.135 1
1 746 . 12 1 1 A 90 90 SER N N 77 115.163 116.852 -1.689 1
1 747 . 12 1 1 A 91 91 VAL H H 78 8.578 8.908 -0.330 1
1 748 . 12 1 1 A 91 91 VAL HA H 78 3.981 3.989 -0.008 1
1 756 . 12 1 1 A 91 91 VAL C C 78 177.480 177.381 0.099 1
1 757 . 12 1 1 A 91 91 VAL CA C 78 67.060 66.464 0.596 1
1 758 . 12 1 1 A 91 91 VAL CB C 78 32.500 31.739 0.761 1
1 761 . 12 1 1 A 91 91 VAL N N 78 123.481 122.940 0.541 1
1 762 . 12 1 1 A 92 92 ALA H H 79 8.607 8.449 0.158 1
1 763 . 12 1 1 A 92 92 ALA HA H 79 4.113 4.030 0.083 1
1 767 . 12 1 1 A 92 92 ALA C C 79 179.868 180.459 -0.591 1
1 768 . 12 1 1 A 92 92 ALA CA C 79 54.890 55.540 -0.650 1
1 769 . 12 1 1 A 92 92 ALA CB C 79 18.790 18.615 0.175 1
1 770 . 12 1 1 A 92 92 ALA N N 79 120.334 122.338 -2.004 1
1 771 . 12 1 1 A 93 93 GLU H H 80 7.886 8.223 -0.337 1
1 772 . 12 1 1 A 93 93 GLU HA H 80 4.010 4.122 -0.112 1
1 777 . 12 1 1 A 93 93 GLU C C 80 179.719 179.004 0.715 1
1 778 . 12 1 1 A 93 93 GLU CA C 80 59.073 59.352 -0.279 1
1 779 . 12 1 1 A 93 93 GLU CB C 80 30.630 29.373 1.257 1
1 781 . 12 1 1 A 93 93 GLU N N 80 117.643 117.117 0.526 1
1 782 . 12 1 1 A 94 94 TRP H H 81 8.299 8.127 0.172 1
1 783 . 12 1 1 A 94 94 TRP HA H 81 4.251 4.219 0.032 1
1 792 . 12 1 1 A 94 94 TRP C C 81 178.772 178.050 0.722 1
1 793 . 12 1 1 A 94 94 TRP CA C 81 60.010 61.203 -1.193 1
1 794 . 12 1 1 A 94 94 TRP CB C 81 27.650 30.166 -2.516 1
1 800 . 12 1 1 A 94 94 TRP N N 81 122.545 122.139 0.406 1
1 802 . 12 1 1 A 95 95 LEU H H 82 8.505 8.710 -0.205 1
1 803 . 12 1 1 A 95 95 LEU HA H 82 2.880 3.090 -0.210 1
1 812 . 12 1 1 A 95 95 LEU C C 82 180.235 179.027 1.208 1
1 813 . 12 1 1 A 95 95 LEU CA C 82 57.400 57.230 0.170 1
1 814 . 12 1 1 A 95 95 LEU CB C 82 40.321 40.767 -0.446 1
1 817 . 12 1 1 A 95 95 LEU N N 82 121.110 119.382 1.728 1
1 818 . 12 1 1 A 96 96 ASP H H 83 8.185 8.244 -0.059 1
1 819 . 12 1 1 A 96 96 ASP HA H 83 4.280 4.378 -0.098 1
1 822 . 12 1 1 A 96 96 ASP C C 83 175.224 177.694 -2.470 1
1 823 . 12 1 1 A 96 96 ASP CA C 83 57.310 56.595 0.715 1
1 824 . 12 1 1 A 96 96 ASP CB C 83 40.321 41.047 -0.726 1
1 825 . 12 1 1 A 96 96 ASP N N 83 119.082 120.085 -1.003 1
1 826 . 12 1 1 A 97 97 SER H H 84 7.989 8.216 -0.227 1
1 827 . 12 1 1 A 97 97 SER HA H 84 4.250 4.439 -0.189 1
1 830 . 12 1 1 A 97 97 SER C C 84 175.346 175.433 -0.087 1
1 831 . 12 1 1 A 97 97 SER CA C 84 60.948 58.898 2.050 1
1 832 . 12 1 1 A 97 97 SER CB C 84 63.370 64.146 -0.776 1
1 833 . 12 1 1 A 97 97 SER N N 84 117.579 112.194 5.385 1
1 834 . 12 1 1 A 98 98 ILE H H 85 6.862 7.318 -0.456 1
1 835 . 12 1 1 A 98 98 ILE HA H 85 4.550 4.025 0.525 1
1 843 . 12 1 1 A 98 98 ILE C C 85 173.308 174.987 -1.679 1
1 844 . 12 1 1 A 98 98 ILE CA C 85 60.948 60.754 0.194 1
1 845 . 12 1 1 A 98 98 ILE CB C 85 37.760 37.437 0.323 1
1 848 . 12 1 1 A 98 98 ILE N N 85 113.733 117.998 -4.265 1
1 849 . 12 1 1 A 99 99 GLU H H 86 7.705 7.960 -0.255 1
1 850 . 12 1 1 A 99 99 GLU HA H 86 4.280 3.837 0.443 1
1 853 . 12 1 1 A 99 99 GLU C C 86 175.224 174.905 0.319 1
1 854 . 12 1 1 A 99 99 GLU CA C 86 56.260 57.423 -1.163 1
1 855 . 12 1 1 A 99 99 GLU CB C 86 26.258 27.661 -1.403 1
1 857 . 12 1 1 A 99 99 GLU N N 86 115.493 118.496 -3.003 1
1 858 . 12 1 1 A 100 100 LEU H H 87 7.989 7.082 0.907 1
1 859 . 12 1 1 A 100 100 LEU HA H 87 4.220 4.723 -0.503 1
1 868 . 12 1 1 A 100 100 LEU C C 87 176.965 176.102 0.863 1
1 869 . 12 1 1 A 100 100 LEU CA C 87 52.510 53.338 -0.828 1
1 870 . 12 1 1 A 100 100 LEU CB C 87 42.196 44.511 -2.315 1
1 873 . 12 1 1 A 100 100 LEU N N 87 117.579 120.202 -2.623 1
1 874 . 12 1 1 A 101 101 GLY H H 88 8.503 7.986 0.517 1
1 875 . 12 1 1 A 101 101 GLY CA C 88 46.884 45.743 1.141 1
1 876 . 12 1 1 A 101 101 GLY N N 88 107.794 109.040 -1.246 1
1 877 . 12 1 1 A 102 102 ASP HA H 89 4.431 4.270 0.161 1
1 880 . 12 1 1 A 102 102 ASP C C 89 178.075 178.447 -0.372 1
1 881 . 12 1 1 A 102 102 ASP CA C 89 57.198 56.840 0.358 1
1 882 . 12 1 1 A 102 102 ASP CB C 89 40.321 40.528 -0.207 1
1 883 . 12 1 1 A 103 103 TYR H H 90 7.899 8.005 -0.106 1
1 884 . 12 1 1 A 103 103 TYR HA H 90 4.940 4.460 0.480 1
1 889 . 12 1 1 A 103 103 TYR C C 90 175.527 178.533 -3.006 1
1 890 . 12 1 1 A 103 103 TYR CA C 90 58.135 60.545 -2.410 1
1 891 . 12 1 1 A 103 103 TYR CB C 90 38.446 37.479 0.967 1
1 894 . 12 1 1 A 103 103 TYR N N 90 115.595 119.623 -4.028 1
1 895 . 12 1 1 A 104 104 THR H H 91 7.971 8.477 -0.506 1
1 896 . 12 1 1 A 104 104 THR HA H 91 4.234 4.036 0.198 1
1 901 . 12 1 1 A 104 104 THR C C 91 175.905 176.650 -0.745 1
1 902 . 12 1 1 A 104 104 THR CA C 91 68.449 67.049 1.400 1
1 904 . 12 1 1 A 104 104 THR N N 91 118.867 116.583 2.284 1
1 905 . 12 1 1 A 105 105 LYS H H 92 8.555 7.843 0.712 1
1 906 . 12 1 1 A 105 105 LYS HA H 92 3.940 4.078 -0.138 1
1 912 . 12 1 1 A 105 105 LYS C C 92 177.310 178.597 -1.287 1
1 913 . 12 1 1 A 105 105 LYS CA C 92 60.948 59.418 1.530 1
1 914 . 12 1 1 A 105 105 LYS CB C 92 31.883 32.402 -0.519 1
1 917 . 12 1 1 A 105 105 LYS N N 92 119.259 121.003 -1.744 1
1 918 . 12 1 1 A 106 106 ALA H H 93 7.920 8.087 -0.167 1
1 919 . 12 1 1 A 106 106 ALA HA H 93 4.128 4.175 -0.047 1
1 923 . 12 1 1 A 106 106 ALA C C 93 180.972 180.410 0.562 1
1 924 . 12 1 1 A 106 106 ALA CA C 93 55.070 55.158 -0.088 1
1 925 . 12 1 1 A 106 106 ALA CB C 93 17.750 18.558 -0.808 1
1 926 . 12 1 1 A 106 106 ALA N N 93 120.398 121.357 -0.959 1
1 927 . 12 1 1 A 107 107 PHE H H 94 8.136 8.918 -0.782 1
1 928 . 12 1 1 A 107 107 PHE HA H 94 4.190 4.601 -0.411 1
1 934 . 12 1 1 A 107 107 PHE C C 94 177.955 178.318 -0.363 1
1 935 . 12 1 1 A 107 107 PHE CA C 94 63.761 61.554 2.207 1
1 936 . 12 1 1 A 107 107 PHE CB C 94 38.446 39.206 -0.760 1
1 940 . 12 1 1 A 107 107 PHE N N 94 117.119 116.279 0.840 1
1 941 . 12 1 1 A 108 108 LEU H H 95 8.351 8.672 -0.321 1
1 942 . 12 1 1 A 108 108 LEU HA H 95 3.889 3.970 -0.081 1
1 951 . 12 1 1 A 108 108 LEU C C 95 182.043 179.277 2.766 1
1 952 . 12 1 1 A 108 108 LEU CA C 95 59.073 58.572 0.501 1
1 953 . 12 1 1 A 108 108 LEU CB C 95 41.259 42.109 -0.850 1
1 956 . 12 1 1 A 108 108 LEU N N 95 118.450 119.805 -1.355 1
1 957 . 12 1 1 A 109 109 ILE H H 96 8.992 8.120 0.872 1
1 958 . 12 1 1 A 109 109 ILE HA H 96 4.069 3.871 0.198 1
1 968 . 12 1 1 A 109 109 ILE C C 96 177.094 177.704 -0.610 1
1 969 . 12 1 1 A 109 109 ILE CA C 96 63.761 64.071 -0.310 1
1 970 . 12 1 1 A 109 109 ILE CB C 96 37.509 37.711 -0.202 1
1 974 . 12 1 1 A 109 109 ILE N N 96 118.177 114.959 3.218 1
1 975 . 12 1 1 A 110 110 ASN H H 97 7.067 8.139 -1.072 1
1 976 . 12 1 1 A 110 110 ASN HA H 97 4.797 4.666 0.131 1
1 981 . 12 1 1 A 110 110 ASN C C 97 173.595 175.396 -1.801 1
1 982 . 12 1 1 A 110 110 ASN CA C 97 54.385 53.353 1.032 1
1 983 . 12 1 1 A 110 110 ASN CB C 97 40.321 38.925 1.396 1
1 984 . 12 1 1 A 110 110 ASN N N 97 116.407 119.392 -2.985 1
1 986 . 12 1 1 A 111 111 GLY H H 98 7.681 8.071 -0.390 1
1 987 . 12 1 1 A 111 111 GLY HA2 H 98 4.080 3.908 0.172 1
1 988 . 12 1 1 A 111 111 GLY HA3 H 98 3.640 3.998 -0.358 1
1 989 . 12 1 1 A 111 111 GLY C C 98 174.552 174.118 0.434 1
1 990 . 12 1 1 A 111 111 GLY CA C 98 45.947 44.973 0.974 1
1 991 . 12 1 1 A 111 111 GLY N N 98 104.440 105.846 -1.406 1
1 992 . 12 1 1 A 112 112 TYR H H 99 8.427 8.252 0.175 1
1 993 . 12 1 1 A 112 112 TYR HA H 99 4.661 4.733 -0.072 1
1 998 . 12 1 1 A 112 112 TYR C C 99 174.425 175.887 -1.462 1
1 999 . 12 1 1 A 112 112 TYR CA C 99 57.198 58.048 -0.850 1
1 1000 . 12 1 1 A 112 112 TYR CB C 99 36.571 38.162 -1.591 1
1 1003 . 12 1 1 A 112 112 TYR N N 99 122.830 120.267 2.563 1
1 1004 . 12 1 1 A 113 113 THR H H 100 7.166 8.813 -1.647 1
1 1005 . 12 1 1 A 113 113 THR HA H 100 4.248 4.604 -0.356 1
1 1009 . 12 1 1 A 113 113 THR C C 100 174.897 174.846 0.051 1
1 1010 . 12 1 1 A 113 113 THR CA C 100 62.290 62.453 -0.163 1
1 1011 . 12 1 1 A 113 113 THR CB C 100 68.970 69.783 -0.813 1
1 1013 . 12 1 1 A 113 113 THR N N 100 104.304 116.292 -11.988 1
1 1014 . 12 1 1 A 114 114 SER H H 101 7.695 8.054 -0.359 1
1 1015 . 12 1 1 A 114 114 SER C C 101 174.372 175.219 -0.847 1
1 1016 . 12 1 1 A 114 114 SER CA C 101 56.260 58.293 -2.033 1
1 1017 . 12 1 1 A 114 114 SER CB C 101 65.636 64.733 0.903 1
1 1018 . 12 1 1 A 114 114 SER N N 101 115.613 116.146 -0.533 1
1 1023 . 12 1 1 A 116 116 ASP HA H 103 4.260 4.298 -0.038 1
1 1026 . 12 1 1 A 116 116 ASP CA C 103 57.198 56.782 0.416 1
1 1027 . 12 1 1 A 116 116 ASP CB C 103 40.321 40.249 0.072 1
1 1028 . 12 1 1 A 117 117 LEU H H 104 7.345 7.818 -0.473 1
1 1029 . 12 1 1 A 117 117 LEU HA H 104 4.290 4.028 0.262 1
1 1038 . 12 1 1 A 117 117 LEU C C 104 178.488 179.437 -0.949 1
1 1039 . 12 1 1 A 117 117 LEU CA C 104 56.260 58.092 -1.832 1
1 1040 . 12 1 1 A 117 117 LEU CB C 104 42.196 40.958 1.238 1
1 1043 . 12 1 1 A 117 117 LEU N N 104 117.878 120.019 -2.141 1
1 1044 . 12 1 1 A 118 118 LEU H H 105 7.514 8.059 -0.545 1
1 1045 . 12 1 1 A 118 118 LEU HA H 105 4.210 4.151 0.059 1
1 1054 . 12 1 1 A 118 118 LEU C C 105 177.002 177.740 -0.738 1
1 1055 . 12 1 1 A 118 118 LEU CA C 105 55.323 57.002 -1.679 1
1 1056 . 12 1 1 A 118 118 LEU CB C 105 42.196 41.532 0.664 1
1 1059 . 12 1 1 A 118 118 LEU N N 105 119.094 117.964 1.130 1
1 1060 . 12 1 1 A 120 120 LYS HA H 107 4.340 4.518 -0.178 1
1 1063 . 12 1 1 A 120 120 LYS C C 107 176.603 175.806 0.797 1
1 1064 . 12 1 1 A 120 120 LYS CA C 107 55.323 55.681 -0.358 1
1 1065 . 12 1 1 A 120 120 LYS CB C 107 31.883 32.990 -1.107 1
1 1068 . 12 1 1 A 121 121 ILE H H 108 7.539 7.612 -0.073 1
1 1069 . 12 1 1 A 121 121 ILE HA H 108 3.987 5.023 -1.036 1
1 1079 . 12 1 1 A 121 121 ILE C C 108 173.247 175.027 -1.780 1
1 1080 . 12 1 1 A 121 121 ILE CA C 108 62.823 58.661 4.162 1
1 1081 . 12 1 1 A 121 121 ILE CB C 108 38.446 41.755 -3.309 1
1 1085 . 12 1 1 A 121 121 ILE N N 108 122.417 117.467 4.950 1
1 1086 . 12 1 1 A 122 122 ALA H H 109 8.290 8.085 0.205 1
1 1087 . 12 1 1 A 122 122 ALA HA H 109 3.970 4.641 -0.671 1
1 1091 . 12 1 1 A 122 122 ALA C C 109 178.318 177.943 0.375 1
1 1092 . 12 1 1 A 122 122 ALA CA C 109 50.150 49.790 0.360 1
1 1093 . 12 1 1 A 122 122 ALA CB C 109 21.630 21.647 -0.017 1
1 1094 . 12 1 1 A 122 122 ALA N N 109 127.784 123.785 3.999 1
1 1095 . 12 1 1 A 123 123 GLU HA H 110 3.707 3.897 -0.190 1
1 1099 . 12 1 1 A 123 123 GLU C C 110 178.290 178.164 0.126 1
1 1100 . 12 1 1 A 123 123 GLU CA C 110 60.948 60.219 0.729 1
1 1101 . 12 1 1 A 123 123 GLU CB C 110 29.070 29.755 -0.685 1
1 1102 . 12 1 1 A 124 124 VAL H H 111 8.333 8.241 0.092 1
1 1103 . 12 1 1 A 124 124 VAL HA H 111 3.850 3.769 0.081 1
1 1111 . 12 1 1 A 124 124 VAL C C 111 177.406 177.546 -0.140 1
1 1112 . 12 1 1 A 124 124 VAL CA C 111 65.636 65.114 0.522 1
1 1113 . 12 1 1 A 124 124 VAL CB C 111 30.730 31.176 -0.446 1
1 1116 . 12 1 1 A 124 124 VAL N N 111 114.438 118.856 -4.418 1
1 1117 . 12 1 1 A 125 125 GLU H H 112 7.442 8.305 -0.863 1
1 1118 . 12 1 1 A 125 125 GLU HA H 112 4.152 4.089 0.063 1
1 1123 . 12 1 1 A 125 125 GLU C C 112 179.982 179.404 0.578 1
1 1124 . 12 1 1 A 125 125 GLU CA C 112 60.010 59.468 0.542 1
1 1125 . 12 1 1 A 125 125 GLU CB C 112 30.008 29.427 0.581 1
1 1127 . 12 1 1 A 125 125 GLU N N 112 121.032 121.865 -0.833 1
1 1128 . 12 1 1 A 126 126 LEU H H 113 7.666 7.946 -0.280 1
1 1129 . 12 1 1 A 126 126 LEU HA H 113 3.846 4.031 -0.185 1
1 1138 . 12 1 1 A 126 126 LEU C C 113 176.991 178.845 -1.854 1
1 1139 . 12 1 1 A 126 126 LEU CA C 113 58.135 58.008 0.127 1
1 1140 . 12 1 1 A 126 126 LEU CB C 113 41.259 41.676 -0.417 1
1 1143 . 12 1 1 A 126 126 LEU N N 113 118.731 121.562 -2.831 1
1 1144 . 12 1 1 A 127 127 ILE H H 114 7.781 8.025 -0.244 1
1 1145 . 12 1 1 A 127 127 ILE HA H 114 3.502 3.876 -0.374 1
1 1153 . 12 1 1 A 127 127 ILE C C 114 178.195 176.759 1.436 1
1 1154 . 12 1 1 A 127 127 ILE CA C 114 65.636 62.913 2.723 1
1 1155 . 12 1 1 A 127 127 ILE CB C 114 40.321 37.687 2.634 1
1 1159 . 12 1 1 A 127 127 ILE N N 114 115.084 118.822 -3.738 1
1 1160 . 12 1 1 A 128 128 ASN H H 115 8.470 8.187 0.283 1
1 1161 . 12 1 1 A 128 128 ASN HA H 115 4.502 4.661 -0.159 1
1 1166 . 12 1 1 A 128 128 ASN C C 115 176.295 175.753 0.542 1
1 1167 . 12 1 1 A 128 128 ASN CA C 115 56.260 54.742 1.518 1
1 1168 . 12 1 1 A 128 128 ASN CB C 115 39.384 39.152 0.232 1
1 1169 . 12 1 1 A 128 128 ASN N N 115 115.158 119.200 -4.042 1
1 1171 . 12 1 1 A 129 129 VAL H H 116 8.116 7.689 0.427 1
1 1172 . 12 1 1 A 129 129 VAL HA H 116 4.090 3.998 0.092 1
1 1180 . 12 1 1 A 129 129 VAL C C 116 176.740 177.195 -0.455 1
1 1181 . 12 1 1 A 129 129 VAL CA C 116 64.400 64.500 -0.100 1
1 1182 . 12 1 1 A 129 129 VAL CB C 116 32.050 32.752 -0.702 1
1 1185 . 12 1 1 A 129 129 VAL N N 116 118.698 117.076 1.622 1
1 1186 . 12 1 1 A 130 130 LEU H H 117 7.294 7.936 -0.642 1
1 1187 . 12 1 1 A 130 130 LEU HA H 117 3.970 4.253 -0.283 1
1 1196 . 12 1 1 A 130 130 LEU C C 117 175.127 176.707 -1.580 1
1 1197 . 12 1 1 A 130 130 LEU CA C 117 56.260 55.079 1.181 1
1 1198 . 12 1 1 A 130 130 LEU CB C 117 41.259 42.498 -1.239 1
1 1201 . 12 1 1 A 130 130 LEU N N 117 116.201 118.751 -2.550 1
1 1202 . 12 1 1 A 131 131 LYS H H 118 6.594 8.178 -1.584 1
1 1203 . 12 1 1 A 131 131 LYS HA H 118 3.980 4.317 -0.337 1
1 1208 . 12 1 1 A 131 131 LYS C C 118 175.589 175.254 0.335 1
1 1209 . 12 1 1 A 131 131 LYS CA C 118 56.260 57.332 -1.072 1
1 1210 . 12 1 1 A 131 131 LYS CB C 118 28.133 30.856 -2.723 1
1 1212 . 12 1 1 A 131 131 LYS N N 118 111.172 118.863 -7.691 1
1 1213 . 12 1 1 A 132 132 ILE H H 119 8.245 8.006 0.239 1
1 1214 . 12 1 1 A 132 132 ILE HA H 119 4.090 4.372 -0.282 1
1 1224 . 12 1 1 A 132 132 ILE C C 119 175.161 175.765 -0.604 1
1 1225 . 12 1 1 A 132 132 ILE CA C 119 60.010 61.019 -1.009 1
1 1226 . 12 1 1 A 132 132 ILE CB C 119 35.633 36.945 -1.312 1
1 1230 . 12 1 1 A 132 132 ILE N N 119 119.484 119.829 -0.345 1
1 1231 . 12 1 1 A 133 133 ASN H H 120 8.054 8.617 -0.563 1
1 1232 . 12 1 1 A 133 133 ASN HA H 120 4.350 4.860 -0.510 1
1 1235 . 12 1 1 A 133 133 ASN C C 120 175.136 175.156 -0.020 1
1 1236 . 12 1 1 A 133 133 ASN CA C 120 54.385 54.168 0.217 1
1 1237 . 12 1 1 A 133 133 ASN CB C 120 39.384 39.373 0.011 1
1 1238 . 12 1 1 A 133 133 ASN N N 120 124.670 125.739 -1.069 1
1 1239 . 12 1 1 A 134 134 LEU H H 121 7.517 7.162 0.355 1
1 1240 . 12 1 1 A 134 134 LEU HA H 121 4.678 4.226 0.452 1
1 1249 . 12 1 1 A 134 134 LEU C C 121 178.051 176.458 1.593 1
1 1250 . 12 1 1 A 134 134 LEU CA C 121 53.447 55.376 -1.929 1
1 1251 . 12 1 1 A 134 134 LEU CB C 121 41.259 43.059 -1.800 1
1 1254 . 12 1 1 A 134 134 LEU N N 121 119.918 119.675 0.243 1
1 1255 . 12 1 1 A 135 135 ILE H H 122 9.389 8.588 0.801 1
1 1256 . 12 1 1 A 135 135 ILE HA H 122 3.540 3.651 -0.111 1
1 1266 . 12 1 1 A 135 135 ILE C C 122 176.425 177.679 -1.254 1
1 1267 . 12 1 1 A 135 135 ILE CA C 122 65.636 65.146 0.490 1
1 1268 . 12 1 1 A 135 135 ILE CB C 122 38.446 37.989 0.457 1
1 1272 . 12 1 1 A 135 135 ILE N N 122 129.949 127.101 2.848 1
1 1273 . 12 1 1 A 136 136 GLY H H 123 8.675 8.309 0.366 1
1 1274 . 12 1 1 A 136 136 GLY HA2 H 123 2.650 3.147 -0.497 1
1 1275 . 12 1 1 A 136 136 GLY HA3 H 123 2.060 3.579 -1.519 1
1 1276 . 12 1 1 A 136 136 GLY C C 123 176.854 176.183 0.671 1
1 1277 . 12 1 1 A 136 136 GLY CA C 123 45.500 46.952 -1.452 1
1 1278 . 12 1 1 A 136 136 GLY N N 123 106.314 108.094 -1.780 1
1 1279 . 12 1 1 A 137 137 HIS H H 124 6.869 7.880 -1.011 1
1 1280 . 12 1 1 A 137 137 HIS HA H 124 4.558 4.384 0.174 1
1 1285 . 12 1 1 A 137 137 HIS C C 124 176.977 177.226 -0.249 1
1 1286 . 12 1 1 A 137 137 HIS CA C 124 57.198 58.848 -1.650 1
1 1287 . 12 1 1 A 137 137 HIS CB C 124 30.945 30.059 0.886 1
1 1290 . 12 1 1 A 137 137 HIS N N 124 118.865 119.920 -1.055 1
1 1291 . 12 1 1 A 138 138 ARG H H 125 7.730 8.220 -0.490 1
1 1292 . 12 1 1 A 138 138 ARG HA H 125 3.770 3.852 -0.082 1
1 1299 . 12 1 1 A 138 138 ARG C C 125 178.288 178.392 -0.104 1
1 1300 . 12 1 1 A 138 138 ARG CA C 125 61.886 59.444 2.442 1
1 1301 . 12 1 1 A 138 138 ARG CB C 125 30.945 29.969 0.976 1
1 1304 . 12 1 1 A 138 138 ARG N N 125 118.149 119.361 -1.212 1
1 1306 . 12 1 1 A 139 139 LYS H H 126 8.679 8.290 0.389 1
1 1307 . 12 1 1 A 139 139 LYS HA H 126 3.990 3.917 0.073 1
1 1310 . 12 1 1 A 139 139 LYS C C 126 179.184 178.834 0.350 1
1 1311 . 12 1 1 A 139 139 LYS CA C 126 58.135 59.386 -1.251 1
1 1312 . 12 1 1 A 139 139 LYS CB C 126 30.945 32.180 -1.235 1
1 1314 . 12 1 1 A 139 139 LYS N N 126 114.003 119.000 -4.997 1
1 1315 . 12 1 1 A 140 140 ARG H H 127 7.248 7.938 -0.690 1
1 1316 . 12 1 1 A 140 140 ARG HA H 127 3.870 3.998 -0.128 1
1 1324 . 12 1 1 A 140 140 ARG C C 127 177.772 178.789 -1.017 1
1 1325 . 12 1 1 A 140 140 ARG CA C 127 60.010 58.973 1.037 1
1 1326 . 12 1 1 A 140 140 ARG CB C 127 30.945 29.729 1.216 1
1 1329 . 12 1 1 A 140 140 ARG N N 127 120.072 119.072 1.000 1
1 1331 . 12 1 1 A 141 141 ILE H H 128 7.706 7.758 -0.052 1
1 1332 . 12 1 1 A 141 141 ILE HA H 128 3.530 3.951 -0.421 1
1 1340 . 12 1 1 A 141 141 ILE C C 128 177.669 178.080 -0.411 1
1 1341 . 12 1 1 A 141 141 ILE CA C 128 65.636 64.415 1.221 1
1 1342 . 12 1 1 A 141 141 ILE CB C 128 38.680 37.519 1.161 1
1 1345 . 12 1 1 A 141 141 ILE N N 128 118.730 117.828 0.902 1
1 1346 . 12 1 1 A 142 142 LEU H H 129 8.194 8.440 -0.246 1
1 1347 . 12 1 1 A 142 142 LEU HA H 129 3.950 4.019 -0.069 1
1 1356 . 12 1 1 A 142 142 LEU C C 129 179.960 178.229 1.731 1
1 1357 . 12 1 1 A 142 142 LEU CA C 129 58.135 58.347 -0.212 1
1 1358 . 12 1 1 A 142 142 LEU CB C 129 41.259 42.135 -0.876 1
1 1361 . 12 1 1 A 142 142 LEU N N 129 117.675 124.138 -6.463 1
1 1362 . 12 1 1 A 143 143 ALA H H 130 8.294 8.832 -0.538 1
1 1363 . 12 1 1 A 143 143 ALA HA H 130 4.220 4.337 -0.117 1
1 1367 . 12 1 1 A 143 143 ALA C C 130 179.899 179.928 -0.029 1
1 1368 . 12 1 1 A 143 143 ALA CA C 130 54.385 55.143 -0.758 1
1 1369 . 12 1 1 A 143 143 ALA CB C 130 19.270 18.137 1.133 1
1 1370 . 12 1 1 A 143 143 ALA N N 130 121.096 120.932 0.164 1
1 1371 . 12 1 1 A 144 144 SER H H 131 7.813 7.890 -0.077 1
1 1372 . 12 1 1 A 144 144 SER HA H 131 4.180 4.244 -0.064 1
1 1375 . 12 1 1 A 144 144 SER C C 131 175.457 177.520 -2.063 1
1 1376 . 12 1 1 A 144 144 SER CA C 131 60.948 61.607 -0.659 1
1 1377 . 12 1 1 A 144 144 SER CB C 131 63.761 63.163 0.598 1
1 1378 . 12 1 1 A 144 144 SER N N 131 112.102 114.100 -1.998 1
1 1379 . 12 1 1 A 145 145 LEU H H 132 7.747 8.227 -0.480 1
1 1380 . 12 1 1 A 145 145 LEU HA H 132 4.140 3.883 0.257 1
1 1389 . 12 1 1 A 145 145 LEU C C 132 178.589 177.350 1.239 1
1 1390 . 12 1 1 A 145 145 LEU CA C 132 56.260 58.452 -2.192 1
1 1391 . 12 1 1 A 145 145 LEU CB C 132 42.196 42.030 0.166 1
1 1394 . 12 1 1 A 145 145 LEU N N 132 117.536 121.132 -3.596 1
1 1395 . 12 1 1 A 146 146 GLY H H 133 7.544 7.904 -0.360 1
1 1396 . 12 1 1 A 146 146 GLY HA2 H 133 3.950 4.073 -0.123 1
1 1397 . 12 1 1 A 146 146 GLY HA3 H 133 3.100 4.073 -0.973 1
1 1398 . 12 1 1 A 146 146 GLY C C 133 173.372 171.928 1.444 1
1 1399 . 12 1 1 A 146 146 GLY CA C 133 45.947 45.154 0.793 1
1 1400 . 12 1 1 A 146 146 GLY N N 133 105.351 103.708 1.643 1
1 1401 . 12 1 1 A 147 147 ASP H H 134 8.342 8.789 -0.447 1
1 1402 . 12 1 1 A 147 147 ASP HA H 134 4.650 5.297 -0.647 1
1 1405 . 12 1 1 A 147 147 ASP C C 134 175.462 174.597 0.865 1
1 1406 . 12 1 1 A 147 147 ASP CA C 134 54.385 52.335 2.050 1
1 1407 . 12 1 1 A 147 147 ASP CB C 134 41.259 44.398 -3.139 1
1 1408 . 12 1 1 A 147 147 ASP N N 134 120.133 120.232 -0.099 1
1 14 . 13 1 1 A 15 15 GLN H H 2 8.439 8.977 -0.538 1
1 15 . 13 1 1 A 15 15 GLN HA H 2 4.594 4.616 -0.022 1
1 20 . 13 1 1 A 15 15 GLN C C 2 175.972 174.982 0.990 1
1 21 . 13 1 1 A 15 15 GLN CA C 2 56.260 55.087 1.173 1
1 22 . 13 1 1 A 15 15 GLN CB C 2 30.945 30.081 0.864 1
1 24 . 13 1 1 A 15 15 GLN N N 2 124.997 128.013 -3.016 1
1 25 . 13 1 1 A 16 16 THR H H 3 8.347 8.785 -0.438 1
1 26 . 13 1 1 A 16 16 THR HA H 3 4.555 4.741 -0.186 1
1 31 . 13 1 1 A 16 16 THR C C 3 175.495 174.760 0.735 1
1 32 . 13 1 1 A 16 16 THR CA C 3 60.010 62.088 -2.078 1
1 33 . 13 1 1 A 16 16 THR CB C 3 71.261 70.676 0.585 1
1 34 . 13 1 1 A 16 16 THR N N 3 113.011 118.712 -5.701 1
1 35 . 13 1 1 A 17 17 VAL H H 4 8.895 8.659 0.236 1
1 36 . 13 1 1 A 17 17 VAL HA H 4 3.670 3.753 -0.083 1
1 44 . 13 1 1 A 17 17 VAL C C 4 178.449 177.669 0.780 1
1 45 . 13 1 1 A 17 17 VAL CA C 4 67.511 66.459 1.052 1
1 46 . 13 1 1 A 17 17 VAL CB C 4 31.883 31.861 0.022 1
1 49 . 13 1 1 A 17 17 VAL N N 4 121.854 126.098 -4.244 1
1 50 . 13 1 1 A 18 18 GLY H H 5 9.017 8.178 0.839 1
1 51 . 13 1 1 A 18 18 GLY HA2 H 5 3.940 3.787 0.153 1
1 52 . 13 1 1 A 18 18 GLY HA3 H 5 3.610 3.801 -0.191 1
1 53 . 13 1 1 A 18 18 GLY C C 5 176.186 175.548 0.638 1
1 54 . 13 1 1 A 18 18 GLY CA C 5 47.822 47.034 0.788 1
1 55 . 13 1 1 A 18 18 GLY N N 5 106.966 107.905 -0.939 1
1 56 . 13 1 1 A 19 19 GLN H H 6 8.072 8.340 -0.268 1
1 57 . 13 1 1 A 19 19 GLN HA H 6 4.037 4.076 -0.039 1
1 62 . 13 1 1 A 19 19 GLN C C 6 179.488 177.905 1.583 1
1 63 . 13 1 1 A 19 19 GLN CA C 6 59.073 58.810 0.263 1
1 64 . 13 1 1 A 19 19 GLN CB C 6 28.489 28.884 -0.395 1
1 66 . 13 1 1 A 19 19 GLN N N 6 122.431 121.076 1.355 1
1 67 . 13 1 1 A 20 20 TRP H H 7 8.756 8.239 0.517 1
1 68 . 13 1 1 A 20 20 TRP HA H 7 4.160 4.326 -0.166 1
1 77 . 13 1 1 A 20 20 TRP C C 7 179.620 178.007 1.613 1
1 78 . 13 1 1 A 20 20 TRP CA C 7 61.886 61.303 0.583 1
1 79 . 13 1 1 A 20 20 TRP CB C 7 28.133 29.739 -1.606 1
1 85 . 13 1 1 A 20 20 TRP N N 7 124.265 122.086 2.179 1
1 87 . 13 1 1 A 21 21 LEU H H 8 9.148 8.739 0.409 1
1 88 . 13 1 1 A 21 21 LEU HA H 8 3.440 3.476 -0.036 1
1 97 . 13 1 1 A 21 21 LEU C C 8 180.521 178.499 2.022 1
1 98 . 13 1 1 A 21 21 LEU CA C 8 56.920 57.630 -0.710 1
1 99 . 13 1 1 A 21 21 LEU CB C 8 41.700 41.529 0.171 1
1 102 . 13 1 1 A 21 21 LEU N N 8 120.548 120.790 -0.242 1
1 103 . 13 1 1 A 22 22 GLU H H 9 8.284 8.213 0.071 1
1 104 . 13 1 1 A 22 22 GLU HA H 9 3.740 3.995 -0.255 1
1 109 . 13 1 1 A 22 22 GLU C C 9 179.960 178.447 1.513 1
1 110 . 13 1 1 A 22 22 GLU CA C 9 60.010 59.091 0.919 1
1 111 . 13 1 1 A 22 22 GLU CB C 9 29.070 29.254 -0.184 1
1 113 . 13 1 1 A 22 22 GLU N N 9 120.133 119.161 0.972 1
1 114 . 13 1 1 A 23 23 SER H H 10 7.891 7.813 0.078 1
1 115 . 13 1 1 A 23 23 SER HA H 10 4.250 4.230 0.020 1
1 118 . 13 1 1 A 23 23 SER C C 10 175.346 176.488 -1.142 1
1 119 . 13 1 1 A 23 23 SER CA C 10 60.948 61.334 -0.386 1
1 120 . 13 1 1 A 23 23 SER CB C 10 63.280 62.837 0.443 1
1 121 . 13 1 1 A 23 23 SER N N 10 117.044 114.220 2.824 1
1 122 . 13 1 1 A 24 24 ILE H H 11 6.862 7.586 -0.724 1
1 123 . 13 1 1 A 24 24 ILE HA H 11 4.487 3.824 0.663 1
1 133 . 13 1 1 A 24 24 ILE C C 11 175.812 176.455 -0.643 1
1 134 . 13 1 1 A 24 24 ILE CA C 11 60.948 63.291 -2.343 1
1 135 . 13 1 1 A 24 24 ILE CB C 11 38.250 37.360 0.890 1
1 139 . 13 1 1 A 24 24 ILE N N 11 113.733 119.136 -5.403 1
1 140 . 13 1 1 A 25 25 GLY H H 12 7.628 7.580 0.048 1
1 141 . 13 1 1 A 25 25 GLY HA2 H 12 3.990 3.844 0.146 1
1 142 . 13 1 1 A 25 25 GLY HA3 H 12 3.800 3.934 -0.134 1
1 143 . 13 1 1 A 25 25 GLY C C 12 173.647 172.008 1.639 1
1 144 . 13 1 1 A 25 25 GLY CA C 12 45.947 45.534 0.413 1
1 145 . 13 1 1 A 25 25 GLY N N 12 109.763 110.297 -0.534 1
1 146 . 13 1 1 A 26 26 LEU H H 13 7.620 8.067 -0.447 1
1 147 . 13 1 1 A 26 26 LEU C C 13 176.186 176.724 -0.538 1
1 148 . 13 1 1 A 26 26 LEU CA C 13 52.700 51.957 0.743 1
1 149 . 13 1 1 A 26 26 LEU CB C 13 43.134 45.572 -2.438 1
1 150 . 13 1 1 A 26 26 LEU N N 13 118.778 121.748 -2.970 1
1 151 . 13 1 1 A 27 27 PRO HA H 14 4.120 4.492 -0.372 1
1 154 . 13 1 1 A 27 27 PRO C C 14 177.955 177.861 0.094 1
1 155 . 13 1 1 A 27 27 PRO CA C 14 64.698 64.374 0.324 1
1 156 . 13 1 1 A 27 27 PRO CB C 14 31.883 31.915 -0.032 1
1 158 . 13 1 1 A 28 28 GLN H H 15 9.838 8.453 1.385 1
1 159 . 13 1 1 A 28 28 GLN HA H 15 4.240 3.969 0.271 1
1 162 . 13 1 1 A 28 28 GLN C C 15 176.836 176.667 0.169 1
1 163 . 13 1 1 A 28 28 GLN CA C 15 58.135 58.341 -0.206 1
1 164 . 13 1 1 A 28 28 GLN CB C 15 27.195 28.055 -0.860 1
1 166 . 13 1 1 A 28 28 GLN N N 15 120.414 117.402 3.012 1
1 167 . 13 1 1 A 29 29 TYR H H 16 6.810 7.214 -0.404 1
1 168 . 13 1 1 A 29 29 TYR HA H 16 5.720 4.487 1.233 1
1 173 . 13 1 1 A 29 29 TYR C C 16 174.814 177.364 -2.550 1
1 174 . 13 1 1 A 29 29 TYR CA C 16 57.198 59.039 -1.841 1
1 175 . 13 1 1 A 29 29 TYR CB C 16 37.509 40.053 -2.544 1
1 178 . 13 1 1 A 29 29 TYR N N 16 119.718 117.337 2.381 1
1 179 . 13 1 1 A 30 30 GLU H H 17 7.509 8.355 -0.846 1
1 180 . 13 1 1 A 30 30 GLU HA H 17 3.650 4.068 -0.418 1
1 184 . 13 1 1 A 30 30 GLU C C 17 177.552 178.452 -0.900 1
1 185 . 13 1 1 A 30 30 GLU CA C 17 60.948 59.768 1.180 1
1 186 . 13 1 1 A 30 30 GLU CB C 17 30.008 29.130 0.878 1
1 188 . 13 1 1 A 30 30 GLU N N 17 122.417 121.967 0.450 1
1 189 . 13 1 1 A 31 31 ASN H H 18 9.259 8.191 1.068 1
1 190 . 13 1 1 A 31 31 ASN HA H 18 4.451 4.472 -0.021 1
1 193 . 13 1 1 A 31 31 ASN C C 18 176.868 177.939 -1.071 1
1 194 . 13 1 1 A 31 31 ASN CA C 18 57.198 56.446 0.752 1
1 195 . 13 1 1 A 31 31 ASN CB C 18 38.446 39.738 -1.292 1
1 196 . 13 1 1 A 31 31 ASN N N 18 116.613 118.312 -1.699 1
1 197 . 13 1 1 A 32 32 HIS H H 19 8.898 8.306 0.592 1
1 198 . 13 1 1 A 32 32 HIS HA H 19 4.140 4.384 -0.244 1
1 202 . 13 1 1 A 32 32 HIS C C 19 178.269 177.717 0.552 1
1 203 . 13 1 1 A 32 32 HIS CA C 19 60.948 59.198 1.750 1
1 204 . 13 1 1 A 32 32 HIS CB C 19 30.008 30.307 -0.299 1
1 206 . 13 1 1 A 32 32 HIS N N 19 118.926 118.469 0.457 1
1 207 . 13 1 1 A 33 33 LEU H H 20 7.825 8.880 -1.055 1
1 208 . 13 1 1 A 33 33 LEU HA H 20 4.305 3.975 0.330 1
1 218 . 13 1 1 A 33 33 LEU C C 20 179.190 179.108 0.082 1
1 219 . 13 1 1 A 33 33 LEU CA C 20 60.010 58.424 1.586 1
1 220 . 13 1 1 A 33 33 LEU CB C 20 40.321 41.833 -1.512 1
1 224 . 13 1 1 A 33 33 LEU N N 20 117.434 119.899 -2.465 1
1 225 . 13 1 1 A 34 34 MET H H 21 8.861 8.442 0.419 1
1 226 . 13 1 1 A 34 34 MET HA H 21 3.980 4.128 -0.148 1
1 234 . 13 1 1 A 34 34 MET C C 21 180.340 177.928 2.412 1
1 235 . 13 1 1 A 34 34 MET CA C 21 58.135 59.142 -1.007 1
1 236 . 13 1 1 A 34 34 MET CB C 21 30.945 32.075 -1.130 1
1 238 . 13 1 1 A 34 34 MET N N 21 118.111 118.549 -0.438 1
1 239 . 13 1 1 A 35 35 ALA H H 22 9.015 8.302 0.713 1
1 240 . 13 1 1 A 35 35 ALA HA H 22 4.239 4.175 0.064 1
1 244 . 13 1 1 A 35 35 ALA C C 22 178.058 178.632 -0.574 1
1 245 . 13 1 1 A 35 35 ALA CA C 22 53.800 54.539 -0.739 1
1 246 . 13 1 1 A 35 35 ALA CB C 22 18.397 18.300 0.097 1
1 247 . 13 1 1 A 35 35 ALA N N 22 120.068 121.407 -1.339 1
1 248 . 13 1 1 A 36 36 ASN H H 23 7.143 7.948 -0.805 1
1 249 . 13 1 1 A 36 36 ASN HA H 23 4.959 4.775 0.184 1
1 254 . 13 1 1 A 36 36 ASN C C 23 174.083 175.487 -1.404 1
1 255 . 13 1 1 A 36 36 ASN CA C 23 54.000 52.977 1.023 1
1 256 . 13 1 1 A 36 36 ASN CB C 23 41.300 38.902 2.398 1
1 257 . 13 1 1 A 36 36 ASN N N 23 111.560 115.025 -3.465 1
1 259 . 13 1 1 A 37 37 GLY H H 24 7.797 8.299 -0.502 1
1 260 . 13 1 1 A 37 37 GLY HA2 H 24 3.430 3.824 -0.394 1
1 261 . 13 1 1 A 37 37 GLY HA3 H 24 3.290 3.912 -0.622 1
1 262 . 13 1 1 A 37 37 GLY C C 24 173.163 174.802 -1.639 1
1 263 . 13 1 1 A 37 37 GLY CA C 24 45.947 45.173 0.774 1
1 264 . 13 1 1 A 37 37 GLY N N 24 106.170 107.621 -1.451 1
1 265 . 13 1 1 A 38 38 PHE H H 25 8.191 7.915 0.276 1
1 266 . 13 1 1 A 38 38 PHE HA H 25 4.910 4.786 0.124 1
1 271 . 13 1 1 A 38 38 PHE C C 25 173.496 175.636 -2.140 1
1 272 . 13 1 1 A 38 38 PHE CA C 25 56.550 56.353 0.197 1
1 273 . 13 1 1 A 38 38 PHE CB C 25 37.220 37.124 0.096 1
1 276 . 13 1 1 A 38 38 PHE N N 25 122.454 119.848 2.606 1
1 277 . 13 1 1 A 39 39 ASP H H 26 6.756 8.556 -1.800 1
1 278 . 13 1 1 A 39 39 ASP HA H 26 5.077 4.913 0.164 1
1 281 . 13 1 1 A 39 39 ASP C C 26 177.463 175.460 2.003 1
1 282 . 13 1 1 A 39 39 ASP CA C 26 53.447 54.258 -0.811 1
1 283 . 13 1 1 A 39 39 ASP CB C 26 42.580 42.118 0.462 1
1 284 . 13 1 1 A 39 39 ASP N N 26 111.309 120.820 -9.511 1
1 285 . 13 1 1 A 40 40 ASN H H 27 7.495 7.995 -0.500 1
1 286 . 13 1 1 A 40 40 ASN HA H 27 4.820 5.002 -0.182 1
1 289 . 13 1 1 A 40 40 ASN C C 27 176.228 175.882 0.346 1
1 290 . 13 1 1 A 40 40 ASN CA C 27 52.510 51.922 0.588 1
1 291 . 13 1 1 A 40 40 ASN CB C 27 40.321 40.232 0.089 1
1 292 . 13 1 1 A 40 40 ASN N N 27 118.385 118.024 0.361 1
1 293 . 13 1 1 A 41 41 VAL H H 28 9.192 8.660 0.532 1
1 294 . 13 1 1 A 41 41 VAL HA H 28 3.550 3.698 -0.148 1
1 302 . 13 1 1 A 41 41 VAL C C 28 176.429 177.561 -1.132 1
1 303 . 13 1 1 A 41 41 VAL CA C 28 65.636 66.055 -0.419 1
1 304 . 13 1 1 A 41 41 VAL CB C 28 31.883 31.629 0.254 1
1 307 . 13 1 1 A 41 41 VAL N N 28 125.741 125.923 -0.182 1
1 308 . 13 1 1 A 42 42 GLN H H 29 8.203 8.260 -0.057 1
1 309 . 13 1 1 A 42 42 GLN HA H 29 4.129 4.004 0.125 1
1 314 . 13 1 1 A 42 42 GLN C C 29 176.591 178.943 -2.352 1
1 315 . 13 1 1 A 42 42 GLN CA C 29 57.198 59.161 -1.963 1
1 316 . 13 1 1 A 42 42 GLN CB C 29 28.133 28.047 0.086 1
1 318 . 13 1 1 A 42 42 GLN N N 29 116.452 119.035 -2.583 1
1 319 . 13 1 1 A 43 43 ALA H H 30 7.781 8.381 -0.600 1
1 320 . 13 1 1 A 43 43 ALA HA H 30 4.650 4.043 0.607 1
1 324 . 13 1 1 A 43 43 ALA C C 30 175.976 180.075 -4.099 1
1 325 . 13 1 1 A 43 43 ALA CA C 30 50.840 54.661 -3.821 1
1 326 . 13 1 1 A 43 43 ALA CB C 30 19.150 18.415 0.735 1
1 327 . 13 1 1 A 43 43 ALA N N 30 122.150 120.823 1.327 1
1 328 . 13 1 1 A 44 44 MET H H 31 7.739 8.149 -0.410 1
1 332 . 13 1 1 A 44 44 MET C C 31 178.275 178.742 -0.467 1
1 333 . 13 1 1 A 44 44 MET CA C 31 55.323 58.262 -2.939 1
1 334 . 13 1 1 A 44 44 MET CB C 31 34.696 31.579 3.117 1
1 336 . 13 1 1 A 44 44 MET N N 31 118.149 116.881 1.268 1
1 337 . 13 1 1 A 45 45 GLY H H 32 7.611 8.444 -0.833 1
1 338 . 13 1 1 A 45 45 GLY N N 32 101.530 109.266 -7.736 1
1 339 . 13 1 1 A 47 47 ASN HA H 34 4.480 5.133 -0.653 1
1 342 . 13 1 1 A 47 47 ASN CA C 34 56.260 52.395 3.865 1
1 343 . 13 1 1 A 47 47 ASN CB C 34 39.384 40.521 -1.137 1
1 344 . 13 1 1 A 49 49 MET HA H 36 4.646 4.495 0.151 1
1 350 . 13 1 1 A 49 49 MET C C 36 173.651 176.054 -2.403 1
1 351 . 13 1 1 A 49 49 MET CA C 36 55.323 56.156 -0.833 1
1 352 . 13 1 1 A 49 49 MET CB C 36 35.633 32.998 2.635 1
1 355 . 13 1 1 A 50 50 GLU H H 37 9.203 8.385 0.818 1
1 356 . 13 1 1 A 50 50 GLU HA H 37 4.650 4.796 -0.146 1
1 361 . 13 1 1 A 50 50 GLU C C 37 177.008 177.117 -0.109 1
1 362 . 13 1 1 A 50 50 GLU CA C 37 54.385 54.450 -0.065 1
1 363 . 13 1 1 A 50 50 GLU CB C 37 33.758 33.227 0.531 1
1 365 . 13 1 1 A 50 50 GLU N N 37 123.229 122.383 0.846 1
1 366 . 13 1 1 A 51 51 ASP H H 38 9.032 8.968 0.064 1
1 367 . 13 1 1 A 51 51 ASP HA H 38 4.149 4.393 -0.244 1
1 370 . 13 1 1 A 51 51 ASP C C 38 177.994 178.446 -0.452 1
1 371 . 13 1 1 A 51 51 ASP CA C 38 59.073 57.256 1.817 1
1 372 . 13 1 1 A 51 51 ASP CB C 38 43.134 39.969 3.165 1
1 373 . 13 1 1 A 51 51 ASP N N 38 122.717 123.705 -0.988 1
1 374 . 13 1 1 A 52 52 GLN H H 39 8.950 7.924 1.026 1
1 375 . 13 1 1 A 52 52 GLN HA H 39 3.940 4.006 -0.066 1
1 378 . 13 1 1 A 52 52 GLN C C 39 177.817 177.991 -0.174 1
1 379 . 13 1 1 A 52 52 GLN CA C 39 59.073 59.037 0.036 1
1 380 . 13 1 1 A 52 52 GLN CB C 39 28.133 28.267 -0.134 1
1 381 . 13 1 1 A 52 52 GLN N N 39 114.086 118.956 -4.870 1
1 382 . 13 1 1 A 53 53 ASP H H 40 7.214 8.095 -0.881 1
1 383 . 13 1 1 A 53 53 ASP HA H 40 4.370 4.371 -0.001 1
1 386 . 13 1 1 A 53 53 ASP C C 40 177.667 178.822 -1.155 1
1 387 . 13 1 1 A 53 53 ASP CA C 40 57.198 57.110 0.088 1
1 388 . 13 1 1 A 53 53 ASP CB C 40 41.800 40.885 0.915 1
1 389 . 13 1 1 A 53 53 ASP N N 40 118.734 120.020 -1.286 1
1 390 . 13 1 1 A 54 54 LEU H H 41 7.180 8.138 -0.958 1
1 391 . 13 1 1 A 54 54 LEU HA H 41 3.990 4.044 -0.054 1
1 400 . 13 1 1 A 54 54 LEU C C 41 178.204 178.555 -0.351 1
1 401 . 13 1 1 A 54 54 LEU CA C 41 56.260 57.919 -1.659 1
1 402 . 13 1 1 A 54 54 LEU CB C 41 41.259 41.543 -0.284 1
1 405 . 13 1 1 A 54 54 LEU N N 41 115.795 116.876 -1.081 1
1 406 . 13 1 1 A 55 55 LEU H H 42 7.823 8.005 -0.182 1
1 407 . 13 1 1 A 55 55 LEU HA H 42 3.920 4.122 -0.202 1
1 416 . 13 1 1 A 55 55 LEU C C 42 180.876 178.543 2.333 1
1 417 . 13 1 1 A 55 55 LEU CA C 42 58.135 57.941 0.194 1
1 418 . 13 1 1 A 55 55 LEU CB C 42 42.196 41.802 0.394 1
1 421 . 13 1 1 A 55 55 LEU N N 42 120.499 121.630 -1.131 1
1 422 . 13 1 1 A 56 56 GLU H H 43 8.127 8.249 -0.122 1
1 423 . 13 1 1 A 56 56 GLU HA H 43 3.966 4.127 -0.161 1
1 428 . 13 1 1 A 56 56 GLU C C 43 178.801 179.005 -0.204 1
1 429 . 13 1 1 A 56 56 GLU CA C 43 60.010 59.513 0.497 1
1 430 . 13 1 1 A 56 56 GLU CB C 43 29.070 29.071 -0.001 1
1 432 . 13 1 1 A 56 56 GLU N N 43 120.955 119.009 1.946 1
1 433 . 13 1 1 A 57 57 ILE H H 44 7.504 7.664 -0.160 1
1 434 . 13 1 1 A 57 57 ILE HA H 44 4.524 3.924 0.600 1
1 444 . 13 1 1 A 57 57 ILE C C 44 175.691 176.744 -1.053 1
1 445 . 13 1 1 A 57 57 ILE CA C 44 61.886 64.406 -2.520 1
1 446 . 13 1 1 A 57 57 ILE CB C 44 37.300 38.385 -1.085 1
1 450 . 13 1 1 A 57 57 ILE N N 44 109.594 118.713 -9.119 1
1 451 . 13 1 1 A 58 58 GLY H H 45 7.724 7.741 -0.017 1
1 452 . 13 1 1 A 58 58 GLY HA2 H 45 3.650 4.172 -0.522 1
1 453 . 13 1 1 A 58 58 GLY HA3 H 45 4.530 4.322 0.208 1
1 454 . 13 1 1 A 58 58 GLY C C 45 174.613 175.184 -0.571 1
1 455 . 13 1 1 A 58 58 GLY CA C 45 45.947 45.208 0.739 1
1 456 . 13 1 1 A 58 58 GLY N N 45 106.680 107.493 -0.813 1
1 457 . 13 1 1 A 59 59 ILE H H 46 8.180 8.047 0.133 1
1 458 . 13 1 1 A 59 59 ILE HA H 46 3.907 4.624 -0.717 1
1 468 . 13 1 1 A 59 59 ILE C C 46 174.235 175.650 -1.415 1
1 469 . 13 1 1 A 59 59 ILE CA C 46 60.948 60.717 0.231 1
1 470 . 13 1 1 A 59 59 ILE CB C 46 33.980 38.065 -4.085 1
1 474 . 13 1 1 A 59 59 ILE N N 46 122.454 118.111 4.343 1
1 475 . 13 1 1 A 60 60 LEU H H 47 7.367 7.505 -0.138 1
1 476 . 13 1 1 A 60 60 LEU HA H 47 3.900 4.327 -0.427 1
1 479 . 13 1 1 A 60 60 LEU C C 47 177.753 177.727 0.026 1
1 480 . 13 1 1 A 60 60 LEU CA C 47 56.260 55.493 0.767 1
1 481 . 13 1 1 A 60 60 LEU CB C 47 42.196 42.717 -0.521 1
1 482 . 13 1 1 A 60 60 LEU N N 47 125.835 123.534 2.301 1
1 483 . 13 1 1 A 63 63 GLY HA2 H 50 3.980 3.974 0.006 1
1 484 . 13 1 1 A 63 63 GLY HA3 H 50 3.950 3.982 -0.032 1
1 485 . 13 1 1 A 63 63 GLY C C 50 177.130 175.318 1.812 1
1 486 . 13 1 1 A 63 63 GLY CA C 50 46.884 45.457 1.427 1
1 487 . 13 1 1 A 64 64 HIS H H 51 7.926 8.001 -0.075 1
1 488 . 13 1 1 A 64 64 HIS HA H 51 4.451 4.024 0.427 1
1 493 . 13 1 1 A 64 64 HIS C C 51 177.613 177.291 0.322 1
1 494 . 13 1 1 A 64 64 HIS CA C 51 57.198 59.289 -2.091 1
1 495 . 13 1 1 A 64 64 HIS CB C 51 30.945 29.785 1.160 1
1 498 . 13 1 1 A 64 64 HIS N N 51 122.284 120.673 1.611 1
1 499 . 13 1 1 A 65 65 ARG H H 52 8.105 8.089 0.016 1
1 500 . 13 1 1 A 65 65 ARG HA H 52 3.685 3.681 0.004 1
1 507 . 13 1 1 A 65 65 ARG C C 52 177.769 178.632 -0.863 1
1 508 . 13 1 1 A 65 65 ARG CA C 52 61.886 59.719 2.167 1
1 509 . 13 1 1 A 65 65 ARG CB C 52 30.945 29.973 0.972 1
1 511 . 13 1 1 A 65 65 ARG N N 52 117.775 117.945 -0.170 1
1 513 . 13 1 1 A 66 66 GLN H H 53 8.090 7.982 0.108 1
1 514 . 13 1 1 A 66 66 GLN HA H 53 3.940 4.030 -0.090 1
1 519 . 13 1 1 A 66 66 GLN C C 53 178.583 177.879 0.704 1
1 520 . 13 1 1 A 66 66 GLN CA C 53 59.073 58.839 0.234 1
1 521 . 13 1 1 A 66 66 GLN CB C 53 28.133 28.589 -0.456 1
1 523 . 13 1 1 A 66 66 GLN N N 53 116.452 118.825 -2.373 1
1 524 . 13 1 1 A 67 67 ARG H H 54 7.845 7.876 -0.031 1
1 525 . 13 1 1 A 67 67 ARG HA H 54 4.010 4.034 -0.024 1
1 528 . 13 1 1 A 67 67 ARG C C 54 179.766 178.973 0.793 1
1 529 . 13 1 1 A 67 67 ARG CA C 54 59.073 59.059 0.014 1
1 530 . 13 1 1 A 67 67 ARG CB C 54 30.720 29.736 0.984 1
1 532 . 13 1 1 A 67 67 ARG N N 54 119.275 119.593 -0.318 1
1 533 . 13 1 1 A 68 68 ILE H H 55 8.032 7.802 0.230 1
1 534 . 13 1 1 A 68 68 ILE HA H 55 3.495 3.516 -0.021 1
1 544 . 13 1 1 A 68 68 ILE C C 55 177.108 178.795 -1.687 1
1 545 . 13 1 1 A 68 68 ILE CA C 55 66.230 64.254 1.976 1
1 546 . 13 1 1 A 68 68 ILE CB C 55 38.020 36.935 1.085 1
1 550 . 13 1 1 A 68 68 ILE N N 55 121.152 118.940 2.212 1
1 551 . 13 1 1 A 69 69 LEU H H 56 8.490 8.154 0.336 1
1 552 . 13 1 1 A 69 69 LEU HA H 56 4.010 3.783 0.227 1
1 561 . 13 1 1 A 69 69 LEU C C 56 179.917 178.849 1.068 1
1 562 . 13 1 1 A 69 69 LEU CA C 56 58.135 58.265 -0.130 1
1 563 . 13 1 1 A 69 69 LEU CB C 56 41.259 41.533 -0.274 1
1 566 . 13 1 1 A 69 69 LEU N N 56 119.072 121.208 -2.136 1
1 567 . 13 1 1 A 70 70 GLN H H 57 8.327 8.418 -0.091 1
1 568 . 13 1 1 A 70 70 GLN HA H 57 4.100 3.952 0.148 1
1 573 . 13 1 1 A 70 70 GLN C C 57 178.798 178.144 0.654 1
1 574 . 13 1 1 A 70 70 GLN CA C 57 59.073 58.793 0.280 1
1 575 . 13 1 1 A 70 70 GLN CB C 57 28.133 28.472 -0.339 1
1 577 . 13 1 1 A 70 70 GLN N N 57 118.172 118.135 0.037 1
1 578 . 13 1 1 A 71 71 ALA H H 58 7.810 7.969 -0.159 1
1 579 . 13 1 1 A 71 71 ALA HA H 58 4.320 4.095 0.225 1
1 583 . 13 1 1 A 71 71 ALA C C 58 172.232 179.538 -7.306 1
1 584 . 13 1 1 A 71 71 ALA CA C 58 55.323 55.172 0.151 1
1 585 . 13 1 1 A 71 71 ALA CB C 58 19.720 18.881 0.839 1
1 586 . 13 1 1 A 71 71 ALA N N 58 122.536 122.399 0.137 1
1 587 . 13 1 1 A 72 72 ILE H H 59 8.840 8.341 0.499 1
1 588 . 13 1 1 A 72 72 ILE HA H 59 4.030 3.999 0.031 1
1 598 . 13 1 1 A 72 72 ILE C C 59 178.678 177.638 1.040 1
1 599 . 13 1 1 A 72 72 ILE CA C 59 64.698 63.633 1.065 1
1 600 . 13 1 1 A 72 72 ILE CB C 59 37.850 37.465 0.385 1
1 604 . 13 1 1 A 72 72 ILE N N 59 118.111 118.610 -0.499 1
1 605 . 13 1 1 A 73 73 GLN H H 60 7.547 8.135 -0.588 1
1 606 . 13 1 1 A 73 73 GLN HA H 60 4.121 4.070 0.051 1
1 611 . 13 1 1 A 73 73 GLN C C 60 176.556 178.262 -1.706 1
1 612 . 13 1 1 A 73 73 GLN CA C 60 58.135 58.749 -0.614 1
1 613 . 13 1 1 A 73 73 GLN CB C 60 28.300 28.839 -0.539 1
1 615 . 13 1 1 A 73 73 GLN N N 60 119.094 121.066 -1.972 1
1 616 . 13 1 1 A 74 74 LEU H H 61 7.350 7.869 -0.519 1
1 617 . 13 1 1 A 74 74 LEU HA H 61 4.408 4.211 0.197 1
1 626 . 13 1 1 A 74 74 LEU C C 61 177.960 178.344 -0.384 1
1 627 . 13 1 1 A 74 74 LEU CA C 61 54.900 56.513 -1.613 1
1 628 . 13 1 1 A 74 74 LEU CB C 61 42.196 41.765 0.431 1
1 631 . 13 1 1 A 74 74 LEU N N 61 115.853 120.780 -4.927 1
1 632 . 13 1 1 A 75 75 LEU H H 62 7.358 7.681 -0.323 1
1 633 . 13 1 1 A 75 75 LEU HA H 62 4.530 4.066 0.464 1
1 642 . 13 1 1 A 75 75 LEU C C 62 177.035 175.839 1.196 1
1 643 . 13 1 1 A 75 75 LEU CA C 62 53.200 60.089 -6.889 1
1 644 . 13 1 1 A 75 75 LEU CB C 62 40.700 40.521 0.179 1
1 647 . 13 1 1 A 75 75 LEU N N 62 121.010 119.914 1.096 1
1 648 . 13 1 1 A 76 76 PRO HA H 63 4.382 4.344 0.038 1
1 655 . 13 1 1 A 76 76 PRO CB C 63 31.883 30.717 1.166 1
1 657 . 13 1 1 A 77 77 LYS H H 64 8.418 8.244 0.174 1
1 658 . 13 1 1 A 77 77 LYS HA H 64 4.140 4.103 0.037 1
1 663 . 13 1 1 A 77 77 LYS C C 64 177.122 176.253 0.869 1
1 664 . 13 1 1 A 77 77 LYS CA C 64 56.260 59.414 -3.154 1
1 665 . 13 1 1 A 77 77 LYS CB C 64 33.340 32.220 1.120 1
1 668 . 13 1 1 A 77 77 LYS N N 64 121.932 118.109 3.823 1
1 669 . 13 1 1 A 78 78 MET H H 65 8.550 7.697 0.853 1
1 670 . 13 1 1 A 78 78 MET HA H 65 4.304 4.657 -0.353 1
1 676 . 13 1 1 A 78 78 MET C C 65 176.105 176.080 0.025 1
1 677 . 13 1 1 A 78 78 MET CA C 65 56.260 53.624 2.636 1
1 678 . 13 1 1 A 78 78 MET CB C 65 32.821 33.086 -0.265 1
1 680 . 13 1 1 A 78 78 MET N N 65 123.498 117.217 6.281 1
1 681 . 13 1 1 A 79 79 ARG H H 66 8.731 8.695 0.036 1
1 682 . 13 1 1 A 79 79 ARG C C 66 173.577 174.482 -0.905 1
1 683 . 13 1 1 A 79 79 ARG CA C 66 53.447 56.416 -2.969 1
1 684 . 13 1 1 A 79 79 ARG CB C 66 30.008 28.498 1.510 1
1 685 . 13 1 1 A 79 79 ARG N N 66 127.355 121.054 6.301 1
1 686 . 13 1 1 A 80 80 PRO HA H 67 4.780 4.463 0.317 1
1 693 . 13 1 1 A 80 80 PRO C C 67 177.043 176.909 0.134 1
1 694 . 13 1 1 A 80 80 PRO CA C 67 61.886 62.807 -0.921 1
1 695 . 13 1 1 A 80 80 PRO CB C 67 32.821 32.265 0.556 1
1 698 . 13 1 1 A 81 81 ILE H H 68 8.580 8.742 -0.162 1
1 699 . 13 1 1 A 81 81 ILE HA H 68 4.040 4.098 -0.058 1
1 709 . 13 1 1 A 81 81 ILE C C 68 176.831 175.877 0.954 1
1 710 . 13 1 1 A 81 81 ILE CA C 68 62.823 62.489 0.334 1
1 711 . 13 1 1 A 81 81 ILE CB C 68 38.580 39.619 -1.039 1
1 715 . 13 1 1 A 81 81 ILE N N 68 118.491 121.727 -3.236 1
1 716 . 13 1 1 A 82 82 GLY H H 69 8.602 7.528 1.074 1
1 717 . 13 1 1 A 82 82 GLY CA C 69 45.009 44.531 0.478 1
1 718 . 13 1 1 A 82 82 GLY N N 69 111.377 109.247 2.130 1
1 721 . 13 1 1 A 84 84 ASP HA H 71 4.490 5.300 -0.810 1
1 724 . 13 1 1 A 84 84 ASP CA C 71 54.385 52.288 2.097 1
1 725 . 13 1 1 A 84 84 ASP CB C 71 40.321 44.454 -4.133 1
1 726 . 13 1 1 A 85 85 GLY H H 72 8.054 8.782 -0.728 1
1 727 . 13 1 1 A 85 85 GLY HA2 H 72 4.040 4.141 -0.101 1
1 728 . 13 1 1 A 85 85 GLY HA3 H 72 3.750 4.168 -0.418 1
1 729 . 13 1 1 A 85 85 GLY C C 72 173.474 173.156 0.318 1
1 730 . 13 1 1 A 85 85 GLY CA C 72 45.009 44.433 0.576 1
1 731 . 13 1 1 A 85 85 GLY N N 72 108.038 111.834 -3.796 1
1 732 . 13 1 1 A 86 86 ALA H H 73 7.858 8.249 -0.391 1
1 733 . 13 1 1 A 86 86 ALA HA H 73 4.370 5.090 -0.720 1
1 737 . 13 1 1 A 86 86 ALA CA C 73 51.990 51.367 0.623 1
1 738 . 13 1 1 A 86 86 ALA CB C 73 19.220 23.619 -4.399 1
1 739 . 13 1 1 A 86 86 ALA N N 73 123.819 122.457 1.362 1
1 742 . 13 1 1 A 90 90 SER H H 77 7.839 8.550 -0.711 1
1 743 . 13 1 1 A 90 90 SER HA H 77 4.770 4.601 0.169 1
1 746 . 13 1 1 A 90 90 SER N N 77 115.163 117.060 -1.897 1
1 747 . 13 1 1 A 91 91 VAL H H 78 8.578 8.850 -0.272 1
1 748 . 13 1 1 A 91 91 VAL HA H 78 3.981 3.944 0.037 1
1 756 . 13 1 1 A 91 91 VAL C C 78 177.480 177.418 0.062 1
1 757 . 13 1 1 A 91 91 VAL CA C 78 67.060 66.239 0.821 1
1 758 . 13 1 1 A 91 91 VAL CB C 78 32.500 31.679 0.821 1
1 761 . 13 1 1 A 91 91 VAL N N 78 123.481 123.829 -0.348 1
1 762 . 13 1 1 A 92 92 ALA H H 79 8.607 8.362 0.245 1
1 763 . 13 1 1 A 92 92 ALA HA H 79 4.113 4.180 -0.067 1
1 767 . 13 1 1 A 92 92 ALA C C 79 179.868 179.136 0.732 1
1 768 . 13 1 1 A 92 92 ALA CA C 79 54.890 55.726 -0.836 1
1 769 . 13 1 1 A 92 92 ALA CB C 79 18.790 18.492 0.298 1
1 770 . 13 1 1 A 92 92 ALA N N 79 120.334 121.941 -1.607 1
1 771 . 13 1 1 A 93 93 GLU H H 80 7.886 8.126 -0.240 1
1 772 . 13 1 1 A 93 93 GLU HA H 80 4.010 4.115 -0.105 1
1 777 . 13 1 1 A 93 93 GLU C C 80 179.719 179.047 0.672 1
1 778 . 13 1 1 A 93 93 GLU CA C 80 59.073 58.956 0.117 1
1 779 . 13 1 1 A 93 93 GLU CB C 80 30.630 29.585 1.045 1
1 781 . 13 1 1 A 93 93 GLU N N 80 117.643 118.956 -1.313 1
1 782 . 13 1 1 A 94 94 TRP H H 81 8.299 8.218 0.081 1
1 783 . 13 1 1 A 94 94 TRP HA H 81 4.251 4.325 -0.074 1
1 792 . 13 1 1 A 94 94 TRP C C 81 178.772 177.896 0.876 1
1 793 . 13 1 1 A 94 94 TRP CA C 81 60.010 61.108 -1.098 1
1 794 . 13 1 1 A 94 94 TRP CB C 81 27.650 29.471 -1.821 1
1 800 . 13 1 1 A 94 94 TRP N N 81 122.545 122.368 0.177 1
1 802 . 13 1 1 A 95 95 LEU H H 82 8.505 8.154 0.351 1
1 803 . 13 1 1 A 95 95 LEU HA H 82 2.880 3.248 -0.368 1
1 812 . 13 1 1 A 95 95 LEU C C 82 180.235 178.902 1.333 1
1 813 . 13 1 1 A 95 95 LEU CA C 82 57.400 57.161 0.239 1
1 814 . 13 1 1 A 95 95 LEU CB C 82 40.321 40.847 -0.526 1
1 817 . 13 1 1 A 95 95 LEU N N 82 121.110 119.216 1.894 1
1 818 . 13 1 1 A 96 96 ASP H H 83 8.185 8.496 -0.311 1
1 819 . 13 1 1 A 96 96 ASP HA H 83 4.280 4.382 -0.102 1
1 822 . 13 1 1 A 96 96 ASP C C 83 175.224 177.735 -2.511 1
1 823 . 13 1 1 A 96 96 ASP CA C 83 57.310 56.503 0.807 1
1 824 . 13 1 1 A 96 96 ASP CB C 83 40.321 41.243 -0.922 1
1 825 . 13 1 1 A 96 96 ASP N N 83 119.082 119.827 -0.745 1
1 826 . 13 1 1 A 97 97 SER H H 84 7.989 7.902 0.087 1
1 827 . 13 1 1 A 97 97 SER HA H 84 4.250 4.435 -0.185 1
1 830 . 13 1 1 A 97 97 SER C C 84 175.346 175.422 -0.076 1
1 831 . 13 1 1 A 97 97 SER CA C 84 60.948 58.534 2.414 1
1 832 . 13 1 1 A 97 97 SER CB C 84 63.370 63.403 -0.033 1
1 833 . 13 1 1 A 97 97 SER N N 84 117.579 113.463 4.116 1
1 834 . 13 1 1 A 98 98 ILE H H 85 6.862 7.609 -0.747 1
1 835 . 13 1 1 A 98 98 ILE HA H 85 4.550 4.014 0.536 1
1 843 . 13 1 1 A 98 98 ILE C C 85 173.308 176.057 -2.749 1
1 844 . 13 1 1 A 98 98 ILE CA C 85 60.948 62.654 -1.706 1
1 845 . 13 1 1 A 98 98 ILE CB C 85 37.760 37.981 -0.221 1
1 848 . 13 1 1 A 98 98 ILE N N 85 113.733 119.630 -5.897 1
1 849 . 13 1 1 A 99 99 GLU H H 86 7.705 7.378 0.327 1
1 850 . 13 1 1 A 99 99 GLU HA H 86 4.280 4.505 -0.225 1
1 853 . 13 1 1 A 99 99 GLU C C 86 175.224 177.738 -2.514 1
1 854 . 13 1 1 A 99 99 GLU CA C 86 56.260 57.777 -1.517 1
1 855 . 13 1 1 A 99 99 GLU CB C 86 26.258 31.655 -5.397 1
1 857 . 13 1 1 A 99 99 GLU N N 86 115.493 116.122 -0.629 1
1 858 . 13 1 1 A 100 100 LEU H H 87 7.989 7.883 0.106 1
1 859 . 13 1 1 A 100 100 LEU HA H 87 4.220 3.751 0.469 1
1 868 . 13 1 1 A 100 100 LEU C C 87 176.965 177.336 -0.371 1
1 869 . 13 1 1 A 100 100 LEU CA C 87 52.510 57.783 -5.273 1
1 870 . 13 1 1 A 100 100 LEU CB C 87 42.196 42.018 0.178 1
1 873 . 13 1 1 A 100 100 LEU N N 87 117.579 120.542 -2.963 1
1 874 . 13 1 1 A 101 101 GLY H H 88 8.503 7.739 0.764 1
1 875 . 13 1 1 A 101 101 GLY CA C 88 46.884 45.408 1.476 1
1 876 . 13 1 1 A 101 101 GLY N N 88 107.794 106.593 1.201 1
1 877 . 13 1 1 A 102 102 ASP HA H 89 4.431 4.152 0.279 1
1 880 . 13 1 1 A 102 102 ASP C C 89 178.075 178.209 -0.134 1
1 881 . 13 1 1 A 102 102 ASP CA C 89 57.198 57.194 0.004 1
1 882 . 13 1 1 A 102 102 ASP CB C 89 40.321 41.004 -0.683 1
1 883 . 13 1 1 A 103 103 TYR H H 90 7.899 7.984 -0.085 1
1 884 . 13 1 1 A 103 103 TYR HA H 90 4.940 4.445 0.495 1
1 889 . 13 1 1 A 103 103 TYR C C 90 175.527 178.430 -2.903 1
1 890 . 13 1 1 A 103 103 TYR CA C 90 58.135 60.444 -2.309 1
1 891 . 13 1 1 A 103 103 TYR CB C 90 38.446 37.853 0.593 1
1 894 . 13 1 1 A 103 103 TYR N N 90 115.595 119.387 -3.792 1
1 895 . 13 1 1 A 104 104 THR H H 91 7.971 8.546 -0.575 1
1 896 . 13 1 1 A 104 104 THR HA H 91 4.234 4.011 0.223 1
1 901 . 13 1 1 A 104 104 THR C C 91 175.905 176.534 -0.629 1
1 902 . 13 1 1 A 104 104 THR CA C 91 68.449 67.069 1.380 1
1 904 . 13 1 1 A 104 104 THR N N 91 118.867 116.349 2.518 1
1 905 . 13 1 1 A 105 105 LYS H H 92 8.555 7.877 0.678 1
1 906 . 13 1 1 A 105 105 LYS HA H 92 3.940 4.082 -0.142 1
1 912 . 13 1 1 A 105 105 LYS C C 92 177.310 178.587 -1.277 1
1 913 . 13 1 1 A 105 105 LYS CA C 92 60.948 59.445 1.503 1
1 914 . 13 1 1 A 105 105 LYS CB C 92 31.883 32.427 -0.544 1
1 917 . 13 1 1 A 105 105 LYS N N 92 119.259 121.490 -2.231 1
1 918 . 13 1 1 A 106 106 ALA H H 93 7.920 8.242 -0.322 1
1 919 . 13 1 1 A 106 106 ALA HA H 93 4.128 4.321 -0.193 1
1 923 . 13 1 1 A 106 106 ALA C C 93 180.972 180.273 0.699 1
1 924 . 13 1 1 A 106 106 ALA CA C 93 55.070 54.822 0.248 1
1 925 . 13 1 1 A 106 106 ALA CB C 93 17.750 18.340 -0.590 1
1 926 . 13 1 1 A 106 106 ALA N N 93 120.398 121.082 -0.684 1
1 927 . 13 1 1 A 107 107 PHE H H 94 8.136 8.740 -0.604 1
1 928 . 13 1 1 A 107 107 PHE HA H 94 4.190 4.623 -0.433 1
1 934 . 13 1 1 A 107 107 PHE C C 94 177.955 178.362 -0.407 1
1 935 . 13 1 1 A 107 107 PHE CA C 94 63.761 61.408 2.353 1
1 936 . 13 1 1 A 107 107 PHE CB C 94 38.446 39.431 -0.985 1
1 940 . 13 1 1 A 107 107 PHE N N 94 117.119 116.093 1.026 1
1 941 . 13 1 1 A 108 108 LEU H H 95 8.351 8.890 -0.539 1
1 942 . 13 1 1 A 108 108 LEU HA H 95 3.889 4.038 -0.149 1
1 951 . 13 1 1 A 108 108 LEU C C 95 182.043 179.560 2.483 1
1 952 . 13 1 1 A 108 108 LEU CA C 95 59.073 58.527 0.546 1
1 953 . 13 1 1 A 108 108 LEU CB C 95 41.259 42.176 -0.917 1
1 956 . 13 1 1 A 108 108 LEU N N 95 118.450 119.704 -1.254 1
1 957 . 13 1 1 A 109 109 ILE H H 96 8.992 8.056 0.936 1
1 958 . 13 1 1 A 109 109 ILE HA H 96 4.069 3.861 0.208 1
1 968 . 13 1 1 A 109 109 ILE C C 96 177.094 177.672 -0.578 1
1 969 . 13 1 1 A 109 109 ILE CA C 96 63.761 64.188 -0.427 1
1 970 . 13 1 1 A 109 109 ILE CB C 96 37.509 37.557 -0.048 1
1 974 . 13 1 1 A 109 109 ILE N N 96 118.177 115.189 2.988 1
1 975 . 13 1 1 A 110 110 ASN H H 97 7.067 8.093 -1.026 1
1 976 . 13 1 1 A 110 110 ASN HA H 97 4.797 4.705 0.092 1
1 981 . 13 1 1 A 110 110 ASN C C 97 173.595 175.319 -1.724 1
1 982 . 13 1 1 A 110 110 ASN CA C 97 54.385 53.250 1.135 1
1 983 . 13 1 1 A 110 110 ASN CB C 97 40.321 38.856 1.465 1
1 984 . 13 1 1 A 110 110 ASN N N 97 116.407 119.156 -2.749 1
1 986 . 13 1 1 A 111 111 GLY H H 98 7.681 8.091 -0.410 1
1 987 . 13 1 1 A 111 111 GLY HA2 H 98 4.080 3.874 0.206 1
1 988 . 13 1 1 A 111 111 GLY HA3 H 98 3.640 3.973 -0.333 1
1 989 . 13 1 1 A 111 111 GLY C C 98 174.552 173.911 0.641 1
1 990 . 13 1 1 A 111 111 GLY CA C 98 45.947 45.026 0.921 1
1 991 . 13 1 1 A 111 111 GLY N N 98 104.440 105.905 -1.465 1
1 992 . 13 1 1 A 112 112 TYR H H 99 8.427 8.158 0.269 1
1 993 . 13 1 1 A 112 112 TYR HA H 99 4.661 4.728 -0.067 1
1 998 . 13 1 1 A 112 112 TYR C C 99 174.425 175.620 -1.195 1
1 999 . 13 1 1 A 112 112 TYR CA C 99 57.198 57.618 -0.420 1
1 1000 . 13 1 1 A 112 112 TYR CB C 99 36.571 38.296 -1.725 1
1 1003 . 13 1 1 A 112 112 TYR N N 99 122.830 119.899 2.931 1
1 1004 . 13 1 1 A 113 113 THR H H 100 7.166 8.834 -1.668 1
1 1005 . 13 1 1 A 113 113 THR HA H 100 4.248 4.707 -0.459 1
1 1009 . 13 1 1 A 113 113 THR C C 100 174.897 174.675 0.222 1
1 1010 . 13 1 1 A 113 113 THR CA C 100 62.290 61.871 0.419 1
1 1011 . 13 1 1 A 113 113 THR CB C 100 68.970 70.329 -1.359 1
1 1013 . 13 1 1 A 113 113 THR N N 100 104.304 115.802 -11.498 1
1 1014 . 13 1 1 A 114 114 SER H H 101 7.695 7.848 -0.153 1
1 1015 . 13 1 1 A 114 114 SER C C 101 174.372 174.341 0.031 1
1 1016 . 13 1 1 A 114 114 SER CA C 101 56.260 57.833 -1.573 1
1 1017 . 13 1 1 A 114 114 SER CB C 101 65.636 65.146 0.490 1
1 1018 . 13 1 1 A 114 114 SER N N 101 115.613 117.034 -1.421 1
1 1023 . 13 1 1 A 116 116 ASP HA H 103 4.260 4.306 -0.046 1
1 1026 . 13 1 1 A 116 116 ASP CA C 103 57.198 57.597 -0.399 1
1 1027 . 13 1 1 A 116 116 ASP CB C 103 40.321 40.206 0.115 1
1 1028 . 13 1 1 A 117 117 LEU H H 104 7.345 8.041 -0.696 1
1 1029 . 13 1 1 A 117 117 LEU HA H 104 4.290 4.035 0.255 1
1 1038 . 13 1 1 A 117 117 LEU C C 104 178.488 179.176 -0.688 1
1 1039 . 13 1 1 A 117 117 LEU CA C 104 56.260 58.222 -1.962 1
1 1040 . 13 1 1 A 117 117 LEU CB C 104 42.196 41.402 0.794 1
1 1043 . 13 1 1 A 117 117 LEU N N 104 117.878 120.654 -2.776 1
1 1044 . 13 1 1 A 118 118 LEU H H 105 7.514 8.222 -0.708 1
1 1045 . 13 1 1 A 118 118 LEU HA H 105 4.210 4.089 0.121 1
1 1054 . 13 1 1 A 118 118 LEU C C 105 177.002 179.511 -2.509 1
1 1055 . 13 1 1 A 118 118 LEU CA C 105 55.323 56.984 -1.661 1
1 1056 . 13 1 1 A 118 118 LEU CB C 105 42.196 41.003 1.193 1
1 1059 . 13 1 1 A 118 118 LEU N N 105 119.094 119.552 -0.458 1
1 1060 . 13 1 1 A 120 120 LYS HA H 107 4.340 4.513 -0.173 1
1 1063 . 13 1 1 A 120 120 LYS C C 107 176.603 176.561 0.042 1
1 1064 . 13 1 1 A 120 120 LYS CA C 107 55.323 55.987 -0.664 1
1 1065 . 13 1 1 A 120 120 LYS CB C 107 31.883 32.603 -0.720 1
1 1068 . 13 1 1 A 121 121 ILE H H 108 7.539 7.349 0.190 1
1 1069 . 13 1 1 A 121 121 ILE HA H 108 3.987 4.319 -0.332 1
1 1079 . 13 1 1 A 121 121 ILE C C 108 173.247 175.172 -1.925 1
1 1080 . 13 1 1 A 121 121 ILE CA C 108 62.823 60.310 2.513 1
1 1081 . 13 1 1 A 121 121 ILE CB C 108 38.446 38.942 -0.496 1
1 1085 . 13 1 1 A 121 121 ILE N N 108 122.417 120.844 1.573 1
1 1086 . 13 1 1 A 122 122 ALA H H 109 8.290 8.475 -0.185 1
1 1087 . 13 1 1 A 122 122 ALA HA H 109 3.970 4.761 -0.791 1
1 1091 . 13 1 1 A 122 122 ALA C C 109 178.318 177.580 0.738 1
1 1092 . 13 1 1 A 122 122 ALA CA C 109 50.150 50.136 0.014 1
1 1093 . 13 1 1 A 122 122 ALA CB C 109 21.630 21.333 0.297 1
1 1094 . 13 1 1 A 122 122 ALA N N 109 127.784 130.151 -2.367 1
1 1095 . 13 1 1 A 123 123 GLU HA H 110 3.707 3.936 -0.229 1
1 1099 . 13 1 1 A 123 123 GLU C C 110 178.290 178.417 -0.127 1
1 1100 . 13 1 1 A 123 123 GLU CA C 110 60.948 60.364 0.584 1
1 1101 . 13 1 1 A 123 123 GLU CB C 110 29.070 29.900 -0.830 1
1 1102 . 13 1 1 A 124 124 VAL H H 111 8.333 8.276 0.057 1
1 1103 . 13 1 1 A 124 124 VAL HA H 111 3.850 3.740 0.110 1
1 1111 . 13 1 1 A 124 124 VAL C C 111 177.406 177.526 -0.120 1
1 1112 . 13 1 1 A 124 124 VAL CA C 111 65.636 65.148 0.488 1
1 1113 . 13 1 1 A 124 124 VAL CB C 111 30.730 31.205 -0.475 1
1 1116 . 13 1 1 A 124 124 VAL N N 111 114.438 118.794 -4.356 1
1 1117 . 13 1 1 A 125 125 GLU H H 112 7.442 8.381 -0.939 1
1 1118 . 13 1 1 A 125 125 GLU HA H 112 4.152 4.057 0.095 1
1 1123 . 13 1 1 A 125 125 GLU C C 112 179.982 179.228 0.754 1
1 1124 . 13 1 1 A 125 125 GLU CA C 112 60.010 59.462 0.548 1
1 1125 . 13 1 1 A 125 125 GLU CB C 112 30.008 29.073 0.935 1
1 1127 . 13 1 1 A 125 125 GLU N N 112 121.032 121.632 -0.600 1
1 1128 . 13 1 1 A 126 126 LEU H H 113 7.666 7.742 -0.076 1
1 1129 . 13 1 1 A 126 126 LEU HA H 113 3.846 4.048 -0.202 1
1 1138 . 13 1 1 A 126 126 LEU C C 113 176.991 178.926 -1.935 1
1 1139 . 13 1 1 A 126 126 LEU CA C 113 58.135 57.904 0.231 1
1 1140 . 13 1 1 A 126 126 LEU CB C 113 41.259 41.712 -0.453 1
1 1143 . 13 1 1 A 126 126 LEU N N 113 118.731 121.189 -2.458 1
1 1144 . 13 1 1 A 127 127 ILE H H 114 7.781 8.087 -0.306 1
1 1145 . 13 1 1 A 127 127 ILE HA H 114 3.502 3.792 -0.290 1
1 1153 . 13 1 1 A 127 127 ILE C C 114 178.195 177.310 0.885 1
1 1154 . 13 1 1 A 127 127 ILE CA C 114 65.636 63.574 2.062 1
1 1155 . 13 1 1 A 127 127 ILE CB C 114 40.321 37.423 2.898 1
1 1159 . 13 1 1 A 127 127 ILE N N 114 115.084 119.526 -4.442 1
1 1160 . 13 1 1 A 128 128 ASN H H 115 8.470 7.999 0.471 1
1 1161 . 13 1 1 A 128 128 ASN HA H 115 4.502 4.598 -0.096 1
1 1166 . 13 1 1 A 128 128 ASN C C 115 176.295 176.903 -0.608 1
1 1167 . 13 1 1 A 128 128 ASN CA C 115 56.260 55.731 0.529 1
1 1168 . 13 1 1 A 128 128 ASN CB C 115 39.384 38.662 0.722 1
1 1169 . 13 1 1 A 128 128 ASN N N 115 115.158 119.978 -4.820 1
1 1171 . 13 1 1 A 129 129 VAL H H 116 8.116 7.760 0.356 1
1 1172 . 13 1 1 A 129 129 VAL HA H 116 4.090 3.868 0.222 1
1 1180 . 13 1 1 A 129 129 VAL C C 116 176.740 177.962 -1.222 1
1 1181 . 13 1 1 A 129 129 VAL CA C 116 64.400 64.854 -0.454 1
1 1182 . 13 1 1 A 129 129 VAL CB C 116 32.050 32.160 -0.110 1
1 1185 . 13 1 1 A 129 129 VAL N N 116 118.698 118.854 -0.156 1
1 1186 . 13 1 1 A 130 130 LEU H H 117 7.294 7.931 -0.637 1
1 1187 . 13 1 1 A 130 130 LEU HA H 117 3.970 4.100 -0.130 1
1 1196 . 13 1 1 A 130 130 LEU C C 117 175.127 176.366 -1.239 1
1 1197 . 13 1 1 A 130 130 LEU CA C 117 56.260 56.306 -0.046 1
1 1198 . 13 1 1 A 130 130 LEU CB C 117 41.259 42.277 -1.018 1
1 1201 . 13 1 1 A 130 130 LEU N N 117 116.201 118.676 -2.475 1
1 1202 . 13 1 1 A 131 131 LYS H H 118 6.594 8.161 -1.567 1
1 1203 . 13 1 1 A 131 131 LYS HA H 118 3.980 4.246 -0.266 1
1 1208 . 13 1 1 A 131 131 LYS C C 118 175.589 176.180 -0.591 1
1 1209 . 13 1 1 A 131 131 LYS CA C 118 56.260 57.217 -0.957 1
1 1210 . 13 1 1 A 131 131 LYS CB C 118 28.133 29.328 -1.195 1
1 1212 . 13 1 1 A 131 131 LYS N N 118 111.172 115.513 -4.341 1
1 1213 . 13 1 1 A 132 132 ILE H H 119 8.245 8.018 0.227 1
1 1214 . 13 1 1 A 132 132 ILE HA H 119 4.090 3.863 0.227 1
1 1224 . 13 1 1 A 132 132 ILE C C 119 175.161 176.370 -1.209 1
1 1225 . 13 1 1 A 132 132 ILE CA C 119 60.010 65.144 -5.134 1
1 1226 . 13 1 1 A 132 132 ILE CB C 119 35.633 37.709 -2.076 1
1 1230 . 13 1 1 A 132 132 ILE N N 119 119.484 118.441 1.043 1
1 1231 . 13 1 1 A 133 133 ASN H H 120 8.054 8.231 -0.177 1
1 1232 . 13 1 1 A 133 133 ASN HA H 120 4.350 4.363 -0.013 1
1 1235 . 13 1 1 A 133 133 ASN C C 120 175.136 174.291 0.845 1
1 1236 . 13 1 1 A 133 133 ASN CA C 120 54.385 53.971 0.414 1
1 1237 . 13 1 1 A 133 133 ASN CB C 120 39.384 37.306 2.078 1
1 1238 . 13 1 1 A 133 133 ASN N N 120 124.670 120.200 4.470 1
1 1239 . 13 1 1 A 134 134 LEU H H 121 7.517 7.852 -0.335 1
1 1240 . 13 1 1 A 134 134 LEU HA H 121 4.678 4.563 0.115 1
1 1249 . 13 1 1 A 134 134 LEU C C 121 178.051 176.583 1.468 1
1 1250 . 13 1 1 A 134 134 LEU CA C 121 53.447 54.406 -0.959 1
1 1251 . 13 1 1 A 134 134 LEU CB C 121 41.259 44.592 -3.333 1
1 1254 . 13 1 1 A 134 134 LEU N N 121 119.918 119.134 0.784 1
1 1255 . 13 1 1 A 135 135 ILE H H 122 9.389 8.798 0.591 1
1 1256 . 13 1 1 A 135 135 ILE HA H 122 3.540 3.652 -0.112 1
1 1266 . 13 1 1 A 135 135 ILE C C 122 176.425 177.444 -1.019 1
1 1267 . 13 1 1 A 135 135 ILE CA C 122 65.636 64.896 0.740 1
1 1268 . 13 1 1 A 135 135 ILE CB C 122 38.446 38.277 0.169 1
1 1272 . 13 1 1 A 135 135 ILE N N 122 129.949 126.459 3.490 1
1 1273 . 13 1 1 A 136 136 GLY H H 123 8.675 8.576 0.099 1
1 1274 . 13 1 1 A 136 136 GLY HA2 H 123 2.650 3.065 -0.415 1
1 1275 . 13 1 1 A 136 136 GLY HA3 H 123 2.060 3.527 -1.467 1
1 1276 . 13 1 1 A 136 136 GLY C C 123 176.854 176.363 0.491 1
1 1277 . 13 1 1 A 136 136 GLY CA C 123 45.500 47.069 -1.569 1
1 1278 . 13 1 1 A 136 136 GLY N N 123 106.314 108.113 -1.799 1
1 1279 . 13 1 1 A 137 137 HIS H H 124 6.869 7.905 -1.036 1
1 1280 . 13 1 1 A 137 137 HIS HA H 124 4.558 4.414 0.144 1
1 1285 . 13 1 1 A 137 137 HIS C C 124 176.977 177.332 -0.355 1
1 1286 . 13 1 1 A 137 137 HIS CA C 124 57.198 58.820 -1.622 1
1 1287 . 13 1 1 A 137 137 HIS CB C 124 30.945 30.091 0.854 1
1 1290 . 13 1 1 A 137 137 HIS N N 124 118.865 120.037 -1.172 1
1 1291 . 13 1 1 A 138 138 ARG H H 125 7.730 8.635 -0.905 1
1 1292 . 13 1 1 A 138 138 ARG HA H 125 3.770 3.898 -0.128 1
1 1299 . 13 1 1 A 138 138 ARG C C 125 178.288 178.400 -0.112 1
1 1300 . 13 1 1 A 138 138 ARG CA C 125 61.886 59.455 2.431 1
1 1301 . 13 1 1 A 138 138 ARG CB C 125 30.945 30.046 0.899 1
1 1304 . 13 1 1 A 138 138 ARG N N 125 118.149 119.324 -1.175 1
1 1306 . 13 1 1 A 139 139 LYS H H 126 8.679 8.234 0.445 1
1 1307 . 13 1 1 A 139 139 LYS HA H 126 3.990 3.969 0.021 1
1 1310 . 13 1 1 A 139 139 LYS C C 126 179.184 178.933 0.251 1
1 1311 . 13 1 1 A 139 139 LYS CA C 126 58.135 59.410 -1.275 1
1 1312 . 13 1 1 A 139 139 LYS CB C 126 30.945 32.139 -1.194 1
1 1314 . 13 1 1 A 139 139 LYS N N 126 114.003 118.954 -4.951 1
1 1315 . 13 1 1 A 140 140 ARG H H 127 7.248 7.894 -0.646 1
1 1316 . 13 1 1 A 140 140 ARG HA H 127 3.870 4.014 -0.144 1
1 1324 . 13 1 1 A 140 140 ARG C C 127 177.772 178.954 -1.182 1
1 1325 . 13 1 1 A 140 140 ARG CA C 127 60.010 58.902 1.108 1
1 1326 . 13 1 1 A 140 140 ARG CB C 127 30.945 29.757 1.188 1
1 1329 . 13 1 1 A 140 140 ARG N N 127 120.072 119.277 0.795 1
1 1331 . 13 1 1 A 141 141 ILE H H 128 7.706 8.106 -0.400 1
1 1332 . 13 1 1 A 141 141 ILE HA H 128 3.530 3.648 -0.118 1
1 1340 . 13 1 1 A 141 141 ILE C C 128 177.669 178.136 -0.467 1
1 1341 . 13 1 1 A 141 141 ILE CA C 128 65.636 65.749 -0.113 1
1 1342 . 13 1 1 A 141 141 ILE CB C 128 38.680 38.237 0.443 1
1 1345 . 13 1 1 A 141 141 ILE N N 128 118.730 119.538 -0.808 1
1 1346 . 13 1 1 A 142 142 LEU H H 129 8.194 8.485 -0.291 1
1 1347 . 13 1 1 A 142 142 LEU HA H 129 3.950 3.954 -0.004 1
1 1356 . 13 1 1 A 142 142 LEU C C 129 179.960 178.673 1.287 1
1 1357 . 13 1 1 A 142 142 LEU CA C 129 58.135 57.931 0.204 1
1 1358 . 13 1 1 A 142 142 LEU CB C 129 41.259 41.595 -0.336 1
1 1361 . 13 1 1 A 142 142 LEU N N 129 117.675 121.423 -3.748 1
1 1362 . 13 1 1 A 143 143 ALA H H 130 8.294 7.982 0.312 1
1 1363 . 13 1 1 A 143 143 ALA HA H 130 4.220 4.059 0.161 1
1 1367 . 13 1 1 A 143 143 ALA C C 130 179.899 179.478 0.421 1
1 1368 . 13 1 1 A 143 143 ALA CA C 130 54.385 55.238 -0.853 1
1 1369 . 13 1 1 A 143 143 ALA CB C 130 19.270 18.578 0.692 1
1 1370 . 13 1 1 A 143 143 ALA N N 130 121.096 121.904 -0.808 1
1 1371 . 13 1 1 A 144 144 SER H H 131 7.813 7.988 -0.175 1
1 1372 . 13 1 1 A 144 144 SER HA H 131 4.180 4.249 -0.069 1
1 1375 . 13 1 1 A 144 144 SER C C 131 175.457 176.416 -0.959 1
1 1376 . 13 1 1 A 144 144 SER CA C 131 60.948 61.270 -0.322 1
1 1377 . 13 1 1 A 144 144 SER CB C 131 63.761 63.406 0.355 1
1 1378 . 13 1 1 A 144 144 SER N N 131 112.102 113.201 -1.099 1
1 1379 . 13 1 1 A 145 145 LEU H H 132 7.747 8.152 -0.405 1
1 1380 . 13 1 1 A 145 145 LEU HA H 132 4.140 4.170 -0.030 1
1 1389 . 13 1 1 A 145 145 LEU C C 132 178.589 177.845 0.744 1
1 1390 . 13 1 1 A 145 145 LEU CA C 132 56.260 56.655 -0.395 1
1 1391 . 13 1 1 A 145 145 LEU CB C 132 42.196 42.984 -0.788 1
1 1394 . 13 1 1 A 145 145 LEU N N 132 117.536 118.985 -1.449 1
1 1395 . 13 1 1 A 146 146 GLY H H 133 7.544 7.938 -0.394 1
1 1396 . 13 1 1 A 146 146 GLY HA2 H 133 3.950 3.995 -0.045 1
1 1397 . 13 1 1 A 146 146 GLY HA3 H 133 3.100 4.001 -0.901 1
1 1398 . 13 1 1 A 146 146 GLY C C 133 173.372 174.092 -0.720 1
1 1399 . 13 1 1 A 146 146 GLY CA C 133 45.947 44.767 1.180 1
1 1400 . 13 1 1 A 146 146 GLY N N 133 105.351 106.417 -1.066 1
1 1401 . 13 1 1 A 147 147 ASP H H 134 8.342 8.849 -0.507 1
1 1402 . 13 1 1 A 147 147 ASP HA H 134 4.650 4.805 -0.155 1
1 1405 . 13 1 1 A 147 147 ASP C C 134 175.462 177.272 -1.810 1
1 1406 . 13 1 1 A 147 147 ASP CA C 134 54.385 54.638 -0.253 1
1 1407 . 13 1 1 A 147 147 ASP CB C 134 41.259 43.362 -2.103 1
1 1408 . 13 1 1 A 147 147 ASP N N 134 120.133 120.615 -0.482 1
1 14 . 14 1 1 A 15 15 GLN H H 2 8.439 8.974 -0.535 1
1 15 . 14 1 1 A 15 15 GLN HA H 2 4.594 5.143 -0.549 1
1 20 . 14 1 1 A 15 15 GLN C C 2 175.972 173.566 2.406 1
1 21 . 14 1 1 A 15 15 GLN CA C 2 56.260 53.768 2.492 1
1 22 . 14 1 1 A 15 15 GLN CB C 2 30.945 32.466 -1.521 1
1 24 . 14 1 1 A 15 15 GLN N N 2 124.997 118.158 6.839 1
1 25 . 14 1 1 A 16 16 THR H H 3 8.347 8.387 -0.040 1
1 26 . 14 1 1 A 16 16 THR HA H 3 4.555 4.758 -0.203 1
1 31 . 14 1 1 A 16 16 THR C C 3 175.495 174.682 0.813 1
1 32 . 14 1 1 A 16 16 THR CA C 3 60.010 61.381 -1.371 1
1 33 . 14 1 1 A 16 16 THR CB C 3 71.261 72.106 -0.845 1
1 34 . 14 1 1 A 16 16 THR N N 3 113.011 112.882 0.129 1
1 35 . 14 1 1 A 17 17 VAL H H 4 8.895 9.080 -0.185 1
1 36 . 14 1 1 A 17 17 VAL HA H 4 3.670 3.820 -0.150 1
1 44 . 14 1 1 A 17 17 VAL C C 4 178.449 177.975 0.474 1
1 45 . 14 1 1 A 17 17 VAL CA C 4 67.511 66.437 1.074 1
1 46 . 14 1 1 A 17 17 VAL CB C 4 31.883 32.078 -0.195 1
1 49 . 14 1 1 A 17 17 VAL N N 4 121.854 124.887 -3.033 1
1 50 . 14 1 1 A 18 18 GLY H H 5 9.017 8.166 0.851 1
1 51 . 14 1 1 A 18 18 GLY HA2 H 5 3.940 3.778 0.162 1
1 52 . 14 1 1 A 18 18 GLY HA3 H 5 3.610 3.788 -0.178 1
1 53 . 14 1 1 A 18 18 GLY C C 5 176.186 175.506 0.680 1
1 54 . 14 1 1 A 18 18 GLY CA C 5 47.822 47.254 0.568 1
1 55 . 14 1 1 A 18 18 GLY N N 5 106.966 107.879 -0.913 1
1 56 . 14 1 1 A 19 19 GLN H H 6 8.072 8.325 -0.253 1
1 57 . 14 1 1 A 19 19 GLN HA H 6 4.037 4.117 -0.080 1
1 62 . 14 1 1 A 19 19 GLN C C 6 179.488 177.866 1.622 1
1 63 . 14 1 1 A 19 19 GLN CA C 6 59.073 58.739 0.334 1
1 64 . 14 1 1 A 19 19 GLN CB C 6 28.489 28.603 -0.114 1
1 66 . 14 1 1 A 19 19 GLN N N 6 122.431 120.961 1.470 1
1 67 . 14 1 1 A 20 20 TRP H H 7 8.756 8.186 0.570 1
1 68 . 14 1 1 A 20 20 TRP HA H 7 4.160 4.360 -0.200 1
1 77 . 14 1 1 A 20 20 TRP C C 7 179.620 178.143 1.477 1
1 78 . 14 1 1 A 20 20 TRP CA C 7 61.886 61.315 0.571 1
1 79 . 14 1 1 A 20 20 TRP CB C 7 28.133 29.690 -1.557 1
1 85 . 14 1 1 A 20 20 TRP N N 7 124.265 122.005 2.260 1
1 87 . 14 1 1 A 21 21 LEU H H 8 9.148 8.860 0.288 1
1 88 . 14 1 1 A 21 21 LEU HA H 8 3.440 3.383 0.057 1
1 97 . 14 1 1 A 21 21 LEU C C 8 180.521 178.674 1.847 1
1 98 . 14 1 1 A 21 21 LEU CA C 8 56.920 57.975 -1.055 1
1 99 . 14 1 1 A 21 21 LEU CB C 8 41.700 41.236 0.464 1
1 102 . 14 1 1 A 21 21 LEU N N 8 120.548 120.738 -0.190 1
1 103 . 14 1 1 A 22 22 GLU H H 9 8.284 8.090 0.194 1
1 104 . 14 1 1 A 22 22 GLU HA H 9 3.740 3.949 -0.209 1
1 109 . 14 1 1 A 22 22 GLU C C 9 179.960 179.185 0.775 1
1 110 . 14 1 1 A 22 22 GLU CA C 9 60.010 59.564 0.446 1
1 111 . 14 1 1 A 22 22 GLU CB C 9 29.070 29.341 -0.271 1
1 113 . 14 1 1 A 22 22 GLU N N 9 120.133 118.887 1.246 1
1 114 . 14 1 1 A 23 23 SER H H 10 7.891 7.879 0.012 1
1 115 . 14 1 1 A 23 23 SER HA H 10 4.250 4.237 0.013 1
1 118 . 14 1 1 A 23 23 SER C C 10 175.346 176.559 -1.213 1
1 119 . 14 1 1 A 23 23 SER CA C 10 60.948 61.271 -0.323 1
1 120 . 14 1 1 A 23 23 SER CB C 10 63.280 62.892 0.388 1
1 121 . 14 1 1 A 23 23 SER N N 10 117.044 115.490 1.554 1
1 122 . 14 1 1 A 24 24 ILE H H 11 6.862 7.483 -0.621 1
1 123 . 14 1 1 A 24 24 ILE HA H 11 4.487 3.923 0.564 1
1 133 . 14 1 1 A 24 24 ILE C C 11 175.812 175.794 0.018 1
1 134 . 14 1 1 A 24 24 ILE CA C 11 60.948 62.829 -1.881 1
1 135 . 14 1 1 A 24 24 ILE CB C 11 38.250 37.715 0.535 1
1 139 . 14 1 1 A 24 24 ILE N N 11 113.733 118.074 -4.341 1
1 140 . 14 1 1 A 25 25 GLY H H 12 7.628 7.617 0.011 1
1 141 . 14 1 1 A 25 25 GLY HA2 H 12 3.990 4.117 -0.127 1
1 142 . 14 1 1 A 25 25 GLY HA3 H 12 3.800 4.223 -0.423 1
1 143 . 14 1 1 A 25 25 GLY C C 12 173.647 172.112 1.535 1
1 144 . 14 1 1 A 25 25 GLY CA C 12 45.947 45.894 0.053 1
1 145 . 14 1 1 A 25 25 GLY N N 12 109.763 110.202 -0.439 1
1 146 . 14 1 1 A 26 26 LEU H H 13 7.620 8.562 -0.942 1
1 147 . 14 1 1 A 26 26 LEU C C 13 176.186 174.178 2.008 1
1 148 . 14 1 1 A 26 26 LEU CA C 13 52.700 51.140 1.560 1
1 149 . 14 1 1 A 26 26 LEU CB C 13 43.134 44.735 -1.601 1
1 150 . 14 1 1 A 26 26 LEU N N 13 118.778 121.398 -2.620 1
1 151 . 14 1 1 A 27 27 PRO HA H 14 4.120 4.700 -0.580 1
1 154 . 14 1 1 A 27 27 PRO C C 14 177.955 176.048 1.907 1
1 155 . 14 1 1 A 27 27 PRO CA C 14 64.698 62.269 2.429 1
1 156 . 14 1 1 A 27 27 PRO CB C 14 31.883 29.102 2.781 1
1 158 . 14 1 1 A 28 28 GLN H H 15 9.838 8.468 1.370 1
1 159 . 14 1 1 A 28 28 GLN HA H 15 4.240 4.372 -0.132 1
1 162 . 14 1 1 A 28 28 GLN C C 15 176.836 175.718 1.118 1
1 163 . 14 1 1 A 28 28 GLN CA C 15 58.135 55.318 2.817 1
1 164 . 14 1 1 A 28 28 GLN CB C 15 27.195 29.860 -2.665 1
1 166 . 14 1 1 A 28 28 GLN N N 15 120.414 122.510 -2.096 1
1 167 . 14 1 1 A 29 29 TYR H H 16 6.810 7.704 -0.894 1
1 168 . 14 1 1 A 29 29 TYR HA H 16 5.720 4.776 0.944 1
1 173 . 14 1 1 A 29 29 TYR C C 16 174.814 176.432 -1.618 1
1 174 . 14 1 1 A 29 29 TYR CA C 16 57.198 57.682 -0.484 1
1 175 . 14 1 1 A 29 29 TYR CB C 16 37.509 39.554 -2.045 1
1 178 . 14 1 1 A 29 29 TYR N N 16 119.718 118.216 1.502 1
1 179 . 14 1 1 A 30 30 GLU H H 17 7.509 8.064 -0.555 1
1 180 . 14 1 1 A 30 30 GLU HA H 17 3.650 4.042 -0.392 1
1 184 . 14 1 1 A 30 30 GLU C C 17 177.552 178.541 -0.989 1
1 185 . 14 1 1 A 30 30 GLU CA C 17 60.948 59.658 1.290 1
1 186 . 14 1 1 A 30 30 GLU CB C 17 30.008 28.756 1.252 1
1 188 . 14 1 1 A 30 30 GLU N N 17 122.417 122.770 -0.353 1
1 189 . 14 1 1 A 31 31 ASN H H 18 9.259 8.279 0.980 1
1 190 . 14 1 1 A 31 31 ASN HA H 18 4.451 4.495 -0.044 1
1 193 . 14 1 1 A 31 31 ASN C C 18 176.868 178.184 -1.316 1
1 194 . 14 1 1 A 31 31 ASN CA C 18 57.198 56.361 0.837 1
1 195 . 14 1 1 A 31 31 ASN CB C 18 38.446 38.536 -0.090 1
1 196 . 14 1 1 A 31 31 ASN N N 18 116.613 118.311 -1.698 1
1 197 . 14 1 1 A 32 32 HIS H H 19 8.898 8.323 0.575 1
1 198 . 14 1 1 A 32 32 HIS HA H 19 4.140 4.360 -0.220 1
1 202 . 14 1 1 A 32 32 HIS C C 19 178.269 177.857 0.412 1
1 203 . 14 1 1 A 32 32 HIS CA C 19 60.948 59.020 1.928 1
1 204 . 14 1 1 A 32 32 HIS CB C 19 30.008 30.205 -0.197 1
1 206 . 14 1 1 A 32 32 HIS N N 19 118.926 118.564 0.362 1
1 207 . 14 1 1 A 33 33 LEU H H 20 7.825 8.710 -0.885 1
1 208 . 14 1 1 A 33 33 LEU HA H 20 4.305 3.941 0.364 1
1 218 . 14 1 1 A 33 33 LEU C C 20 179.190 179.112 0.078 1
1 219 . 14 1 1 A 33 33 LEU CA C 20 60.010 58.402 1.608 1
1 220 . 14 1 1 A 33 33 LEU CB C 20 40.321 41.955 -1.634 1
1 224 . 14 1 1 A 33 33 LEU N N 20 117.434 119.959 -2.525 1
1 225 . 14 1 1 A 34 34 MET H H 21 8.861 8.463 0.398 1
1 226 . 14 1 1 A 34 34 MET HA H 21 3.980 4.130 -0.150 1
1 234 . 14 1 1 A 34 34 MET C C 21 180.340 177.993 2.347 1
1 235 . 14 1 1 A 34 34 MET CA C 21 58.135 59.126 -0.991 1
1 236 . 14 1 1 A 34 34 MET CB C 21 30.945 32.075 -1.130 1
1 238 . 14 1 1 A 34 34 MET N N 21 118.111 118.554 -0.443 1
1 239 . 14 1 1 A 35 35 ALA H H 22 9.015 8.576 0.439 1
1 240 . 14 1 1 A 35 35 ALA HA H 22 4.239 4.176 0.063 1
1 244 . 14 1 1 A 35 35 ALA C C 22 178.058 178.505 -0.447 1
1 245 . 14 1 1 A 35 35 ALA CA C 22 53.800 54.553 -0.753 1
1 246 . 14 1 1 A 35 35 ALA CB C 22 18.397 18.302 0.095 1
1 247 . 14 1 1 A 35 35 ALA N N 22 120.068 121.414 -1.346 1
1 248 . 14 1 1 A 36 36 ASN H H 23 7.143 8.057 -0.914 1
1 249 . 14 1 1 A 36 36 ASN HA H 23 4.959 4.902 0.057 1
1 254 . 14 1 1 A 36 36 ASN C C 23 174.083 175.393 -1.310 1
1 255 . 14 1 1 A 36 36 ASN CA C 23 54.000 52.637 1.363 1
1 256 . 14 1 1 A 36 36 ASN CB C 23 41.300 38.905 2.395 1
1 257 . 14 1 1 A 36 36 ASN N N 23 111.560 115.026 -3.466 1
1 259 . 14 1 1 A 37 37 GLY H H 24 7.797 8.322 -0.525 1
1 260 . 14 1 1 A 37 37 GLY HA2 H 24 3.430 3.825 -0.395 1
1 261 . 14 1 1 A 37 37 GLY HA3 H 24 3.290 3.904 -0.614 1
1 262 . 14 1 1 A 37 37 GLY C C 24 173.163 174.786 -1.623 1
1 263 . 14 1 1 A 37 37 GLY CA C 24 45.947 45.176 0.771 1
1 264 . 14 1 1 A 37 37 GLY N N 24 106.170 107.897 -1.727 1
1 265 . 14 1 1 A 38 38 PHE H H 25 8.191 7.965 0.226 1
1 266 . 14 1 1 A 38 38 PHE HA H 25 4.910 4.772 0.138 1
1 271 . 14 1 1 A 38 38 PHE C C 25 173.496 175.702 -2.206 1
1 272 . 14 1 1 A 38 38 PHE CA C 25 56.550 56.359 0.191 1
1 273 . 14 1 1 A 38 38 PHE CB C 25 37.220 37.129 0.091 1
1 276 . 14 1 1 A 38 38 PHE N N 25 122.454 119.901 2.553 1
1 277 . 14 1 1 A 39 39 ASP H H 26 6.756 8.528 -1.772 1
1 278 . 14 1 1 A 39 39 ASP HA H 26 5.077 4.925 0.152 1
1 281 . 14 1 1 A 39 39 ASP C C 26 177.463 175.470 1.993 1
1 282 . 14 1 1 A 39 39 ASP CA C 26 53.447 54.165 -0.718 1
1 283 . 14 1 1 A 39 39 ASP CB C 26 42.580 42.031 0.549 1
1 284 . 14 1 1 A 39 39 ASP N N 26 111.309 120.778 -9.469 1
1 285 . 14 1 1 A 40 40 ASN H H 27 7.495 7.953 -0.458 1
1 286 . 14 1 1 A 40 40 ASN HA H 27 4.820 5.056 -0.236 1
1 289 . 14 1 1 A 40 40 ASN C C 27 176.228 175.672 0.556 1
1 290 . 14 1 1 A 40 40 ASN CA C 27 52.510 51.699 0.811 1
1 291 . 14 1 1 A 40 40 ASN CB C 27 40.321 40.814 -0.493 1
1 292 . 14 1 1 A 40 40 ASN N N 27 118.385 118.141 0.244 1
1 293 . 14 1 1 A 41 41 VAL H H 28 9.192 8.647 0.545 1
1 294 . 14 1 1 A 41 41 VAL HA H 28 3.550 3.732 -0.182 1
1 302 . 14 1 1 A 41 41 VAL C C 28 176.429 177.990 -1.561 1
1 303 . 14 1 1 A 41 41 VAL CA C 28 65.636 66.096 -0.460 1
1 304 . 14 1 1 A 41 41 VAL CB C 28 31.883 31.632 0.251 1
1 307 . 14 1 1 A 41 41 VAL N N 28 125.741 125.644 0.097 1
1 308 . 14 1 1 A 42 42 GLN H H 29 8.203 8.144 0.059 1
1 309 . 14 1 1 A 42 42 GLN HA H 29 4.129 4.082 0.047 1
1 314 . 14 1 1 A 42 42 GLN C C 29 176.591 178.556 -1.965 1
1 315 . 14 1 1 A 42 42 GLN CA C 29 57.198 58.433 -1.235 1
1 316 . 14 1 1 A 42 42 GLN CB C 29 28.133 28.971 -0.838 1
1 318 . 14 1 1 A 42 42 GLN N N 29 116.452 120.613 -4.161 1
1 319 . 14 1 1 A 43 43 ALA H H 30 7.781 8.164 -0.383 1
1 320 . 14 1 1 A 43 43 ALA HA H 30 4.650 4.109 0.541 1
1 324 . 14 1 1 A 43 43 ALA C C 30 175.976 178.516 -2.540 1
1 325 . 14 1 1 A 43 43 ALA CA C 30 50.840 54.109 -3.269 1
1 326 . 14 1 1 A 43 43 ALA CB C 30 19.150 18.249 0.901 1
1 327 . 14 1 1 A 43 43 ALA N N 30 122.150 121.774 0.376 1
1 328 . 14 1 1 A 44 44 MET H H 31 7.739 7.943 -0.204 1
1 332 . 14 1 1 A 44 44 MET C C 31 178.275 176.857 1.418 1
1 333 . 14 1 1 A 44 44 MET CA C 31 55.323 55.486 -0.163 1
1 334 . 14 1 1 A 44 44 MET CB C 31 34.696 31.957 2.739 1
1 336 . 14 1 1 A 44 44 MET N N 31 118.149 115.127 3.022 1
1 337 . 14 1 1 A 45 45 GLY H H 32 7.611 8.203 -0.592 1
1 338 . 14 1 1 A 45 45 GLY N N 32 101.530 107.923 -6.393 1
1 339 . 14 1 1 A 47 47 ASN HA H 34 4.480 5.095 -0.615 1
1 342 . 14 1 1 A 47 47 ASN CA C 34 56.260 52.396 3.864 1
1 343 . 14 1 1 A 47 47 ASN CB C 34 39.384 41.769 -2.385 1
1 344 . 14 1 1 A 49 49 MET HA H 36 4.646 4.402 0.244 1
1 350 . 14 1 1 A 49 49 MET C C 36 173.651 175.815 -2.164 1
1 351 . 14 1 1 A 49 49 MET CA C 36 55.323 56.112 -0.789 1
1 352 . 14 1 1 A 49 49 MET CB C 36 35.633 33.305 2.328 1
1 355 . 14 1 1 A 50 50 GLU H H 37 9.203 8.507 0.696 1
1 356 . 14 1 1 A 50 50 GLU HA H 37 4.650 4.499 0.151 1
1 361 . 14 1 1 A 50 50 GLU C C 37 177.008 177.670 -0.662 1
1 362 . 14 1 1 A 50 50 GLU CA C 37 54.385 55.976 -1.591 1
1 363 . 14 1 1 A 50 50 GLU CB C 37 33.758 30.514 3.244 1
1 365 . 14 1 1 A 50 50 GLU N N 37 123.229 126.462 -3.233 1
1 366 . 14 1 1 A 51 51 ASP H H 38 9.032 9.128 -0.096 1
1 367 . 14 1 1 A 51 51 ASP HA H 38 4.149 4.322 -0.173 1
1 370 . 14 1 1 A 51 51 ASP C C 38 177.994 178.182 -0.188 1
1 371 . 14 1 1 A 51 51 ASP CA C 38 59.073 57.169 1.904 1
1 372 . 14 1 1 A 51 51 ASP CB C 38 43.134 39.897 3.237 1
1 373 . 14 1 1 A 51 51 ASP N N 38 122.717 122.688 0.029 1
1 374 . 14 1 1 A 52 52 GLN H H 39 8.950 8.258 0.692 1
1 375 . 14 1 1 A 52 52 GLN HA H 39 3.940 4.106 -0.166 1
1 378 . 14 1 1 A 52 52 GLN C C 39 177.817 177.779 0.038 1
1 379 . 14 1 1 A 52 52 GLN CA C 39 59.073 58.772 0.301 1
1 380 . 14 1 1 A 52 52 GLN CB C 39 28.133 28.507 -0.374 1
1 381 . 14 1 1 A 52 52 GLN N N 39 114.086 118.414 -4.328 1
1 382 . 14 1 1 A 53 53 ASP H H 40 7.214 8.008 -0.794 1
1 383 . 14 1 1 A 53 53 ASP HA H 40 4.370 4.463 -0.093 1
1 386 . 14 1 1 A 53 53 ASP C C 40 177.667 178.652 -0.985 1
1 387 . 14 1 1 A 53 53 ASP CA C 40 57.198 57.347 -0.149 1
1 388 . 14 1 1 A 53 53 ASP CB C 40 41.800 40.932 0.868 1
1 389 . 14 1 1 A 53 53 ASP N N 40 118.734 120.484 -1.750 1
1 390 . 14 1 1 A 54 54 LEU H H 41 7.180 8.190 -1.010 1
1 391 . 14 1 1 A 54 54 LEU HA H 41 3.990 3.967 0.023 1
1 400 . 14 1 1 A 54 54 LEU C C 41 178.204 178.380 -0.176 1
1 401 . 14 1 1 A 54 54 LEU CA C 41 56.260 58.669 -2.409 1
1 402 . 14 1 1 A 54 54 LEU CB C 41 41.259 41.757 -0.498 1
1 405 . 14 1 1 A 54 54 LEU N N 41 115.795 121.957 -6.162 1
1 406 . 14 1 1 A 55 55 LEU H H 42 7.823 8.627 -0.804 1
1 407 . 14 1 1 A 55 55 LEU HA H 42 3.920 4.085 -0.165 1
1 416 . 14 1 1 A 55 55 LEU C C 42 180.876 178.584 2.292 1
1 417 . 14 1 1 A 55 55 LEU CA C 42 58.135 58.122 0.013 1
1 418 . 14 1 1 A 55 55 LEU CB C 42 42.196 41.067 1.129 1
1 421 . 14 1 1 A 55 55 LEU N N 42 120.499 119.758 0.741 1
1 422 . 14 1 1 A 56 56 GLU H H 43 8.127 8.244 -0.117 1
1 423 . 14 1 1 A 56 56 GLU HA H 43 3.966 4.150 -0.184 1
1 428 . 14 1 1 A 56 56 GLU C C 43 178.801 179.395 -0.594 1
1 429 . 14 1 1 A 56 56 GLU CA C 43 60.010 59.183 0.827 1
1 430 . 14 1 1 A 56 56 GLU CB C 43 29.070 29.444 -0.374 1
1 432 . 14 1 1 A 56 56 GLU N N 43 120.955 119.063 1.892 1
1 433 . 14 1 1 A 57 57 ILE H H 44 7.504 7.630 -0.126 1
1 434 . 14 1 1 A 57 57 ILE HA H 44 4.524 3.924 0.600 1
1 444 . 14 1 1 A 57 57 ILE C C 44 175.691 177.421 -1.730 1
1 445 . 14 1 1 A 57 57 ILE CA C 44 61.886 64.753 -2.867 1
1 446 . 14 1 1 A 57 57 ILE CB C 44 37.300 38.469 -1.169 1
1 450 . 14 1 1 A 57 57 ILE N N 44 109.594 118.126 -8.532 1
1 451 . 14 1 1 A 58 58 GLY H H 45 7.724 6.967 0.757 1
1 452 . 14 1 1 A 58 58 GLY HA2 H 45 3.650 4.288 -0.638 1
1 453 . 14 1 1 A 58 58 GLY HA3 H 45 4.530 4.428 0.102 1
1 454 . 14 1 1 A 58 58 GLY C C 45 174.613 173.798 0.815 1
1 455 . 14 1 1 A 58 58 GLY CA C 45 45.947 45.685 0.262 1
1 456 . 14 1 1 A 58 58 GLY N N 45 106.680 106.224 0.456 1
1 457 . 14 1 1 A 59 59 ILE H H 46 8.180 8.072 0.108 1
1 458 . 14 1 1 A 59 59 ILE HA H 46 3.907 4.651 -0.744 1
1 468 . 14 1 1 A 59 59 ILE C C 46 174.235 175.502 -1.267 1
1 469 . 14 1 1 A 59 59 ILE CA C 46 60.948 59.452 1.496 1
1 470 . 14 1 1 A 59 59 ILE CB C 46 33.980 40.513 -6.533 1
1 474 . 14 1 1 A 59 59 ILE N N 46 122.454 121.244 1.210 1
1 475 . 14 1 1 A 60 60 LEU H H 47 7.367 8.559 -1.192 1
1 476 . 14 1 1 A 60 60 LEU HA H 47 3.900 4.461 -0.561 1
1 479 . 14 1 1 A 60 60 LEU C C 47 177.753 178.503 -0.750 1
1 480 . 14 1 1 A 60 60 LEU CA C 47 56.260 54.267 1.993 1
1 481 . 14 1 1 A 60 60 LEU CB C 47 42.196 42.635 -0.439 1
1 482 . 14 1 1 A 60 60 LEU N N 47 125.835 125.099 0.736 1
1 483 . 14 1 1 A 63 63 GLY HA2 H 50 3.980 3.734 0.246 1
1 484 . 14 1 1 A 63 63 GLY HA3 H 50 3.950 3.750 0.200 1
1 485 . 14 1 1 A 63 63 GLY C C 50 177.130 175.827 1.303 1
1 486 . 14 1 1 A 63 63 GLY CA C 50 46.884 47.055 -0.171 1
1 487 . 14 1 1 A 64 64 HIS H H 51 7.926 7.841 0.085 1
1 488 . 14 1 1 A 64 64 HIS HA H 51 4.451 4.446 0.005 1
1 493 . 14 1 1 A 64 64 HIS C C 51 177.613 176.436 1.177 1
1 494 . 14 1 1 A 64 64 HIS CA C 51 57.198 56.798 0.400 1
1 495 . 14 1 1 A 64 64 HIS CB C 51 30.945 30.696 0.249 1
1 498 . 14 1 1 A 64 64 HIS N N 51 122.284 121.472 0.812 1
1 499 . 14 1 1 A 65 65 ARG H H 52 8.105 8.129 -0.024 1
1 500 . 14 1 1 A 65 65 ARG HA H 52 3.685 3.707 -0.022 1
1 507 . 14 1 1 A 65 65 ARG C C 52 177.769 178.199 -0.430 1
1 508 . 14 1 1 A 65 65 ARG CA C 52 61.886 59.636 2.250 1
1 509 . 14 1 1 A 65 65 ARG CB C 52 30.945 30.016 0.929 1
1 511 . 14 1 1 A 65 65 ARG N N 52 117.775 119.377 -1.602 1
1 513 . 14 1 1 A 66 66 GLN H H 53 8.090 7.941 0.149 1
1 514 . 14 1 1 A 66 66 GLN HA H 53 3.940 3.955 -0.015 1
1 519 . 14 1 1 A 66 66 GLN C C 53 178.583 178.168 0.415 1
1 520 . 14 1 1 A 66 66 GLN CA C 53 59.073 58.905 0.168 1
1 521 . 14 1 1 A 66 66 GLN CB C 53 28.133 28.638 -0.505 1
1 523 . 14 1 1 A 66 66 GLN N N 53 116.452 118.411 -1.959 1
1 524 . 14 1 1 A 67 67 ARG H H 54 7.845 7.644 0.201 1
1 525 . 14 1 1 A 67 67 ARG HA H 54 4.010 3.884 0.126 1
1 528 . 14 1 1 A 67 67 ARG C C 54 179.766 178.755 1.011 1
1 529 . 14 1 1 A 67 67 ARG CA C 54 59.073 58.695 0.378 1
1 530 . 14 1 1 A 67 67 ARG CB C 54 30.720 29.503 1.217 1
1 532 . 14 1 1 A 67 67 ARG N N 54 119.275 119.877 -0.602 1
1 533 . 14 1 1 A 68 68 ILE H H 55 8.032 7.691 0.341 1
1 534 . 14 1 1 A 68 68 ILE HA H 55 3.495 3.486 0.009 1
1 544 . 14 1 1 A 68 68 ILE C C 55 177.108 178.718 -1.610 1
1 545 . 14 1 1 A 68 68 ILE CA C 55 66.230 64.751 1.479 1
1 546 . 14 1 1 A 68 68 ILE CB C 55 38.020 37.109 0.911 1
1 550 . 14 1 1 A 68 68 ILE N N 55 121.152 119.243 1.909 1
1 551 . 14 1 1 A 69 69 LEU H H 56 8.490 8.275 0.215 1
1 552 . 14 1 1 A 69 69 LEU HA H 56 4.010 3.761 0.249 1
1 561 . 14 1 1 A 69 69 LEU C C 56 179.917 178.861 1.056 1
1 562 . 14 1 1 A 69 69 LEU CA C 56 58.135 58.124 0.011 1
1 563 . 14 1 1 A 69 69 LEU CB C 56 41.259 41.635 -0.376 1
1 566 . 14 1 1 A 69 69 LEU N N 56 119.072 121.083 -2.011 1
1 567 . 14 1 1 A 70 70 GLN H H 57 8.327 8.650 -0.323 1
1 568 . 14 1 1 A 70 70 GLN HA H 57 4.100 3.955 0.145 1
1 573 . 14 1 1 A 70 70 GLN C C 57 178.798 178.044 0.754 1
1 574 . 14 1 1 A 70 70 GLN CA C 57 59.073 58.799 0.274 1
1 575 . 14 1 1 A 70 70 GLN CB C 57 28.133 28.459 -0.326 1
1 577 . 14 1 1 A 70 70 GLN N N 57 118.172 118.211 -0.039 1
1 578 . 14 1 1 A 71 71 ALA H H 58 7.810 7.818 -0.008 1
1 579 . 14 1 1 A 71 71 ALA HA H 58 4.320 4.102 0.218 1
1 583 . 14 1 1 A 71 71 ALA C C 58 172.232 179.190 -6.958 1
1 584 . 14 1 1 A 71 71 ALA CA C 58 55.323 55.226 0.097 1
1 585 . 14 1 1 A 71 71 ALA CB C 58 19.720 19.011 0.709 1
1 586 . 14 1 1 A 71 71 ALA N N 58 122.536 122.348 0.188 1
1 587 . 14 1 1 A 72 72 ILE H H 59 8.840 8.380 0.460 1
1 588 . 14 1 1 A 72 72 ILE HA H 59 4.030 4.009 0.021 1
1 598 . 14 1 1 A 72 72 ILE C C 59 178.678 177.597 1.081 1
1 599 . 14 1 1 A 72 72 ILE CA C 59 64.698 63.907 0.791 1
1 600 . 14 1 1 A 72 72 ILE CB C 59 37.850 37.598 0.252 1
1 604 . 14 1 1 A 72 72 ILE N N 59 118.111 119.025 -0.914 1
1 605 . 14 1 1 A 73 73 GLN H H 60 7.547 8.122 -0.575 1
1 606 . 14 1 1 A 73 73 GLN HA H 60 4.121 4.089 0.032 1
1 611 . 14 1 1 A 73 73 GLN C C 60 176.556 178.089 -1.533 1
1 612 . 14 1 1 A 73 73 GLN CA C 60 58.135 58.500 -0.365 1
1 613 . 14 1 1 A 73 73 GLN CB C 60 28.300 28.502 -0.202 1
1 615 . 14 1 1 A 73 73 GLN N N 60 119.094 120.934 -1.840 1
1 616 . 14 1 1 A 74 74 LEU H H 61 7.350 7.810 -0.460 1
1 617 . 14 1 1 A 74 74 LEU HA H 61 4.408 4.286 0.122 1
1 626 . 14 1 1 A 74 74 LEU C C 61 177.960 177.537 0.423 1
1 627 . 14 1 1 A 74 74 LEU CA C 61 54.900 55.724 -0.824 1
1 628 . 14 1 1 A 74 74 LEU CB C 61 42.196 42.456 -0.260 1
1 631 . 14 1 1 A 74 74 LEU N N 61 115.853 118.535 -2.682 1
1 632 . 14 1 1 A 75 75 LEU H H 62 7.358 7.587 -0.229 1
1 633 . 14 1 1 A 75 75 LEU HA H 62 4.530 4.385 0.145 1
1 642 . 14 1 1 A 75 75 LEU C C 62 177.035 174.998 2.037 1
1 643 . 14 1 1 A 75 75 LEU CA C 62 53.200 53.662 -0.462 1
1 644 . 14 1 1 A 75 75 LEU CB C 62 40.700 42.343 -1.643 1
1 647 . 14 1 1 A 75 75 LEU N N 62 121.010 121.792 -0.782 1
1 648 . 14 1 1 A 76 76 PRO HA H 63 4.382 4.585 -0.203 1
1 655 . 14 1 1 A 76 76 PRO CB C 63 31.883 33.073 -1.190 1
1 657 . 14 1 1 A 77 77 LYS H H 64 8.418 8.332 0.086 1
1 658 . 14 1 1 A 77 77 LYS HA H 64 4.140 5.022 -0.882 1
1 663 . 14 1 1 A 77 77 LYS C C 64 177.122 175.934 1.188 1
1 664 . 14 1 1 A 77 77 LYS CA C 64 56.260 54.398 1.862 1
1 665 . 14 1 1 A 77 77 LYS CB C 64 33.340 34.980 -1.640 1
1 668 . 14 1 1 A 77 77 LYS N N 64 121.932 116.726 5.206 1
1 669 . 14 1 1 A 78 78 MET H H 65 8.550 8.736 -0.186 1
1 670 . 14 1 1 A 78 78 MET HA H 65 4.304 4.643 -0.339 1
1 676 . 14 1 1 A 78 78 MET C C 65 176.105 176.820 -0.715 1
1 677 . 14 1 1 A 78 78 MET CA C 65 56.260 57.140 -0.880 1
1 678 . 14 1 1 A 78 78 MET CB C 65 32.821 34.724 -1.903 1
1 680 . 14 1 1 A 78 78 MET N N 65 123.498 120.708 2.790 1
1 681 . 14 1 1 A 79 79 ARG H H 66 8.731 7.739 0.992 1
1 682 . 14 1 1 A 79 79 ARG C C 66 173.577 173.599 -0.022 1
1 683 . 14 1 1 A 79 79 ARG CA C 66 53.447 53.973 -0.526 1
1 684 . 14 1 1 A 79 79 ARG CB C 66 30.008 30.608 -0.600 1
1 685 . 14 1 1 A 79 79 ARG N N 66 127.355 119.171 8.184 1
1 686 . 14 1 1 A 80 80 PRO HA H 67 4.780 4.590 0.190 1
1 693 . 14 1 1 A 80 80 PRO C C 67 177.043 175.498 1.545 1
1 694 . 14 1 1 A 80 80 PRO CA C 67 61.886 62.355 -0.469 1
1 695 . 14 1 1 A 80 80 PRO CB C 67 32.821 32.921 -0.100 1
1 698 . 14 1 1 A 81 81 ILE H H 68 8.580 8.533 0.047 1
1 699 . 14 1 1 A 81 81 ILE HA H 68 4.040 4.453 -0.413 1
1 709 . 14 1 1 A 81 81 ILE C C 68 176.831 177.209 -0.378 1
1 710 . 14 1 1 A 81 81 ILE CA C 68 62.823 60.258 2.565 1
1 711 . 14 1 1 A 81 81 ILE CB C 68 38.580 39.479 -0.899 1
1 715 . 14 1 1 A 81 81 ILE N N 68 118.491 120.989 -2.498 1
1 716 . 14 1 1 A 82 82 GLY H H 69 8.602 8.546 0.056 1
1 717 . 14 1 1 A 82 82 GLY CA C 69 45.009 47.394 -2.385 1
1 718 . 14 1 1 A 82 82 GLY N N 69 111.377 114.141 -2.764 1
1 721 . 14 1 1 A 84 84 ASP HA H 71 4.490 4.547 -0.057 1
1 724 . 14 1 1 A 84 84 ASP CA C 71 54.385 54.901 -0.516 1
1 725 . 14 1 1 A 84 84 ASP CB C 71 40.321 41.519 -1.198 1
1 726 . 14 1 1 A 85 85 GLY H H 72 8.054 8.732 -0.678 1
1 727 . 14 1 1 A 85 85 GLY HA2 H 72 4.040 3.874 0.166 1
1 728 . 14 1 1 A 85 85 GLY HA3 H 72 3.750 3.883 -0.133 1
1 729 . 14 1 1 A 85 85 GLY C C 72 173.474 175.127 -1.653 1
1 730 . 14 1 1 A 85 85 GLY CA C 72 45.009 46.891 -1.882 1
1 731 . 14 1 1 A 85 85 GLY N N 72 108.038 112.576 -4.538 1
1 732 . 14 1 1 A 86 86 ALA H H 73 7.858 8.538 -0.680 1
1 733 . 14 1 1 A 86 86 ALA HA H 73 4.370 3.897 0.473 1
1 737 . 14 1 1 A 86 86 ALA CA C 73 51.990 52.811 -0.821 1
1 738 . 14 1 1 A 86 86 ALA CB C 73 19.220 17.220 2.000 1
1 739 . 14 1 1 A 86 86 ALA N N 73 123.819 125.642 -1.823 1
1 742 . 14 1 1 A 90 90 SER H H 77 7.839 7.854 -0.015 1
1 743 . 14 1 1 A 90 90 SER HA H 77 4.770 4.806 -0.036 1
1 746 . 14 1 1 A 90 90 SER N N 77 115.163 114.071 1.092 1
1 747 . 14 1 1 A 91 91 VAL H H 78 8.578 9.051 -0.473 1
1 748 . 14 1 1 A 91 91 VAL HA H 78 3.981 3.954 0.027 1
1 756 . 14 1 1 A 91 91 VAL C C 78 177.480 177.373 0.107 1
1 757 . 14 1 1 A 91 91 VAL CA C 78 67.060 66.279 0.781 1
1 758 . 14 1 1 A 91 91 VAL CB C 78 32.500 31.631 0.869 1
1 761 . 14 1 1 A 91 91 VAL N N 78 123.481 122.499 0.982 1
1 762 . 14 1 1 A 92 92 ALA H H 79 8.607 8.410 0.197 1
1 763 . 14 1 1 A 92 92 ALA HA H 79 4.113 4.292 -0.179 1
1 767 . 14 1 1 A 92 92 ALA C C 79 179.868 179.920 -0.052 1
1 768 . 14 1 1 A 92 92 ALA CA C 79 54.890 55.877 -0.987 1
1 769 . 14 1 1 A 92 92 ALA CB C 79 18.790 18.058 0.732 1
1 770 . 14 1 1 A 92 92 ALA N N 79 120.334 121.980 -1.646 1
1 771 . 14 1 1 A 93 93 GLU H H 80 7.886 8.192 -0.306 1
1 772 . 14 1 1 A 93 93 GLU HA H 80 4.010 4.052 -0.042 1
1 777 . 14 1 1 A 93 93 GLU C C 80 179.719 178.530 1.189 1
1 778 . 14 1 1 A 93 93 GLU CA C 80 59.073 58.327 0.746 1
1 779 . 14 1 1 A 93 93 GLU CB C 80 30.630 29.367 1.263 1
1 781 . 14 1 1 A 93 93 GLU N N 80 117.643 117.463 0.180 1
1 782 . 14 1 1 A 94 94 TRP H H 81 8.299 8.062 0.237 1
1 783 . 14 1 1 A 94 94 TRP HA H 81 4.251 4.336 -0.085 1
1 792 . 14 1 1 A 94 94 TRP C C 81 178.772 177.651 1.121 1
1 793 . 14 1 1 A 94 94 TRP CA C 81 60.010 60.794 -0.784 1
1 794 . 14 1 1 A 94 94 TRP CB C 81 27.650 29.439 -1.789 1
1 800 . 14 1 1 A 94 94 TRP N N 81 122.545 123.664 -1.119 1
1 802 . 14 1 1 A 95 95 LEU H H 82 8.505 7.681 0.824 1
1 803 . 14 1 1 A 95 95 LEU HA H 82 2.880 3.588 -0.708 1
1 812 . 14 1 1 A 95 95 LEU C C 82 180.235 178.469 1.766 1
1 813 . 14 1 1 A 95 95 LEU CA C 82 57.400 56.569 0.831 1
1 814 . 14 1 1 A 95 95 LEU CB C 82 40.321 41.357 -1.036 1
1 817 . 14 1 1 A 95 95 LEU N N 82 121.110 119.063 2.047 1
1 818 . 14 1 1 A 96 96 ASP H H 83 8.185 8.490 -0.305 1
1 819 . 14 1 1 A 96 96 ASP HA H 83 4.280 4.371 -0.091 1
1 822 . 14 1 1 A 96 96 ASP C C 83 175.224 177.722 -2.498 1
1 823 . 14 1 1 A 96 96 ASP CA C 83 57.310 56.809 0.501 1
1 824 . 14 1 1 A 96 96 ASP CB C 83 40.321 41.306 -0.985 1
1 825 . 14 1 1 A 96 96 ASP N N 83 119.082 119.482 -0.400 1
1 826 . 14 1 1 A 97 97 SER H H 84 7.989 7.863 0.126 1
1 827 . 14 1 1 A 97 97 SER HA H 84 4.250 4.325 -0.075 1
1 830 . 14 1 1 A 97 97 SER C C 84 175.346 175.448 -0.102 1
1 831 . 14 1 1 A 97 97 SER CA C 84 60.948 60.388 0.560 1
1 832 . 14 1 1 A 97 97 SER CB C 84 63.370 63.115 0.255 1
1 833 . 14 1 1 A 97 97 SER N N 84 117.579 116.044 1.535 1
1 834 . 14 1 1 A 98 98 ILE H H 85 6.862 7.800 -0.938 1
1 835 . 14 1 1 A 98 98 ILE HA H 85 4.550 3.932 0.618 1
1 843 . 14 1 1 A 98 98 ILE C C 85 173.308 176.336 -3.028 1
1 844 . 14 1 1 A 98 98 ILE CA C 85 60.948 63.593 -2.645 1
1 845 . 14 1 1 A 98 98 ILE CB C 85 37.760 38.083 -0.323 1
1 848 . 14 1 1 A 98 98 ILE N N 85 113.733 120.478 -6.745 1
1 849 . 14 1 1 A 99 99 GLU H H 86 7.705 7.338 0.367 1
1 850 . 14 1 1 A 99 99 GLU HA H 86 4.280 4.577 -0.297 1
1 853 . 14 1 1 A 99 99 GLU C C 86 175.224 175.469 -0.245 1
1 854 . 14 1 1 A 99 99 GLU CA C 86 56.260 57.866 -1.606 1
1 855 . 14 1 1 A 99 99 GLU CB C 86 26.258 32.158 -5.900 1
1 857 . 14 1 1 A 99 99 GLU N N 86 115.493 116.770 -1.277 1
1 858 . 14 1 1 A 100 100 LEU H H 87 7.989 7.648 0.341 1
1 859 . 14 1 1 A 100 100 LEU HA H 87 4.220 4.657 -0.437 1
1 868 . 14 1 1 A 100 100 LEU C C 87 176.965 176.904 0.061 1
1 869 . 14 1 1 A 100 100 LEU CA C 87 52.510 53.236 -0.726 1
1 870 . 14 1 1 A 100 100 LEU CB C 87 42.196 44.287 -2.091 1
1 873 . 14 1 1 A 100 100 LEU N N 87 117.579 116.177 1.402 1
1 874 . 14 1 1 A 101 101 GLY H H 88 8.503 8.679 -0.176 1
1 875 . 14 1 1 A 101 101 GLY CA C 88 46.884 45.444 1.440 1
1 876 . 14 1 1 A 101 101 GLY N N 88 107.794 109.070 -1.276 1
1 877 . 14 1 1 A 102 102 ASP HA H 89 4.431 4.252 0.179 1
1 880 . 14 1 1 A 102 102 ASP C C 89 178.075 178.447 -0.372 1
1 881 . 14 1 1 A 102 102 ASP CA C 89 57.198 56.875 0.323 1
1 882 . 14 1 1 A 102 102 ASP CB C 89 40.321 40.353 -0.032 1
1 883 . 14 1 1 A 103 103 TYR H H 90 7.899 8.088 -0.189 1
1 884 . 14 1 1 A 103 103 TYR HA H 90 4.940 4.464 0.476 1
1 889 . 14 1 1 A 103 103 TYR C C 90 175.527 178.564 -3.037 1
1 890 . 14 1 1 A 103 103 TYR CA C 90 58.135 60.405 -2.270 1
1 891 . 14 1 1 A 103 103 TYR CB C 90 38.446 37.727 0.719 1
1 894 . 14 1 1 A 103 103 TYR N N 90 115.595 119.574 -3.979 1
1 895 . 14 1 1 A 104 104 THR H H 91 7.971 8.374 -0.403 1
1 896 . 14 1 1 A 104 104 THR HA H 91 4.234 4.084 0.150 1
1 901 . 14 1 1 A 104 104 THR C C 91 175.905 176.849 -0.944 1
1 902 . 14 1 1 A 104 104 THR CA C 91 68.449 67.083 1.366 1
1 904 . 14 1 1 A 104 104 THR N N 91 118.867 116.674 2.193 1
1 905 . 14 1 1 A 105 105 LYS H H 92 8.555 8.226 0.329 1
1 906 . 14 1 1 A 105 105 LYS HA H 92 3.940 4.065 -0.125 1
1 912 . 14 1 1 A 105 105 LYS C C 92 177.310 178.949 -1.639 1
1 913 . 14 1 1 A 105 105 LYS CA C 92 60.948 59.617 1.331 1
1 914 . 14 1 1 A 105 105 LYS CB C 92 31.883 32.413 -0.530 1
1 917 . 14 1 1 A 105 105 LYS N N 92 119.259 119.785 -0.526 1
1 918 . 14 1 1 A 106 106 ALA H H 93 7.920 7.780 0.140 1
1 919 . 14 1 1 A 106 106 ALA HA H 93 4.128 4.189 -0.061 1
1 923 . 14 1 1 A 106 106 ALA C C 93 180.972 180.415 0.557 1
1 924 . 14 1 1 A 106 106 ALA CA C 93 55.070 55.261 -0.191 1
1 925 . 14 1 1 A 106 106 ALA CB C 93 17.750 18.430 -0.680 1
1 926 . 14 1 1 A 106 106 ALA N N 93 120.398 122.114 -1.716 1
1 927 . 14 1 1 A 107 107 PHE H H 94 8.136 8.595 -0.459 1
1 928 . 14 1 1 A 107 107 PHE HA H 94 4.190 4.649 -0.459 1
1 934 . 14 1 1 A 107 107 PHE C C 94 177.955 178.314 -0.359 1
1 935 . 14 1 1 A 107 107 PHE CA C 94 63.761 61.622 2.139 1
1 936 . 14 1 1 A 107 107 PHE CB C 94 38.446 39.241 -0.795 1
1 940 . 14 1 1 A 107 107 PHE N N 94 117.119 116.317 0.802 1
1 941 . 14 1 1 A 108 108 LEU H H 95 8.351 8.671 -0.320 1
1 942 . 14 1 1 A 108 108 LEU HA H 95 3.889 3.971 -0.082 1
1 951 . 14 1 1 A 108 108 LEU C C 95 182.043 179.140 2.903 1
1 952 . 14 1 1 A 108 108 LEU CA C 95 59.073 58.557 0.516 1
1 953 . 14 1 1 A 108 108 LEU CB C 95 41.259 41.867 -0.608 1
1 956 . 14 1 1 A 108 108 LEU N N 95 118.450 119.799 -1.349 1
1 957 . 14 1 1 A 109 109 ILE H H 96 8.992 8.133 0.859 1
1 958 . 14 1 1 A 109 109 ILE HA H 96 4.069 3.888 0.181 1
1 968 . 14 1 1 A 109 109 ILE C C 96 177.094 177.858 -0.764 1
1 969 . 14 1 1 A 109 109 ILE CA C 96 63.761 64.458 -0.697 1
1 970 . 14 1 1 A 109 109 ILE CB C 96 37.509 37.715 -0.206 1
1 974 . 14 1 1 A 109 109 ILE N N 96 118.177 115.484 2.693 1
1 975 . 14 1 1 A 110 110 ASN H H 97 7.067 7.939 -0.872 1
1 976 . 14 1 1 A 110 110 ASN HA H 97 4.797 4.752 0.045 1
1 981 . 14 1 1 A 110 110 ASN C C 97 173.595 175.318 -1.723 1
1 982 . 14 1 1 A 110 110 ASN CA C 97 54.385 53.832 0.553 1
1 983 . 14 1 1 A 110 110 ASN CB C 97 40.321 39.153 1.168 1
1 984 . 14 1 1 A 110 110 ASN N N 97 116.407 119.478 -3.071 1
1 986 . 14 1 1 A 111 111 GLY H H 98 7.681 7.927 -0.246 1
1 987 . 14 1 1 A 111 111 GLY HA2 H 98 4.080 3.915 0.165 1
1 988 . 14 1 1 A 111 111 GLY HA3 H 98 3.640 4.008 -0.368 1
1 989 . 14 1 1 A 111 111 GLY C C 98 174.552 174.317 0.235 1
1 990 . 14 1 1 A 111 111 GLY CA C 98 45.947 45.167 0.780 1
1 991 . 14 1 1 A 111 111 GLY N N 98 104.440 107.443 -3.003 1
1 992 . 14 1 1 A 112 112 TYR H H 99 8.427 8.027 0.400 1
1 993 . 14 1 1 A 112 112 TYR HA H 99 4.661 4.602 0.059 1
1 998 . 14 1 1 A 112 112 TYR C C 99 174.425 175.555 -1.130 1
1 999 . 14 1 1 A 112 112 TYR CA C 99 57.198 58.467 -1.269 1
1 1000 . 14 1 1 A 112 112 TYR CB C 99 36.571 38.395 -1.824 1
1 1003 . 14 1 1 A 112 112 TYR N N 99 122.830 120.406 2.424 1
1 1004 . 14 1 1 A 113 113 THR H H 100 7.166 8.491 -1.325 1
1 1005 . 14 1 1 A 113 113 THR HA H 100 4.248 4.503 -0.255 1
1 1009 . 14 1 1 A 113 113 THR C C 100 174.897 174.475 0.422 1
1 1010 . 14 1 1 A 113 113 THR CA C 100 62.290 63.365 -1.075 1
1 1011 . 14 1 1 A 113 113 THR CB C 100 68.970 70.407 -1.437 1
1 1013 . 14 1 1 A 113 113 THR N N 100 104.304 120.297 -15.993 1
1 1014 . 14 1 1 A 114 114 SER H H 101 7.695 8.074 -0.379 1
1 1015 . 14 1 1 A 114 114 SER C C 101 174.372 174.531 -0.159 1
1 1016 . 14 1 1 A 114 114 SER CA C 101 56.260 57.256 -0.996 1
1 1017 . 14 1 1 A 114 114 SER CB C 101 65.636 65.449 0.187 1
1 1018 . 14 1 1 A 114 114 SER N N 101 115.613 115.721 -0.108 1
1 1023 . 14 1 1 A 116 116 ASP HA H 103 4.260 4.334 -0.074 1
1 1026 . 14 1 1 A 116 116 ASP CA C 103 57.198 56.721 0.477 1
1 1027 . 14 1 1 A 116 116 ASP CB C 103 40.321 40.257 0.064 1
1 1028 . 14 1 1 A 117 117 LEU H H 104 7.345 7.985 -0.640 1
1 1029 . 14 1 1 A 117 117 LEU HA H 104 4.290 4.087 0.203 1
1 1038 . 14 1 1 A 117 117 LEU C C 104 178.488 179.085 -0.597 1
1 1039 . 14 1 1 A 117 117 LEU CA C 104 56.260 57.843 -1.583 1
1 1040 . 14 1 1 A 117 117 LEU CB C 104 42.196 41.743 0.453 1
1 1043 . 14 1 1 A 117 117 LEU N N 104 117.878 121.237 -3.359 1
1 1044 . 14 1 1 A 118 118 LEU H H 105 7.514 8.294 -0.780 1
1 1045 . 14 1 1 A 118 118 LEU HA H 105 4.210 4.142 0.068 1
1 1054 . 14 1 1 A 118 118 LEU C C 105 177.002 177.894 -0.892 1
1 1055 . 14 1 1 A 118 118 LEU CA C 105 55.323 56.983 -1.660 1
1 1056 . 14 1 1 A 118 118 LEU CB C 105 42.196 41.139 1.057 1
1 1059 . 14 1 1 A 118 118 LEU N N 105 119.094 118.795 0.299 1
1 1060 . 14 1 1 A 120 120 LYS HA H 107 4.340 4.477 -0.137 1
1 1063 . 14 1 1 A 120 120 LYS C C 107 176.603 175.760 0.843 1
1 1064 . 14 1 1 A 120 120 LYS CA C 107 55.323 56.247 -0.924 1
1 1065 . 14 1 1 A 120 120 LYS CB C 107 31.883 32.866 -0.983 1
1 1068 . 14 1 1 A 121 121 ILE H H 108 7.539 7.485 0.054 1
1 1069 . 14 1 1 A 121 121 ILE HA H 108 3.987 4.849 -0.862 1
1 1079 . 14 1 1 A 121 121 ILE C C 108 173.247 175.177 -1.930 1
1 1080 . 14 1 1 A 121 121 ILE CA C 108 62.823 58.813 4.010 1
1 1081 . 14 1 1 A 121 121 ILE CB C 108 38.446 42.166 -3.720 1
1 1085 . 14 1 1 A 121 121 ILE N N 108 122.417 116.816 5.601 1
1 1086 . 14 1 1 A 122 122 ALA H H 109 8.290 8.044 0.246 1
1 1087 . 14 1 1 A 122 122 ALA HA H 109 3.970 4.665 -0.695 1
1 1091 . 14 1 1 A 122 122 ALA C C 109 178.318 177.769 0.549 1
1 1092 . 14 1 1 A 122 122 ALA CA C 109 50.150 50.049 0.101 1
1 1093 . 14 1 1 A 122 122 ALA CB C 109 21.630 20.382 1.248 1
1 1094 . 14 1 1 A 122 122 ALA N N 109 127.784 125.077 2.707 1
1 1095 . 14 1 1 A 123 123 GLU HA H 110 3.707 3.950 -0.243 1
1 1099 . 14 1 1 A 123 123 GLU C C 110 178.290 178.426 -0.136 1
1 1100 . 14 1 1 A 123 123 GLU CA C 110 60.948 60.288 0.660 1
1 1101 . 14 1 1 A 123 123 GLU CB C 110 29.070 29.802 -0.732 1
1 1102 . 14 1 1 A 124 124 VAL H H 111 8.333 8.327 0.006 1
1 1103 . 14 1 1 A 124 124 VAL HA H 111 3.850 3.737 0.113 1
1 1111 . 14 1 1 A 124 124 VAL C C 111 177.406 177.552 -0.146 1
1 1112 . 14 1 1 A 124 124 VAL CA C 111 65.636 65.156 0.480 1
1 1113 . 14 1 1 A 124 124 VAL CB C 111 30.730 31.256 -0.526 1
1 1116 . 14 1 1 A 124 124 VAL N N 111 114.438 118.756 -4.318 1
1 1117 . 14 1 1 A 125 125 GLU H H 112 7.442 8.337 -0.895 1
1 1118 . 14 1 1 A 125 125 GLU HA H 112 4.152 4.056 0.096 1
1 1123 . 14 1 1 A 125 125 GLU C C 112 179.982 179.338 0.644 1
1 1124 . 14 1 1 A 125 125 GLU CA C 112 60.010 59.468 0.542 1
1 1125 . 14 1 1 A 125 125 GLU CB C 112 30.008 29.325 0.683 1
1 1127 . 14 1 1 A 125 125 GLU N N 112 121.032 121.850 -0.818 1
1 1128 . 14 1 1 A 126 126 LEU H H 113 7.666 7.873 -0.207 1
1 1129 . 14 1 1 A 126 126 LEU HA H 113 3.846 4.040 -0.194 1
1 1138 . 14 1 1 A 126 126 LEU C C 113 176.991 178.830 -1.839 1
1 1139 . 14 1 1 A 126 126 LEU CA C 113 58.135 57.958 0.177 1
1 1140 . 14 1 1 A 126 126 LEU CB C 113 41.259 41.859 -0.600 1
1 1143 . 14 1 1 A 126 126 LEU N N 113 118.731 121.260 -2.529 1
1 1144 . 14 1 1 A 127 127 ILE H H 114 7.781 7.999 -0.218 1
1 1145 . 14 1 1 A 127 127 ILE HA H 114 3.502 3.880 -0.378 1
1 1153 . 14 1 1 A 127 127 ILE C C 114 178.195 176.846 1.349 1
1 1154 . 14 1 1 A 127 127 ILE CA C 114 65.636 62.673 2.963 1
1 1155 . 14 1 1 A 127 127 ILE CB C 114 40.321 37.651 2.670 1
1 1159 . 14 1 1 A 127 127 ILE N N 114 115.084 118.771 -3.687 1
1 1160 . 14 1 1 A 128 128 ASN H H 115 8.470 8.071 0.399 1
1 1161 . 14 1 1 A 128 128 ASN HA H 115 4.502 4.688 -0.186 1
1 1166 . 14 1 1 A 128 128 ASN C C 115 176.295 176.119 0.176 1
1 1167 . 14 1 1 A 128 128 ASN CA C 115 56.260 54.868 1.392 1
1 1168 . 14 1 1 A 128 128 ASN CB C 115 39.384 39.181 0.203 1
1 1169 . 14 1 1 A 128 128 ASN N N 115 115.158 118.980 -3.822 1
1 1171 . 14 1 1 A 129 129 VAL H H 116 8.116 7.734 0.382 1
1 1172 . 14 1 1 A 129 129 VAL HA H 116 4.090 3.950 0.140 1
1 1180 . 14 1 1 A 129 129 VAL C C 116 176.740 177.226 -0.486 1
1 1181 . 14 1 1 A 129 129 VAL CA C 116 64.400 64.528 -0.128 1
1 1182 . 14 1 1 A 129 129 VAL CB C 116 32.050 32.647 -0.597 1
1 1185 . 14 1 1 A 129 129 VAL N N 116 118.698 117.743 0.955 1
1 1186 . 14 1 1 A 130 130 LEU H H 117 7.294 7.919 -0.625 1
1 1187 . 14 1 1 A 130 130 LEU HA H 117 3.970 4.247 -0.277 1
1 1196 . 14 1 1 A 130 130 LEU C C 117 175.127 176.275 -1.148 1
1 1197 . 14 1 1 A 130 130 LEU CA C 117 56.260 54.531 1.729 1
1 1198 . 14 1 1 A 130 130 LEU CB C 117 41.259 41.522 -0.263 1
1 1201 . 14 1 1 A 130 130 LEU N N 117 116.201 118.987 -2.786 1
1 1202 . 14 1 1 A 131 131 LYS H H 118 6.594 7.971 -1.377 1
1 1203 . 14 1 1 A 131 131 LYS HA H 118 3.980 4.306 -0.326 1
1 1208 . 14 1 1 A 131 131 LYS C C 118 175.589 175.437 0.152 1
1 1209 . 14 1 1 A 131 131 LYS CA C 118 56.260 57.137 -0.877 1
1 1210 . 14 1 1 A 131 131 LYS CB C 118 28.133 30.250 -2.117 1
1 1212 . 14 1 1 A 131 131 LYS N N 118 111.172 117.485 -6.313 1
1 1213 . 14 1 1 A 132 132 ILE H H 119 8.245 7.989 0.256 1
1 1214 . 14 1 1 A 132 132 ILE HA H 119 4.090 4.366 -0.276 1
1 1224 . 14 1 1 A 132 132 ILE C C 119 175.161 175.842 -0.681 1
1 1225 . 14 1 1 A 132 132 ILE CA C 119 60.010 61.154 -1.144 1
1 1226 . 14 1 1 A 132 132 ILE CB C 119 35.633 37.016 -1.383 1
1 1230 . 14 1 1 A 132 132 ILE N N 119 119.484 120.741 -1.257 1
1 1231 . 14 1 1 A 133 133 ASN H H 120 8.054 9.077 -1.023 1
1 1232 . 14 1 1 A 133 133 ASN HA H 120 4.350 4.751 -0.401 1
1 1235 . 14 1 1 A 133 133 ASN C C 120 175.136 175.807 -0.671 1
1 1236 . 14 1 1 A 133 133 ASN CA C 120 54.385 54.874 -0.489 1
1 1237 . 14 1 1 A 133 133 ASN CB C 120 39.384 39.231 0.153 1
1 1238 . 14 1 1 A 133 133 ASN N N 120 124.670 127.177 -2.507 1
1 1239 . 14 1 1 A 134 134 LEU H H 121 7.517 7.350 0.167 1
1 1240 . 14 1 1 A 134 134 LEU HA H 121 4.678 4.109 0.569 1
1 1249 . 14 1 1 A 134 134 LEU C C 121 178.051 177.398 0.653 1
1 1250 . 14 1 1 A 134 134 LEU CA C 121 53.447 55.949 -2.502 1
1 1251 . 14 1 1 A 134 134 LEU CB C 121 41.259 43.057 -1.798 1
1 1254 . 14 1 1 A 134 134 LEU N N 121 119.918 119.096 0.822 1
1 1255 . 14 1 1 A 135 135 ILE H H 122 9.389 8.459 0.930 1
1 1256 . 14 1 1 A 135 135 ILE HA H 122 3.540 3.728 -0.188 1
1 1266 . 14 1 1 A 135 135 ILE C C 122 176.425 177.616 -1.191 1
1 1267 . 14 1 1 A 135 135 ILE CA C 122 65.636 65.225 0.411 1
1 1268 . 14 1 1 A 135 135 ILE CB C 122 38.446 38.017 0.429 1
1 1272 . 14 1 1 A 135 135 ILE N N 122 129.949 127.016 2.933 1
1 1273 . 14 1 1 A 136 136 GLY H H 123 8.675 8.523 0.152 1
1 1274 . 14 1 1 A 136 136 GLY HA2 H 123 2.650 3.177 -0.527 1
1 1275 . 14 1 1 A 136 136 GLY HA3 H 123 2.060 3.562 -1.502 1
1 1276 . 14 1 1 A 136 136 GLY C C 123 176.854 176.375 0.479 1
1 1277 . 14 1 1 A 136 136 GLY CA C 123 45.500 47.093 -1.593 1
1 1278 . 14 1 1 A 136 136 GLY N N 123 106.314 108.139 -1.825 1
1 1279 . 14 1 1 A 137 137 HIS H H 124 6.869 7.841 -0.972 1
1 1280 . 14 1 1 A 137 137 HIS HA H 124 4.558 4.509 0.049 1
1 1285 . 14 1 1 A 137 137 HIS C C 124 176.977 177.379 -0.402 1
1 1286 . 14 1 1 A 137 137 HIS CA C 124 57.198 58.504 -1.306 1
1 1287 . 14 1 1 A 137 137 HIS CB C 124 30.945 30.076 0.869 1
1 1290 . 14 1 1 A 137 137 HIS N N 124 118.865 120.147 -1.282 1
1 1291 . 14 1 1 A 138 138 ARG H H 125 7.730 8.277 -0.547 1
1 1292 . 14 1 1 A 138 138 ARG HA H 125 3.770 3.811 -0.041 1
1 1299 . 14 1 1 A 138 138 ARG C C 125 178.288 178.343 -0.055 1
1 1300 . 14 1 1 A 138 138 ARG CA C 125 61.886 59.049 2.837 1
1 1301 . 14 1 1 A 138 138 ARG CB C 125 30.945 29.648 1.297 1
1 1304 . 14 1 1 A 138 138 ARG N N 125 118.149 119.512 -1.363 1
1 1306 . 14 1 1 A 139 139 LYS H H 126 8.679 8.026 0.653 1
1 1307 . 14 1 1 A 139 139 LYS HA H 126 3.990 3.995 -0.005 1
1 1310 . 14 1 1 A 139 139 LYS C C 126 179.184 178.712 0.472 1
1 1311 . 14 1 1 A 139 139 LYS CA C 126 58.135 59.228 -1.093 1
1 1312 . 14 1 1 A 139 139 LYS CB C 126 30.945 32.016 -1.071 1
1 1314 . 14 1 1 A 139 139 LYS N N 126 114.003 119.114 -5.111 1
1 1315 . 14 1 1 A 140 140 ARG H H 127 7.248 8.133 -0.885 1
1 1316 . 14 1 1 A 140 140 ARG HA H 127 3.870 4.042 -0.172 1
1 1324 . 14 1 1 A 140 140 ARG C C 127 177.772 178.468 -0.696 1
1 1325 . 14 1 1 A 140 140 ARG CA C 127 60.010 58.690 1.320 1
1 1326 . 14 1 1 A 140 140 ARG CB C 127 30.945 30.063 0.882 1
1 1329 . 14 1 1 A 140 140 ARG N N 127 120.072 117.761 2.311 1
1 1331 . 14 1 1 A 141 141 ILE H H 128 7.706 7.897 -0.191 1
1 1332 . 14 1 1 A 141 141 ILE HA H 128 3.530 3.677 -0.147 1
1 1340 . 14 1 1 A 141 141 ILE C C 128 177.669 178.140 -0.471 1
1 1341 . 14 1 1 A 141 141 ILE CA C 128 65.636 65.421 0.215 1
1 1342 . 14 1 1 A 141 141 ILE CB C 128 38.680 38.063 0.617 1
1 1345 . 14 1 1 A 141 141 ILE N N 128 118.730 121.003 -2.273 1
1 1346 . 14 1 1 A 142 142 LEU H H 129 8.194 7.994 0.200 1
1 1347 . 14 1 1 A 142 142 LEU HA H 129 3.950 4.019 -0.069 1
1 1356 . 14 1 1 A 142 142 LEU C C 129 179.960 178.388 1.572 1
1 1357 . 14 1 1 A 142 142 LEU CA C 129 58.135 58.135 0.000 1
1 1358 . 14 1 1 A 142 142 LEU CB C 129 41.259 41.411 -0.152 1
1 1361 . 14 1 1 A 142 142 LEU N N 129 117.675 121.368 -3.693 1
1 1362 . 14 1 1 A 143 143 ALA H H 130 8.294 8.666 -0.372 1
1 1363 . 14 1 1 A 143 143 ALA HA H 130 4.220 4.009 0.211 1
1 1367 . 14 1 1 A 143 143 ALA C C 130 179.899 179.645 0.254 1
1 1368 . 14 1 1 A 143 143 ALA CA C 130 54.385 55.318 -0.933 1
1 1369 . 14 1 1 A 143 143 ALA CB C 130 19.270 18.100 1.170 1
1 1370 . 14 1 1 A 143 143 ALA N N 130 121.096 121.193 -0.097 1
1 1371 . 14 1 1 A 144 144 SER H H 131 7.813 8.144 -0.331 1
1 1372 . 14 1 1 A 144 144 SER HA H 131 4.180 4.576 -0.396 1
1 1375 . 14 1 1 A 144 144 SER C C 131 175.457 176.833 -1.376 1
1 1376 . 14 1 1 A 144 144 SER CA C 131 60.948 61.272 -0.324 1
1 1377 . 14 1 1 A 144 144 SER CB C 131 63.761 63.318 0.443 1
1 1378 . 14 1 1 A 144 144 SER N N 131 112.102 113.442 -1.340 1
1 1379 . 14 1 1 A 145 145 LEU H H 132 7.747 7.983 -0.236 1
1 1380 . 14 1 1 A 145 145 LEU HA H 132 4.140 4.129 0.011 1
1 1389 . 14 1 1 A 145 145 LEU C C 132 178.589 177.805 0.784 1
1 1390 . 14 1 1 A 145 145 LEU CA C 132 56.260 56.862 -0.602 1
1 1391 . 14 1 1 A 145 145 LEU CB C 132 42.196 42.629 -0.433 1
1 1394 . 14 1 1 A 145 145 LEU N N 132 117.536 118.818 -1.282 1
1 1395 . 14 1 1 A 146 146 GLY H H 133 7.544 7.991 -0.447 1
1 1396 . 14 1 1 A 146 146 GLY HA2 H 133 3.950 4.060 -0.110 1
1 1397 . 14 1 1 A 146 146 GLY HA3 H 133 3.100 4.069 -0.969 1
1 1398 . 14 1 1 A 146 146 GLY C C 133 173.372 174.135 -0.763 1
1 1399 . 14 1 1 A 146 146 GLY CA C 133 45.947 44.927 1.020 1
1 1400 . 14 1 1 A 146 146 GLY N N 133 105.351 106.403 -1.052 1
1 1401 . 14 1 1 A 147 147 ASP H H 134 8.342 8.495 -0.153 1
1 1402 . 14 1 1 A 147 147 ASP HA H 134 4.650 4.838 -0.188 1
1 1405 . 14 1 1 A 147 147 ASP C C 134 175.462 176.807 -1.345 1
1 1406 . 14 1 1 A 147 147 ASP CA C 134 54.385 54.999 -0.614 1
1 1407 . 14 1 1 A 147 147 ASP CB C 134 41.259 42.710 -1.451 1
1 1408 . 14 1 1 A 147 147 ASP N N 134 120.133 122.932 -2.799 1
1 14 . 15 1 1 A 15 15 GLN H H 2 8.439 7.509 0.930 1
1 15 . 15 1 1 A 15 15 GLN HA H 2 4.594 4.913 -0.319 1
1 20 . 15 1 1 A 15 15 GLN C C 2 175.972 174.277 1.695 1
1 21 . 15 1 1 A 15 15 GLN CA C 2 56.260 54.201 2.059 1
1 22 . 15 1 1 A 15 15 GLN CB C 2 30.945 32.279 -1.334 1
1 24 . 15 1 1 A 15 15 GLN N N 2 124.997 121.197 3.800 1
1 25 . 15 1 1 A 16 16 THR H H 3 8.347 8.721 -0.374 1
1 26 . 15 1 1 A 16 16 THR HA H 3 4.555 4.807 -0.252 1
1 31 . 15 1 1 A 16 16 THR C C 3 175.495 174.976 0.519 1
1 32 . 15 1 1 A 16 16 THR CA C 3 60.010 61.769 -1.759 1
1 33 . 15 1 1 A 16 16 THR CB C 3 71.261 71.317 -0.056 1
1 34 . 15 1 1 A 16 16 THR N N 3 113.011 118.846 -5.835 1
1 35 . 15 1 1 A 17 17 VAL H H 4 8.895 8.741 0.154 1
1 36 . 15 1 1 A 17 17 VAL HA H 4 3.670 3.799 -0.129 1
1 44 . 15 1 1 A 17 17 VAL C C 4 178.449 177.801 0.648 1
1 45 . 15 1 1 A 17 17 VAL CA C 4 67.511 66.388 1.123 1
1 46 . 15 1 1 A 17 17 VAL CB C 4 31.883 32.044 -0.161 1
1 49 . 15 1 1 A 17 17 VAL N N 4 121.854 125.394 -3.540 1
1 50 . 15 1 1 A 18 18 GLY H H 5 9.017 8.239 0.778 1
1 51 . 15 1 1 A 18 18 GLY HA2 H 5 3.940 3.766 0.174 1
1 52 . 15 1 1 A 18 18 GLY HA3 H 5 3.610 3.780 -0.170 1
1 53 . 15 1 1 A 18 18 GLY C C 5 176.186 175.715 0.471 1
1 54 . 15 1 1 A 18 18 GLY CA C 5 47.822 47.153 0.669 1
1 55 . 15 1 1 A 18 18 GLY N N 5 106.966 107.910 -0.944 1
1 56 . 15 1 1 A 19 19 GLN H H 6 8.072 8.329 -0.257 1
1 57 . 15 1 1 A 19 19 GLN HA H 6 4.037 4.067 -0.030 1
1 62 . 15 1 1 A 19 19 GLN C C 6 179.488 177.868 1.620 1
1 63 . 15 1 1 A 19 19 GLN CA C 6 59.073 58.828 0.245 1
1 64 . 15 1 1 A 19 19 GLN CB C 6 28.489 29.170 -0.681 1
1 66 . 15 1 1 A 19 19 GLN N N 6 122.431 120.964 1.467 1
1 67 . 15 1 1 A 20 20 TRP H H 7 8.756 8.130 0.626 1
1 68 . 15 1 1 A 20 20 TRP HA H 7 4.160 4.304 -0.144 1
1 77 . 15 1 1 A 20 20 TRP C C 7 179.620 177.962 1.658 1
1 78 . 15 1 1 A 20 20 TRP CA C 7 61.886 61.015 0.871 1
1 79 . 15 1 1 A 20 20 TRP CB C 7 28.133 29.922 -1.789 1
1 85 . 15 1 1 A 20 20 TRP N N 7 124.265 122.160 2.105 1
1 87 . 15 1 1 A 21 21 LEU H H 8 9.148 8.644 0.504 1
1 88 . 15 1 1 A 21 21 LEU HA H 8 3.440 3.363 0.077 1
1 97 . 15 1 1 A 21 21 LEU C C 8 180.521 178.573 1.948 1
1 98 . 15 1 1 A 21 21 LEU CA C 8 56.920 57.601 -0.681 1
1 99 . 15 1 1 A 21 21 LEU CB C 8 41.700 41.818 -0.118 1
1 102 . 15 1 1 A 21 21 LEU N N 8 120.548 120.676 -0.128 1
1 103 . 15 1 1 A 22 22 GLU H H 9 8.284 8.305 -0.021 1
1 104 . 15 1 1 A 22 22 GLU HA H 9 3.740 3.935 -0.195 1
1 109 . 15 1 1 A 22 22 GLU C C 9 179.960 178.391 1.569 1
1 110 . 15 1 1 A 22 22 GLU CA C 9 60.010 59.174 0.836 1
1 111 . 15 1 1 A 22 22 GLU CB C 9 29.070 28.694 0.376 1
1 113 . 15 1 1 A 22 22 GLU N N 9 120.133 120.096 0.037 1
1 114 . 15 1 1 A 23 23 SER H H 10 7.891 7.863 0.028 1
1 115 . 15 1 1 A 23 23 SER HA H 10 4.250 4.090 0.160 1
1 118 . 15 1 1 A 23 23 SER C C 10 175.346 175.448 -0.102 1
1 119 . 15 1 1 A 23 23 SER CA C 10 60.948 60.932 0.016 1
1 120 . 15 1 1 A 23 23 SER CB C 10 63.280 63.042 0.238 1
1 121 . 15 1 1 A 23 23 SER N N 10 117.044 115.129 1.915 1
1 122 . 15 1 1 A 24 24 ILE H H 11 6.862 7.375 -0.513 1
1 123 . 15 1 1 A 24 24 ILE HA H 11 4.487 4.290 0.197 1
1 133 . 15 1 1 A 24 24 ILE C C 11 175.812 175.428 0.384 1
1 134 . 15 1 1 A 24 24 ILE CA C 11 60.948 61.182 -0.234 1
1 135 . 15 1 1 A 24 24 ILE CB C 11 38.250 38.738 -0.488 1
1 139 . 15 1 1 A 24 24 ILE N N 11 113.733 114.472 -0.739 1
1 140 . 15 1 1 A 25 25 GLY H H 12 7.628 7.638 -0.010 1
1 141 . 15 1 1 A 25 25 GLY HA2 H 12 3.990 3.801 0.189 1
1 142 . 15 1 1 A 25 25 GLY HA3 H 12 3.800 3.854 -0.054 1
1 143 . 15 1 1 A 25 25 GLY C C 12 173.647 172.165 1.482 1
1 144 . 15 1 1 A 25 25 GLY CA C 12 45.947 44.967 0.980 1
1 145 . 15 1 1 A 25 25 GLY N N 12 109.763 110.714 -0.951 1
1 146 . 15 1 1 A 26 26 LEU H H 13 7.620 7.851 -0.231 1
1 147 . 15 1 1 A 26 26 LEU C C 13 176.186 173.914 2.272 1
1 148 . 15 1 1 A 26 26 LEU CA C 13 52.700 51.471 1.229 1
1 149 . 15 1 1 A 26 26 LEU CB C 13 43.134 44.266 -1.132 1
1 150 . 15 1 1 A 26 26 LEU N N 13 118.778 122.372 -3.594 1
1 151 . 15 1 1 A 27 27 PRO HA H 14 4.120 4.413 -0.293 1
1 154 . 15 1 1 A 27 27 PRO C C 14 177.955 176.537 1.418 1
1 155 . 15 1 1 A 27 27 PRO CA C 14 64.698 62.613 2.085 1
1 156 . 15 1 1 A 27 27 PRO CB C 14 31.883 32.589 -0.706 1
1 158 . 15 1 1 A 28 28 GLN H H 15 9.838 8.694 1.144 1
1 159 . 15 1 1 A 28 28 GLN HA H 15 4.240 3.882 0.358 1
1 162 . 15 1 1 A 28 28 GLN C C 15 176.836 175.301 1.535 1
1 163 . 15 1 1 A 28 28 GLN CA C 15 58.135 57.642 0.493 1
1 164 . 15 1 1 A 28 28 GLN CB C 15 27.195 27.034 0.161 1
1 166 . 15 1 1 A 28 28 GLN N N 15 120.414 115.349 5.065 1
1 167 . 15 1 1 A 29 29 TYR H H 16 6.810 8.087 -1.277 1
1 168 . 15 1 1 A 29 29 TYR HA H 16 5.720 4.481 1.239 1
1 173 . 15 1 1 A 29 29 TYR C C 16 174.814 178.044 -3.230 1
1 174 . 15 1 1 A 29 29 TYR CA C 16 57.198 59.190 -1.992 1
1 175 . 15 1 1 A 29 29 TYR CB C 16 37.509 40.312 -2.803 1
1 178 . 15 1 1 A 29 29 TYR N N 16 119.718 117.663 2.055 1
1 179 . 15 1 1 A 30 30 GLU H H 17 7.509 8.313 -0.804 1
1 180 . 15 1 1 A 30 30 GLU HA H 17 3.650 4.190 -0.540 1
1 184 . 15 1 1 A 30 30 GLU C C 17 177.552 178.468 -0.916 1
1 185 . 15 1 1 A 30 30 GLU CA C 17 60.948 59.177 1.771 1
1 186 . 15 1 1 A 30 30 GLU CB C 17 30.008 29.407 0.601 1
1 188 . 15 1 1 A 30 30 GLU N N 17 122.417 119.220 3.197 1
1 189 . 15 1 1 A 31 31 ASN H H 18 9.259 8.255 1.004 1
1 190 . 15 1 1 A 31 31 ASN HA H 18 4.451 4.470 -0.019 1
1 193 . 15 1 1 A 31 31 ASN C C 18 176.868 178.100 -1.232 1
1 194 . 15 1 1 A 31 31 ASN CA C 18 57.198 56.394 0.804 1
1 195 . 15 1 1 A 31 31 ASN CB C 18 38.446 39.635 -1.189 1
1 196 . 15 1 1 A 31 31 ASN N N 18 116.613 118.726 -2.113 1
1 197 . 15 1 1 A 32 32 HIS H H 19 8.898 7.936 0.962 1
1 198 . 15 1 1 A 32 32 HIS HA H 19 4.140 4.323 -0.183 1
1 202 . 15 1 1 A 32 32 HIS C C 19 178.269 177.702 0.567 1
1 203 . 15 1 1 A 32 32 HIS CA C 19 60.948 59.425 1.523 1
1 204 . 15 1 1 A 32 32 HIS CB C 19 30.008 29.831 0.177 1
1 206 . 15 1 1 A 32 32 HIS N N 19 118.926 118.325 0.601 1
1 207 . 15 1 1 A 33 33 LEU H H 20 7.825 8.653 -0.828 1
1 208 . 15 1 1 A 33 33 LEU HA H 20 4.305 3.918 0.387 1
1 218 . 15 1 1 A 33 33 LEU C C 20 179.190 178.999 0.191 1
1 219 . 15 1 1 A 33 33 LEU CA C 20 60.010 58.310 1.700 1
1 220 . 15 1 1 A 33 33 LEU CB C 20 40.321 42.071 -1.750 1
1 224 . 15 1 1 A 33 33 LEU N N 20 117.434 119.868 -2.434 1
1 225 . 15 1 1 A 34 34 MET H H 21 8.861 8.881 -0.020 1
1 226 . 15 1 1 A 34 34 MET HA H 21 3.980 4.205 -0.225 1
1 234 . 15 1 1 A 34 34 MET C C 21 180.340 178.814 1.526 1
1 235 . 15 1 1 A 34 34 MET CA C 21 58.135 58.820 -0.685 1
1 236 . 15 1 1 A 34 34 MET CB C 21 30.945 32.319 -1.374 1
1 238 . 15 1 1 A 34 34 MET N N 21 118.111 116.622 1.489 1
1 239 . 15 1 1 A 35 35 ALA H H 22 9.015 8.152 0.863 1
1 240 . 15 1 1 A 35 35 ALA HA H 22 4.239 4.110 0.129 1
1 244 . 15 1 1 A 35 35 ALA C C 22 178.058 178.973 -0.915 1
1 245 . 15 1 1 A 35 35 ALA CA C 22 53.800 54.886 -1.086 1
1 246 . 15 1 1 A 35 35 ALA CB C 22 18.397 18.261 0.136 1
1 247 . 15 1 1 A 35 35 ALA N N 22 120.068 121.677 -1.609 1
1 248 . 15 1 1 A 36 36 ASN H H 23 7.143 8.017 -0.874 1
1 249 . 15 1 1 A 36 36 ASN HA H 23 4.959 4.755 0.204 1
1 254 . 15 1 1 A 36 36 ASN C C 23 174.083 175.690 -1.607 1
1 255 . 15 1 1 A 36 36 ASN CA C 23 54.000 53.232 0.768 1
1 256 . 15 1 1 A 36 36 ASN CB C 23 41.300 39.178 2.122 1
1 257 . 15 1 1 A 36 36 ASN N N 23 111.560 115.072 -3.512 1
1 259 . 15 1 1 A 37 37 GLY H H 24 7.797 8.327 -0.530 1
1 260 . 15 1 1 A 37 37 GLY HA2 H 24 3.430 3.914 -0.484 1
1 261 . 15 1 1 A 37 37 GLY HA3 H 24 3.290 3.986 -0.696 1
1 262 . 15 1 1 A 37 37 GLY C C 24 173.163 175.066 -1.903 1
1 263 . 15 1 1 A 37 37 GLY CA C 24 45.947 45.161 0.786 1
1 264 . 15 1 1 A 37 37 GLY N N 24 106.170 107.156 -0.986 1
1 265 . 15 1 1 A 38 38 PHE H H 25 8.191 7.957 0.234 1
1 266 . 15 1 1 A 38 38 PHE HA H 25 4.910 4.789 0.121 1
1 271 . 15 1 1 A 38 38 PHE C C 25 173.496 175.682 -2.186 1
1 272 . 15 1 1 A 38 38 PHE CA C 25 56.550 56.302 0.248 1
1 273 . 15 1 1 A 38 38 PHE CB C 25 37.220 36.908 0.312 1
1 276 . 15 1 1 A 38 38 PHE N N 25 122.454 119.747 2.707 1
1 277 . 15 1 1 A 39 39 ASP H H 26 6.756 8.320 -1.564 1
1 278 . 15 1 1 A 39 39 ASP HA H 26 5.077 4.911 0.166 1
1 281 . 15 1 1 A 39 39 ASP C C 26 177.463 175.355 2.108 1
1 282 . 15 1 1 A 39 39 ASP CA C 26 53.447 54.008 -0.561 1
1 283 . 15 1 1 A 39 39 ASP CB C 26 42.580 41.738 0.842 1
1 284 . 15 1 1 A 39 39 ASP N N 26 111.309 119.036 -7.727 1
1 285 . 15 1 1 A 40 40 ASN H H 27 7.495 7.869 -0.374 1
1 286 . 15 1 1 A 40 40 ASN HA H 27 4.820 5.025 -0.205 1
1 289 . 15 1 1 A 40 40 ASN C C 27 176.228 175.749 0.479 1
1 290 . 15 1 1 A 40 40 ASN CA C 27 52.510 51.899 0.611 1
1 291 . 15 1 1 A 40 40 ASN CB C 27 40.321 40.663 -0.342 1
1 292 . 15 1 1 A 40 40 ASN N N 27 118.385 118.434 -0.049 1
1 293 . 15 1 1 A 41 41 VAL H H 28 9.192 8.632 0.560 1
1 294 . 15 1 1 A 41 41 VAL HA H 28 3.550 3.652 -0.102 1
1 302 . 15 1 1 A 41 41 VAL C C 28 176.429 177.461 -1.032 1
1 303 . 15 1 1 A 41 41 VAL CA C 28 65.636 66.179 -0.543 1
1 304 . 15 1 1 A 41 41 VAL CB C 28 31.883 31.667 0.216 1
1 307 . 15 1 1 A 41 41 VAL N N 28 125.741 125.935 -0.194 1
1 308 . 15 1 1 A 42 42 GLN H H 29 8.203 8.200 0.003 1
1 309 . 15 1 1 A 42 42 GLN HA H 29 4.129 4.032 0.097 1
1 314 . 15 1 1 A 42 42 GLN C C 29 176.591 178.647 -2.056 1
1 315 . 15 1 1 A 42 42 GLN CA C 29 57.198 59.031 -1.833 1
1 316 . 15 1 1 A 42 42 GLN CB C 29 28.133 28.062 0.071 1
1 318 . 15 1 1 A 42 42 GLN N N 29 116.452 118.907 -2.455 1
1 319 . 15 1 1 A 43 43 ALA H H 30 7.781 8.454 -0.673 1
1 320 . 15 1 1 A 43 43 ALA HA H 30 4.650 4.064 0.586 1
1 324 . 15 1 1 A 43 43 ALA C C 30 175.976 178.095 -2.119 1
1 325 . 15 1 1 A 43 43 ALA CA C 30 50.840 54.576 -3.736 1
1 326 . 15 1 1 A 43 43 ALA CB C 30 19.150 18.335 0.815 1
1 327 . 15 1 1 A 43 43 ALA N N 30 122.150 120.760 1.390 1
1 328 . 15 1 1 A 44 44 MET H H 31 7.739 8.113 -0.374 1
1 332 . 15 1 1 A 44 44 MET C C 31 178.275 177.415 0.860 1
1 333 . 15 1 1 A 44 44 MET CA C 31 55.323 54.121 1.202 1
1 334 . 15 1 1 A 44 44 MET CB C 31 34.696 31.826 2.870 1
1 336 . 15 1 1 A 44 44 MET N N 31 118.149 113.692 4.457 1
1 337 . 15 1 1 A 45 45 GLY H H 32 7.611 8.517 -0.906 1
1 338 . 15 1 1 A 45 45 GLY N N 32 101.530 109.900 -8.370 1
1 339 . 15 1 1 A 47 47 ASN HA H 34 4.480 4.820 -0.340 1
1 342 . 15 1 1 A 47 47 ASN CA C 34 56.260 52.790 3.470 1
1 343 . 15 1 1 A 47 47 ASN CB C 34 39.384 39.949 -0.565 1
1 344 . 15 1 1 A 49 49 MET HA H 36 4.646 4.477 0.169 1
1 350 . 15 1 1 A 49 49 MET C C 36 173.651 175.788 -2.137 1
1 351 . 15 1 1 A 49 49 MET CA C 36 55.323 55.959 -0.636 1
1 352 . 15 1 1 A 49 49 MET CB C 36 35.633 33.170 2.463 1
1 355 . 15 1 1 A 50 50 GLU H H 37 9.203 8.638 0.565 1
1 356 . 15 1 1 A 50 50 GLU HA H 37 4.650 4.455 0.195 1
1 361 . 15 1 1 A 50 50 GLU C C 37 177.008 177.590 -0.582 1
1 362 . 15 1 1 A 50 50 GLU CA C 37 54.385 56.226 -1.841 1
1 363 . 15 1 1 A 50 50 GLU CB C 37 33.758 30.659 3.099 1
1 365 . 15 1 1 A 50 50 GLU N N 37 123.229 126.794 -3.565 1
1 366 . 15 1 1 A 51 51 ASP H H 38 9.032 9.008 0.024 1
1 367 . 15 1 1 A 51 51 ASP HA H 38 4.149 4.391 -0.242 1
1 370 . 15 1 1 A 51 51 ASP C C 38 177.994 178.262 -0.268 1
1 371 . 15 1 1 A 51 51 ASP CA C 38 59.073 57.251 1.822 1
1 372 . 15 1 1 A 51 51 ASP CB C 38 43.134 39.876 3.258 1
1 373 . 15 1 1 A 51 51 ASP N N 38 122.717 122.618 0.099 1
1 374 . 15 1 1 A 52 52 GLN H H 39 8.950 8.276 0.674 1
1 375 . 15 1 1 A 52 52 GLN HA H 39 3.940 4.020 -0.080 1
1 378 . 15 1 1 A 52 52 GLN C C 39 177.817 178.642 -0.825 1
1 379 . 15 1 1 A 52 52 GLN CA C 39 59.073 59.105 -0.032 1
1 380 . 15 1 1 A 52 52 GLN CB C 39 28.133 28.345 -0.212 1
1 381 . 15 1 1 A 52 52 GLN N N 39 114.086 118.927 -4.841 1
1 382 . 15 1 1 A 53 53 ASP H H 40 7.214 8.018 -0.804 1
1 383 . 15 1 1 A 53 53 ASP HA H 40 4.370 4.486 -0.116 1
1 386 . 15 1 1 A 53 53 ASP C C 40 177.667 178.919 -1.252 1
1 387 . 15 1 1 A 53 53 ASP CA C 40 57.198 57.088 0.110 1
1 388 . 15 1 1 A 53 53 ASP CB C 40 41.800 40.763 1.037 1
1 389 . 15 1 1 A 53 53 ASP N N 40 118.734 120.100 -1.366 1
1 390 . 15 1 1 A 54 54 LEU H H 41 7.180 8.083 -0.903 1
1 391 . 15 1 1 A 54 54 LEU HA H 41 3.990 4.004 -0.014 1
1 400 . 15 1 1 A 54 54 LEU C C 41 178.204 178.313 -0.109 1
1 401 . 15 1 1 A 54 54 LEU CA C 41 56.260 57.965 -1.705 1
1 402 . 15 1 1 A 54 54 LEU CB C 41 41.259 41.591 -0.332 1
1 405 . 15 1 1 A 54 54 LEU N N 41 115.795 117.845 -2.050 1
1 406 . 15 1 1 A 55 55 LEU H H 42 7.823 7.708 0.115 1
1 407 . 15 1 1 A 55 55 LEU HA H 42 3.920 4.148 -0.228 1
1 416 . 15 1 1 A 55 55 LEU C C 42 180.876 178.560 2.316 1
1 417 . 15 1 1 A 55 55 LEU CA C 42 58.135 56.762 1.373 1
1 418 . 15 1 1 A 55 55 LEU CB C 42 42.196 42.504 -0.308 1
1 421 . 15 1 1 A 55 55 LEU N N 42 120.499 121.433 -0.934 1
1 422 . 15 1 1 A 56 56 GLU H H 43 8.127 8.255 -0.128 1
1 423 . 15 1 1 A 56 56 GLU HA H 43 3.966 4.021 -0.055 1
1 428 . 15 1 1 A 56 56 GLU C C 43 178.801 178.896 -0.095 1
1 429 . 15 1 1 A 56 56 GLU CA C 43 60.010 59.189 0.821 1
1 430 . 15 1 1 A 56 56 GLU CB C 43 29.070 29.498 -0.428 1
1 432 . 15 1 1 A 56 56 GLU N N 43 120.955 119.230 1.725 1
1 433 . 15 1 1 A 57 57 ILE H H 44 7.504 7.486 0.018 1
1 434 . 15 1 1 A 57 57 ILE HA H 44 4.524 3.822 0.702 1
1 444 . 15 1 1 A 57 57 ILE C C 44 175.691 177.255 -1.564 1
1 445 . 15 1 1 A 57 57 ILE CA C 44 61.886 64.948 -3.062 1
1 446 . 15 1 1 A 57 57 ILE CB C 44 37.300 38.347 -1.047 1
1 450 . 15 1 1 A 57 57 ILE N N 44 109.594 119.694 -10.100 1
1 451 . 15 1 1 A 58 58 GLY H H 45 7.724 7.485 0.239 1
1 452 . 15 1 1 A 58 58 GLY HA2 H 45 3.650 4.093 -0.443 1
1 453 . 15 1 1 A 58 58 GLY HA3 H 45 4.530 4.123 0.407 1
1 454 . 15 1 1 A 58 58 GLY C C 45 174.613 174.311 0.302 1
1 455 . 15 1 1 A 58 58 GLY CA C 45 45.947 45.239 0.708 1
1 456 . 15 1 1 A 58 58 GLY N N 45 106.680 106.575 0.105 1
1 457 . 15 1 1 A 59 59 ILE H H 46 8.180 7.954 0.226 1
1 458 . 15 1 1 A 59 59 ILE HA H 46 3.907 4.207 -0.300 1
1 468 . 15 1 1 A 59 59 ILE C C 46 174.235 175.405 -1.170 1
1 469 . 15 1 1 A 59 59 ILE CA C 46 60.948 60.430 0.518 1
1 470 . 15 1 1 A 59 59 ILE CB C 46 33.980 36.815 -2.835 1
1 474 . 15 1 1 A 59 59 ILE N N 46 122.454 122.121 0.333 1
1 475 . 15 1 1 A 60 60 LEU H H 47 7.367 8.244 -0.877 1
1 476 . 15 1 1 A 60 60 LEU HA H 47 3.900 3.953 -0.053 1
1 479 . 15 1 1 A 60 60 LEU C C 47 177.753 177.467 0.286 1
1 480 . 15 1 1 A 60 60 LEU CA C 47 56.260 58.389 -2.129 1
1 481 . 15 1 1 A 60 60 LEU CB C 47 42.196 41.782 0.414 1
1 482 . 15 1 1 A 60 60 LEU N N 47 125.835 129.247 -3.412 1
1 483 . 15 1 1 A 63 63 GLY HA2 H 50 3.980 3.905 0.075 1
1 484 . 15 1 1 A 63 63 GLY HA3 H 50 3.950 3.909 0.041 1
1 485 . 15 1 1 A 63 63 GLY C C 50 177.130 175.352 1.778 1
1 486 . 15 1 1 A 63 63 GLY CA C 50 46.884 46.604 0.280 1
1 487 . 15 1 1 A 64 64 HIS H H 51 7.926 8.171 -0.245 1
1 488 . 15 1 1 A 64 64 HIS HA H 51 4.451 4.229 0.222 1
1 493 . 15 1 1 A 64 64 HIS C C 51 177.613 177.184 0.429 1
1 494 . 15 1 1 A 64 64 HIS CA C 51 57.198 58.777 -1.579 1
1 495 . 15 1 1 A 64 64 HIS CB C 51 30.945 30.347 0.598 1
1 498 . 15 1 1 A 64 64 HIS N N 51 122.284 121.833 0.451 1
1 499 . 15 1 1 A 65 65 ARG H H 52 8.105 8.128 -0.023 1
1 500 . 15 1 1 A 65 65 ARG HA H 52 3.685 3.756 -0.071 1
1 507 . 15 1 1 A 65 65 ARG C C 52 177.769 179.316 -1.547 1
1 508 . 15 1 1 A 65 65 ARG CA C 52 61.886 59.702 2.184 1
1 509 . 15 1 1 A 65 65 ARG CB C 52 30.945 30.011 0.934 1
1 511 . 15 1 1 A 65 65 ARG N N 52 117.775 118.321 -0.546 1
1 513 . 15 1 1 A 66 66 GLN H H 53 8.090 8.334 -0.244 1
1 514 . 15 1 1 A 66 66 GLN HA H 53 3.940 3.945 -0.005 1
1 519 . 15 1 1 A 66 66 GLN C C 53 178.583 178.298 0.285 1
1 520 . 15 1 1 A 66 66 GLN CA C 53 59.073 59.211 -0.138 1
1 521 . 15 1 1 A 66 66 GLN CB C 53 28.133 28.425 -0.292 1
1 523 . 15 1 1 A 66 66 GLN N N 53 116.452 119.029 -2.577 1
1 524 . 15 1 1 A 67 67 ARG H H 54 7.845 7.802 0.043 1
1 525 . 15 1 1 A 67 67 ARG HA H 54 4.010 4.034 -0.024 1
1 528 . 15 1 1 A 67 67 ARG C C 54 179.766 178.928 0.838 1
1 529 . 15 1 1 A 67 67 ARG CA C 54 59.073 58.931 0.142 1
1 530 . 15 1 1 A 67 67 ARG CB C 54 30.720 29.968 0.752 1
1 532 . 15 1 1 A 67 67 ARG N N 54 119.275 119.714 -0.439 1
1 533 . 15 1 1 A 68 68 ILE H H 55 8.032 7.813 0.219 1
1 534 . 15 1 1 A 68 68 ILE HA H 55 3.495 3.576 -0.081 1
1 544 . 15 1 1 A 68 68 ILE C C 55 177.108 178.866 -1.758 1
1 545 . 15 1 1 A 68 68 ILE CA C 55 66.230 64.755 1.475 1
1 546 . 15 1 1 A 68 68 ILE CB C 55 38.020 37.064 0.956 1
1 550 . 15 1 1 A 68 68 ILE N N 55 121.152 119.332 1.820 1
1 551 . 15 1 1 A 69 69 LEU H H 56 8.490 8.077 0.413 1
1 552 . 15 1 1 A 69 69 LEU HA H 56 4.010 3.807 0.203 1
1 561 . 15 1 1 A 69 69 LEU C C 56 179.917 178.830 1.087 1
1 562 . 15 1 1 A 69 69 LEU CA C 56 58.135 58.349 -0.214 1
1 563 . 15 1 1 A 69 69 LEU CB C 56 41.259 41.627 -0.368 1
1 566 . 15 1 1 A 69 69 LEU N N 56 119.072 121.494 -2.422 1
1 567 . 15 1 1 A 70 70 GLN H H 57 8.327 8.620 -0.293 1
1 568 . 15 1 1 A 70 70 GLN HA H 57 4.100 4.074 0.026 1
1 573 . 15 1 1 A 70 70 GLN C C 57 178.798 177.822 0.976 1
1 574 . 15 1 1 A 70 70 GLN CA C 57 59.073 58.347 0.726 1
1 575 . 15 1 1 A 70 70 GLN CB C 57 28.133 28.296 -0.163 1
1 577 . 15 1 1 A 70 70 GLN N N 57 118.172 116.960 1.212 1
1 578 . 15 1 1 A 71 71 ALA H H 58 7.810 7.864 -0.054 1
1 579 . 15 1 1 A 71 71 ALA HA H 58 4.320 4.112 0.208 1
1 583 . 15 1 1 A 71 71 ALA C C 58 172.232 179.497 -7.265 1
1 584 . 15 1 1 A 71 71 ALA CA C 58 55.323 55.171 0.152 1
1 585 . 15 1 1 A 71 71 ALA CB C 58 19.720 18.798 0.922 1
1 586 . 15 1 1 A 71 71 ALA N N 58 122.536 121.819 0.717 1
1 587 . 15 1 1 A 72 72 ILE H H 59 8.840 8.487 0.353 1
1 588 . 15 1 1 A 72 72 ILE HA H 59 4.030 4.077 -0.047 1
1 598 . 15 1 1 A 72 72 ILE C C 59 178.678 177.355 1.323 1
1 599 . 15 1 1 A 72 72 ILE CA C 59 64.698 63.248 1.450 1
1 600 . 15 1 1 A 72 72 ILE CB C 59 37.850 37.849 0.001 1
1 604 . 15 1 1 A 72 72 ILE N N 59 118.111 118.560 -0.449 1
1 605 . 15 1 1 A 73 73 GLN H H 60 7.547 7.994 -0.447 1
1 606 . 15 1 1 A 73 73 GLN HA H 60 4.121 4.242 -0.121 1
1 611 . 15 1 1 A 73 73 GLN C C 60 176.556 177.974 -1.418 1
1 612 . 15 1 1 A 73 73 GLN CA C 60 58.135 57.797 0.338 1
1 613 . 15 1 1 A 73 73 GLN CB C 60 28.300 28.958 -0.658 1
1 615 . 15 1 1 A 73 73 GLN N N 60 119.094 120.912 -1.818 1
1 616 . 15 1 1 A 74 74 LEU H H 61 7.350 8.036 -0.686 1
1 617 . 15 1 1 A 74 74 LEU HA H 61 4.408 4.249 0.159 1
1 626 . 15 1 1 A 74 74 LEU C C 61 177.960 176.515 1.445 1
1 627 . 15 1 1 A 74 74 LEU CA C 61 54.900 57.519 -2.619 1
1 628 . 15 1 1 A 74 74 LEU CB C 61 42.196 42.388 -0.192 1
1 631 . 15 1 1 A 74 74 LEU N N 61 115.853 120.437 -4.584 1
1 632 . 15 1 1 A 75 75 LEU H H 62 7.358 7.816 -0.458 1
1 633 . 15 1 1 A 75 75 LEU HA H 62 4.530 4.455 0.075 1
1 642 . 15 1 1 A 75 75 LEU C C 62 177.035 176.171 0.864 1
1 643 . 15 1 1 A 75 75 LEU CA C 62 53.200 53.523 -0.323 1
1 644 . 15 1 1 A 75 75 LEU CB C 62 40.700 41.974 -1.274 1
1 647 . 15 1 1 A 75 75 LEU N N 62 121.010 117.353 3.657 1
1 648 . 15 1 1 A 76 76 PRO HA H 63 4.382 4.570 -0.188 1
1 655 . 15 1 1 A 76 76 PRO CB C 63 31.883 31.931 -0.048 1
1 657 . 15 1 1 A 77 77 LYS H H 64 8.418 8.491 -0.073 1
1 658 . 15 1 1 A 77 77 LYS HA H 64 4.140 4.646 -0.506 1
1 663 . 15 1 1 A 77 77 LYS C C 64 177.122 176.543 0.579 1
1 664 . 15 1 1 A 77 77 LYS CA C 64 56.260 55.488 0.772 1
1 665 . 15 1 1 A 77 77 LYS CB C 64 33.340 33.257 0.083 1
1 668 . 15 1 1 A 77 77 LYS N N 64 121.932 121.320 0.612 1
1 669 . 15 1 1 A 78 78 MET H H 65 8.550 8.517 0.033 1
1 670 . 15 1 1 A 78 78 MET HA H 65 4.304 4.589 -0.285 1
1 676 . 15 1 1 A 78 78 MET C C 65 176.105 175.660 0.445 1
1 677 . 15 1 1 A 78 78 MET CA C 65 56.260 55.542 0.718 1
1 678 . 15 1 1 A 78 78 MET CB C 65 32.821 33.305 -0.484 1
1 680 . 15 1 1 A 78 78 MET N N 65 123.498 121.604 1.894 1
1 681 . 15 1 1 A 79 79 ARG H H 66 8.731 8.704 0.027 1
1 682 . 15 1 1 A 79 79 ARG C C 66 173.577 175.660 -2.083 1
1 683 . 15 1 1 A 79 79 ARG CA C 66 53.447 57.793 -4.346 1
1 684 . 15 1 1 A 79 79 ARG CB C 66 30.008 29.170 0.838 1
1 685 . 15 1 1 A 79 79 ARG N N 66 127.355 125.236 2.119 1
1 686 . 15 1 1 A 80 80 PRO HA H 67 4.780 4.484 0.296 1
1 693 . 15 1 1 A 80 80 PRO C C 67 177.043 176.525 0.518 1
1 694 . 15 1 1 A 80 80 PRO CA C 67 61.886 64.818 -2.932 1
1 695 . 15 1 1 A 80 80 PRO CB C 67 32.821 32.086 0.735 1
1 698 . 15 1 1 A 81 81 ILE H H 68 8.580 7.564 1.016 1
1 699 . 15 1 1 A 81 81 ILE HA H 68 4.040 4.295 -0.255 1
1 709 . 15 1 1 A 81 81 ILE C C 68 176.831 176.194 0.637 1
1 710 . 15 1 1 A 81 81 ILE CA C 68 62.823 60.945 1.878 1
1 711 . 15 1 1 A 81 81 ILE CB C 68 38.580 39.014 -0.434 1
1 715 . 15 1 1 A 81 81 ILE N N 68 118.491 117.879 0.612 1
1 716 . 15 1 1 A 82 82 GLY H H 69 8.602 8.548 0.054 1
1 717 . 15 1 1 A 82 82 GLY CA C 69 45.009 45.813 -0.804 1
1 718 . 15 1 1 A 82 82 GLY N N 69 111.377 114.465 -3.088 1
1 721 . 15 1 1 A 84 84 ASP HA H 71 4.490 4.247 0.243 1
1 724 . 15 1 1 A 84 84 ASP CA C 71 54.385 54.553 -0.168 1
1 725 . 15 1 1 A 84 84 ASP CB C 71 40.321 41.082 -0.761 1
1 726 . 15 1 1 A 85 85 GLY H H 72 8.054 8.708 -0.654 1
1 727 . 15 1 1 A 85 85 GLY HA2 H 72 4.040 3.941 0.099 1
1 728 . 15 1 1 A 85 85 GLY HA3 H 72 3.750 3.975 -0.225 1
1 729 . 15 1 1 A 85 85 GLY C C 72 173.474 174.445 -0.971 1
1 730 . 15 1 1 A 85 85 GLY CA C 72 45.009 45.140 -0.131 1
1 731 . 15 1 1 A 85 85 GLY N N 72 108.038 110.435 -2.397 1
1 732 . 15 1 1 A 86 86 ALA H H 73 7.858 7.835 0.023 1
1 733 . 15 1 1 A 86 86 ALA HA H 73 4.370 4.280 0.090 1
1 737 . 15 1 1 A 86 86 ALA CA C 73 51.990 51.386 0.604 1
1 738 . 15 1 1 A 86 86 ALA CB C 73 19.220 20.403 -1.183 1
1 739 . 15 1 1 A 86 86 ALA N N 73 123.819 122.970 0.849 1
1 742 . 15 1 1 A 90 90 SER H H 77 7.839 7.778 0.061 1
1 743 . 15 1 1 A 90 90 SER HA H 77 4.770 4.764 0.006 1
1 746 . 15 1 1 A 90 90 SER N N 77 115.163 113.015 2.148 1
1 747 . 15 1 1 A 91 91 VAL H H 78 8.578 9.039 -0.461 1
1 748 . 15 1 1 A 91 91 VAL HA H 78 3.981 3.923 0.058 1
1 756 . 15 1 1 A 91 91 VAL C C 78 177.480 177.316 0.164 1
1 757 . 15 1 1 A 91 91 VAL CA C 78 67.060 66.258 0.802 1
1 758 . 15 1 1 A 91 91 VAL CB C 78 32.500 31.646 0.854 1
1 761 . 15 1 1 A 91 91 VAL N N 78 123.481 122.446 1.035 1
1 762 . 15 1 1 A 92 92 ALA H H 79 8.607 8.360 0.247 1
1 763 . 15 1 1 A 92 92 ALA HA H 79 4.113 4.010 0.103 1
1 767 . 15 1 1 A 92 92 ALA C C 79 179.868 180.467 -0.599 1
1 768 . 15 1 1 A 92 92 ALA CA C 79 54.890 55.631 -0.741 1
1 769 . 15 1 1 A 92 92 ALA CB C 79 18.790 18.418 0.372 1
1 770 . 15 1 1 A 92 92 ALA N N 79 120.334 122.368 -2.034 1
1 771 . 15 1 1 A 93 93 GLU H H 80 7.886 8.062 -0.176 1
1 772 . 15 1 1 A 93 93 GLU HA H 80 4.010 4.059 -0.049 1
1 777 . 15 1 1 A 93 93 GLU C C 80 179.719 178.830 0.889 1
1 778 . 15 1 1 A 93 93 GLU CA C 80 59.073 58.893 0.180 1
1 779 . 15 1 1 A 93 93 GLU CB C 80 30.630 29.147 1.483 1
1 781 . 15 1 1 A 93 93 GLU N N 80 117.643 117.426 0.217 1
1 782 . 15 1 1 A 94 94 TRP H H 81 8.299 8.050 0.249 1
1 783 . 15 1 1 A 94 94 TRP HA H 81 4.251 4.281 -0.030 1
1 792 . 15 1 1 A 94 94 TRP C C 81 178.772 178.168 0.604 1
1 793 . 15 1 1 A 94 94 TRP CA C 81 60.010 61.493 -1.483 1
1 794 . 15 1 1 A 94 94 TRP CB C 81 27.650 29.948 -2.298 1
1 800 . 15 1 1 A 94 94 TRP N N 81 122.545 123.326 -0.781 1
1 802 . 15 1 1 A 95 95 LEU H H 82 8.505 8.613 -0.108 1
1 803 . 15 1 1 A 95 95 LEU HA H 82 2.880 3.091 -0.211 1
1 812 . 15 1 1 A 95 95 LEU C C 82 180.235 178.900 1.335 1
1 813 . 15 1 1 A 95 95 LEU CA C 82 57.400 56.926 0.474 1
1 814 . 15 1 1 A 95 95 LEU CB C 82 40.321 40.736 -0.415 1
1 817 . 15 1 1 A 95 95 LEU N N 82 121.110 119.176 1.934 1
1 818 . 15 1 1 A 96 96 ASP H H 83 8.185 8.269 -0.084 1
1 819 . 15 1 1 A 96 96 ASP HA H 83 4.280 4.354 -0.074 1
1 822 . 15 1 1 A 96 96 ASP C C 83 175.224 177.720 -2.496 1
1 823 . 15 1 1 A 96 96 ASP CA C 83 57.310 56.751 0.559 1
1 824 . 15 1 1 A 96 96 ASP CB C 83 40.321 41.208 -0.887 1
1 825 . 15 1 1 A 96 96 ASP N N 83 119.082 119.944 -0.862 1
1 826 . 15 1 1 A 97 97 SER H H 84 7.989 7.874 0.115 1
1 827 . 15 1 1 A 97 97 SER HA H 84 4.250 4.404 -0.154 1
1 830 . 15 1 1 A 97 97 SER C C 84 175.346 175.284 0.062 1
1 831 . 15 1 1 A 97 97 SER CA C 84 60.948 59.174 1.774 1
1 832 . 15 1 1 A 97 97 SER CB C 84 63.370 63.965 -0.595 1
1 833 . 15 1 1 A 97 97 SER N N 84 117.579 112.256 5.323 1
1 834 . 15 1 1 A 98 98 ILE H H 85 6.862 7.380 -0.518 1
1 835 . 15 1 1 A 98 98 ILE HA H 85 4.550 4.058 0.492 1
1 843 . 15 1 1 A 98 98 ILE C C 85 173.308 174.929 -1.621 1
1 844 . 15 1 1 A 98 98 ILE CA C 85 60.948 60.759 0.189 1
1 845 . 15 1 1 A 98 98 ILE CB C 85 37.760 37.539 0.221 1
1 848 . 15 1 1 A 98 98 ILE N N 85 113.733 117.946 -4.213 1
1 849 . 15 1 1 A 99 99 GLU H H 86 7.705 7.915 -0.210 1
1 850 . 15 1 1 A 99 99 GLU HA H 86 4.280 3.826 0.454 1
1 853 . 15 1 1 A 99 99 GLU C C 86 175.224 174.579 0.645 1
1 854 . 15 1 1 A 99 99 GLU CA C 86 56.260 57.532 -1.272 1
1 855 . 15 1 1 A 99 99 GLU CB C 86 26.258 27.096 -0.838 1
1 857 . 15 1 1 A 99 99 GLU N N 86 115.493 118.733 -3.240 1
1 858 . 15 1 1 A 100 100 LEU H H 87 7.989 7.048 0.941 1
1 859 . 15 1 1 A 100 100 LEU HA H 87 4.220 4.714 -0.494 1
1 868 . 15 1 1 A 100 100 LEU C C 87 176.965 175.756 1.209 1
1 869 . 15 1 1 A 100 100 LEU CA C 87 52.510 53.240 -0.730 1
1 870 . 15 1 1 A 100 100 LEU CB C 87 42.196 44.786 -2.590 1
1 873 . 15 1 1 A 100 100 LEU N N 87 117.579 118.883 -1.304 1
1 874 . 15 1 1 A 101 101 GLY H H 88 8.503 8.084 0.419 1
1 875 . 15 1 1 A 101 101 GLY CA C 88 46.884 45.925 0.959 1
1 876 . 15 1 1 A 101 101 GLY N N 88 107.794 112.881 -5.087 1
1 877 . 15 1 1 A 102 102 ASP HA H 89 4.431 4.284 0.147 1
1 880 . 15 1 1 A 102 102 ASP C C 89 178.075 178.434 -0.359 1
1 881 . 15 1 1 A 102 102 ASP CA C 89 57.198 56.828 0.370 1
1 882 . 15 1 1 A 102 102 ASP CB C 89 40.321 40.465 -0.144 1
1 883 . 15 1 1 A 103 103 TYR H H 90 7.899 8.078 -0.179 1
1 884 . 15 1 1 A 103 103 TYR HA H 90 4.940 4.460 0.480 1
1 889 . 15 1 1 A 103 103 TYR C C 90 175.527 178.535 -3.008 1
1 890 . 15 1 1 A 103 103 TYR CA C 90 58.135 60.497 -2.362 1
1 891 . 15 1 1 A 103 103 TYR CB C 90 38.446 37.670 0.776 1
1 894 . 15 1 1 A 103 103 TYR N N 90 115.595 119.660 -4.065 1
1 895 . 15 1 1 A 104 104 THR H H 91 7.971 8.406 -0.435 1
1 896 . 15 1 1 A 104 104 THR HA H 91 4.234 4.041 0.193 1
1 901 . 15 1 1 A 104 104 THR C C 91 175.905 176.481 -0.576 1
1 902 . 15 1 1 A 104 104 THR CA C 91 68.449 67.265 1.184 1
1 904 . 15 1 1 A 104 104 THR N N 91 118.867 116.723 2.144 1
1 905 . 15 1 1 A 105 105 LYS H H 92 8.555 7.925 0.630 1
1 906 . 15 1 1 A 105 105 LYS HA H 92 3.940 4.065 -0.125 1
1 912 . 15 1 1 A 105 105 LYS C C 92 177.310 178.613 -1.303 1
1 913 . 15 1 1 A 105 105 LYS CA C 92 60.948 59.455 1.493 1
1 914 . 15 1 1 A 105 105 LYS CB C 92 31.883 32.410 -0.527 1
1 917 . 15 1 1 A 105 105 LYS N N 92 119.259 121.397 -2.138 1
1 918 . 15 1 1 A 106 106 ALA H H 93 7.920 8.013 -0.093 1
1 919 . 15 1 1 A 106 106 ALA HA H 93 4.128 4.151 -0.023 1
1 923 . 15 1 1 A 106 106 ALA C C 93 180.972 180.377 0.595 1
1 924 . 15 1 1 A 106 106 ALA CA C 93 55.070 55.136 -0.066 1
1 925 . 15 1 1 A 106 106 ALA CB C 93 17.750 18.488 -0.738 1
1 926 . 15 1 1 A 106 106 ALA N N 93 120.398 121.429 -1.031 1
1 927 . 15 1 1 A 107 107 PHE H H 94 8.136 8.740 -0.604 1
1 928 . 15 1 1 A 107 107 PHE HA H 94 4.190 4.631 -0.441 1
1 934 . 15 1 1 A 107 107 PHE C C 94 177.955 178.272 -0.317 1
1 935 . 15 1 1 A 107 107 PHE CA C 94 63.761 61.562 2.199 1
1 936 . 15 1 1 A 107 107 PHE CB C 94 38.446 38.843 -0.397 1
1 940 . 15 1 1 A 107 107 PHE N N 94 117.119 116.304 0.815 1
1 941 . 15 1 1 A 108 108 LEU H H 95 8.351 8.698 -0.347 1
1 942 . 15 1 1 A 108 108 LEU HA H 95 3.889 3.977 -0.088 1
1 951 . 15 1 1 A 108 108 LEU C C 95 182.043 179.183 2.860 1
1 952 . 15 1 1 A 108 108 LEU CA C 95 59.073 58.554 0.519 1
1 953 . 15 1 1 A 108 108 LEU CB C 95 41.259 41.864 -0.605 1
1 956 . 15 1 1 A 108 108 LEU N N 95 118.450 119.843 -1.393 1
1 957 . 15 1 1 A 109 109 ILE H H 96 8.992 8.133 0.859 1
1 958 . 15 1 1 A 109 109 ILE HA H 96 4.069 3.836 0.233 1
1 968 . 15 1 1 A 109 109 ILE C C 96 177.094 178.027 -0.933 1
1 969 . 15 1 1 A 109 109 ILE CA C 96 63.761 64.472 -0.711 1
1 970 . 15 1 1 A 109 109 ILE CB C 96 37.509 37.661 -0.152 1
1 974 . 15 1 1 A 109 109 ILE N N 96 118.177 115.142 3.035 1
1 975 . 15 1 1 A 110 110 ASN H H 97 7.067 8.067 -1.000 1
1 976 . 15 1 1 A 110 110 ASN HA H 97 4.797 4.610 0.187 1
1 981 . 15 1 1 A 110 110 ASN C C 97 173.595 175.338 -1.743 1
1 982 . 15 1 1 A 110 110 ASN CA C 97 54.385 53.556 0.829 1
1 983 . 15 1 1 A 110 110 ASN CB C 97 40.321 38.693 1.628 1
1 984 . 15 1 1 A 110 110 ASN N N 97 116.407 120.044 -3.637 1
1 986 . 15 1 1 A 111 111 GLY H H 98 7.681 7.983 -0.302 1
1 987 . 15 1 1 A 111 111 GLY HA2 H 98 4.080 3.932 0.148 1
1 988 . 15 1 1 A 111 111 GLY HA3 H 98 3.640 4.031 -0.391 1
1 989 . 15 1 1 A 111 111 GLY C C 98 174.552 174.084 0.468 1
1 990 . 15 1 1 A 111 111 GLY CA C 98 45.947 44.898 1.049 1
1 991 . 15 1 1 A 111 111 GLY N N 98 104.440 105.831 -1.391 1
1 992 . 15 1 1 A 112 112 TYR H H 99 8.427 8.195 0.232 1
1 993 . 15 1 1 A 112 112 TYR HA H 99 4.661 4.761 -0.100 1
1 998 . 15 1 1 A 112 112 TYR C C 99 174.425 175.636 -1.211 1
1 999 . 15 1 1 A 112 112 TYR CA C 99 57.198 57.814 -0.616 1
1 1000 . 15 1 1 A 112 112 TYR CB C 99 36.571 38.298 -1.727 1
1 1003 . 15 1 1 A 112 112 TYR N N 99 122.830 120.092 2.738 1
1 1004 . 15 1 1 A 113 113 THR H H 100 7.166 8.763 -1.597 1
1 1005 . 15 1 1 A 113 113 THR HA H 100 4.248 4.662 -0.414 1
1 1009 . 15 1 1 A 113 113 THR C C 100 174.897 174.676 0.221 1
1 1010 . 15 1 1 A 113 113 THR CA C 100 62.290 62.297 -0.007 1
1 1011 . 15 1 1 A 113 113 THR CB C 100 68.970 70.061 -1.091 1
1 1013 . 15 1 1 A 113 113 THR N N 100 104.304 116.094 -11.790 1
1 1014 . 15 1 1 A 114 114 SER H H 101 7.695 7.973 -0.278 1
1 1015 . 15 1 1 A 114 114 SER C C 101 174.372 174.300 0.072 1
1 1016 . 15 1 1 A 114 114 SER CA C 101 56.260 57.590 -1.330 1
1 1017 . 15 1 1 A 114 114 SER CB C 101 65.636 64.948 0.688 1
1 1018 . 15 1 1 A 114 114 SER N N 101 115.613 116.401 -0.788 1
1 1023 . 15 1 1 A 116 116 ASP HA H 103 4.260 4.321 -0.061 1
1 1026 . 15 1 1 A 116 116 ASP CA C 103 57.198 57.713 -0.515 1
1 1027 . 15 1 1 A 116 116 ASP CB C 103 40.321 40.324 -0.003 1
1 1028 . 15 1 1 A 117 117 LEU H H 104 7.345 7.884 -0.539 1
1 1029 . 15 1 1 A 117 117 LEU HA H 104 4.290 4.080 0.210 1
1 1038 . 15 1 1 A 117 117 LEU C C 104 178.488 178.518 -0.030 1
1 1039 . 15 1 1 A 117 117 LEU CA C 104 56.260 58.256 -1.996 1
1 1040 . 15 1 1 A 117 117 LEU CB C 104 42.196 41.430 0.766 1
1 1043 . 15 1 1 A 117 117 LEU N N 104 117.878 121.767 -3.889 1
1 1044 . 15 1 1 A 118 118 LEU H H 105 7.514 8.393 -0.879 1
1 1045 . 15 1 1 A 118 118 LEU HA H 105 4.210 4.061 0.149 1
1 1054 . 15 1 1 A 118 118 LEU C C 105 177.002 178.947 -1.945 1
1 1055 . 15 1 1 A 118 118 LEU CA C 105 55.323 57.045 -1.722 1
1 1056 . 15 1 1 A 118 118 LEU CB C 105 42.196 40.827 1.369 1
1 1059 . 15 1 1 A 118 118 LEU N N 105 119.094 118.311 0.783 1
1 1060 . 15 1 1 A 120 120 LYS HA H 107 4.340 4.426 -0.086 1
1 1063 . 15 1 1 A 120 120 LYS C C 107 176.603 175.136 1.467 1
1 1064 . 15 1 1 A 120 120 LYS CA C 107 55.323 55.716 -0.393 1
1 1065 . 15 1 1 A 120 120 LYS CB C 107 31.883 32.398 -0.515 1
1 1068 . 15 1 1 A 121 121 ILE H H 108 7.539 7.354 0.185 1
1 1069 . 15 1 1 A 121 121 ILE HA H 108 3.987 4.782 -0.795 1
1 1079 . 15 1 1 A 121 121 ILE C C 108 173.247 174.791 -1.544 1
1 1080 . 15 1 1 A 121 121 ILE CA C 108 62.823 59.674 3.149 1
1 1081 . 15 1 1 A 121 121 ILE CB C 108 38.446 40.765 -2.319 1
1 1085 . 15 1 1 A 121 121 ILE N N 108 122.417 121.158 1.259 1
1 1086 . 15 1 1 A 122 122 ALA H H 109 8.290 8.270 0.020 1
1 1087 . 15 1 1 A 122 122 ALA HA H 109 3.970 4.654 -0.684 1
1 1091 . 15 1 1 A 122 122 ALA C C 109 178.318 177.777 0.541 1
1 1092 . 15 1 1 A 122 122 ALA CA C 109 50.150 49.733 0.417 1
1 1093 . 15 1 1 A 122 122 ALA CB C 109 21.630 21.137 0.493 1
1 1094 . 15 1 1 A 122 122 ALA N N 109 127.784 128.655 -0.871 1
1 1095 . 15 1 1 A 123 123 GLU HA H 110 3.707 3.901 -0.194 1
1 1099 . 15 1 1 A 123 123 GLU C C 110 178.290 178.027 0.263 1
1 1100 . 15 1 1 A 123 123 GLU CA C 110 60.948 59.864 1.084 1
1 1101 . 15 1 1 A 123 123 GLU CB C 110 29.070 29.699 -0.629 1
1 1102 . 15 1 1 A 124 124 VAL H H 111 8.333 8.211 0.122 1
1 1103 . 15 1 1 A 124 124 VAL HA H 111 3.850 3.786 0.064 1
1 1111 . 15 1 1 A 124 124 VAL C C 111 177.406 177.624 -0.218 1
1 1112 . 15 1 1 A 124 124 VAL CA C 111 65.636 65.005 0.631 1
1 1113 . 15 1 1 A 124 124 VAL CB C 111 30.730 31.083 -0.353 1
1 1116 . 15 1 1 A 124 124 VAL N N 111 114.438 118.814 -4.376 1
1 1117 . 15 1 1 A 125 125 GLU H H 112 7.442 8.222 -0.780 1
1 1118 . 15 1 1 A 125 125 GLU HA H 112 4.152 4.014 0.138 1
1 1123 . 15 1 1 A 125 125 GLU C C 112 179.982 179.202 0.780 1
1 1124 . 15 1 1 A 125 125 GLU CA C 112 60.010 59.433 0.577 1
1 1125 . 15 1 1 A 125 125 GLU CB C 112 30.008 29.294 0.714 1
1 1127 . 15 1 1 A 125 125 GLU N N 112 121.032 121.701 -0.669 1
1 1128 . 15 1 1 A 126 126 LEU H H 113 7.666 7.739 -0.073 1
1 1129 . 15 1 1 A 126 126 LEU HA H 113 3.846 4.009 -0.163 1
1 1138 . 15 1 1 A 126 126 LEU C C 113 176.991 178.791 -1.800 1
1 1139 . 15 1 1 A 126 126 LEU CA C 113 58.135 57.969 0.166 1
1 1140 . 15 1 1 A 126 126 LEU CB C 113 41.259 41.756 -0.497 1
1 1143 . 15 1 1 A 126 126 LEU N N 113 118.731 121.376 -2.645 1
1 1144 . 15 1 1 A 127 127 ILE H H 114 7.781 8.081 -0.300 1
1 1145 . 15 1 1 A 127 127 ILE HA H 114 3.502 3.896 -0.394 1
1 1153 . 15 1 1 A 127 127 ILE C C 114 178.195 176.835 1.360 1
1 1154 . 15 1 1 A 127 127 ILE CA C 114 65.636 62.841 2.795 1
1 1155 . 15 1 1 A 127 127 ILE CB C 114 40.321 37.695 2.626 1
1 1159 . 15 1 1 A 127 127 ILE N N 114 115.084 119.440 -4.356 1
1 1160 . 15 1 1 A 128 128 ASN H H 115 8.470 8.073 0.397 1
1 1161 . 15 1 1 A 128 128 ASN HA H 115 4.502 4.725 -0.223 1
1 1166 . 15 1 1 A 128 128 ASN C C 115 176.295 175.801 0.494 1
1 1167 . 15 1 1 A 128 128 ASN CA C 115 56.260 54.733 1.527 1
1 1168 . 15 1 1 A 128 128 ASN CB C 115 39.384 39.169 0.215 1
1 1169 . 15 1 1 A 128 128 ASN N N 115 115.158 118.984 -3.826 1
1 1171 . 15 1 1 A 129 129 VAL H H 116 8.116 7.701 0.415 1
1 1172 . 15 1 1 A 129 129 VAL HA H 116 4.090 4.000 0.090 1
1 1180 . 15 1 1 A 129 129 VAL C C 116 176.740 177.493 -0.753 1
1 1181 . 15 1 1 A 129 129 VAL CA C 116 64.400 64.528 -0.128 1
1 1182 . 15 1 1 A 129 129 VAL CB C 116 32.050 32.737 -0.687 1
1 1185 . 15 1 1 A 129 129 VAL N N 116 118.698 117.505 1.193 1
1 1186 . 15 1 1 A 130 130 LEU H H 117 7.294 7.931 -0.637 1
1 1187 . 15 1 1 A 130 130 LEU HA H 117 3.970 4.126 -0.156 1
1 1196 . 15 1 1 A 130 130 LEU C C 117 175.127 176.052 -0.925 1
1 1197 . 15 1 1 A 130 130 LEU CA C 117 56.260 55.054 1.206 1
1 1198 . 15 1 1 A 130 130 LEU CB C 117 41.259 41.976 -0.717 1
1 1201 . 15 1 1 A 130 130 LEU N N 117 116.201 118.940 -2.739 1
1 1202 . 15 1 1 A 131 131 LYS H H 118 6.594 7.728 -1.134 1
1 1203 . 15 1 1 A 131 131 LYS HA H 118 3.980 4.200 -0.220 1
1 1208 . 15 1 1 A 131 131 LYS C C 118 175.589 175.377 0.212 1
1 1209 . 15 1 1 A 131 131 LYS CA C 118 56.260 57.548 -1.288 1
1 1210 . 15 1 1 A 131 131 LYS CB C 118 28.133 29.552 -1.419 1
1 1212 . 15 1 1 A 131 131 LYS N N 118 111.172 115.898 -4.726 1
1 1213 . 15 1 1 A 132 132 ILE H H 119 8.245 7.870 0.375 1
1 1214 . 15 1 1 A 132 132 ILE HA H 119 4.090 4.310 -0.220 1
1 1224 . 15 1 1 A 132 132 ILE C C 119 175.161 175.680 -0.519 1
1 1225 . 15 1 1 A 132 132 ILE CA C 119 60.010 60.977 -0.967 1
1 1226 . 15 1 1 A 132 132 ILE CB C 119 35.633 38.111 -2.478 1
1 1230 . 15 1 1 A 132 132 ILE N N 119 119.484 119.741 -0.257 1
1 1231 . 15 1 1 A 133 133 ASN H H 120 8.054 8.659 -0.605 1
1 1232 . 15 1 1 A 133 133 ASN HA H 120 4.350 5.012 -0.662 1
1 1235 . 15 1 1 A 133 133 ASN C C 120 175.136 175.290 -0.154 1
1 1236 . 15 1 1 A 133 133 ASN CA C 120 54.385 53.719 0.666 1
1 1237 . 15 1 1 A 133 133 ASN CB C 120 39.384 40.696 -1.312 1
1 1238 . 15 1 1 A 133 133 ASN N N 120 124.670 125.325 -0.655 1
1 1239 . 15 1 1 A 134 134 LEU H H 121 7.517 7.252 0.265 1
1 1240 . 15 1 1 A 134 134 LEU HA H 121 4.678 4.023 0.655 1
1 1249 . 15 1 1 A 134 134 LEU C C 121 178.051 177.352 0.699 1
1 1250 . 15 1 1 A 134 134 LEU CA C 121 53.447 56.017 -2.570 1
1 1251 . 15 1 1 A 134 134 LEU CB C 121 41.259 43.175 -1.916 1
1 1254 . 15 1 1 A 134 134 LEU N N 121 119.918 120.120 -0.202 1
1 1255 . 15 1 1 A 135 135 ILE H H 122 9.389 8.601 0.788 1
1 1256 . 15 1 1 A 135 135 ILE HA H 122 3.540 3.662 -0.122 1
1 1266 . 15 1 1 A 135 135 ILE C C 122 176.425 177.628 -1.203 1
1 1267 . 15 1 1 A 135 135 ILE CA C 122 65.636 64.974 0.662 1
1 1268 . 15 1 1 A 135 135 ILE CB C 122 38.446 38.322 0.124 1
1 1272 . 15 1 1 A 135 135 ILE N N 122 129.949 126.601 3.348 1
1 1273 . 15 1 1 A 136 136 GLY H H 123 8.675 8.636 0.039 1
1 1274 . 15 1 1 A 136 136 GLY HA2 H 123 2.650 3.225 -0.575 1
1 1275 . 15 1 1 A 136 136 GLY HA3 H 123 2.060 3.579 -1.519 1
1 1276 . 15 1 1 A 136 136 GLY C C 123 176.854 176.389 0.465 1
1 1277 . 15 1 1 A 136 136 GLY CA C 123 45.500 47.179 -1.679 1
1 1278 . 15 1 1 A 136 136 GLY N N 123 106.314 108.225 -1.911 1
1 1279 . 15 1 1 A 137 137 HIS H H 124 6.869 7.925 -1.056 1
1 1280 . 15 1 1 A 137 137 HIS HA H 124 4.558 4.544 0.014 1
1 1285 . 15 1 1 A 137 137 HIS C C 124 176.977 177.482 -0.505 1
1 1286 . 15 1 1 A 137 137 HIS CA C 124 57.198 58.793 -1.595 1
1 1287 . 15 1 1 A 137 137 HIS CB C 124 30.945 29.942 1.003 1
1 1290 . 15 1 1 A 137 137 HIS N N 124 118.865 120.158 -1.293 1
1 1291 . 15 1 1 A 138 138 ARG H H 125 7.730 8.561 -0.831 1
1 1292 . 15 1 1 A 138 138 ARG HA H 125 3.770 3.890 -0.120 1
1 1299 . 15 1 1 A 138 138 ARG C C 125 178.288 178.368 -0.080 1
1 1300 . 15 1 1 A 138 138 ARG CA C 125 61.886 59.321 2.565 1
1 1301 . 15 1 1 A 138 138 ARG CB C 125 30.945 29.906 1.039 1
1 1304 . 15 1 1 A 138 138 ARG N N 125 118.149 119.647 -1.498 1
1 1306 . 15 1 1 A 139 139 LYS H H 126 8.679 8.209 0.470 1
1 1307 . 15 1 1 A 139 139 LYS HA H 126 3.990 3.964 0.026 1
1 1310 . 15 1 1 A 139 139 LYS C C 126 179.184 178.514 0.670 1
1 1311 . 15 1 1 A 139 139 LYS CA C 126 58.135 59.331 -1.196 1
1 1312 . 15 1 1 A 139 139 LYS CB C 126 30.945 32.260 -1.315 1
1 1314 . 15 1 1 A 139 139 LYS N N 126 114.003 118.960 -4.957 1
1 1315 . 15 1 1 A 140 140 ARG H H 127 7.248 8.152 -0.904 1
1 1316 . 15 1 1 A 140 140 ARG HA H 127 3.870 3.940 -0.070 1
1 1324 . 15 1 1 A 140 140 ARG C C 127 177.772 178.828 -1.056 1
1 1325 . 15 1 1 A 140 140 ARG CA C 127 60.010 59.265 0.745 1
1 1326 . 15 1 1 A 140 140 ARG CB C 127 30.945 29.977 0.968 1
1 1329 . 15 1 1 A 140 140 ARG N N 127 120.072 117.975 2.097 1
1 1331 . 15 1 1 A 141 141 ILE H H 128 7.706 8.082 -0.376 1
1 1332 . 15 1 1 A 141 141 ILE HA H 128 3.530 3.750 -0.220 1
1 1340 . 15 1 1 A 141 141 ILE C C 128 177.669 178.134 -0.465 1
1 1341 . 15 1 1 A 141 141 ILE CA C 128 65.636 65.674 -0.038 1
1 1342 . 15 1 1 A 141 141 ILE CB C 128 38.680 38.252 0.428 1
1 1345 . 15 1 1 A 141 141 ILE N N 128 118.730 120.463 -1.733 1
1 1346 . 15 1 1 A 142 142 LEU H H 129 8.194 8.492 -0.298 1
1 1347 . 15 1 1 A 142 142 LEU HA H 129 3.950 3.972 -0.022 1
1 1356 . 15 1 1 A 142 142 LEU C C 129 179.960 178.555 1.405 1
1 1357 . 15 1 1 A 142 142 LEU CA C 129 58.135 57.944 0.191 1
1 1358 . 15 1 1 A 142 142 LEU CB C 129 41.259 41.505 -0.246 1
1 1361 . 15 1 1 A 142 142 LEU N N 129 117.675 121.134 -3.459 1
1 1362 . 15 1 1 A 143 143 ALA H H 130 8.294 8.337 -0.043 1
1 1363 . 15 1 1 A 143 143 ALA HA H 130 4.220 4.032 0.188 1
1 1367 . 15 1 1 A 143 143 ALA C C 130 179.899 179.623 0.276 1
1 1368 . 15 1 1 A 143 143 ALA CA C 130 54.385 55.224 -0.839 1
1 1369 . 15 1 1 A 143 143 ALA CB C 130 19.270 18.384 0.886 1
1 1370 . 15 1 1 A 143 143 ALA N N 130 121.096 121.784 -0.688 1
1 1371 . 15 1 1 A 144 144 SER H H 131 7.813 8.419 -0.606 1
1 1372 . 15 1 1 A 144 144 SER HA H 131 4.180 4.207 -0.027 1
1 1375 . 15 1 1 A 144 144 SER C C 131 175.457 177.552 -2.095 1
1 1376 . 15 1 1 A 144 144 SER CA C 131 60.948 61.764 -0.816 1
1 1377 . 15 1 1 A 144 144 SER CB C 131 63.761 62.602 1.159 1
1 1378 . 15 1 1 A 144 144 SER N N 131 112.102 113.418 -1.316 1
1 1379 . 15 1 1 A 145 145 LEU H H 132 7.747 7.638 0.109 1
1 1380 . 15 1 1 A 145 145 LEU HA H 132 4.140 4.046 0.094 1
1 1389 . 15 1 1 A 145 145 LEU C C 132 178.589 177.747 0.842 1
1 1390 . 15 1 1 A 145 145 LEU CA C 132 56.260 56.842 -0.582 1
1 1391 . 15 1 1 A 145 145 LEU CB C 132 42.196 43.128 -0.932 1
1 1394 . 15 1 1 A 145 145 LEU N N 132 117.536 120.027 -2.491 1
1 1395 . 15 1 1 A 146 146 GLY H H 133 7.544 7.506 0.038 1
1 1396 . 15 1 1 A 146 146 GLY HA2 H 133 3.950 4.030 -0.080 1
1 1397 . 15 1 1 A 146 146 GLY HA3 H 133 3.100 4.041 -0.941 1
1 1398 . 15 1 1 A 146 146 GLY C C 133 173.372 174.181 -0.809 1
1 1399 . 15 1 1 A 146 146 GLY CA C 133 45.947 45.553 0.394 1
1 1400 . 15 1 1 A 146 146 GLY N N 133 105.351 103.832 1.519 1
1 1401 . 15 1 1 A 147 147 ASP H H 134 8.342 8.932 -0.590 1
1 1402 . 15 1 1 A 147 147 ASP HA H 134 4.650 4.568 0.082 1
1 1405 . 15 1 1 A 147 147 ASP C C 134 175.462 176.275 -0.813 1
1 1406 . 15 1 1 A 147 147 ASP CA C 134 54.385 55.879 -1.494 1
1 1407 . 15 1 1 A 147 147 ASP CB C 134 41.259 41.245 0.014 1
1 1408 . 15 1 1 A 147 147 ASP N N 134 120.133 123.893 -3.760 1
1 14 . 16 1 1 A 15 15 GLN H H 2 8.439 7.760 0.679 1
1 15 . 16 1 1 A 15 15 GLN HA H 2 4.594 4.903 -0.309 1
1 20 . 16 1 1 A 15 15 GLN C C 2 175.972 174.296 1.676 1
1 21 . 16 1 1 A 15 15 GLN CA C 2 56.260 53.949 2.311 1
1 22 . 16 1 1 A 15 15 GLN CB C 2 30.945 30.434 0.511 1
1 24 . 16 1 1 A 15 15 GLN N N 2 124.997 117.936 7.061 1
1 25 . 16 1 1 A 16 16 THR H H 3 8.347 8.417 -0.070 1
1 26 . 16 1 1 A 16 16 THR HA H 3 4.555 4.697 -0.142 1
1 31 . 16 1 1 A 16 16 THR C C 3 175.495 174.707 0.788 1
1 32 . 16 1 1 A 16 16 THR CA C 3 60.010 61.270 -1.260 1
1 33 . 16 1 1 A 16 16 THR CB C 3 71.261 72.317 -1.056 1
1 34 . 16 1 1 A 16 16 THR N N 3 113.011 112.711 0.300 1
1 35 . 16 1 1 A 17 17 VAL H H 4 8.895 9.084 -0.189 1
1 36 . 16 1 1 A 17 17 VAL HA H 4 3.670 3.832 -0.162 1
1 44 . 16 1 1 A 17 17 VAL C C 4 178.449 177.838 0.611 1
1 45 . 16 1 1 A 17 17 VAL CA C 4 67.511 66.380 1.131 1
1 46 . 16 1 1 A 17 17 VAL CB C 4 31.883 31.832 0.051 1
1 49 . 16 1 1 A 17 17 VAL N N 4 121.854 124.668 -2.814 1
1 50 . 16 1 1 A 18 18 GLY H H 5 9.017 8.407 0.610 1
1 51 . 16 1 1 A 18 18 GLY HA2 H 5 3.940 3.840 0.100 1
1 52 . 16 1 1 A 18 18 GLY HA3 H 5 3.610 3.854 -0.244 1
1 53 . 16 1 1 A 18 18 GLY C C 5 176.186 175.862 0.324 1
1 54 . 16 1 1 A 18 18 GLY CA C 5 47.822 47.175 0.647 1
1 55 . 16 1 1 A 18 18 GLY N N 5 106.966 107.795 -0.829 1
1 56 . 16 1 1 A 19 19 GLN H H 6 8.072 8.323 -0.251 1
1 57 . 16 1 1 A 19 19 GLN HA H 6 4.037 4.135 -0.098 1
1 62 . 16 1 1 A 19 19 GLN C C 6 179.488 178.159 1.329 1
1 63 . 16 1 1 A 19 19 GLN CA C 6 59.073 58.686 0.387 1
1 64 . 16 1 1 A 19 19 GLN CB C 6 28.489 28.749 -0.260 1
1 66 . 16 1 1 A 19 19 GLN N N 6 122.431 121.028 1.403 1
1 67 . 16 1 1 A 20 20 TRP H H 7 8.756 8.269 0.487 1
1 68 . 16 1 1 A 20 20 TRP HA H 7 4.160 4.293 -0.133 1
1 77 . 16 1 1 A 20 20 TRP C C 7 179.620 178.011 1.609 1
1 78 . 16 1 1 A 20 20 TRP CA C 7 61.886 61.060 0.826 1
1 79 . 16 1 1 A 20 20 TRP CB C 7 28.133 29.747 -1.614 1
1 85 . 16 1 1 A 20 20 TRP N N 7 124.265 122.174 2.091 1
1 87 . 16 1 1 A 21 21 LEU H H 8 9.148 8.521 0.627 1
1 88 . 16 1 1 A 21 21 LEU HA H 8 3.440 3.542 -0.102 1
1 97 . 16 1 1 A 21 21 LEU C C 8 180.521 178.415 2.106 1
1 98 . 16 1 1 A 21 21 LEU CA C 8 56.920 58.029 -1.109 1
1 99 . 16 1 1 A 21 21 LEU CB C 8 41.700 41.398 0.302 1
1 102 . 16 1 1 A 21 21 LEU N N 8 120.548 120.668 -0.120 1
1 103 . 16 1 1 A 22 22 GLU H H 9 8.284 8.531 -0.247 1
1 104 . 16 1 1 A 22 22 GLU HA H 9 3.740 3.925 -0.185 1
1 109 . 16 1 1 A 22 22 GLU C C 9 179.960 178.550 1.410 1
1 110 . 16 1 1 A 22 22 GLU CA C 9 60.010 59.802 0.208 1
1 111 . 16 1 1 A 22 22 GLU CB C 9 29.070 29.173 -0.103 1
1 113 . 16 1 1 A 22 22 GLU N N 9 120.133 119.448 0.685 1
1 114 . 16 1 1 A 23 23 SER H H 10 7.891 7.851 0.040 1
1 115 . 16 1 1 A 23 23 SER HA H 10 4.250 4.211 0.039 1
1 118 . 16 1 1 A 23 23 SER C C 10 175.346 176.573 -1.227 1
1 119 . 16 1 1 A 23 23 SER CA C 10 60.948 61.380 -0.432 1
1 120 . 16 1 1 A 23 23 SER CB C 10 63.280 63.025 0.255 1
1 121 . 16 1 1 A 23 23 SER N N 10 117.044 114.451 2.593 1
1 122 . 16 1 1 A 24 24 ILE H H 11 6.862 7.709 -0.847 1
1 123 . 16 1 1 A 24 24 ILE HA H 11 4.487 3.892 0.595 1
1 133 . 16 1 1 A 24 24 ILE C C 11 175.812 175.694 0.118 1
1 134 . 16 1 1 A 24 24 ILE CA C 11 60.948 63.565 -2.617 1
1 135 . 16 1 1 A 24 24 ILE CB C 11 38.250 37.351 0.899 1
1 139 . 16 1 1 A 24 24 ILE N N 11 113.733 117.802 -4.069 1
1 140 . 16 1 1 A 25 25 GLY H H 12 7.628 7.627 0.001 1
1 141 . 16 1 1 A 25 25 GLY HA2 H 12 3.990 4.087 -0.097 1
1 142 . 16 1 1 A 25 25 GLY HA3 H 12 3.800 4.091 -0.291 1
1 143 . 16 1 1 A 25 25 GLY C C 12 173.647 171.782 1.865 1
1 144 . 16 1 1 A 25 25 GLY CA C 12 45.947 45.983 -0.036 1
1 145 . 16 1 1 A 25 25 GLY N N 12 109.763 109.840 -0.077 1
1 146 . 16 1 1 A 26 26 LEU H H 13 7.620 8.221 -0.601 1
1 147 . 16 1 1 A 26 26 LEU C C 13 176.186 174.218 1.968 1
1 148 . 16 1 1 A 26 26 LEU CA C 13 52.700 51.936 0.764 1
1 149 . 16 1 1 A 26 26 LEU CB C 13 43.134 46.033 -2.899 1
1 150 . 16 1 1 A 26 26 LEU N N 13 118.778 122.115 -3.337 1
1 151 . 16 1 1 A 27 27 PRO HA H 14 4.120 4.707 -0.587 1
1 154 . 16 1 1 A 27 27 PRO C C 14 177.955 176.415 1.540 1
1 155 . 16 1 1 A 27 27 PRO CA C 14 64.698 62.278 2.420 1
1 156 . 16 1 1 A 27 27 PRO CB C 14 31.883 29.087 2.796 1
1 158 . 16 1 1 A 28 28 GLN H H 15 9.838 8.789 1.049 1
1 159 . 16 1 1 A 28 28 GLN HA H 15 4.240 4.445 -0.205 1
1 162 . 16 1 1 A 28 28 GLN C C 15 176.836 176.199 0.637 1
1 163 . 16 1 1 A 28 28 GLN CA C 15 58.135 56.267 1.868 1
1 164 . 16 1 1 A 28 28 GLN CB C 15 27.195 30.298 -3.103 1
1 166 . 16 1 1 A 28 28 GLN N N 15 120.414 122.746 -2.332 1
1 167 . 16 1 1 A 29 29 TYR H H 16 6.810 7.944 -1.134 1
1 168 . 16 1 1 A 29 29 TYR HA H 16 5.720 4.643 1.077 1
1 173 . 16 1 1 A 29 29 TYR C C 16 174.814 176.660 -1.846 1
1 174 . 16 1 1 A 29 29 TYR CA C 16 57.198 57.605 -0.407 1
1 175 . 16 1 1 A 29 29 TYR CB C 16 37.509 39.195 -1.686 1
1 178 . 16 1 1 A 29 29 TYR N N 16 119.718 115.834 3.884 1
1 179 . 16 1 1 A 30 30 GLU H H 17 7.509 8.480 -0.971 1
1 180 . 16 1 1 A 30 30 GLU HA H 17 3.650 4.177 -0.527 1
1 184 . 16 1 1 A 30 30 GLU C C 17 177.552 178.329 -0.777 1
1 185 . 16 1 1 A 30 30 GLU CA C 17 60.948 59.221 1.727 1
1 186 . 16 1 1 A 30 30 GLU CB C 17 30.008 29.387 0.621 1
1 188 . 16 1 1 A 30 30 GLU N N 17 122.417 119.914 2.503 1
1 189 . 16 1 1 A 31 31 ASN H H 18 9.259 8.029 1.230 1
1 190 . 16 1 1 A 31 31 ASN HA H 18 4.451 4.504 -0.053 1
1 193 . 16 1 1 A 31 31 ASN C C 18 176.868 178.019 -1.151 1
1 194 . 16 1 1 A 31 31 ASN CA C 18 57.198 56.503 0.695 1
1 195 . 16 1 1 A 31 31 ASN CB C 18 38.446 39.629 -1.183 1
1 196 . 16 1 1 A 31 31 ASN N N 18 116.613 118.522 -1.909 1
1 197 . 16 1 1 A 32 32 HIS H H 19 8.898 8.327 0.571 1
1 198 . 16 1 1 A 32 32 HIS HA H 19 4.140 4.342 -0.202 1
1 202 . 16 1 1 A 32 32 HIS C C 19 178.269 177.726 0.543 1
1 203 . 16 1 1 A 32 32 HIS CA C 19 60.948 59.056 1.892 1
1 204 . 16 1 1 A 32 32 HIS CB C 19 30.008 30.350 -0.342 1
1 206 . 16 1 1 A 32 32 HIS N N 19 118.926 118.491 0.435 1
1 207 . 16 1 1 A 33 33 LEU H H 20 7.825 8.864 -1.039 1
1 208 . 16 1 1 A 33 33 LEU HA H 20 4.305 3.963 0.342 1
1 218 . 16 1 1 A 33 33 LEU C C 20 179.190 178.994 0.196 1
1 219 . 16 1 1 A 33 33 LEU CA C 20 60.010 58.382 1.628 1
1 220 . 16 1 1 A 33 33 LEU CB C 20 40.321 41.974 -1.653 1
1 224 . 16 1 1 A 33 33 LEU N N 20 117.434 119.896 -2.462 1
1 225 . 16 1 1 A 34 34 MET H H 21 8.861 8.561 0.300 1
1 226 . 16 1 1 A 34 34 MET HA H 21 3.980 4.188 -0.208 1
1 234 . 16 1 1 A 34 34 MET C C 21 180.340 178.761 1.579 1
1 235 . 16 1 1 A 34 34 MET CA C 21 58.135 58.707 -0.572 1
1 236 . 16 1 1 A 34 34 MET CB C 21 30.945 32.335 -1.390 1
1 238 . 16 1 1 A 34 34 MET N N 21 118.111 116.558 1.553 1
1 239 . 16 1 1 A 35 35 ALA H H 22 9.015 8.498 0.517 1
1 240 . 16 1 1 A 35 35 ALA HA H 22 4.239 4.132 0.107 1
1 244 . 16 1 1 A 35 35 ALA C C 22 178.058 178.498 -0.440 1
1 245 . 16 1 1 A 35 35 ALA CA C 22 53.800 54.575 -0.775 1
1 246 . 16 1 1 A 35 35 ALA CB C 22 18.397 18.255 0.142 1
1 247 . 16 1 1 A 35 35 ALA N N 22 120.068 121.685 -1.617 1
1 248 . 16 1 1 A 36 36 ASN H H 23 7.143 8.074 -0.931 1
1 249 . 16 1 1 A 36 36 ASN HA H 23 4.959 4.895 0.064 1
1 254 . 16 1 1 A 36 36 ASN C C 23 174.083 175.350 -1.267 1
1 255 . 16 1 1 A 36 36 ASN CA C 23 54.000 52.618 1.382 1
1 256 . 16 1 1 A 36 36 ASN CB C 23 41.300 38.905 2.395 1
1 257 . 16 1 1 A 36 36 ASN N N 23 111.560 115.008 -3.448 1
1 259 . 16 1 1 A 37 37 GLY H H 24 7.797 8.256 -0.459 1
1 260 . 16 1 1 A 37 37 GLY HA2 H 24 3.430 3.735 -0.305 1
1 261 . 16 1 1 A 37 37 GLY HA3 H 24 3.290 3.858 -0.568 1
1 262 . 16 1 1 A 37 37 GLY C C 24 173.163 174.854 -1.691 1
1 263 . 16 1 1 A 37 37 GLY CA C 24 45.947 45.125 0.822 1
1 264 . 16 1 1 A 37 37 GLY N N 24 106.170 107.873 -1.703 1
1 265 . 16 1 1 A 38 38 PHE H H 25 8.191 7.897 0.294 1
1 266 . 16 1 1 A 38 38 PHE HA H 25 4.910 4.750 0.160 1
1 271 . 16 1 1 A 38 38 PHE C C 25 173.496 175.596 -2.100 1
1 272 . 16 1 1 A 38 38 PHE CA C 25 56.550 56.354 0.196 1
1 273 . 16 1 1 A 38 38 PHE CB C 25 37.220 37.140 0.080 1
1 276 . 16 1 1 A 38 38 PHE N N 25 122.454 119.877 2.577 1
1 277 . 16 1 1 A 39 39 ASP H H 26 6.756 8.518 -1.762 1
1 278 . 16 1 1 A 39 39 ASP HA H 26 5.077 4.965 0.112 1
1 281 . 16 1 1 A 39 39 ASP C C 26 177.463 175.257 2.206 1
1 282 . 16 1 1 A 39 39 ASP CA C 26 53.447 53.603 -0.156 1
1 283 . 16 1 1 A 39 39 ASP CB C 26 42.580 41.510 1.070 1
1 284 . 16 1 1 A 39 39 ASP N N 26 111.309 120.370 -9.061 1
1 285 . 16 1 1 A 40 40 ASN H H 27 7.495 7.912 -0.417 1
1 286 . 16 1 1 A 40 40 ASN HA H 27 4.820 5.089 -0.269 1
1 289 . 16 1 1 A 40 40 ASN C C 27 176.228 175.458 0.770 1
1 290 . 16 1 1 A 40 40 ASN CA C 27 52.510 51.662 0.848 1
1 291 . 16 1 1 A 40 40 ASN CB C 27 40.321 41.296 -0.975 1
1 292 . 16 1 1 A 40 40 ASN N N 27 118.385 118.472 -0.087 1
1 293 . 16 1 1 A 41 41 VAL H H 28 9.192 8.660 0.532 1
1 294 . 16 1 1 A 41 41 VAL HA H 28 3.550 3.629 -0.079 1
1 302 . 16 1 1 A 41 41 VAL C C 28 176.429 177.453 -1.024 1
1 303 . 16 1 1 A 41 41 VAL CA C 28 65.636 66.009 -0.373 1
1 304 . 16 1 1 A 41 41 VAL CB C 28 31.883 31.558 0.325 1
1 307 . 16 1 1 A 41 41 VAL N N 28 125.741 125.752 -0.011 1
1 308 . 16 1 1 A 42 42 GLN H H 29 8.203 8.185 0.018 1
1 309 . 16 1 1 A 42 42 GLN HA H 29 4.129 4.046 0.083 1
1 314 . 16 1 1 A 42 42 GLN C C 29 176.591 178.750 -2.159 1
1 315 . 16 1 1 A 42 42 GLN CA C 29 57.198 58.883 -1.685 1
1 316 . 16 1 1 A 42 42 GLN CB C 29 28.133 28.155 -0.022 1
1 318 . 16 1 1 A 42 42 GLN N N 29 116.452 119.120 -2.668 1
1 319 . 16 1 1 A 43 43 ALA H H 30 7.781 8.043 -0.262 1
1 320 . 16 1 1 A 43 43 ALA HA H 30 4.650 4.139 0.511 1
1 324 . 16 1 1 A 43 43 ALA C C 30 175.976 178.037 -2.061 1
1 325 . 16 1 1 A 43 43 ALA CA C 30 50.840 54.130 -3.290 1
1 326 . 16 1 1 A 43 43 ALA CB C 30 19.150 18.371 0.779 1
1 327 . 16 1 1 A 43 43 ALA N N 30 122.150 120.932 1.218 1
1 328 . 16 1 1 A 44 44 MET H H 31 7.739 8.117 -0.378 1
1 332 . 16 1 1 A 44 44 MET C C 31 178.275 177.526 0.749 1
1 333 . 16 1 1 A 44 44 MET CA C 31 55.323 54.091 1.232 1
1 334 . 16 1 1 A 44 44 MET CB C 31 34.696 31.895 2.801 1
1 336 . 16 1 1 A 44 44 MET N N 31 118.149 113.973 4.176 1
1 337 . 16 1 1 A 45 45 GLY H H 32 7.611 8.494 -0.883 1
1 338 . 16 1 1 A 45 45 GLY N N 32 101.530 109.841 -8.311 1
1 339 . 16 1 1 A 47 47 ASN HA H 34 4.480 5.076 -0.596 1
1 342 . 16 1 1 A 47 47 ASN CA C 34 56.260 51.379 4.881 1
1 343 . 16 1 1 A 47 47 ASN CB C 34 39.384 40.741 -1.357 1
1 344 . 16 1 1 A 49 49 MET HA H 36 4.646 4.404 0.242 1
1 350 . 16 1 1 A 49 49 MET C C 36 173.651 176.083 -2.432 1
1 351 . 16 1 1 A 49 49 MET CA C 36 55.323 56.467 -1.144 1
1 352 . 16 1 1 A 49 49 MET CB C 36 35.633 33.434 2.199 1
1 355 . 16 1 1 A 50 50 GLU H H 37 9.203 8.736 0.467 1
1 356 . 16 1 1 A 50 50 GLU HA H 37 4.650 4.650 0.000 1
1 361 . 16 1 1 A 50 50 GLU C C 37 177.008 177.486 -0.478 1
1 362 . 16 1 1 A 50 50 GLU CA C 37 54.385 54.968 -0.583 1
1 363 . 16 1 1 A 50 50 GLU CB C 37 33.758 31.738 2.020 1
1 365 . 16 1 1 A 50 50 GLU N N 37 123.229 124.848 -1.619 1
1 366 . 16 1 1 A 51 51 ASP H H 38 9.032 8.935 0.097 1
1 367 . 16 1 1 A 51 51 ASP HA H 38 4.149 4.307 -0.158 1
1 370 . 16 1 1 A 51 51 ASP C C 38 177.994 178.250 -0.256 1
1 371 . 16 1 1 A 51 51 ASP CA C 38 59.073 56.951 2.122 1
1 372 . 16 1 1 A 51 51 ASP CB C 38 43.134 39.837 3.297 1
1 373 . 16 1 1 A 51 51 ASP N N 38 122.717 121.738 0.979 1
1 374 . 16 1 1 A 52 52 GLN H H 39 8.950 8.253 0.697 1
1 375 . 16 1 1 A 52 52 GLN HA H 39 3.940 3.962 -0.022 1
1 378 . 16 1 1 A 52 52 GLN C C 39 177.817 178.431 -0.614 1
1 379 . 16 1 1 A 52 52 GLN CA C 39 59.073 59.078 -0.005 1
1 380 . 16 1 1 A 52 52 GLN CB C 39 28.133 28.477 -0.344 1
1 381 . 16 1 1 A 52 52 GLN N N 39 114.086 119.679 -5.593 1
1 382 . 16 1 1 A 53 53 ASP H H 40 7.214 8.208 -0.994 1
1 383 . 16 1 1 A 53 53 ASP HA H 40 4.370 4.520 -0.150 1
1 386 . 16 1 1 A 53 53 ASP C C 40 177.667 178.477 -0.810 1
1 387 . 16 1 1 A 53 53 ASP CA C 40 57.198 57.425 -0.227 1
1 388 . 16 1 1 A 53 53 ASP CB C 40 41.800 40.209 1.591 1
1 389 . 16 1 1 A 53 53 ASP N N 40 118.734 120.227 -1.493 1
1 390 . 16 1 1 A 54 54 LEU H H 41 7.180 8.183 -1.003 1
1 391 . 16 1 1 A 54 54 LEU HA H 41 3.990 3.954 0.036 1
1 400 . 16 1 1 A 54 54 LEU C C 41 178.204 178.422 -0.218 1
1 401 . 16 1 1 A 54 54 LEU CA C 41 56.260 58.630 -2.370 1
1 402 . 16 1 1 A 54 54 LEU CB C 41 41.259 41.829 -0.570 1
1 405 . 16 1 1 A 54 54 LEU N N 41 115.795 122.510 -6.715 1
1 406 . 16 1 1 A 55 55 LEU H H 42 7.823 8.328 -0.505 1
1 407 . 16 1 1 A 55 55 LEU HA H 42 3.920 4.058 -0.138 1
1 416 . 16 1 1 A 55 55 LEU C C 42 180.876 178.736 2.140 1
1 417 . 16 1 1 A 55 55 LEU CA C 42 58.135 57.796 0.339 1
1 418 . 16 1 1 A 55 55 LEU CB C 42 42.196 41.241 0.955 1
1 421 . 16 1 1 A 55 55 LEU N N 42 120.499 118.443 2.056 1
1 422 . 16 1 1 A 56 56 GLU H H 43 8.127 8.402 -0.275 1
1 423 . 16 1 1 A 56 56 GLU HA H 43 3.966 4.101 -0.135 1
1 428 . 16 1 1 A 56 56 GLU C C 43 178.801 179.082 -0.281 1
1 429 . 16 1 1 A 56 56 GLU CA C 43 60.010 59.047 0.963 1
1 430 . 16 1 1 A 56 56 GLU CB C 43 29.070 29.787 -0.717 1
1 432 . 16 1 1 A 56 56 GLU N N 43 120.955 120.403 0.552 1
1 433 . 16 1 1 A 57 57 ILE H H 44 7.504 7.673 -0.169 1
1 434 . 16 1 1 A 57 57 ILE HA H 44 4.524 3.973 0.551 1
1 444 . 16 1 1 A 57 57 ILE C C 44 175.691 176.534 -0.843 1
1 445 . 16 1 1 A 57 57 ILE CA C 44 61.886 63.740 -1.854 1
1 446 . 16 1 1 A 57 57 ILE CB C 44 37.300 38.445 -1.145 1
1 450 . 16 1 1 A 57 57 ILE N N 44 109.594 117.712 -8.118 1
1 451 . 16 1 1 A 58 58 GLY H H 45 7.724 7.287 0.437 1
1 452 . 16 1 1 A 58 58 GLY HA2 H 45 3.650 4.163 -0.513 1
1 453 . 16 1 1 A 58 58 GLY HA3 H 45 4.530 4.315 0.215 1
1 454 . 16 1 1 A 58 58 GLY C C 45 174.613 175.338 -0.725 1
1 455 . 16 1 1 A 58 58 GLY CA C 45 45.947 45.280 0.667 1
1 456 . 16 1 1 A 58 58 GLY N N 45 106.680 107.568 -0.888 1
1 457 . 16 1 1 A 59 59 ILE H H 46 8.180 8.024 0.156 1
1 458 . 16 1 1 A 59 59 ILE HA H 46 3.907 4.396 -0.489 1
1 468 . 16 1 1 A 59 59 ILE C C 46 174.235 176.666 -2.431 1
1 469 . 16 1 1 A 59 59 ILE CA C 46 60.948 61.826 -0.878 1
1 470 . 16 1 1 A 59 59 ILE CB C 46 33.980 38.719 -4.739 1
1 474 . 16 1 1 A 59 59 ILE N N 46 122.454 117.674 4.780 1
1 475 . 16 1 1 A 60 60 LEU H H 47 7.367 7.911 -0.544 1
1 476 . 16 1 1 A 60 60 LEU HA H 47 3.900 4.014 -0.114 1
1 479 . 16 1 1 A 60 60 LEU C C 47 177.753 178.700 -0.947 1
1 480 . 16 1 1 A 60 60 LEU CA C 47 56.260 57.945 -1.685 1
1 481 . 16 1 1 A 60 60 LEU CB C 47 42.196 41.535 0.661 1
1 482 . 16 1 1 A 60 60 LEU N N 47 125.835 123.271 2.564 1
1 483 . 16 1 1 A 63 63 GLY HA2 H 50 3.980 3.907 0.073 1
1 484 . 16 1 1 A 63 63 GLY HA3 H 50 3.950 3.912 0.038 1
1 485 . 16 1 1 A 63 63 GLY C C 50 177.130 174.413 2.717 1
1 486 . 16 1 1 A 63 63 GLY CA C 50 46.884 47.043 -0.159 1
1 487 . 16 1 1 A 64 64 HIS H H 51 7.926 7.935 -0.009 1
1 488 . 16 1 1 A 64 64 HIS HA H 51 4.451 4.600 -0.149 1
1 493 . 16 1 1 A 64 64 HIS C C 51 177.613 176.956 0.657 1
1 494 . 16 1 1 A 64 64 HIS CA C 51 57.198 56.311 0.887 1
1 495 . 16 1 1 A 64 64 HIS CB C 51 30.945 31.088 -0.143 1
1 498 . 16 1 1 A 64 64 HIS N N 51 122.284 120.471 1.813 1
1 499 . 16 1 1 A 65 65 ARG H H 52 8.105 8.188 -0.083 1
1 500 . 16 1 1 A 65 65 ARG HA H 52 3.685 3.729 -0.044 1
1 507 . 16 1 1 A 65 65 ARG C C 52 177.769 178.920 -1.151 1
1 508 . 16 1 1 A 65 65 ARG CA C 52 61.886 59.723 2.163 1
1 509 . 16 1 1 A 65 65 ARG CB C 52 30.945 30.003 0.942 1
1 511 . 16 1 1 A 65 65 ARG N N 52 117.775 118.477 -0.702 1
1 513 . 16 1 1 A 66 66 GLN H H 53 8.090 8.081 0.009 1
1 514 . 16 1 1 A 66 66 GLN HA H 53 3.940 3.933 0.007 1
1 519 . 16 1 1 A 66 66 GLN C C 53 178.583 178.417 0.166 1
1 520 . 16 1 1 A 66 66 GLN CA C 53 59.073 59.230 -0.157 1
1 521 . 16 1 1 A 66 66 GLN CB C 53 28.133 28.212 -0.079 1
1 523 . 16 1 1 A 66 66 GLN N N 53 116.452 118.724 -2.272 1
1 524 . 16 1 1 A 67 67 ARG H H 54 7.845 7.776 0.069 1
1 525 . 16 1 1 A 67 67 ARG HA H 54 4.010 3.859 0.151 1
1 528 . 16 1 1 A 67 67 ARG C C 54 179.766 178.838 0.928 1
1 529 . 16 1 1 A 67 67 ARG CA C 54 59.073 59.042 0.031 1
1 530 . 16 1 1 A 67 67 ARG CB C 54 30.720 29.703 1.017 1
1 532 . 16 1 1 A 67 67 ARG N N 54 119.275 119.506 -0.231 1
1 533 . 16 1 1 A 68 68 ILE H H 55 8.032 7.643 0.389 1
1 534 . 16 1 1 A 68 68 ILE HA H 55 3.495 3.494 0.001 1
1 544 . 16 1 1 A 68 68 ILE C C 55 177.108 178.828 -1.720 1
1 545 . 16 1 1 A 68 68 ILE CA C 55 66.230 64.588 1.642 1
1 546 . 16 1 1 A 68 68 ILE CB C 55 38.020 37.147 0.873 1
1 550 . 16 1 1 A 68 68 ILE N N 55 121.152 120.241 0.911 1
1 551 . 16 1 1 A 69 69 LEU H H 56 8.490 8.182 0.308 1
1 552 . 16 1 1 A 69 69 LEU HA H 56 4.010 3.760 0.250 1
1 561 . 16 1 1 A 69 69 LEU C C 56 179.917 178.863 1.054 1
1 562 . 16 1 1 A 69 69 LEU CA C 56 58.135 58.149 -0.014 1
1 563 . 16 1 1 A 69 69 LEU CB C 56 41.259 41.570 -0.311 1
1 566 . 16 1 1 A 69 69 LEU N N 56 119.072 121.386 -2.314 1
1 567 . 16 1 1 A 70 70 GLN H H 57 8.327 8.659 -0.332 1
1 568 . 16 1 1 A 70 70 GLN HA H 57 4.100 3.900 0.200 1
1 573 . 16 1 1 A 70 70 GLN C C 57 178.798 177.932 0.866 1
1 574 . 16 1 1 A 70 70 GLN CA C 57 59.073 58.864 0.209 1
1 575 . 16 1 1 A 70 70 GLN CB C 57 28.133 28.602 -0.469 1
1 577 . 16 1 1 A 70 70 GLN N N 57 118.172 118.237 -0.065 1
1 578 . 16 1 1 A 71 71 ALA H H 58 7.810 8.108 -0.298 1
1 579 . 16 1 1 A 71 71 ALA HA H 58 4.320 4.100 0.220 1
1 583 . 16 1 1 A 71 71 ALA C C 58 172.232 179.869 -7.637 1
1 584 . 16 1 1 A 71 71 ALA CA C 58 55.323 55.194 0.129 1
1 585 . 16 1 1 A 71 71 ALA CB C 58 19.720 18.673 1.047 1
1 586 . 16 1 1 A 71 71 ALA N N 58 122.536 121.669 0.867 1
1 587 . 16 1 1 A 72 72 ILE H H 59 8.840 8.313 0.527 1
1 588 . 16 1 1 A 72 72 ILE HA H 59 4.030 4.003 0.027 1
1 598 . 16 1 1 A 72 72 ILE C C 59 178.678 177.746 0.932 1
1 599 . 16 1 1 A 72 72 ILE CA C 59 64.698 63.349 1.349 1
1 600 . 16 1 1 A 72 72 ILE CB C 59 37.850 37.330 0.520 1
1 604 . 16 1 1 A 72 72 ILE N N 59 118.111 118.487 -0.376 1
1 605 . 16 1 1 A 73 73 GLN H H 60 7.547 8.233 -0.686 1
1 606 . 16 1 1 A 73 73 GLN HA H 60 4.121 4.016 0.105 1
1 611 . 16 1 1 A 73 73 GLN C C 60 176.556 177.923 -1.367 1
1 612 . 16 1 1 A 73 73 GLN CA C 60 58.135 59.047 -0.912 1
1 613 . 16 1 1 A 73 73 GLN CB C 60 28.300 28.162 0.138 1
1 615 . 16 1 1 A 73 73 GLN N N 60 119.094 121.500 -2.406 1
1 616 . 16 1 1 A 74 74 LEU H H 61 7.350 8.020 -0.670 1
1 617 . 16 1 1 A 74 74 LEU HA H 61 4.408 4.179 0.229 1
1 626 . 16 1 1 A 74 74 LEU C C 61 177.960 177.095 0.865 1
1 627 . 16 1 1 A 74 74 LEU CA C 61 54.900 57.640 -2.740 1
1 628 . 16 1 1 A 74 74 LEU CB C 61 42.196 41.909 0.287 1
1 631 . 16 1 1 A 74 74 LEU N N 61 115.853 119.363 -3.510 1
1 632 . 16 1 1 A 75 75 LEU H H 62 7.358 8.004 -0.646 1
1 633 . 16 1 1 A 75 75 LEU HA H 62 4.530 4.096 0.434 1
1 642 . 16 1 1 A 75 75 LEU C C 62 177.035 176.297 0.738 1
1 643 . 16 1 1 A 75 75 LEU CA C 62 53.200 55.724 -2.524 1
1 644 . 16 1 1 A 75 75 LEU CB C 62 40.700 40.731 -0.031 1
1 647 . 16 1 1 A 75 75 LEU N N 62 121.010 119.852 1.158 1
1 648 . 16 1 1 A 76 76 PRO HA H 63 4.382 4.557 -0.175 1
1 655 . 16 1 1 A 76 76 PRO CB C 63 31.883 31.768 0.115 1
1 657 . 16 1 1 A 77 77 LYS H H 64 8.418 9.002 -0.584 1
1 658 . 16 1 1 A 77 77 LYS HA H 64 4.140 4.265 -0.125 1
1 663 . 16 1 1 A 77 77 LYS C C 64 177.122 178.675 -1.553 1
1 664 . 16 1 1 A 77 77 LYS CA C 64 56.260 58.493 -2.233 1
1 665 . 16 1 1 A 77 77 LYS CB C 64 33.340 32.407 0.933 1
1 668 . 16 1 1 A 77 77 LYS N N 64 121.932 125.152 -3.220 1
1 669 . 16 1 1 A 78 78 MET H H 65 8.550 8.325 0.225 1
1 670 . 16 1 1 A 78 78 MET HA H 65 4.304 4.080 0.224 1
1 676 . 16 1 1 A 78 78 MET C C 65 176.105 178.960 -2.855 1
1 677 . 16 1 1 A 78 78 MET CA C 65 56.260 58.955 -2.695 1
1 678 . 16 1 1 A 78 78 MET CB C 65 32.821 32.767 0.054 1
1 680 . 16 1 1 A 78 78 MET N N 65 123.498 118.379 5.119 1
1 681 . 16 1 1 A 79 79 ARG H H 66 8.731 8.069 0.662 1
1 682 . 16 1 1 A 79 79 ARG C C 66 173.577 176.590 -3.013 1
1 683 . 16 1 1 A 79 79 ARG CA C 66 53.447 61.281 -7.834 1
1 684 . 16 1 1 A 79 79 ARG CB C 66 30.008 28.395 1.613 1
1 685 . 16 1 1 A 79 79 ARG N N 66 127.355 118.936 8.419 1
1 686 . 16 1 1 A 80 80 PRO HA H 67 4.780 4.404 0.376 1
1 693 . 16 1 1 A 80 80 PRO C C 67 177.043 176.075 0.968 1
1 694 . 16 1 1 A 80 80 PRO CA C 67 61.886 62.339 -0.453 1
1 695 . 16 1 1 A 80 80 PRO CB C 67 32.821 33.239 -0.418 1
1 698 . 16 1 1 A 81 81 ILE H H 68 8.580 8.286 0.294 1
1 699 . 16 1 1 A 81 81 ILE HA H 68 4.040 4.519 -0.479 1
1 709 . 16 1 1 A 81 81 ILE C C 68 176.831 176.018 0.813 1
1 710 . 16 1 1 A 81 81 ILE CA C 68 62.823 60.859 1.964 1
1 711 . 16 1 1 A 81 81 ILE CB C 68 38.580 40.040 -1.460 1
1 715 . 16 1 1 A 81 81 ILE N N 68 118.491 116.648 1.843 1
1 716 . 16 1 1 A 82 82 GLY H H 69 8.602 7.795 0.807 1
1 717 . 16 1 1 A 82 82 GLY CA C 69 45.009 45.843 -0.834 1
1 718 . 16 1 1 A 82 82 GLY N N 69 111.377 111.563 -0.186 1
1 721 . 16 1 1 A 84 84 ASP HA H 71 4.490 5.029 -0.539 1
1 724 . 16 1 1 A 84 84 ASP CA C 71 54.385 51.948 2.437 1
1 725 . 16 1 1 A 84 84 ASP CB C 71 40.321 42.490 -2.169 1
1 726 . 16 1 1 A 85 85 GLY H H 72 8.054 8.408 -0.354 1
1 727 . 16 1 1 A 85 85 GLY HA2 H 72 4.040 4.094 -0.054 1
1 728 . 16 1 1 A 85 85 GLY HA3 H 72 3.750 4.113 -0.363 1
1 729 . 16 1 1 A 85 85 GLY C C 72 173.474 173.269 0.205 1
1 730 . 16 1 1 A 85 85 GLY CA C 72 45.009 44.175 0.834 1
1 731 . 16 1 1 A 85 85 GLY N N 72 108.038 106.355 1.683 1
1 732 . 16 1 1 A 86 86 ALA H H 73 7.858 8.395 -0.537 1
1 733 . 16 1 1 A 86 86 ALA HA H 73 4.370 5.063 -0.693 1
1 737 . 16 1 1 A 86 86 ALA CA C 73 51.990 51.517 0.473 1
1 738 . 16 1 1 A 86 86 ALA CB C 73 19.220 23.248 -4.028 1
1 739 . 16 1 1 A 86 86 ALA N N 73 123.819 122.964 0.855 1
1 742 . 16 1 1 A 90 90 SER H H 77 7.839 7.903 -0.064 1
1 743 . 16 1 1 A 90 90 SER HA H 77 4.770 4.892 -0.122 1
1 746 . 16 1 1 A 90 90 SER N N 77 115.163 116.334 -1.171 1
1 747 . 16 1 1 A 91 91 VAL H H 78 8.578 9.082 -0.504 1
1 748 . 16 1 1 A 91 91 VAL HA H 78 3.981 3.981 0.000 1
1 756 . 16 1 1 A 91 91 VAL C C 78 177.480 177.395 0.085 1
1 757 . 16 1 1 A 91 91 VAL CA C 78 67.060 66.365 0.695 1
1 758 . 16 1 1 A 91 91 VAL CB C 78 32.500 31.671 0.829 1
1 761 . 16 1 1 A 91 91 VAL N N 78 123.481 123.451 0.030 1
1 762 . 16 1 1 A 92 92 ALA H H 79 8.607 8.347 0.260 1
1 763 . 16 1 1 A 92 92 ALA HA H 79 4.113 3.953 0.160 1
1 767 . 16 1 1 A 92 92 ALA C C 79 179.868 179.076 0.792 1
1 768 . 16 1 1 A 92 92 ALA CA C 79 54.890 55.746 -0.856 1
1 769 . 16 1 1 A 92 92 ALA CB C 79 18.790 18.428 0.362 1
1 770 . 16 1 1 A 92 92 ALA N N 79 120.334 122.447 -2.113 1
1 771 . 16 1 1 A 93 93 GLU H H 80 7.886 8.266 -0.380 1
1 772 . 16 1 1 A 93 93 GLU HA H 80 4.010 4.008 0.002 1
1 777 . 16 1 1 A 93 93 GLU C C 80 179.719 178.694 1.025 1
1 778 . 16 1 1 A 93 93 GLU CA C 80 59.073 59.201 -0.128 1
1 779 . 16 1 1 A 93 93 GLU CB C 80 30.630 29.490 1.140 1
1 781 . 16 1 1 A 93 93 GLU N N 80 117.643 118.659 -1.016 1
1 782 . 16 1 1 A 94 94 TRP H H 81 8.299 8.030 0.269 1
1 783 . 16 1 1 A 94 94 TRP HA H 81 4.251 4.293 -0.042 1
1 792 . 16 1 1 A 94 94 TRP C C 81 178.772 178.004 0.768 1
1 793 . 16 1 1 A 94 94 TRP CA C 81 60.010 61.268 -1.258 1
1 794 . 16 1 1 A 94 94 TRP CB C 81 27.650 29.823 -2.173 1
1 800 . 16 1 1 A 94 94 TRP N N 81 122.545 122.410 0.135 1
1 802 . 16 1 1 A 95 95 LEU H H 82 8.505 8.738 -0.233 1
1 803 . 16 1 1 A 95 95 LEU HA H 82 2.880 2.872 0.008 1
1 812 . 16 1 1 A 95 95 LEU C C 82 180.235 178.781 1.454 1
1 813 . 16 1 1 A 95 95 LEU CA C 82 57.400 56.964 0.436 1
1 814 . 16 1 1 A 95 95 LEU CB C 82 40.321 40.893 -0.572 1
1 817 . 16 1 1 A 95 95 LEU N N 82 121.110 119.393 1.717 1
1 818 . 16 1 1 A 96 96 ASP H H 83 8.185 8.275 -0.090 1
1 819 . 16 1 1 A 96 96 ASP HA H 83 4.280 4.364 -0.084 1
1 822 . 16 1 1 A 96 96 ASP C C 83 175.224 177.939 -2.715 1
1 823 . 16 1 1 A 96 96 ASP CA C 83 57.310 56.711 0.599 1
1 824 . 16 1 1 A 96 96 ASP CB C 83 40.321 41.464 -1.143 1
1 825 . 16 1 1 A 96 96 ASP N N 83 119.082 120.331 -1.249 1
1 826 . 16 1 1 A 97 97 SER H H 84 7.989 8.106 -0.117 1
1 827 . 16 1 1 A 97 97 SER HA H 84 4.250 4.101 0.149 1
1 830 . 16 1 1 A 97 97 SER C C 84 175.346 175.342 0.004 1
1 831 . 16 1 1 A 97 97 SER CA C 84 60.948 60.928 0.020 1
1 832 . 16 1 1 A 97 97 SER CB C 84 63.370 62.906 0.464 1
1 833 . 16 1 1 A 97 97 SER N N 84 117.579 113.597 3.982 1
1 834 . 16 1 1 A 98 98 ILE H H 85 6.862 7.549 -0.687 1
1 835 . 16 1 1 A 98 98 ILE HA H 85 4.550 4.057 0.493 1
1 843 . 16 1 1 A 98 98 ILE C C 85 173.308 175.299 -1.991 1
1 844 . 16 1 1 A 98 98 ILE CA C 85 60.948 60.673 0.275 1
1 845 . 16 1 1 A 98 98 ILE CB C 85 37.760 37.719 0.041 1
1 848 . 16 1 1 A 98 98 ILE N N 85 113.733 117.869 -4.136 1
1 849 . 16 1 1 A 99 99 GLU H H 86 7.705 7.602 0.103 1
1 850 . 16 1 1 A 99 99 GLU HA H 86 4.280 3.941 0.339 1
1 853 . 16 1 1 A 99 99 GLU C C 86 175.224 175.554 -0.330 1
1 854 . 16 1 1 A 99 99 GLU CA C 86 56.260 57.178 -0.918 1
1 855 . 16 1 1 A 99 99 GLU CB C 86 26.258 27.343 -1.085 1
1 857 . 16 1 1 A 99 99 GLU N N 86 115.493 120.261 -4.768 1
1 858 . 16 1 1 A 100 100 LEU H H 87 7.989 8.245 -0.256 1
1 859 . 16 1 1 A 100 100 LEU HA H 87 4.220 4.168 0.052 1
1 868 . 16 1 1 A 100 100 LEU C C 87 176.965 177.855 -0.890 1
1 869 . 16 1 1 A 100 100 LEU CA C 87 52.510 56.642 -4.132 1
1 870 . 16 1 1 A 100 100 LEU CB C 87 42.196 42.271 -0.075 1
1 873 . 16 1 1 A 100 100 LEU N N 87 117.579 119.453 -1.874 1
1 874 . 16 1 1 A 101 101 GLY H H 88 8.503 7.847 0.656 1
1 875 . 16 1 1 A 101 101 GLY CA C 88 46.884 45.487 1.397 1
1 876 . 16 1 1 A 101 101 GLY N N 88 107.794 107.708 0.086 1
1 877 . 16 1 1 A 102 102 ASP HA H 89 4.431 4.248 0.183 1
1 880 . 16 1 1 A 102 102 ASP C C 89 178.075 178.234 -0.159 1
1 881 . 16 1 1 A 102 102 ASP CA C 89 57.198 56.980 0.218 1
1 882 . 16 1 1 A 102 102 ASP CB C 89 40.321 40.386 -0.065 1
1 883 . 16 1 1 A 103 103 TYR H H 90 7.899 8.043 -0.144 1
1 884 . 16 1 1 A 103 103 TYR HA H 90 4.940 4.411 0.529 1
1 889 . 16 1 1 A 103 103 TYR C C 90 175.527 178.506 -2.979 1
1 890 . 16 1 1 A 103 103 TYR CA C 90 58.135 60.519 -2.384 1
1 891 . 16 1 1 A 103 103 TYR CB C 90 38.446 37.203 1.243 1
1 894 . 16 1 1 A 103 103 TYR N N 90 115.595 119.983 -4.388 1
1 895 . 16 1 1 A 104 104 THR H H 91 7.971 8.287 -0.316 1
1 896 . 16 1 1 A 104 104 THR HA H 91 4.234 3.971 0.263 1
1 901 . 16 1 1 A 104 104 THR C C 91 175.905 176.516 -0.611 1
1 902 . 16 1 1 A 104 104 THR CA C 91 68.449 67.038 1.411 1
1 904 . 16 1 1 A 104 104 THR N N 91 118.867 116.578 2.289 1
1 905 . 16 1 1 A 105 105 LYS H H 92 8.555 7.839 0.716 1
1 906 . 16 1 1 A 105 105 LYS HA H 92 3.940 4.075 -0.135 1
1 912 . 16 1 1 A 105 105 LYS C C 92 177.310 178.635 -1.325 1
1 913 . 16 1 1 A 105 105 LYS CA C 92 60.948 59.434 1.514 1
1 914 . 16 1 1 A 105 105 LYS CB C 92 31.883 32.391 -0.508 1
1 917 . 16 1 1 A 105 105 LYS N N 92 119.259 120.804 -1.545 1
1 918 . 16 1 1 A 106 106 ALA H H 93 7.920 8.136 -0.216 1
1 919 . 16 1 1 A 106 106 ALA HA H 93 4.128 4.212 -0.084 1
1 923 . 16 1 1 A 106 106 ALA C C 93 180.972 180.319 0.653 1
1 924 . 16 1 1 A 106 106 ALA CA C 93 55.070 55.012 0.058 1
1 925 . 16 1 1 A 106 106 ALA CB C 93 17.750 18.414 -0.664 1
1 926 . 16 1 1 A 106 106 ALA N N 93 120.398 121.369 -0.971 1
1 927 . 16 1 1 A 107 107 PHE H H 94 8.136 8.573 -0.437 1
1 928 . 16 1 1 A 107 107 PHE HA H 94 4.190 4.579 -0.389 1
1 934 . 16 1 1 A 107 107 PHE C C 94 177.955 178.310 -0.355 1
1 935 . 16 1 1 A 107 107 PHE CA C 94 63.761 61.513 2.248 1
1 936 . 16 1 1 A 107 107 PHE CB C 94 38.446 39.193 -0.747 1
1 940 . 16 1 1 A 107 107 PHE N N 94 117.119 116.224 0.895 1
1 941 . 16 1 1 A 108 108 LEU H H 95 8.351 8.665 -0.314 1
1 942 . 16 1 1 A 108 108 LEU HA H 95 3.889 3.995 -0.106 1
1 951 . 16 1 1 A 108 108 LEU C C 95 182.043 179.366 2.677 1
1 952 . 16 1 1 A 108 108 LEU CA C 95 59.073 58.572 0.501 1
1 953 . 16 1 1 A 108 108 LEU CB C 95 41.259 42.252 -0.993 1
1 956 . 16 1 1 A 108 108 LEU N N 95 118.450 119.792 -1.342 1
1 957 . 16 1 1 A 109 109 ILE H H 96 8.992 8.122 0.870 1
1 958 . 16 1 1 A 109 109 ILE HA H 96 4.069 3.855 0.214 1
1 968 . 16 1 1 A 109 109 ILE C C 96 177.094 177.693 -0.599 1
1 969 . 16 1 1 A 109 109 ILE CA C 96 63.761 64.418 -0.657 1
1 970 . 16 1 1 A 109 109 ILE CB C 96 37.509 37.733 -0.224 1
1 974 . 16 1 1 A 109 109 ILE N N 96 118.177 115.060 3.117 1
1 975 . 16 1 1 A 110 110 ASN H H 97 7.067 8.064 -0.997 1
1 976 . 16 1 1 A 110 110 ASN HA H 97 4.797 4.682 0.115 1
1 981 . 16 1 1 A 110 110 ASN C C 97 173.595 175.314 -1.719 1
1 982 . 16 1 1 A 110 110 ASN CA C 97 54.385 53.321 1.064 1
1 983 . 16 1 1 A 110 110 ASN CB C 97 40.321 38.729 1.592 1
1 984 . 16 1 1 A 110 110 ASN N N 97 116.407 119.571 -3.164 1
1 986 . 16 1 1 A 111 111 GLY H H 98 7.681 8.011 -0.330 1
1 987 . 16 1 1 A 111 111 GLY HA2 H 98 4.080 3.921 0.159 1
1 988 . 16 1 1 A 111 111 GLY HA3 H 98 3.640 4.012 -0.372 1
1 989 . 16 1 1 A 111 111 GLY C C 98 174.552 174.272 0.280 1
1 990 . 16 1 1 A 111 111 GLY CA C 98 45.947 44.853 1.094 1
1 991 . 16 1 1 A 111 111 GLY N N 98 104.440 105.707 -1.267 1
1 992 . 16 1 1 A 112 112 TYR H H 99 8.427 8.307 0.120 1
1 993 . 16 1 1 A 112 112 TYR HA H 99 4.661 4.708 -0.047 1
1 998 . 16 1 1 A 112 112 TYR C C 99 174.425 175.626 -1.201 1
1 999 . 16 1 1 A 112 112 TYR CA C 99 57.198 58.227 -1.029 1
1 1000 . 16 1 1 A 112 112 TYR CB C 99 36.571 38.093 -1.522 1
1 1003 . 16 1 1 A 112 112 TYR N N 99 122.830 120.094 2.736 1
1 1004 . 16 1 1 A 113 113 THR H H 100 7.166 8.326 -1.160 1
1 1005 . 16 1 1 A 113 113 THR HA H 100 4.248 4.546 -0.298 1
1 1009 . 16 1 1 A 113 113 THR C C 100 174.897 174.403 0.494 1
1 1010 . 16 1 1 A 113 113 THR CA C 100 62.290 63.042 -0.752 1
1 1011 . 16 1 1 A 113 113 THR CB C 100 68.970 70.212 -1.242 1
1 1013 . 16 1 1 A 113 113 THR N N 100 104.304 119.455 -15.151 1
1 1014 . 16 1 1 A 114 114 SER H H 101 7.695 7.963 -0.268 1
1 1015 . 16 1 1 A 114 114 SER C C 101 174.372 174.226 0.146 1
1 1016 . 16 1 1 A 114 114 SER CA C 101 56.260 57.227 -0.967 1
1 1017 . 16 1 1 A 114 114 SER CB C 101 65.636 65.972 -0.336 1
1 1018 . 16 1 1 A 114 114 SER N N 101 115.613 116.279 -0.666 1
1 1023 . 16 1 1 A 116 116 ASP HA H 103 4.260 4.333 -0.073 1
1 1026 . 16 1 1 A 116 116 ASP CA C 103 57.198 57.706 -0.508 1
1 1027 . 16 1 1 A 116 116 ASP CB C 103 40.321 40.247 0.074 1
1 1028 . 16 1 1 A 117 117 LEU H H 104 7.345 7.864 -0.519 1
1 1029 . 16 1 1 A 117 117 LEU HA H 104 4.290 3.994 0.296 1
1 1038 . 16 1 1 A 117 117 LEU C C 104 178.488 178.759 -0.271 1
1 1039 . 16 1 1 A 117 117 LEU CA C 104 56.260 57.916 -1.656 1
1 1040 . 16 1 1 A 117 117 LEU CB C 104 42.196 41.237 0.959 1
1 1043 . 16 1 1 A 117 117 LEU N N 104 117.878 118.372 -0.494 1
1 1044 . 16 1 1 A 118 118 LEU H H 105 7.514 7.992 -0.478 1
1 1045 . 16 1 1 A 118 118 LEU HA H 105 4.210 4.168 0.042 1
1 1054 . 16 1 1 A 118 118 LEU C C 105 177.002 177.713 -0.711 1
1 1055 . 16 1 1 A 118 118 LEU CA C 105 55.323 56.972 -1.649 1
1 1056 . 16 1 1 A 118 118 LEU CB C 105 42.196 41.556 0.640 1
1 1059 . 16 1 1 A 118 118 LEU N N 105 119.094 119.080 0.014 1
1 1060 . 16 1 1 A 120 120 LYS HA H 107 4.340 4.575 -0.235 1
1 1063 . 16 1 1 A 120 120 LYS C C 107 176.603 175.925 0.678 1
1 1064 . 16 1 1 A 120 120 LYS CA C 107 55.323 55.158 0.165 1
1 1065 . 16 1 1 A 120 120 LYS CB C 107 31.883 33.263 -1.380 1
1 1068 . 16 1 1 A 121 121 ILE H H 108 7.539 7.574 -0.035 1
1 1069 . 16 1 1 A 121 121 ILE HA H 108 3.987 5.029 -1.042 1
1 1079 . 16 1 1 A 121 121 ILE C C 108 173.247 175.261 -2.014 1
1 1080 . 16 1 1 A 121 121 ILE CA C 108 62.823 58.755 4.068 1
1 1081 . 16 1 1 A 121 121 ILE CB C 108 38.446 41.617 -3.171 1
1 1085 . 16 1 1 A 121 121 ILE N N 108 122.417 116.383 6.034 1
1 1086 . 16 1 1 A 122 122 ALA H H 109 8.290 8.021 0.269 1
1 1087 . 16 1 1 A 122 122 ALA HA H 109 3.970 4.637 -0.667 1
1 1091 . 16 1 1 A 122 122 ALA C C 109 178.318 178.365 -0.047 1
1 1092 . 16 1 1 A 122 122 ALA CA C 109 50.150 49.732 0.418 1
1 1093 . 16 1 1 A 122 122 ALA CB C 109 21.630 20.984 0.646 1
1 1094 . 16 1 1 A 122 122 ALA N N 109 127.784 124.293 3.491 1
1 1095 . 16 1 1 A 123 123 GLU HA H 110 3.707 3.985 -0.278 1
1 1099 . 16 1 1 A 123 123 GLU C C 110 178.290 178.881 -0.591 1
1 1100 . 16 1 1 A 123 123 GLU CA C 110 60.948 59.748 1.200 1
1 1101 . 16 1 1 A 123 123 GLU CB C 110 29.070 29.556 -0.486 1
1 1102 . 16 1 1 A 124 124 VAL H H 111 8.333 8.220 0.113 1
1 1103 . 16 1 1 A 124 124 VAL HA H 111 3.850 3.770 0.080 1
1 1111 . 16 1 1 A 124 124 VAL C C 111 177.406 177.621 -0.215 1
1 1112 . 16 1 1 A 124 124 VAL CA C 111 65.636 65.116 0.520 1
1 1113 . 16 1 1 A 124 124 VAL CB C 111 30.730 31.197 -0.467 1
1 1116 . 16 1 1 A 124 124 VAL N N 111 114.438 120.637 -6.199 1
1 1117 . 16 1 1 A 125 125 GLU H H 112 7.442 8.234 -0.792 1
1 1118 . 16 1 1 A 125 125 GLU HA H 112 4.152 4.083 0.069 1
1 1123 . 16 1 1 A 125 125 GLU C C 112 179.982 179.298 0.684 1
1 1124 . 16 1 1 A 125 125 GLU CA C 112 60.010 59.320 0.690 1
1 1125 . 16 1 1 A 125 125 GLU CB C 112 30.008 29.423 0.585 1
1 1127 . 16 1 1 A 125 125 GLU N N 112 121.032 121.862 -0.830 1
1 1128 . 16 1 1 A 126 126 LEU H H 113 7.666 8.030 -0.364 1
1 1129 . 16 1 1 A 126 126 LEU HA H 113 3.846 4.072 -0.226 1
1 1138 . 16 1 1 A 126 126 LEU C C 113 176.991 178.797 -1.806 1
1 1139 . 16 1 1 A 126 126 LEU CA C 113 58.135 57.847 0.288 1
1 1140 . 16 1 1 A 126 126 LEU CB C 113 41.259 41.797 -0.538 1
1 1143 . 16 1 1 A 126 126 LEU N N 113 118.731 121.899 -3.168 1
1 1144 . 16 1 1 A 127 127 ILE H H 114 7.781 7.820 -0.039 1
1 1145 . 16 1 1 A 127 127 ILE HA H 114 3.502 3.892 -0.390 1
1 1153 . 16 1 1 A 127 127 ILE C C 114 178.195 177.151 1.044 1
1 1154 . 16 1 1 A 127 127 ILE CA C 114 65.636 62.904 2.732 1
1 1155 . 16 1 1 A 127 127 ILE CB C 114 40.321 37.865 2.456 1
1 1159 . 16 1 1 A 127 127 ILE N N 114 115.084 118.569 -3.485 1
1 1160 . 16 1 1 A 128 128 ASN H H 115 8.470 8.174 0.296 1
1 1161 . 16 1 1 A 128 128 ASN HA H 115 4.502 4.630 -0.128 1
1 1166 . 16 1 1 A 128 128 ASN C C 115 176.295 175.874 0.421 1
1 1167 . 16 1 1 A 128 128 ASN CA C 115 56.260 54.799 1.461 1
1 1168 . 16 1 1 A 128 128 ASN CB C 115 39.384 39.048 0.336 1
1 1169 . 16 1 1 A 128 128 ASN N N 115 115.158 119.291 -4.133 1
1 1171 . 16 1 1 A 129 129 VAL H H 116 8.116 7.574 0.542 1
1 1172 . 16 1 1 A 129 129 VAL HA H 116 4.090 4.070 0.020 1
1 1180 . 16 1 1 A 129 129 VAL C C 116 176.740 177.141 -0.401 1
1 1181 . 16 1 1 A 129 129 VAL CA C 116 64.400 64.304 0.096 1
1 1182 . 16 1 1 A 129 129 VAL CB C 116 32.050 33.122 -1.072 1
1 1185 . 16 1 1 A 129 129 VAL N N 116 118.698 116.969 1.729 1
1 1186 . 16 1 1 A 130 130 LEU H H 117 7.294 7.852 -0.558 1
1 1187 . 16 1 1 A 130 130 LEU HA H 117 3.970 4.279 -0.309 1
1 1196 . 16 1 1 A 130 130 LEU C C 117 175.127 176.614 -1.487 1
1 1197 . 16 1 1 A 130 130 LEU CA C 117 56.260 54.922 1.338 1
1 1198 . 16 1 1 A 130 130 LEU CB C 117 41.259 42.321 -1.062 1
1 1201 . 16 1 1 A 130 130 LEU N N 117 116.201 118.774 -2.573 1
1 1202 . 16 1 1 A 131 131 LYS H H 118 6.594 8.108 -1.514 1
1 1203 . 16 1 1 A 131 131 LYS HA H 118 3.980 4.336 -0.356 1
1 1208 . 16 1 1 A 131 131 LYS C C 118 175.589 175.310 0.279 1
1 1209 . 16 1 1 A 131 131 LYS CA C 118 56.260 57.426 -1.166 1
1 1210 . 16 1 1 A 131 131 LYS CB C 118 28.133 30.801 -2.668 1
1 1212 . 16 1 1 A 131 131 LYS N N 118 111.172 118.795 -7.623 1
1 1213 . 16 1 1 A 132 132 ILE H H 119 8.245 7.999 0.246 1
1 1214 . 16 1 1 A 132 132 ILE HA H 119 4.090 4.438 -0.348 1
1 1224 . 16 1 1 A 132 132 ILE C C 119 175.161 175.828 -0.667 1
1 1225 . 16 1 1 A 132 132 ILE CA C 119 60.010 61.274 -1.264 1
1 1226 . 16 1 1 A 132 132 ILE CB C 119 35.633 36.563 -0.930 1
1 1230 . 16 1 1 A 132 132 ILE N N 119 119.484 120.015 -0.531 1
1 1231 . 16 1 1 A 133 133 ASN H H 120 8.054 9.094 -1.040 1
1 1232 . 16 1 1 A 133 133 ASN HA H 120 4.350 4.778 -0.428 1
1 1235 . 16 1 1 A 133 133 ASN C C 120 175.136 175.694 -0.558 1
1 1236 . 16 1 1 A 133 133 ASN CA C 120 54.385 54.764 -0.379 1
1 1237 . 16 1 1 A 133 133 ASN CB C 120 39.384 39.396 -0.012 1
1 1238 . 16 1 1 A 133 133 ASN N N 120 124.670 127.253 -2.583 1
1 1239 . 16 1 1 A 134 134 LEU H H 121 7.517 7.312 0.205 1
1 1240 . 16 1 1 A 134 134 LEU HA H 121 4.678 4.056 0.622 1
1 1249 . 16 1 1 A 134 134 LEU C C 121 178.051 177.190 0.861 1
1 1250 . 16 1 1 A 134 134 LEU CA C 121 53.447 55.960 -2.513 1
1 1251 . 16 1 1 A 134 134 LEU CB C 121 41.259 42.963 -1.704 1
1 1254 . 16 1 1 A 134 134 LEU N N 121 119.918 119.367 0.551 1
1 1255 . 16 1 1 A 135 135 ILE H H 122 9.389 8.280 1.109 1
1 1256 . 16 1 1 A 135 135 ILE HA H 122 3.540 3.668 -0.128 1
1 1266 . 16 1 1 A 135 135 ILE C C 122 176.425 177.585 -1.160 1
1 1267 . 16 1 1 A 135 135 ILE CA C 122 65.636 65.081 0.555 1
1 1268 . 16 1 1 A 135 135 ILE CB C 122 38.446 38.088 0.358 1
1 1272 . 16 1 1 A 135 135 ILE N N 122 129.949 127.074 2.875 1
1 1273 . 16 1 1 A 136 136 GLY H H 123 8.675 8.473 0.202 1
1 1274 . 16 1 1 A 136 136 GLY HA2 H 123 2.650 2.963 -0.313 1
1 1275 . 16 1 1 A 136 136 GLY HA3 H 123 2.060 3.481 -1.421 1
1 1276 . 16 1 1 A 136 136 GLY C C 123 176.854 176.236 0.618 1
1 1277 . 16 1 1 A 136 136 GLY CA C 123 45.500 46.975 -1.475 1
1 1278 . 16 1 1 A 136 136 GLY N N 123 106.314 107.899 -1.585 1
1 1279 . 16 1 1 A 137 137 HIS H H 124 6.869 7.756 -0.887 1
1 1280 . 16 1 1 A 137 137 HIS HA H 124 4.558 4.496 0.062 1
1 1285 . 16 1 1 A 137 137 HIS C C 124 176.977 177.482 -0.505 1
1 1286 . 16 1 1 A 137 137 HIS CA C 124 57.198 58.905 -1.707 1
1 1287 . 16 1 1 A 137 137 HIS CB C 124 30.945 30.146 0.799 1
1 1290 . 16 1 1 A 137 137 HIS N N 124 118.865 119.945 -1.080 1
1 1291 . 16 1 1 A 138 138 ARG H H 125 7.730 8.376 -0.646 1
1 1292 . 16 1 1 A 138 138 ARG HA H 125 3.770 3.878 -0.108 1
1 1299 . 16 1 1 A 138 138 ARG C C 125 178.288 178.478 -0.190 1
1 1300 . 16 1 1 A 138 138 ARG CA C 125 61.886 59.306 2.580 1
1 1301 . 16 1 1 A 138 138 ARG CB C 125 30.945 29.802 1.143 1
1 1304 . 16 1 1 A 138 138 ARG N N 125 118.149 119.439 -1.290 1
1 1306 . 16 1 1 A 139 139 LYS H H 126 8.679 8.274 0.405 1
1 1307 . 16 1 1 A 139 139 LYS HA H 126 3.990 3.975 0.015 1
1 1310 . 16 1 1 A 139 139 LYS C C 126 179.184 178.403 0.781 1
1 1311 . 16 1 1 A 139 139 LYS CA C 126 58.135 59.579 -1.444 1
1 1312 . 16 1 1 A 139 139 LYS CB C 126 30.945 32.168 -1.223 1
1 1314 . 16 1 1 A 139 139 LYS N N 126 114.003 119.007 -5.004 1
1 1315 . 16 1 1 A 140 140 ARG H H 127 7.248 8.164 -0.916 1
1 1316 . 16 1 1 A 140 140 ARG HA H 127 3.870 3.921 -0.051 1
1 1324 . 16 1 1 A 140 140 ARG C C 127 177.772 179.040 -1.268 1
1 1325 . 16 1 1 A 140 140 ARG CA C 127 60.010 59.440 0.570 1
1 1326 . 16 1 1 A 140 140 ARG CB C 127 30.945 29.935 1.010 1
1 1329 . 16 1 1 A 140 140 ARG N N 127 120.072 118.277 1.795 1
1 1331 . 16 1 1 A 141 141 ILE H H 128 7.706 8.051 -0.345 1
1 1332 . 16 1 1 A 141 141 ILE HA H 128 3.530 3.693 -0.163 1
1 1340 . 16 1 1 A 141 141 ILE C C 128 177.669 178.014 -0.345 1
1 1341 . 16 1 1 A 141 141 ILE CA C 128 65.636 65.881 -0.245 1
1 1342 . 16 1 1 A 141 141 ILE CB C 128 38.680 38.065 0.615 1
1 1345 . 16 1 1 A 141 141 ILE N N 128 118.730 120.591 -1.861 1
1 1346 . 16 1 1 A 142 142 LEU H H 129 8.194 8.493 -0.299 1
1 1347 . 16 1 1 A 142 142 LEU HA H 129 3.950 3.962 -0.012 1
1 1356 . 16 1 1 A 142 142 LEU C C 129 179.960 179.527 0.433 1
1 1357 . 16 1 1 A 142 142 LEU CA C 129 58.135 57.992 0.143 1
1 1358 . 16 1 1 A 142 142 LEU CB C 129 41.259 41.553 -0.294 1
1 1361 . 16 1 1 A 142 142 LEU N N 129 117.675 118.945 -1.270 1
1 1362 . 16 1 1 A 143 143 ALA H H 130 8.294 8.432 -0.138 1
1 1363 . 16 1 1 A 143 143 ALA HA H 130 4.220 4.067 0.153 1
1 1367 . 16 1 1 A 143 143 ALA C C 130 179.899 179.813 0.086 1
1 1368 . 16 1 1 A 143 143 ALA CA C 130 54.385 55.286 -0.901 1
1 1369 . 16 1 1 A 143 143 ALA CB C 130 19.270 18.367 0.903 1
1 1370 . 16 1 1 A 143 143 ALA N N 130 121.096 122.813 -1.717 1
1 1371 . 16 1 1 A 144 144 SER H H 131 7.813 8.328 -0.515 1
1 1372 . 16 1 1 A 144 144 SER HA H 131 4.180 4.259 -0.079 1
1 1375 . 16 1 1 A 144 144 SER C C 131 175.457 176.816 -1.359 1
1 1376 . 16 1 1 A 144 144 SER CA C 131 60.948 61.268 -0.320 1
1 1377 . 16 1 1 A 144 144 SER CB C 131 63.761 63.301 0.460 1
1 1378 . 16 1 1 A 144 144 SER N N 131 112.102 113.399 -1.297 1
1 1379 . 16 1 1 A 145 145 LEU H H 132 7.747 7.676 0.071 1
1 1380 . 16 1 1 A 145 145 LEU HA H 132 4.140 4.069 0.071 1
1 1389 . 16 1 1 A 145 145 LEU C C 132 178.589 176.964 1.625 1
1 1390 . 16 1 1 A 145 145 LEU CA C 132 56.260 56.598 -0.338 1
1 1391 . 16 1 1 A 145 145 LEU CB C 132 42.196 42.544 -0.348 1
1 1394 . 16 1 1 A 145 145 LEU N N 132 117.536 118.822 -1.286 1
1 1395 . 16 1 1 A 146 146 GLY H H 133 7.544 7.357 0.187 1
1 1396 . 16 1 1 A 146 146 GLY HA2 H 133 3.950 3.987 -0.037 1
1 1397 . 16 1 1 A 146 146 GLY HA3 H 133 3.100 3.995 -0.895 1
1 1398 . 16 1 1 A 146 146 GLY C C 133 173.372 174.112 -0.740 1
1 1399 . 16 1 1 A 146 146 GLY CA C 133 45.947 45.791 0.156 1
1 1400 . 16 1 1 A 146 146 GLY N N 133 105.351 104.184 1.167 1
1 1401 . 16 1 1 A 147 147 ASP H H 134 8.342 8.942 -0.600 1
1 1402 . 16 1 1 A 147 147 ASP HA H 134 4.650 4.555 0.095 1
1 1405 . 16 1 1 A 147 147 ASP C C 134 175.462 177.591 -2.129 1
1 1406 . 16 1 1 A 147 147 ASP CA C 134 54.385 56.320 -1.935 1
1 1407 . 16 1 1 A 147 147 ASP CB C 134 41.259 41.540 -0.281 1
1 1408 . 16 1 1 A 147 147 ASP N N 134 120.133 121.529 -1.396 1
1 14 . 17 1 1 A 15 15 GLN H H 2 8.439 9.100 -0.661 1
1 15 . 17 1 1 A 15 15 GLN HA H 2 4.594 5.060 -0.466 1
1 20 . 17 1 1 A 15 15 GLN C C 2 175.972 174.265 1.707 1
1 21 . 17 1 1 A 15 15 GLN CA C 2 56.260 54.164 2.096 1
1 22 . 17 1 1 A 15 15 GLN CB C 2 30.945 32.518 -1.573 1
1 24 . 17 1 1 A 15 15 GLN N N 2 124.997 129.002 -4.005 1
1 25 . 17 1 1 A 16 16 THR H H 3 8.347 8.797 -0.450 1
1 26 . 17 1 1 A 16 16 THR HA H 3 4.555 4.798 -0.243 1
1 31 . 17 1 1 A 16 16 THR C C 3 175.495 175.086 0.409 1
1 32 . 17 1 1 A 16 16 THR CA C 3 60.010 61.835 -1.825 1
1 33 . 17 1 1 A 16 16 THR CB C 3 71.261 71.251 0.010 1
1 34 . 17 1 1 A 16 16 THR N N 3 113.011 120.031 -7.020 1
1 35 . 17 1 1 A 17 17 VAL H H 4 8.895 8.720 0.175 1
1 36 . 17 1 1 A 17 17 VAL HA H 4 3.670 3.799 -0.129 1
1 44 . 17 1 1 A 17 17 VAL C C 4 178.449 178.019 0.430 1
1 45 . 17 1 1 A 17 17 VAL CA C 4 67.511 66.478 1.033 1
1 46 . 17 1 1 A 17 17 VAL CB C 4 31.883 31.664 0.219 1
1 49 . 17 1 1 A 17 17 VAL N N 4 121.854 125.475 -3.621 1
1 50 . 17 1 1 A 18 18 GLY H H 5 9.017 8.408 0.609 1
1 51 . 17 1 1 A 18 18 GLY HA2 H 5 3.940 3.832 0.108 1
1 52 . 17 1 1 A 18 18 GLY HA3 H 5 3.610 3.841 -0.231 1
1 53 . 17 1 1 A 18 18 GLY C C 5 176.186 175.563 0.623 1
1 54 . 17 1 1 A 18 18 GLY CA C 5 47.822 47.441 0.381 1
1 55 . 17 1 1 A 18 18 GLY N N 5 106.966 107.404 -0.438 1
1 56 . 17 1 1 A 19 19 GLN H H 6 8.072 8.012 0.060 1
1 57 . 17 1 1 A 19 19 GLN HA H 6 4.037 4.125 -0.088 1
1 62 . 17 1 1 A 19 19 GLN C C 6 179.488 178.202 1.286 1
1 63 . 17 1 1 A 19 19 GLN CA C 6 59.073 58.529 0.544 1
1 64 . 17 1 1 A 19 19 GLN CB C 6 28.489 28.748 -0.259 1
1 66 . 17 1 1 A 19 19 GLN N N 6 122.431 120.933 1.498 1
1 67 . 17 1 1 A 20 20 TRP H H 7 8.756 8.273 0.483 1
1 68 . 17 1 1 A 20 20 TRP HA H 7 4.160 4.349 -0.189 1
1 77 . 17 1 1 A 20 20 TRP C C 7 179.620 177.783 1.837 1
1 78 . 17 1 1 A 20 20 TRP CA C 7 61.886 61.078 0.808 1
1 79 . 17 1 1 A 20 20 TRP CB C 7 28.133 29.686 -1.553 1
1 85 . 17 1 1 A 20 20 TRP N N 7 124.265 122.064 2.201 1
1 87 . 17 1 1 A 21 21 LEU H H 8 9.148 8.734 0.414 1
1 88 . 17 1 1 A 21 21 LEU HA H 8 3.440 3.604 -0.164 1
1 97 . 17 1 1 A 21 21 LEU C C 8 180.521 178.194 2.327 1
1 98 . 17 1 1 A 21 21 LEU CA C 8 56.920 58.007 -1.087 1
1 99 . 17 1 1 A 21 21 LEU CB C 8 41.700 41.687 0.013 1
1 102 . 17 1 1 A 21 21 LEU N N 8 120.548 120.736 -0.188 1
1 103 . 17 1 1 A 22 22 GLU H H 9 8.284 8.519 -0.235 1
1 104 . 17 1 1 A 22 22 GLU HA H 9 3.740 4.030 -0.290 1
1 109 . 17 1 1 A 22 22 GLU C C 9 179.960 178.630 1.330 1
1 110 . 17 1 1 A 22 22 GLU CA C 9 60.010 58.782 1.228 1
1 111 . 17 1 1 A 22 22 GLU CB C 9 29.070 28.367 0.703 1
1 113 . 17 1 1 A 22 22 GLU N N 9 120.133 117.793 2.340 1
1 114 . 17 1 1 A 23 23 SER H H 10 7.891 7.767 0.124 1
1 115 . 17 1 1 A 23 23 SER HA H 10 4.250 4.216 0.034 1
1 118 . 17 1 1 A 23 23 SER C C 10 175.346 176.435 -1.089 1
1 119 . 17 1 1 A 23 23 SER CA C 10 60.948 61.213 -0.265 1
1 120 . 17 1 1 A 23 23 SER CB C 10 63.280 62.825 0.455 1
1 121 . 17 1 1 A 23 23 SER N N 10 117.044 115.597 1.447 1
1 122 . 17 1 1 A 24 24 ILE H H 11 6.862 7.436 -0.574 1
1 123 . 17 1 1 A 24 24 ILE HA H 11 4.487 3.738 0.749 1
1 133 . 17 1 1 A 24 24 ILE C C 11 175.812 175.996 -0.184 1
1 134 . 17 1 1 A 24 24 ILE CA C 11 60.948 63.301 -2.353 1
1 135 . 17 1 1 A 24 24 ILE CB C 11 38.250 37.288 0.962 1
1 139 . 17 1 1 A 24 24 ILE N N 11 113.733 119.039 -5.306 1
1 140 . 17 1 1 A 25 25 GLY H H 12 7.628 7.802 -0.174 1
1 141 . 17 1 1 A 25 25 GLY HA2 H 12 3.990 3.830 0.160 1
1 142 . 17 1 1 A 25 25 GLY HA3 H 12 3.800 3.892 -0.092 1
1 143 . 17 1 1 A 25 25 GLY C C 12 173.647 171.763 1.884 1
1 144 . 17 1 1 A 25 25 GLY CA C 12 45.947 45.549 0.398 1
1 145 . 17 1 1 A 25 25 GLY N N 12 109.763 110.306 -0.543 1
1 146 . 17 1 1 A 26 26 LEU H H 13 7.620 8.240 -0.620 1
1 147 . 17 1 1 A 26 26 LEU C C 13 176.186 174.394 1.792 1
1 148 . 17 1 1 A 26 26 LEU CA C 13 52.700 51.677 1.023 1
1 149 . 17 1 1 A 26 26 LEU CB C 13 43.134 44.867 -1.733 1
1 150 . 17 1 1 A 26 26 LEU N N 13 118.778 122.519 -3.741 1
1 151 . 17 1 1 A 27 27 PRO HA H 14 4.120 4.662 -0.542 1
1 154 . 17 1 1 A 27 27 PRO C C 14 177.955 175.623 2.332 1
1 155 . 17 1 1 A 27 27 PRO CA C 14 64.698 62.228 2.470 1
1 156 . 17 1 1 A 27 27 PRO CB C 14 31.883 29.074 2.809 1
1 158 . 17 1 1 A 28 28 GLN H H 15 9.838 8.484 1.354 1
1 159 . 17 1 1 A 28 28 GLN HA H 15 4.240 4.310 -0.070 1
1 162 . 17 1 1 A 28 28 GLN C C 15 176.836 175.699 1.137 1
1 163 . 17 1 1 A 28 28 GLN CA C 15 58.135 55.666 2.469 1
1 164 . 17 1 1 A 28 28 GLN CB C 15 27.195 30.050 -2.855 1
1 166 . 17 1 1 A 28 28 GLN N N 15 120.414 121.603 -1.189 1
1 167 . 17 1 1 A 29 29 TYR H H 16 6.810 7.628 -0.818 1
1 168 . 17 1 1 A 29 29 TYR HA H 16 5.720 4.784 0.936 1
1 173 . 17 1 1 A 29 29 TYR C C 16 174.814 176.429 -1.615 1
1 174 . 17 1 1 A 29 29 TYR CA C 16 57.198 57.713 -0.515 1
1 175 . 17 1 1 A 29 29 TYR CB C 16 37.509 39.498 -1.989 1
1 178 . 17 1 1 A 29 29 TYR N N 16 119.718 117.764 1.954 1
1 179 . 17 1 1 A 30 30 GLU H H 17 7.509 8.097 -0.588 1
1 180 . 17 1 1 A 30 30 GLU HA H 17 3.650 4.011 -0.361 1
1 184 . 17 1 1 A 30 30 GLU C C 17 177.552 178.355 -0.803 1
1 185 . 17 1 1 A 30 30 GLU CA C 17 60.948 59.422 1.526 1
1 186 . 17 1 1 A 30 30 GLU CB C 17 30.008 29.131 0.877 1
1 188 . 17 1 1 A 30 30 GLU N N 17 122.417 123.012 -0.595 1
1 189 . 17 1 1 A 31 31 ASN H H 18 9.259 8.239 1.020 1
1 190 . 17 1 1 A 31 31 ASN HA H 18 4.451 4.483 -0.032 1
1 193 . 17 1 1 A 31 31 ASN C C 18 176.868 178.042 -1.174 1
1 194 . 17 1 1 A 31 31 ASN CA C 18 57.198 56.432 0.766 1
1 195 . 17 1 1 A 31 31 ASN CB C 18 38.446 39.429 -0.983 1
1 196 . 17 1 1 A 31 31 ASN N N 18 116.613 118.039 -1.426 1
1 197 . 17 1 1 A 32 32 HIS H H 19 8.898 8.208 0.690 1
1 198 . 17 1 1 A 32 32 HIS HA H 19 4.140 4.354 -0.214 1
1 202 . 17 1 1 A 32 32 HIS C C 19 178.269 177.710 0.559 1
1 203 . 17 1 1 A 32 32 HIS CA C 19 60.948 59.340 1.608 1
1 204 . 17 1 1 A 32 32 HIS CB C 19 30.008 30.216 -0.208 1
1 206 . 17 1 1 A 32 32 HIS N N 19 118.926 118.431 0.495 1
1 207 . 17 1 1 A 33 33 LEU H H 20 7.825 9.027 -1.202 1
1 208 . 17 1 1 A 33 33 LEU HA H 20 4.305 3.916 0.389 1
1 218 . 17 1 1 A 33 33 LEU C C 20 179.190 179.184 0.006 1
1 219 . 17 1 1 A 33 33 LEU CA C 20 60.010 58.440 1.570 1
1 220 . 17 1 1 A 33 33 LEU CB C 20 40.321 42.111 -1.790 1
1 224 . 17 1 1 A 33 33 LEU N N 20 117.434 119.957 -2.523 1
1 225 . 17 1 1 A 34 34 MET H H 21 8.861 8.740 0.121 1
1 226 . 17 1 1 A 34 34 MET HA H 21 3.980 4.310 -0.330 1
1 234 . 17 1 1 A 34 34 MET C C 21 180.340 178.707 1.633 1
1 235 . 17 1 1 A 34 34 MET CA C 21 58.135 58.511 -0.376 1
1 236 . 17 1 1 A 34 34 MET CB C 21 30.945 32.108 -1.163 1
1 238 . 17 1 1 A 34 34 MET N N 21 118.111 117.657 0.454 1
1 239 . 17 1 1 A 35 35 ALA H H 22 9.015 8.539 0.476 1
1 240 . 17 1 1 A 35 35 ALA HA H 22 4.239 4.116 0.123 1
1 244 . 17 1 1 A 35 35 ALA C C 22 178.058 178.492 -0.434 1
1 245 . 17 1 1 A 35 35 ALA CA C 22 53.800 54.630 -0.830 1
1 246 . 17 1 1 A 35 35 ALA CB C 22 18.397 18.278 0.119 1
1 247 . 17 1 1 A 35 35 ALA N N 22 120.068 122.030 -1.962 1
1 248 . 17 1 1 A 36 36 ASN H H 23 7.143 8.106 -0.963 1
1 249 . 17 1 1 A 36 36 ASN HA H 23 4.959 4.902 0.057 1
1 254 . 17 1 1 A 36 36 ASN C C 23 174.083 175.387 -1.304 1
1 255 . 17 1 1 A 36 36 ASN CA C 23 54.000 52.641 1.359 1
1 256 . 17 1 1 A 36 36 ASN CB C 23 41.300 38.929 2.371 1
1 257 . 17 1 1 A 36 36 ASN N N 23 111.560 114.966 -3.406 1
1 259 . 17 1 1 A 37 37 GLY H H 24 7.797 8.254 -0.457 1
1 260 . 17 1 1 A 37 37 GLY HA2 H 24 3.430 3.854 -0.424 1
1 261 . 17 1 1 A 37 37 GLY HA3 H 24 3.290 3.939 -0.649 1
1 262 . 17 1 1 A 37 37 GLY C C 24 173.163 174.863 -1.700 1
1 263 . 17 1 1 A 37 37 GLY CA C 24 45.947 45.212 0.735 1
1 264 . 17 1 1 A 37 37 GLY N N 24 106.170 107.901 -1.731 1
1 265 . 17 1 1 A 38 38 PHE H H 25 8.191 7.949 0.242 1
1 266 . 17 1 1 A 38 38 PHE HA H 25 4.910 4.769 0.141 1
1 271 . 17 1 1 A 38 38 PHE C C 25 173.496 175.695 -2.199 1
1 272 . 17 1 1 A 38 38 PHE CA C 25 56.550 56.353 0.197 1
1 273 . 17 1 1 A 38 38 PHE CB C 25 37.220 37.137 0.083 1
1 276 . 17 1 1 A 38 38 PHE N N 25 122.454 119.743 2.711 1
1 277 . 17 1 1 A 39 39 ASP H H 26 6.756 8.437 -1.681 1
1 278 . 17 1 1 A 39 39 ASP HA H 26 5.077 4.912 0.165 1
1 281 . 17 1 1 A 39 39 ASP C C 26 177.463 175.437 2.026 1
1 282 . 17 1 1 A 39 39 ASP CA C 26 53.447 54.039 -0.592 1
1 283 . 17 1 1 A 39 39 ASP CB C 26 42.580 42.035 0.545 1
1 284 . 17 1 1 A 39 39 ASP N N 26 111.309 120.709 -9.400 1
1 285 . 17 1 1 A 40 40 ASN H H 27 7.495 7.869 -0.374 1
1 286 . 17 1 1 A 40 40 ASN HA H 27 4.820 5.010 -0.190 1
1 289 . 17 1 1 A 40 40 ASN C C 27 176.228 175.834 0.394 1
1 290 . 17 1 1 A 40 40 ASN CA C 27 52.510 51.921 0.589 1
1 291 . 17 1 1 A 40 40 ASN CB C 27 40.321 40.064 0.257 1
1 292 . 17 1 1 A 40 40 ASN N N 27 118.385 118.167 0.218 1
1 293 . 17 1 1 A 41 41 VAL H H 28 9.192 8.621 0.571 1
1 294 . 17 1 1 A 41 41 VAL HA H 28 3.550 3.649 -0.099 1
1 302 . 17 1 1 A 41 41 VAL C C 28 176.429 177.673 -1.244 1
1 303 . 17 1 1 A 41 41 VAL CA C 28 65.636 65.865 -0.229 1
1 304 . 17 1 1 A 41 41 VAL CB C 28 31.883 31.728 0.155 1
1 307 . 17 1 1 A 41 41 VAL N N 28 125.741 125.726 0.015 1
1 308 . 17 1 1 A 42 42 GLN H H 29 8.203 8.182 0.021 1
1 309 . 17 1 1 A 42 42 GLN HA H 29 4.129 3.900 0.229 1
1 314 . 17 1 1 A 42 42 GLN C C 29 176.591 178.125 -1.534 1
1 315 . 17 1 1 A 42 42 GLN CA C 29 57.198 58.889 -1.691 1
1 316 . 17 1 1 A 42 42 GLN CB C 29 28.133 28.442 -0.309 1
1 318 . 17 1 1 A 42 42 GLN N N 29 116.452 120.755 -4.303 1
1 319 . 17 1 1 A 43 43 ALA H H 30 7.781 8.352 -0.571 1
1 320 . 17 1 1 A 43 43 ALA HA H 30 4.650 4.058 0.592 1
1 324 . 17 1 1 A 43 43 ALA C C 30 175.976 180.084 -4.108 1
1 325 . 17 1 1 A 43 43 ALA CA C 30 50.840 54.438 -3.598 1
1 326 . 17 1 1 A 43 43 ALA CB C 30 19.150 18.245 0.905 1
1 327 . 17 1 1 A 43 43 ALA N N 30 122.150 121.165 0.985 1
1 328 . 17 1 1 A 44 44 MET H H 31 7.739 8.106 -0.367 1
1 332 . 17 1 1 A 44 44 MET C C 31 178.275 177.105 1.170 1
1 333 . 17 1 1 A 44 44 MET CA C 31 55.323 57.109 -1.786 1
1 334 . 17 1 1 A 44 44 MET CB C 31 34.696 32.092 2.604 1
1 336 . 17 1 1 A 44 44 MET N N 31 118.149 116.814 1.335 1
1 337 . 17 1 1 A 45 45 GLY H H 32 7.611 8.027 -0.416 1
1 338 . 17 1 1 A 45 45 GLY N N 32 101.530 108.185 -6.655 1
1 339 . 17 1 1 A 47 47 ASN HA H 34 4.480 4.346 0.134 1
1 342 . 17 1 1 A 47 47 ASN CA C 34 56.260 54.461 1.799 1
1 343 . 17 1 1 A 47 47 ASN CB C 34 39.384 36.324 3.060 1
1 344 . 17 1 1 A 49 49 MET HA H 36 4.646 4.333 0.313 1
1 350 . 17 1 1 A 49 49 MET C C 36 173.651 175.160 -1.509 1
1 351 . 17 1 1 A 49 49 MET CA C 36 55.323 56.139 -0.816 1
1 352 . 17 1 1 A 49 49 MET CB C 36 35.633 32.923 2.710 1
1 355 . 17 1 1 A 50 50 GLU H H 37 9.203 8.956 0.247 1
1 356 . 17 1 1 A 50 50 GLU HA H 37 4.650 4.767 -0.117 1
1 361 . 17 1 1 A 50 50 GLU C C 37 177.008 177.424 -0.416 1
1 362 . 17 1 1 A 50 50 GLU CA C 37 54.385 54.761 -0.376 1
1 363 . 17 1 1 A 50 50 GLU CB C 37 33.758 32.926 0.832 1
1 365 . 17 1 1 A 50 50 GLU N N 37 123.229 126.350 -3.121 1
1 366 . 17 1 1 A 51 51 ASP H H 38 9.032 8.893 0.139 1
1 367 . 17 1 1 A 51 51 ASP HA H 38 4.149 4.332 -0.183 1
1 370 . 17 1 1 A 51 51 ASP C C 38 177.994 178.324 -0.330 1
1 371 . 17 1 1 A 51 51 ASP CA C 38 59.073 57.091 1.982 1
1 372 . 17 1 1 A 51 51 ASP CB C 38 43.134 39.833 3.301 1
1 373 . 17 1 1 A 51 51 ASP N N 38 122.717 123.782 -1.065 1
1 374 . 17 1 1 A 52 52 GLN H H 39 8.950 8.281 0.669 1
1 375 . 17 1 1 A 52 52 GLN HA H 39 3.940 3.958 -0.018 1
1 378 . 17 1 1 A 52 52 GLN C C 39 177.817 178.685 -0.868 1
1 379 . 17 1 1 A 52 52 GLN CA C 39 59.073 59.120 -0.047 1
1 380 . 17 1 1 A 52 52 GLN CB C 39 28.133 28.519 -0.386 1
1 381 . 17 1 1 A 52 52 GLN N N 39 114.086 119.692 -5.606 1
1 382 . 17 1 1 A 53 53 ASP H H 40 7.214 8.012 -0.798 1
1 383 . 17 1 1 A 53 53 ASP HA H 40 4.370 4.527 -0.157 1
1 386 . 17 1 1 A 53 53 ASP C C 40 177.667 179.197 -1.530 1
1 387 . 17 1 1 A 53 53 ASP CA C 40 57.198 56.943 0.255 1
1 388 . 17 1 1 A 53 53 ASP CB C 40 41.800 40.963 0.837 1
1 389 . 17 1 1 A 53 53 ASP N N 40 118.734 120.161 -1.427 1
1 390 . 17 1 1 A 54 54 LEU H H 41 7.180 8.048 -0.868 1
1 391 . 17 1 1 A 54 54 LEU HA H 41 3.990 3.932 0.058 1
1 400 . 17 1 1 A 54 54 LEU C C 41 178.204 178.123 0.081 1
1 401 . 17 1 1 A 54 54 LEU CA C 41 56.260 57.737 -1.477 1
1 402 . 17 1 1 A 54 54 LEU CB C 41 41.259 41.340 -0.081 1
1 405 . 17 1 1 A 54 54 LEU N N 41 115.795 118.052 -2.257 1
1 406 . 17 1 1 A 55 55 LEU H H 42 7.823 7.755 0.068 1
1 407 . 17 1 1 A 55 55 LEU HA H 42 3.920 4.189 -0.269 1
1 416 . 17 1 1 A 55 55 LEU C C 42 180.876 178.295 2.581 1
1 417 . 17 1 1 A 55 55 LEU CA C 42 58.135 56.813 1.322 1
1 418 . 17 1 1 A 55 55 LEU CB C 42 42.196 42.462 -0.266 1
1 421 . 17 1 1 A 55 55 LEU N N 42 120.499 121.481 -0.982 1
1 422 . 17 1 1 A 56 56 GLU H H 43 8.127 8.106 0.021 1
1 423 . 17 1 1 A 56 56 GLU HA H 43 3.966 4.159 -0.193 1
1 428 . 17 1 1 A 56 56 GLU C C 43 178.801 179.279 -0.478 1
1 429 . 17 1 1 A 56 56 GLU CA C 43 60.010 59.113 0.897 1
1 430 . 17 1 1 A 56 56 GLU CB C 43 29.070 29.275 -0.205 1
1 432 . 17 1 1 A 56 56 GLU N N 43 120.955 118.524 2.431 1
1 433 . 17 1 1 A 57 57 ILE H H 44 7.504 7.763 -0.259 1
1 434 . 17 1 1 A 57 57 ILE HA H 44 4.524 3.841 0.683 1
1 444 . 17 1 1 A 57 57 ILE C C 44 175.691 176.838 -1.147 1
1 445 . 17 1 1 A 57 57 ILE CA C 44 61.886 64.667 -2.781 1
1 446 . 17 1 1 A 57 57 ILE CB C 44 37.300 38.362 -1.062 1
1 450 . 17 1 1 A 57 57 ILE N N 44 109.594 119.029 -9.435 1
1 451 . 17 1 1 A 58 58 GLY H H 45 7.724 7.629 0.095 1
1 452 . 17 1 1 A 58 58 GLY HA2 H 45 3.650 4.161 -0.511 1
1 453 . 17 1 1 A 58 58 GLY HA3 H 45 4.530 4.317 0.213 1
1 454 . 17 1 1 A 58 58 GLY C C 45 174.613 175.791 -1.178 1
1 455 . 17 1 1 A 58 58 GLY CA C 45 45.947 45.167 0.780 1
1 456 . 17 1 1 A 58 58 GLY N N 45 106.680 107.545 -0.865 1
1 457 . 17 1 1 A 59 59 ILE H H 46 8.180 8.042 0.138 1
1 458 . 17 1 1 A 59 59 ILE HA H 46 3.907 3.977 -0.070 1
1 468 . 17 1 1 A 59 59 ILE C C 46 174.235 176.877 -2.642 1
1 469 . 17 1 1 A 59 59 ILE CA C 46 60.948 62.232 -1.284 1
1 470 . 17 1 1 A 59 59 ILE CB C 46 33.980 36.962 -2.982 1
1 474 . 17 1 1 A 59 59 ILE N N 46 122.454 117.942 4.512 1
1 475 . 17 1 1 A 60 60 LEU H H 47 7.367 7.786 -0.419 1
1 476 . 17 1 1 A 60 60 LEU HA H 47 3.900 4.076 -0.176 1
1 479 . 17 1 1 A 60 60 LEU C C 47 177.753 179.409 -1.656 1
1 480 . 17 1 1 A 60 60 LEU CA C 47 56.260 57.295 -1.035 1
1 481 . 17 1 1 A 60 60 LEU CB C 47 42.196 41.300 0.896 1
1 482 . 17 1 1 A 60 60 LEU N N 47 125.835 122.319 3.516 1
1 483 . 17 1 1 A 63 63 GLY HA2 H 50 3.980 3.841 0.139 1
1 484 . 17 1 1 A 63 63 GLY HA3 H 50 3.950 3.859 0.091 1
1 485 . 17 1 1 A 63 63 GLY C C 50 177.130 174.316 2.814 1
1 486 . 17 1 1 A 63 63 GLY CA C 50 46.884 46.946 -0.062 1
1 487 . 17 1 1 A 64 64 HIS H H 51 7.926 8.045 -0.119 1
1 488 . 17 1 1 A 64 64 HIS HA H 51 4.451 4.821 -0.370 1
1 493 . 17 1 1 A 64 64 HIS C C 51 177.613 175.855 1.758 1
1 494 . 17 1 1 A 64 64 HIS CA C 51 57.198 55.474 1.724 1
1 495 . 17 1 1 A 64 64 HIS CB C 51 30.945 29.884 1.061 1
1 498 . 17 1 1 A 64 64 HIS N N 51 122.284 120.741 1.543 1
1 499 . 17 1 1 A 65 65 ARG H H 52 8.105 7.945 0.160 1
1 500 . 17 1 1 A 65 65 ARG HA H 52 3.685 3.839 -0.154 1
1 507 . 17 1 1 A 65 65 ARG C C 52 177.769 178.712 -0.943 1
1 508 . 17 1 1 A 65 65 ARG CA C 52 61.886 59.737 2.149 1
1 509 . 17 1 1 A 65 65 ARG CB C 52 30.945 30.037 0.908 1
1 511 . 17 1 1 A 65 65 ARG N N 52 117.775 121.295 -3.520 1
1 513 . 17 1 1 A 66 66 GLN H H 53 8.090 8.056 0.034 1
1 514 . 17 1 1 A 66 66 GLN HA H 53 3.940 4.034 -0.094 1
1 519 . 17 1 1 A 66 66 GLN C C 53 178.583 178.197 0.386 1
1 520 . 17 1 1 A 66 66 GLN CA C 53 59.073 59.123 -0.050 1
1 521 . 17 1 1 A 66 66 GLN CB C 53 28.133 28.178 -0.045 1
1 523 . 17 1 1 A 66 66 GLN N N 53 116.452 118.820 -2.368 1
1 524 . 17 1 1 A 67 67 ARG H H 54 7.845 7.911 -0.066 1
1 525 . 17 1 1 A 67 67 ARG HA H 54 4.010 4.058 -0.048 1
1 528 . 17 1 1 A 67 67 ARG C C 54 179.766 178.996 0.770 1
1 529 . 17 1 1 A 67 67 ARG CA C 54 59.073 59.090 -0.017 1
1 530 . 17 1 1 A 67 67 ARG CB C 54 30.720 29.931 0.789 1
1 532 . 17 1 1 A 67 67 ARG N N 54 119.275 120.138 -0.863 1
1 533 . 17 1 1 A 68 68 ILE H H 55 8.032 8.172 -0.140 1
1 534 . 17 1 1 A 68 68 ILE HA H 55 3.495 3.589 -0.094 1
1 544 . 17 1 1 A 68 68 ILE C C 55 177.108 178.573 -1.465 1
1 545 . 17 1 1 A 68 68 ILE CA C 55 66.230 65.329 0.901 1
1 546 . 17 1 1 A 68 68 ILE CB C 55 38.020 37.634 0.386 1
1 550 . 17 1 1 A 68 68 ILE N N 55 121.152 119.762 1.390 1
1 551 . 17 1 1 A 69 69 LEU H H 56 8.490 8.310 0.180 1
1 552 . 17 1 1 A 69 69 LEU HA H 56 4.010 3.895 0.115 1
1 561 . 17 1 1 A 69 69 LEU C C 56 179.917 179.234 0.683 1
1 562 . 17 1 1 A 69 69 LEU CA C 56 58.135 58.345 -0.210 1
1 563 . 17 1 1 A 69 69 LEU CB C 56 41.259 41.675 -0.416 1
1 566 . 17 1 1 A 69 69 LEU N N 56 119.072 120.476 -1.404 1
1 567 . 17 1 1 A 70 70 GLN H H 57 8.327 8.521 -0.194 1
1 568 . 17 1 1 A 70 70 GLN HA H 57 4.100 3.956 0.144 1
1 573 . 17 1 1 A 70 70 GLN C C 57 178.798 177.895 0.903 1
1 574 . 17 1 1 A 70 70 GLN CA C 57 59.073 59.047 0.026 1
1 575 . 17 1 1 A 70 70 GLN CB C 57 28.133 28.811 -0.678 1
1 577 . 17 1 1 A 70 70 GLN N N 57 118.172 118.243 -0.071 1
1 578 . 17 1 1 A 71 71 ALA H H 58 7.810 8.036 -0.226 1
1 579 . 17 1 1 A 71 71 ALA HA H 58 4.320 4.144 0.176 1
1 583 . 17 1 1 A 71 71 ALA C C 58 172.232 179.808 -7.576 1
1 584 . 17 1 1 A 71 71 ALA CA C 58 55.323 55.273 0.050 1
1 585 . 17 1 1 A 71 71 ALA CB C 58 19.720 18.825 0.895 1
1 586 . 17 1 1 A 71 71 ALA N N 58 122.536 121.992 0.544 1
1 587 . 17 1 1 A 72 72 ILE H H 59 8.840 8.611 0.229 1
1 588 . 17 1 1 A 72 72 ILE HA H 59 4.030 3.952 0.078 1
1 598 . 17 1 1 A 72 72 ILE C C 59 178.678 177.663 1.015 1
1 599 . 17 1 1 A 72 72 ILE CA C 59 64.698 63.453 1.245 1
1 600 . 17 1 1 A 72 72 ILE CB C 59 37.850 37.311 0.539 1
1 604 . 17 1 1 A 72 72 ILE N N 59 118.111 118.941 -0.830 1
1 605 . 17 1 1 A 73 73 GLN H H 60 7.547 8.127 -0.580 1
1 606 . 17 1 1 A 73 73 GLN HA H 60 4.121 4.089 0.032 1
1 611 . 17 1 1 A 73 73 GLN C C 60 176.556 177.838 -1.282 1
1 612 . 17 1 1 A 73 73 GLN CA C 60 58.135 58.787 -0.652 1
1 613 . 17 1 1 A 73 73 GLN CB C 60 28.300 28.640 -0.340 1
1 615 . 17 1 1 A 73 73 GLN N N 60 119.094 121.080 -1.986 1
1 616 . 17 1 1 A 74 74 LEU H H 61 7.350 7.905 -0.555 1
1 617 . 17 1 1 A 74 74 LEU HA H 61 4.408 4.197 0.211 1
1 626 . 17 1 1 A 74 74 LEU C C 61 177.960 178.827 -0.867 1
1 627 . 17 1 1 A 74 74 LEU CA C 61 54.900 56.677 -1.777 1
1 628 . 17 1 1 A 74 74 LEU CB C 61 42.196 41.964 0.232 1
1 631 . 17 1 1 A 74 74 LEU N N 61 115.853 120.120 -4.267 1
1 632 . 17 1 1 A 75 75 LEU H H 62 7.358 7.605 -0.247 1
1 633 . 17 1 1 A 75 75 LEU HA H 62 4.530 4.053 0.477 1
1 642 . 17 1 1 A 75 75 LEU C C 62 177.035 175.871 1.164 1
1 643 . 17 1 1 A 75 75 LEU CA C 62 53.200 60.082 -6.882 1
1 644 . 17 1 1 A 75 75 LEU CB C 62 40.700 40.164 0.536 1
1 647 . 17 1 1 A 75 75 LEU N N 62 121.010 119.838 1.172 1
1 648 . 17 1 1 A 76 76 PRO HA H 63 4.382 4.380 0.002 1
1 655 . 17 1 1 A 76 76 PRO CB C 63 31.883 31.319 0.564 1
1 657 . 17 1 1 A 77 77 LYS H H 64 8.418 8.232 0.186 1
1 658 . 17 1 1 A 77 77 LYS HA H 64 4.140 4.160 -0.020 1
1 663 . 17 1 1 A 77 77 LYS C C 64 177.122 176.604 0.518 1
1 664 . 17 1 1 A 77 77 LYS CA C 64 56.260 58.886 -2.626 1
1 665 . 17 1 1 A 77 77 LYS CB C 64 33.340 32.331 1.009 1
1 668 . 17 1 1 A 77 77 LYS N N 64 121.932 117.515 4.417 1
1 669 . 17 1 1 A 78 78 MET H H 65 8.550 7.534 1.016 1
1 670 . 17 1 1 A 78 78 MET HA H 65 4.304 4.673 -0.369 1
1 676 . 17 1 1 A 78 78 MET C C 65 176.105 175.642 0.463 1
1 677 . 17 1 1 A 78 78 MET CA C 65 56.260 53.916 2.344 1
1 678 . 17 1 1 A 78 78 MET CB C 65 32.821 34.467 -1.646 1
1 680 . 17 1 1 A 78 78 MET N N 65 123.498 119.146 4.352 1
1 681 . 17 1 1 A 79 79 ARG H H 66 8.731 8.990 -0.259 1
1 682 . 17 1 1 A 79 79 ARG C C 66 173.577 175.906 -2.329 1
1 683 . 17 1 1 A 79 79 ARG CA C 66 53.447 56.947 -3.500 1
1 684 . 17 1 1 A 79 79 ARG CB C 66 30.008 28.799 1.209 1
1 685 . 17 1 1 A 79 79 ARG N N 66 127.355 126.293 1.062 1
1 686 . 17 1 1 A 80 80 PRO HA H 67 4.780 4.553 0.227 1
1 693 . 17 1 1 A 80 80 PRO C C 67 177.043 176.987 0.056 1
1 694 . 17 1 1 A 80 80 PRO CA C 67 61.886 62.316 -0.430 1
1 695 . 17 1 1 A 80 80 PRO CB C 67 32.821 30.178 2.643 1
1 698 . 17 1 1 A 81 81 ILE H H 68 8.580 8.052 0.528 1
1 699 . 17 1 1 A 81 81 ILE HA H 68 4.040 3.842 0.198 1
1 709 . 17 1 1 A 81 81 ILE C C 68 176.831 176.062 0.769 1
1 710 . 17 1 1 A 81 81 ILE CA C 68 62.823 61.508 1.315 1
1 711 . 17 1 1 A 81 81 ILE CB C 68 38.580 37.612 0.968 1
1 715 . 17 1 1 A 81 81 ILE N N 68 118.491 123.133 -4.642 1
1 716 . 17 1 1 A 82 82 GLY H H 69 8.602 8.215 0.387 1
1 717 . 17 1 1 A 82 82 GLY CA C 69 45.009 46.883 -1.874 1
1 718 . 17 1 1 A 82 82 GLY N N 69 111.377 112.519 -1.142 1
1 721 . 17 1 1 A 84 84 ASP HA H 71 4.490 5.104 -0.614 1
1 724 . 17 1 1 A 84 84 ASP CA C 71 54.385 52.172 2.213 1
1 725 . 17 1 1 A 84 84 ASP CB C 71 40.321 42.967 -2.646 1
1 726 . 17 1 1 A 85 85 GLY H H 72 8.054 8.738 -0.684 1
1 727 . 17 1 1 A 85 85 GLY HA2 H 72 4.040 3.958 0.082 1
1 728 . 17 1 1 A 85 85 GLY HA3 H 72 3.750 3.975 -0.225 1
1 729 . 17 1 1 A 85 85 GLY C C 72 173.474 173.694 -0.220 1
1 730 . 17 1 1 A 85 85 GLY CA C 72 45.009 46.651 -1.642 1
1 731 . 17 1 1 A 85 85 GLY N N 72 108.038 110.828 -2.790 1
1 732 . 17 1 1 A 86 86 ALA H H 73 7.858 7.778 0.080 1
1 733 . 17 1 1 A 86 86 ALA HA H 73 4.370 4.483 -0.113 1
1 737 . 17 1 1 A 86 86 ALA CA C 73 51.990 51.194 0.796 1
1 738 . 17 1 1 A 86 86 ALA CB C 73 19.220 22.036 -2.816 1
1 739 . 17 1 1 A 86 86 ALA N N 73 123.819 121.996 1.823 1
1 742 . 17 1 1 A 90 90 SER H H 77 7.839 8.457 -0.618 1
1 743 . 17 1 1 A 90 90 SER HA H 77 4.770 4.534 0.236 1
1 746 . 17 1 1 A 90 90 SER N N 77 115.163 115.952 -0.789 1
1 747 . 17 1 1 A 91 91 VAL H H 78 8.578 8.812 -0.234 1
1 748 . 17 1 1 A 91 91 VAL HA H 78 3.981 3.918 0.063 1
1 756 . 17 1 1 A 91 91 VAL C C 78 177.480 177.183 0.297 1
1 757 . 17 1 1 A 91 91 VAL CA C 78 67.060 66.727 0.333 1
1 758 . 17 1 1 A 91 91 VAL CB C 78 32.500 31.797 0.703 1
1 761 . 17 1 1 A 91 91 VAL N N 78 123.481 123.482 -0.001 1
1 762 . 17 1 1 A 92 92 ALA H H 79 8.607 8.333 0.274 1
1 763 . 17 1 1 A 92 92 ALA HA H 79 4.113 4.257 -0.144 1
1 767 . 17 1 1 A 92 92 ALA C C 79 179.868 180.251 -0.383 1
1 768 . 17 1 1 A 92 92 ALA CA C 79 54.890 55.661 -0.771 1
1 769 . 17 1 1 A 92 92 ALA CB C 79 18.790 18.370 0.420 1
1 770 . 17 1 1 A 92 92 ALA N N 79 120.334 122.342 -2.008 1
1 771 . 17 1 1 A 93 93 GLU H H 80 7.886 8.083 -0.197 1
1 772 . 17 1 1 A 93 93 GLU HA H 80 4.010 4.007 0.003 1
1 777 . 17 1 1 A 93 93 GLU C C 80 179.719 178.931 0.788 1
1 778 . 17 1 1 A 93 93 GLU CA C 80 59.073 59.410 -0.337 1
1 779 . 17 1 1 A 93 93 GLU CB C 80 30.630 29.433 1.197 1
1 781 . 17 1 1 A 93 93 GLU N N 80 117.643 117.612 0.031 1
1 782 . 17 1 1 A 94 94 TRP H H 81 8.299 8.144 0.155 1
1 783 . 17 1 1 A 94 94 TRP HA H 81 4.251 4.233 0.018 1
1 792 . 17 1 1 A 94 94 TRP C C 81 178.772 178.534 0.238 1
1 793 . 17 1 1 A 94 94 TRP CA C 81 60.010 61.110 -1.100 1
1 794 . 17 1 1 A 94 94 TRP CB C 81 27.650 30.134 -2.484 1
1 800 . 17 1 1 A 94 94 TRP N N 81 122.545 122.509 0.036 1
1 802 . 17 1 1 A 95 95 LEU H H 82 8.505 8.363 0.142 1
1 803 . 17 1 1 A 95 95 LEU HA H 82 2.880 3.181 -0.301 1
1 812 . 17 1 1 A 95 95 LEU C C 82 180.235 179.002 1.233 1
1 813 . 17 1 1 A 95 95 LEU CA C 82 57.400 56.827 0.573 1
1 814 . 17 1 1 A 95 95 LEU CB C 82 40.321 40.627 -0.306 1
1 817 . 17 1 1 A 95 95 LEU N N 82 121.110 118.729 2.381 1
1 818 . 17 1 1 A 96 96 ASP H H 83 8.185 8.402 -0.217 1
1 819 . 17 1 1 A 96 96 ASP HA H 83 4.280 4.332 -0.052 1
1 822 . 17 1 1 A 96 96 ASP C C 83 175.224 177.811 -2.587 1
1 823 . 17 1 1 A 96 96 ASP CA C 83 57.310 57.296 0.014 1
1 824 . 17 1 1 A 96 96 ASP CB C 83 40.321 42.061 -1.740 1
1 825 . 17 1 1 A 96 96 ASP N N 83 119.082 120.392 -1.310 1
1 826 . 17 1 1 A 97 97 SER H H 84 7.989 7.775 0.214 1
1 827 . 17 1 1 A 97 97 SER HA H 84 4.250 4.423 -0.173 1
1 830 . 17 1 1 A 97 97 SER C C 84 175.346 174.661 0.685 1
1 831 . 17 1 1 A 97 97 SER CA C 84 60.948 59.554 1.394 1
1 832 . 17 1 1 A 97 97 SER CB C 84 63.370 63.743 -0.373 1
1 833 . 17 1 1 A 97 97 SER N N 84 117.579 112.807 4.772 1
1 834 . 17 1 1 A 98 98 ILE H H 85 6.862 7.393 -0.531 1
1 835 . 17 1 1 A 98 98 ILE HA H 85 4.550 4.287 0.263 1
1 843 . 17 1 1 A 98 98 ILE C C 85 173.308 175.518 -2.210 1
1 844 . 17 1 1 A 98 98 ILE CA C 85 60.948 60.556 0.392 1
1 845 . 17 1 1 A 98 98 ILE CB C 85 37.760 37.467 0.293 1
1 848 . 17 1 1 A 98 98 ILE N N 85 113.733 117.972 -4.239 1
1 849 . 17 1 1 A 99 99 GLU H H 86 7.705 8.036 -0.331 1
1 850 . 17 1 1 A 99 99 GLU HA H 86 4.280 3.936 0.344 1
1 853 . 17 1 1 A 99 99 GLU C C 86 175.224 176.239 -1.015 1
1 854 . 17 1 1 A 99 99 GLU CA C 86 56.260 57.175 -0.915 1
1 855 . 17 1 1 A 99 99 GLU CB C 86 26.258 27.308 -1.050 1
1 857 . 17 1 1 A 99 99 GLU N N 86 115.493 120.272 -4.779 1
1 858 . 17 1 1 A 100 100 LEU H H 87 7.989 8.141 -0.152 1
1 859 . 17 1 1 A 100 100 LEU HA H 87 4.220 4.496 -0.276 1
1 868 . 17 1 1 A 100 100 LEU C C 87 176.965 177.672 -0.707 1
1 869 . 17 1 1 A 100 100 LEU CA C 87 52.510 53.917 -1.407 1
1 870 . 17 1 1 A 100 100 LEU CB C 87 42.196 43.109 -0.913 1
1 873 . 17 1 1 A 100 100 LEU N N 87 117.579 120.623 -3.044 1
1 874 . 17 1 1 A 101 101 GLY H H 88 8.503 8.245 0.258 1
1 875 . 17 1 1 A 101 101 GLY CA C 88 46.884 47.168 -0.284 1
1 876 . 17 1 1 A 101 101 GLY N N 88 107.794 109.112 -1.318 1
1 877 . 17 1 1 A 102 102 ASP HA H 89 4.431 4.255 0.176 1
1 880 . 17 1 1 A 102 102 ASP C C 89 178.075 178.484 -0.409 1
1 881 . 17 1 1 A 102 102 ASP CA C 89 57.198 56.841 0.357 1
1 882 . 17 1 1 A 102 102 ASP CB C 89 40.321 40.502 -0.181 1
1 883 . 17 1 1 A 103 103 TYR H H 90 7.899 7.896 0.003 1
1 884 . 17 1 1 A 103 103 TYR HA H 90 4.940 4.334 0.606 1
1 889 . 17 1 1 A 103 103 TYR C C 90 175.527 178.364 -2.837 1
1 890 . 17 1 1 A 103 103 TYR CA C 90 58.135 60.393 -2.258 1
1 891 . 17 1 1 A 103 103 TYR CB C 90 38.446 37.728 0.718 1
1 894 . 17 1 1 A 103 103 TYR N N 90 115.595 119.530 -3.935 1
1 895 . 17 1 1 A 104 104 THR H H 91 7.971 8.293 -0.322 1
1 896 . 17 1 1 A 104 104 THR HA H 91 4.234 3.961 0.273 1
1 901 . 17 1 1 A 104 104 THR C C 91 175.905 176.518 -0.613 1
1 902 . 17 1 1 A 104 104 THR CA C 91 68.449 67.016 1.433 1
1 904 . 17 1 1 A 104 104 THR N N 91 118.867 116.530 2.337 1
1 905 . 17 1 1 A 105 105 LYS H H 92 8.555 7.929 0.626 1
1 906 . 17 1 1 A 105 105 LYS HA H 92 3.940 4.065 -0.125 1
1 912 . 17 1 1 A 105 105 LYS C C 92 177.310 178.667 -1.357 1
1 913 . 17 1 1 A 105 105 LYS CA C 92 60.948 59.423 1.525 1
1 914 . 17 1 1 A 105 105 LYS CB C 92 31.883 32.415 -0.532 1
1 917 . 17 1 1 A 105 105 LYS N N 92 119.259 120.807 -1.548 1
1 918 . 17 1 1 A 106 106 ALA H H 93 7.920 8.079 -0.159 1
1 919 . 17 1 1 A 106 106 ALA HA H 93 4.128 4.160 -0.032 1
1 923 . 17 1 1 A 106 106 ALA C C 93 180.972 180.449 0.523 1
1 924 . 17 1 1 A 106 106 ALA CA C 93 55.070 55.103 -0.033 1
1 925 . 17 1 1 A 106 106 ALA CB C 93 17.750 18.809 -1.059 1
1 926 . 17 1 1 A 106 106 ALA N N 93 120.398 121.415 -1.017 1
1 927 . 17 1 1 A 107 107 PHE H H 94 8.136 8.558 -0.422 1
1 928 . 17 1 1 A 107 107 PHE HA H 94 4.190 4.572 -0.382 1
1 934 . 17 1 1 A 107 107 PHE C C 94 177.955 178.309 -0.354 1
1 935 . 17 1 1 A 107 107 PHE CA C 94 63.761 61.525 2.236 1
1 936 . 17 1 1 A 107 107 PHE CB C 94 38.446 38.819 -0.373 1
1 940 . 17 1 1 A 107 107 PHE N N 94 117.119 116.153 0.966 1
1 941 . 17 1 1 A 108 108 LEU H H 95 8.351 8.698 -0.347 1
1 942 . 17 1 1 A 108 108 LEU HA H 95 3.889 3.966 -0.077 1
1 951 . 17 1 1 A 108 108 LEU C C 95 182.043 179.213 2.830 1
1 952 . 17 1 1 A 108 108 LEU CA C 95 59.073 58.565 0.508 1
1 953 . 17 1 1 A 108 108 LEU CB C 95 41.259 42.081 -0.822 1
1 956 . 17 1 1 A 108 108 LEU N N 95 118.450 119.811 -1.361 1
1 957 . 17 1 1 A 109 109 ILE H H 96 8.992 8.115 0.877 1
1 958 . 17 1 1 A 109 109 ILE HA H 96 4.069 3.856 0.213 1
1 968 . 17 1 1 A 109 109 ILE C C 96 177.094 177.777 -0.683 1
1 969 . 17 1 1 A 109 109 ILE CA C 96 63.761 64.291 -0.530 1
1 970 . 17 1 1 A 109 109 ILE CB C 96 37.509 37.704 -0.195 1
1 974 . 17 1 1 A 109 109 ILE N N 96 118.177 115.003 3.174 1
1 975 . 17 1 1 A 110 110 ASN H H 97 7.067 8.082 -1.015 1
1 976 . 17 1 1 A 110 110 ASN HA H 97 4.797 4.648 0.149 1
1 981 . 17 1 1 A 110 110 ASN C C 97 173.595 175.444 -1.849 1
1 982 . 17 1 1 A 110 110 ASN CA C 97 54.385 53.330 1.055 1
1 983 . 17 1 1 A 110 110 ASN CB C 97 40.321 39.024 1.297 1
1 984 . 17 1 1 A 110 110 ASN N N 97 116.407 119.141 -2.734 1
1 986 . 17 1 1 A 111 111 GLY H H 98 7.681 8.048 -0.367 1
1 987 . 17 1 1 A 111 111 GLY HA2 H 98 4.080 3.935 0.145 1
1 988 . 17 1 1 A 111 111 GLY HA3 H 98 3.640 4.020 -0.380 1
1 989 . 17 1 1 A 111 111 GLY C C 98 174.552 174.141 0.411 1
1 990 . 17 1 1 A 111 111 GLY CA C 98 45.947 45.028 0.919 1
1 991 . 17 1 1 A 111 111 GLY N N 98 104.440 105.804 -1.364 1
1 992 . 17 1 1 A 112 112 TYR H H 99 8.427 8.372 0.055 1
1 993 . 17 1 1 A 112 112 TYR HA H 99 4.661 4.871 -0.210 1
1 998 . 17 1 1 A 112 112 TYR C C 99 174.425 176.188 -1.763 1
1 999 . 17 1 1 A 112 112 TYR CA C 99 57.198 57.384 -0.186 1
1 1000 . 17 1 1 A 112 112 TYR CB C 99 36.571 37.528 -0.957 1
1 1003 . 17 1 1 A 112 112 TYR N N 99 122.830 120.290 2.540 1
1 1004 . 17 1 1 A 113 113 THR H H 100 7.166 7.981 -0.815 1
1 1005 . 17 1 1 A 113 113 THR HA H 100 4.248 4.569 -0.321 1
1 1009 . 17 1 1 A 113 113 THR C C 100 174.897 175.379 -0.482 1
1 1010 . 17 1 1 A 113 113 THR CA C 100 62.290 62.662 -0.372 1
1 1011 . 17 1 1 A 113 113 THR CB C 100 68.970 69.664 -0.694 1
1 1013 . 17 1 1 A 113 113 THR N N 100 104.304 115.319 -11.015 1
1 1014 . 17 1 1 A 114 114 SER H H 101 7.695 7.830 -0.135 1
1 1015 . 17 1 1 A 114 114 SER C C 101 174.372 174.413 -0.041 1
1 1016 . 17 1 1 A 114 114 SER CA C 101 56.260 57.781 -1.521 1
1 1017 . 17 1 1 A 114 114 SER CB C 101 65.636 65.219 0.417 1
1 1018 . 17 1 1 A 114 114 SER N N 101 115.613 116.570 -0.957 1
1 1023 . 17 1 1 A 116 116 ASP HA H 103 4.260 4.363 -0.103 1
1 1026 . 17 1 1 A 116 116 ASP CA C 103 57.198 57.732 -0.534 1
1 1027 . 17 1 1 A 116 116 ASP CB C 103 40.321 40.366 -0.045 1
1 1028 . 17 1 1 A 117 117 LEU H H 104 7.345 7.908 -0.563 1
1 1029 . 17 1 1 A 117 117 LEU HA H 104 4.290 4.010 0.280 1
1 1038 . 17 1 1 A 117 117 LEU C C 104 178.488 178.956 -0.468 1
1 1039 . 17 1 1 A 117 117 LEU CA C 104 56.260 57.940 -1.680 1
1 1040 . 17 1 1 A 117 117 LEU CB C 104 42.196 41.365 0.831 1
1 1043 . 17 1 1 A 117 117 LEU N N 104 117.878 118.118 -0.240 1
1 1044 . 17 1 1 A 118 118 LEU H H 105 7.514 8.057 -0.543 1
1 1045 . 17 1 1 A 118 118 LEU HA H 105 4.210 4.211 -0.001 1
1 1054 . 17 1 1 A 118 118 LEU C C 105 177.002 177.757 -0.755 1
1 1055 . 17 1 1 A 118 118 LEU CA C 105 55.323 57.013 -1.690 1
1 1056 . 17 1 1 A 118 118 LEU CB C 105 42.196 41.720 0.476 1
1 1059 . 17 1 1 A 118 118 LEU N N 105 119.094 119.117 -0.023 1
1 1060 . 17 1 1 A 120 120 LYS HA H 107 4.340 4.528 -0.188 1
1 1063 . 17 1 1 A 120 120 LYS C C 107 176.603 176.032 0.571 1
1 1064 . 17 1 1 A 120 120 LYS CA C 107 55.323 55.833 -0.510 1
1 1065 . 17 1 1 A 120 120 LYS CB C 107 31.883 33.634 -1.751 1
1 1068 . 17 1 1 A 121 121 ILE H H 108 7.539 7.381 0.158 1
1 1069 . 17 1 1 A 121 121 ILE HA H 108 3.987 4.814 -0.827 1
1 1079 . 17 1 1 A 121 121 ILE C C 108 173.247 175.577 -2.330 1
1 1080 . 17 1 1 A 121 121 ILE CA C 108 62.823 59.446 3.377 1
1 1081 . 17 1 1 A 121 121 ILE CB C 108 38.446 40.715 -2.269 1
1 1085 . 17 1 1 A 121 121 ILE N N 108 122.417 116.447 5.970 1
1 1086 . 17 1 1 A 122 122 ALA H H 109 8.290 8.246 0.044 1
1 1087 . 17 1 1 A 122 122 ALA HA H 109 3.970 4.642 -0.672 1
1 1091 . 17 1 1 A 122 122 ALA C C 109 178.318 178.284 0.034 1
1 1092 . 17 1 1 A 122 122 ALA CA C 109 50.150 49.786 0.364 1
1 1093 . 17 1 1 A 122 122 ALA CB C 109 21.630 21.610 0.020 1
1 1094 . 17 1 1 A 122 122 ALA N N 109 127.784 124.625 3.159 1
1 1095 . 17 1 1 A 123 123 GLU HA H 110 3.707 3.984 -0.277 1
1 1099 . 17 1 1 A 123 123 GLU C C 110 178.290 178.654 -0.364 1
1 1100 . 17 1 1 A 123 123 GLU CA C 110 60.948 59.855 1.093 1
1 1101 . 17 1 1 A 123 123 GLU CB C 110 29.070 29.453 -0.383 1
1 1102 . 17 1 1 A 124 124 VAL H H 111 8.333 8.247 0.086 1
1 1103 . 17 1 1 A 124 124 VAL HA H 111 3.850 3.754 0.096 1
1 1111 . 17 1 1 A 124 124 VAL C C 111 177.406 177.438 -0.032 1
1 1112 . 17 1 1 A 124 124 VAL CA C 111 65.636 65.003 0.633 1
1 1113 . 17 1 1 A 124 124 VAL CB C 111 30.730 31.195 -0.465 1
1 1116 . 17 1 1 A 124 124 VAL N N 111 114.438 120.382 -5.944 1
1 1117 . 17 1 1 A 125 125 GLU H H 112 7.442 8.434 -0.992 1
1 1118 . 17 1 1 A 125 125 GLU HA H 112 4.152 4.054 0.098 1
1 1123 . 17 1 1 A 125 125 GLU C C 112 179.982 179.323 0.659 1
1 1124 . 17 1 1 A 125 125 GLU CA C 112 60.010 59.566 0.444 1
1 1125 . 17 1 1 A 125 125 GLU CB C 112 30.008 29.188 0.820 1
1 1127 . 17 1 1 A 125 125 GLU N N 112 121.032 121.702 -0.670 1
1 1128 . 17 1 1 A 126 126 LEU H H 113 7.666 7.829 -0.163 1
1 1129 . 17 1 1 A 126 126 LEU HA H 113 3.846 4.039 -0.193 1
1 1138 . 17 1 1 A 126 126 LEU C C 113 176.991 178.938 -1.947 1
1 1139 . 17 1 1 A 126 126 LEU CA C 113 58.135 57.990 0.145 1
1 1140 . 17 1 1 A 126 126 LEU CB C 113 41.259 41.776 -0.517 1
1 1143 . 17 1 1 A 126 126 LEU N N 113 118.731 121.299 -2.568 1
1 1144 . 17 1 1 A 127 127 ILE H H 114 7.781 8.014 -0.233 1
1 1145 . 17 1 1 A 127 127 ILE HA H 114 3.502 3.881 -0.379 1
1 1153 . 17 1 1 A 127 127 ILE C C 114 178.195 176.911 1.284 1
1 1154 . 17 1 1 A 127 127 ILE CA C 114 65.636 63.327 2.309 1
1 1155 . 17 1 1 A 127 127 ILE CB C 114 40.321 37.712 2.609 1
1 1159 . 17 1 1 A 127 127 ILE N N 114 115.084 118.803 -3.719 1
1 1160 . 17 1 1 A 128 128 ASN H H 115 8.470 7.947 0.523 1
1 1161 . 17 1 1 A 128 128 ASN HA H 115 4.502 4.761 -0.259 1
1 1166 . 17 1 1 A 128 128 ASN C C 115 176.295 176.578 -0.283 1
1 1167 . 17 1 1 A 128 128 ASN CA C 115 56.260 54.225 2.035 1
1 1168 . 17 1 1 A 128 128 ASN CB C 115 39.384 39.216 0.168 1
1 1169 . 17 1 1 A 128 128 ASN N N 115 115.158 119.135 -3.977 1
1 1171 . 17 1 1 A 129 129 VAL H H 116 8.116 7.815 0.301 1
1 1172 . 17 1 1 A 129 129 VAL HA H 116 4.090 3.973 0.117 1
1 1180 . 17 1 1 A 129 129 VAL C C 116 176.740 177.541 -0.801 1
1 1181 . 17 1 1 A 129 129 VAL CA C 116 64.400 64.499 -0.099 1
1 1182 . 17 1 1 A 129 129 VAL CB C 116 32.050 32.534 -0.484 1
1 1185 . 17 1 1 A 129 129 VAL N N 116 118.698 117.879 0.819 1
1 1186 . 17 1 1 A 130 130 LEU H H 117 7.294 7.936 -0.642 1
1 1187 . 17 1 1 A 130 130 LEU HA H 117 3.970 4.192 -0.222 1
1 1196 . 17 1 1 A 130 130 LEU C C 117 175.127 176.157 -1.030 1
1 1197 . 17 1 1 A 130 130 LEU CA C 117 56.260 55.050 1.210 1
1 1198 . 17 1 1 A 130 130 LEU CB C 117 41.259 42.238 -0.979 1
1 1201 . 17 1 1 A 130 130 LEU N N 117 116.201 119.034 -2.833 1
1 1202 . 17 1 1 A 131 131 LYS H H 118 6.594 7.860 -1.266 1
1 1203 . 17 1 1 A 131 131 LYS HA H 118 3.980 4.213 -0.233 1
1 1208 . 17 1 1 A 131 131 LYS C C 118 175.589 175.360 0.229 1
1 1209 . 17 1 1 A 131 131 LYS CA C 118 56.260 57.467 -1.207 1
1 1210 . 17 1 1 A 131 131 LYS CB C 118 28.133 29.316 -1.183 1
1 1212 . 17 1 1 A 131 131 LYS N N 118 111.172 115.904 -4.732 1
1 1213 . 17 1 1 A 132 132 ILE H H 119 8.245 7.974 0.271 1
1 1214 . 17 1 1 A 132 132 ILE HA H 119 4.090 4.335 -0.245 1
1 1224 . 17 1 1 A 132 132 ILE C C 119 175.161 175.754 -0.593 1
1 1225 . 17 1 1 A 132 132 ILE CA C 119 60.010 61.150 -1.140 1
1 1226 . 17 1 1 A 132 132 ILE CB C 119 35.633 37.422 -1.789 1
1 1230 . 17 1 1 A 132 132 ILE N N 119 119.484 120.357 -0.873 1
1 1231 . 17 1 1 A 133 133 ASN H H 120 8.054 9.121 -1.067 1
1 1232 . 17 1 1 A 133 133 ASN HA H 120 4.350 4.787 -0.437 1
1 1235 . 17 1 1 A 133 133 ASN C C 120 175.136 175.643 -0.507 1
1 1236 . 17 1 1 A 133 133 ASN CA C 120 54.385 53.787 0.598 1
1 1237 . 17 1 1 A 133 133 ASN CB C 120 39.384 39.761 -0.377 1
1 1238 . 17 1 1 A 133 133 ASN N N 120 124.670 126.713 -2.043 1
1 1239 . 17 1 1 A 134 134 LEU H H 121 7.517 7.233 0.284 1
1 1240 . 17 1 1 A 134 134 LEU HA H 121 4.678 4.119 0.559 1
1 1249 . 17 1 1 A 134 134 LEU C C 121 178.051 177.636 0.415 1
1 1250 . 17 1 1 A 134 134 LEU CA C 121 53.447 56.179 -2.732 1
1 1251 . 17 1 1 A 134 134 LEU CB C 121 41.259 42.814 -1.555 1
1 1254 . 17 1 1 A 134 134 LEU N N 121 119.918 119.387 0.531 1
1 1255 . 17 1 1 A 135 135 ILE H H 122 9.389 8.909 0.480 1
1 1256 . 17 1 1 A 135 135 ILE HA H 122 3.540 3.709 -0.169 1
1 1266 . 17 1 1 A 135 135 ILE C C 122 176.425 178.007 -1.582 1
1 1267 . 17 1 1 A 135 135 ILE CA C 122 65.636 65.264 0.372 1
1 1268 . 17 1 1 A 135 135 ILE CB C 122 38.446 38.060 0.386 1
1 1272 . 17 1 1 A 135 135 ILE N N 122 129.949 125.583 4.366 1
1 1273 . 17 1 1 A 136 136 GLY H H 123 8.675 8.502 0.173 1
1 1274 . 17 1 1 A 136 136 GLY HA2 H 123 2.650 3.178 -0.528 1
1 1275 . 17 1 1 A 136 136 GLY HA3 H 123 2.060 3.549 -1.489 1
1 1276 . 17 1 1 A 136 136 GLY C C 123 176.854 176.691 0.163 1
1 1277 . 17 1 1 A 136 136 GLY CA C 123 45.500 47.081 -1.581 1
1 1278 . 17 1 1 A 136 136 GLY N N 123 106.314 107.711 -1.397 1
1 1279 . 17 1 1 A 137 137 HIS H H 124 6.869 7.848 -0.979 1
1 1280 . 17 1 1 A 137 137 HIS HA H 124 4.558 4.631 -0.073 1
1 1285 . 17 1 1 A 137 137 HIS C C 124 176.977 177.784 -0.807 1
1 1286 . 17 1 1 A 137 137 HIS CA C 124 57.198 58.450 -1.252 1
1 1287 . 17 1 1 A 137 137 HIS CB C 124 30.945 29.593 1.352 1
1 1290 . 17 1 1 A 137 137 HIS N N 124 118.865 120.233 -1.368 1
1 1291 . 17 1 1 A 138 138 ARG H H 125 7.730 8.235 -0.505 1
1 1292 . 17 1 1 A 138 138 ARG HA H 125 3.770 3.987 -0.217 1
1 1299 . 17 1 1 A 138 138 ARG C C 125 178.288 178.473 -0.185 1
1 1300 . 17 1 1 A 138 138 ARG CA C 125 61.886 58.682 3.204 1
1 1301 . 17 1 1 A 138 138 ARG CB C 125 30.945 29.935 1.010 1
1 1304 . 17 1 1 A 138 138 ARG N N 125 118.149 118.114 0.035 1
1 1306 . 17 1 1 A 139 139 LYS H H 126 8.679 8.232 0.447 1
1 1307 . 17 1 1 A 139 139 LYS HA H 126 3.990 3.988 0.002 1
1 1310 . 17 1 1 A 139 139 LYS C C 126 179.184 178.842 0.342 1
1 1311 . 17 1 1 A 139 139 LYS CA C 126 58.135 59.453 -1.318 1
1 1312 . 17 1 1 A 139 139 LYS CB C 126 30.945 32.048 -1.103 1
1 1314 . 17 1 1 A 139 139 LYS N N 126 114.003 119.448 -5.445 1
1 1315 . 17 1 1 A 140 140 ARG H H 127 7.248 8.006 -0.758 1
1 1316 . 17 1 1 A 140 140 ARG HA H 127 3.870 3.973 -0.103 1
1 1324 . 17 1 1 A 140 140 ARG C C 127 177.772 178.823 -1.051 1
1 1325 . 17 1 1 A 140 140 ARG CA C 127 60.010 59.288 0.722 1
1 1326 . 17 1 1 A 140 140 ARG CB C 127 30.945 29.847 1.098 1
1 1329 . 17 1 1 A 140 140 ARG N N 127 120.072 117.958 2.114 1
1 1331 . 17 1 1 A 141 141 ILE H H 128 7.706 8.171 -0.465 1
1 1332 . 17 1 1 A 141 141 ILE HA H 128 3.530 3.886 -0.356 1
1 1340 . 17 1 1 A 141 141 ILE C C 128 177.669 178.146 -0.477 1
1 1341 . 17 1 1 A 141 141 ILE CA C 128 65.636 65.622 0.014 1
1 1342 . 17 1 1 A 141 141 ILE CB C 128 38.680 38.122 0.558 1
1 1345 . 17 1 1 A 141 141 ILE N N 128 118.730 120.822 -2.092 1
1 1346 . 17 1 1 A 142 142 LEU H H 129 8.194 7.996 0.198 1
1 1347 . 17 1 1 A 142 142 LEU HA H 129 3.950 4.003 -0.053 1
1 1356 . 17 1 1 A 142 142 LEU C C 129 179.960 178.264 1.696 1
1 1357 . 17 1 1 A 142 142 LEU CA C 129 58.135 58.121 0.014 1
1 1358 . 17 1 1 A 142 142 LEU CB C 129 41.259 41.512 -0.253 1
1 1361 . 17 1 1 A 142 142 LEU N N 129 117.675 121.361 -3.686 1
1 1362 . 17 1 1 A 143 143 ALA H H 130 8.294 8.649 -0.355 1
1 1363 . 17 1 1 A 143 143 ALA HA H 130 4.220 4.006 0.214 1
1 1367 . 17 1 1 A 143 143 ALA C C 130 179.899 179.945 -0.046 1
1 1368 . 17 1 1 A 143 143 ALA CA C 130 54.385 55.206 -0.821 1
1 1369 . 17 1 1 A 143 143 ALA CB C 130 19.270 17.928 1.342 1
1 1370 . 17 1 1 A 143 143 ALA N N 130 121.096 120.922 0.174 1
1 1371 . 17 1 1 A 144 144 SER H H 131 7.813 8.048 -0.235 1
1 1372 . 17 1 1 A 144 144 SER HA H 131 4.180 4.163 0.017 1
1 1375 . 17 1 1 A 144 144 SER C C 131 175.457 175.942 -0.485 1
1 1376 . 17 1 1 A 144 144 SER CA C 131 60.948 62.198 -1.250 1
1 1377 . 17 1 1 A 144 144 SER CB C 131 63.761 63.381 0.380 1
1 1378 . 17 1 1 A 144 144 SER N N 131 112.102 114.350 -2.248 1
1 1379 . 17 1 1 A 145 145 LEU H H 132 7.747 7.715 0.032 1
1 1380 . 17 1 1 A 145 145 LEU HA H 132 4.140 4.065 0.075 1
1 1389 . 17 1 1 A 145 145 LEU C C 132 178.589 177.848 0.741 1
1 1390 . 17 1 1 A 145 145 LEU CA C 132 56.260 57.347 -1.087 1
1 1391 . 17 1 1 A 145 145 LEU CB C 132 42.196 42.406 -0.210 1
1 1394 . 17 1 1 A 145 145 LEU N N 132 117.536 118.950 -1.414 1
1 1395 . 17 1 1 A 146 146 GLY H H 133 7.544 7.983 -0.439 1
1 1396 . 17 1 1 A 146 146 GLY HA2 H 133 3.950 3.941 0.009 1
1 1397 . 17 1 1 A 146 146 GLY HA3 H 133 3.100 3.954 -0.854 1
1 1398 . 17 1 1 A 146 146 GLY C C 133 173.372 172.378 0.994 1
1 1399 . 17 1 1 A 146 146 GLY CA C 133 45.947 46.455 -0.508 1
1 1400 . 17 1 1 A 146 146 GLY N N 133 105.351 107.315 -1.964 1
1 1401 . 17 1 1 A 147 147 ASP H H 134 8.342 8.501 -0.159 1
1 1402 . 17 1 1 A 147 147 ASP HA H 134 4.650 4.959 -0.309 1
1 1405 . 17 1 1 A 147 147 ASP C C 134 175.462 174.933 0.529 1
1 1406 . 17 1 1 A 147 147 ASP CA C 134 54.385 53.137 1.248 1
1 1407 . 17 1 1 A 147 147 ASP CB C 134 41.259 41.017 0.242 1
1 1408 . 17 1 1 A 147 147 ASP N N 134 120.133 125.823 -5.690 1
1 14 . 18 1 1 A 15 15 GLN H H 2 8.439 7.534 0.905 1
1 15 . 18 1 1 A 15 15 GLN HA H 2 4.594 4.918 -0.324 1
1 20 . 18 1 1 A 15 15 GLN C C 2 175.972 174.438 1.534 1
1 21 . 18 1 1 A 15 15 GLN CA C 2 56.260 54.388 1.872 1
1 22 . 18 1 1 A 15 15 GLN CB C 2 30.945 31.883 -0.938 1
1 24 . 18 1 1 A 15 15 GLN N N 2 124.997 121.517 3.480 1
1 25 . 18 1 1 A 16 16 THR H H 3 8.347 8.594 -0.247 1
1 26 . 18 1 1 A 16 16 THR HA H 3 4.555 4.780 -0.225 1
1 31 . 18 1 1 A 16 16 THR C C 3 175.495 174.975 0.520 1
1 32 . 18 1 1 A 16 16 THR CA C 3 60.010 61.640 -1.630 1
1 33 . 18 1 1 A 16 16 THR CB C 3 71.261 71.906 -0.645 1
1 34 . 18 1 1 A 16 16 THR N N 3 113.011 118.940 -5.929 1
1 35 . 18 1 1 A 17 17 VAL H H 4 8.895 8.922 -0.027 1
1 36 . 18 1 1 A 17 17 VAL HA H 4 3.670 3.800 -0.130 1
1 44 . 18 1 1 A 17 17 VAL C C 4 178.449 178.004 0.445 1
1 45 . 18 1 1 A 17 17 VAL CA C 4 67.511 66.483 1.028 1
1 46 . 18 1 1 A 17 17 VAL CB C 4 31.883 31.640 0.243 1
1 49 . 18 1 1 A 17 17 VAL N N 4 121.854 125.137 -3.283 1
1 50 . 18 1 1 A 18 18 GLY H H 5 9.017 8.466 0.551 1
1 51 . 18 1 1 A 18 18 GLY HA2 H 5 3.940 3.850 0.090 1
1 52 . 18 1 1 A 18 18 GLY HA3 H 5 3.610 3.869 -0.259 1
1 53 . 18 1 1 A 18 18 GLY C C 5 176.186 175.747 0.439 1
1 54 . 18 1 1 A 18 18 GLY CA C 5 47.822 47.215 0.607 1
1 55 . 18 1 1 A 18 18 GLY N N 5 106.966 107.554 -0.588 1
1 56 . 18 1 1 A 19 19 GLN H H 6 8.072 8.327 -0.255 1
1 57 . 18 1 1 A 19 19 GLN HA H 6 4.037 4.136 -0.099 1
1 62 . 18 1 1 A 19 19 GLN C C 6 179.488 178.047 1.441 1
1 63 . 18 1 1 A 19 19 GLN CA C 6 59.073 58.688 0.385 1
1 64 . 18 1 1 A 19 19 GLN CB C 6 28.489 28.729 -0.240 1
1 66 . 18 1 1 A 19 19 GLN N N 6 122.431 120.931 1.500 1
1 67 . 18 1 1 A 20 20 TRP H H 7 8.756 8.317 0.439 1
1 68 . 18 1 1 A 20 20 TRP HA H 7 4.160 4.363 -0.203 1
1 77 . 18 1 1 A 20 20 TRP C C 7 179.620 177.800 1.820 1
1 78 . 18 1 1 A 20 20 TRP CA C 7 61.886 61.114 0.772 1
1 79 . 18 1 1 A 20 20 TRP CB C 7 28.133 29.636 -1.503 1
1 85 . 18 1 1 A 20 20 TRP N N 7 124.265 122.063 2.202 1
1 87 . 18 1 1 A 21 21 LEU H H 8 9.148 8.490 0.658 1
1 88 . 18 1 1 A 21 21 LEU HA H 8 3.440 3.582 -0.142 1
1 97 . 18 1 1 A 21 21 LEU C C 8 180.521 178.416 2.105 1
1 98 . 18 1 1 A 21 21 LEU CA C 8 56.920 58.005 -1.085 1
1 99 . 18 1 1 A 21 21 LEU CB C 8 41.700 41.826 -0.126 1
1 102 . 18 1 1 A 21 21 LEU N N 8 120.548 120.826 -0.278 1
1 103 . 18 1 1 A 22 22 GLU H H 9 8.284 8.727 -0.443 1
1 104 . 18 1 1 A 22 22 GLU HA H 9 3.740 4.074 -0.334 1
1 109 . 18 1 1 A 22 22 GLU C C 9 179.960 178.364 1.596 1
1 110 . 18 1 1 A 22 22 GLU CA C 9 60.010 58.801 1.209 1
1 111 . 18 1 1 A 22 22 GLU CB C 9 29.070 28.071 0.999 1
1 113 . 18 1 1 A 22 22 GLU N N 9 120.133 117.769 2.364 1
1 114 . 18 1 1 A 23 23 SER H H 10 7.891 7.761 0.130 1
1 115 . 18 1 1 A 23 23 SER HA H 10 4.250 4.305 -0.055 1
1 118 . 18 1 1 A 23 23 SER C C 10 175.346 176.351 -1.005 1
1 119 . 18 1 1 A 23 23 SER CA C 10 60.948 61.178 -0.230 1
1 120 . 18 1 1 A 23 23 SER CB C 10 63.280 62.844 0.436 1
1 121 . 18 1 1 A 23 23 SER N N 10 117.044 115.531 1.513 1
1 122 . 18 1 1 A 24 24 ILE H H 11 6.862 7.572 -0.710 1
1 123 . 18 1 1 A 24 24 ILE HA H 11 4.487 3.875 0.612 1
1 133 . 18 1 1 A 24 24 ILE C C 11 175.812 175.750 0.062 1
1 134 . 18 1 1 A 24 24 ILE CA C 11 60.948 62.796 -1.848 1
1 135 . 18 1 1 A 24 24 ILE CB C 11 38.250 37.584 0.666 1
1 139 . 18 1 1 A 24 24 ILE N N 11 113.733 118.255 -4.522 1
1 140 . 18 1 1 A 25 25 GLY H H 12 7.628 7.521 0.107 1
1 141 . 18 1 1 A 25 25 GLY HA2 H 12 3.990 3.965 0.025 1
1 142 . 18 1 1 A 25 25 GLY HA3 H 12 3.800 4.012 -0.212 1
1 143 . 18 1 1 A 25 25 GLY C C 12 173.647 171.756 1.891 1
1 144 . 18 1 1 A 25 25 GLY CA C 12 45.947 46.157 -0.210 1
1 145 . 18 1 1 A 25 25 GLY N N 12 109.763 109.454 0.309 1
1 146 . 18 1 1 A 26 26 LEU H H 13 7.620 8.283 -0.663 1
1 147 . 18 1 1 A 26 26 LEU C C 13 176.186 174.558 1.628 1
1 148 . 18 1 1 A 26 26 LEU CA C 13 52.700 51.492 1.208 1
1 149 . 18 1 1 A 26 26 LEU CB C 13 43.134 44.555 -1.421 1
1 150 . 18 1 1 A 26 26 LEU N N 13 118.778 123.986 -5.208 1
1 151 . 18 1 1 A 27 27 PRO HA H 14 4.120 4.651 -0.531 1
1 154 . 18 1 1 A 27 27 PRO C C 14 177.955 175.938 2.017 1
1 155 . 18 1 1 A 27 27 PRO CA C 14 64.698 62.279 2.419 1
1 156 . 18 1 1 A 27 27 PRO CB C 14 31.883 29.141 2.742 1
1 158 . 18 1 1 A 28 28 GLN H H 15 9.838 8.618 1.220 1
1 159 . 18 1 1 A 28 28 GLN HA H 15 4.240 4.410 -0.170 1
1 162 . 18 1 1 A 28 28 GLN C C 15 176.836 175.516 1.320 1
1 163 . 18 1 1 A 28 28 GLN CA C 15 58.135 55.553 2.582 1
1 164 . 18 1 1 A 28 28 GLN CB C 15 27.195 29.905 -2.710 1
1 166 . 18 1 1 A 28 28 GLN N N 15 120.414 122.274 -1.860 1
1 167 . 18 1 1 A 29 29 TYR H H 16 6.810 7.855 -1.045 1
1 168 . 18 1 1 A 29 29 TYR HA H 16 5.720 4.684 1.036 1
1 173 . 18 1 1 A 29 29 TYR C C 16 174.814 176.687 -1.873 1
1 174 . 18 1 1 A 29 29 TYR CA C 16 57.198 57.724 -0.526 1
1 175 . 18 1 1 A 29 29 TYR CB C 16 37.509 39.761 -2.252 1
1 178 . 18 1 1 A 29 29 TYR N N 16 119.718 117.682 2.036 1
1 179 . 18 1 1 A 30 30 GLU H H 17 7.509 8.418 -0.909 1
1 180 . 18 1 1 A 30 30 GLU HA H 17 3.650 4.190 -0.540 1
1 184 . 18 1 1 A 30 30 GLU C C 17 177.552 178.278 -0.726 1
1 185 . 18 1 1 A 30 30 GLU CA C 17 60.948 59.181 1.767 1
1 186 . 18 1 1 A 30 30 GLU CB C 17 30.008 29.441 0.567 1
1 188 . 18 1 1 A 30 30 GLU N N 17 122.417 120.053 2.364 1
1 189 . 18 1 1 A 31 31 ASN H H 18 9.259 8.137 1.122 1
1 190 . 18 1 1 A 31 31 ASN HA H 18 4.451 4.429 0.022 1
1 193 . 18 1 1 A 31 31 ASN C C 18 176.868 178.280 -1.412 1
1 194 . 18 1 1 A 31 31 ASN CA C 18 57.198 56.560 0.638 1
1 195 . 18 1 1 A 31 31 ASN CB C 18 38.446 38.326 0.120 1
1 196 . 18 1 1 A 31 31 ASN N N 18 116.613 118.800 -2.187 1
1 197 . 18 1 1 A 32 32 HIS H H 19 8.898 8.008 0.890 1
1 198 . 18 1 1 A 32 32 HIS HA H 19 4.140 4.388 -0.248 1
1 202 . 18 1 1 A 32 32 HIS C C 19 178.269 177.773 0.496 1
1 203 . 18 1 1 A 32 32 HIS CA C 19 60.948 59.289 1.659 1
1 204 . 18 1 1 A 32 32 HIS CB C 19 30.008 30.040 -0.032 1
1 206 . 18 1 1 A 32 32 HIS N N 19 118.926 118.792 0.134 1
1 207 . 18 1 1 A 33 33 LEU H H 20 7.825 8.741 -0.916 1
1 208 . 18 1 1 A 33 33 LEU HA H 20 4.305 3.925 0.380 1
1 218 . 18 1 1 A 33 33 LEU C C 20 179.190 179.120 0.070 1
1 219 . 18 1 1 A 33 33 LEU CA C 20 60.010 58.346 1.664 1
1 220 . 18 1 1 A 33 33 LEU CB C 20 40.321 41.945 -1.624 1
1 224 . 18 1 1 A 33 33 LEU N N 20 117.434 119.892 -2.458 1
1 225 . 18 1 1 A 34 34 MET H H 21 8.861 8.605 0.256 1
1 226 . 18 1 1 A 34 34 MET HA H 21 3.980 4.108 -0.128 1
1 234 . 18 1 1 A 34 34 MET C C 21 180.340 177.838 2.502 1
1 235 . 18 1 1 A 34 34 MET CA C 21 58.135 59.145 -1.010 1
1 236 . 18 1 1 A 34 34 MET CB C 21 30.945 32.079 -1.134 1
1 238 . 18 1 1 A 34 34 MET N N 21 118.111 118.544 -0.433 1
1 239 . 18 1 1 A 35 35 ALA H H 22 9.015 8.290 0.725 1
1 240 . 18 1 1 A 35 35 ALA HA H 22 4.239 4.170 0.069 1
1 244 . 18 1 1 A 35 35 ALA C C 22 178.058 178.754 -0.696 1
1 245 . 18 1 1 A 35 35 ALA CA C 22 53.800 54.523 -0.723 1
1 246 . 18 1 1 A 35 35 ALA CB C 22 18.397 18.308 0.089 1
1 247 . 18 1 1 A 35 35 ALA N N 22 120.068 121.597 -1.529 1
1 248 . 18 1 1 A 36 36 ASN H H 23 7.143 7.956 -0.813 1
1 249 . 18 1 1 A 36 36 ASN HA H 23 4.959 4.785 0.174 1
1 254 . 18 1 1 A 36 36 ASN C C 23 174.083 175.484 -1.401 1
1 255 . 18 1 1 A 36 36 ASN CA C 23 54.000 52.998 1.002 1
1 256 . 18 1 1 A 36 36 ASN CB C 23 41.300 39.001 2.299 1
1 257 . 18 1 1 A 36 36 ASN N N 23 111.560 115.059 -3.499 1
1 259 . 18 1 1 A 37 37 GLY H H 24 7.797 8.284 -0.487 1
1 260 . 18 1 1 A 37 37 GLY HA2 H 24 3.430 3.841 -0.411 1
1 261 . 18 1 1 A 37 37 GLY HA3 H 24 3.290 3.902 -0.612 1
1 262 . 18 1 1 A 37 37 GLY C C 24 173.163 174.749 -1.586 1
1 263 . 18 1 1 A 37 37 GLY CA C 24 45.947 45.217 0.730 1
1 264 . 18 1 1 A 37 37 GLY N N 24 106.170 107.643 -1.473 1
1 265 . 18 1 1 A 38 38 PHE H H 25 8.191 7.942 0.249 1
1 266 . 18 1 1 A 38 38 PHE HA H 25 4.910 4.736 0.174 1
1 271 . 18 1 1 A 38 38 PHE C C 25 173.496 175.744 -2.248 1
1 272 . 18 1 1 A 38 38 PHE CA C 25 56.550 56.330 0.220 1
1 273 . 18 1 1 A 38 38 PHE CB C 25 37.220 37.081 0.139 1
1 276 . 18 1 1 A 38 38 PHE N N 25 122.454 119.873 2.581 1
1 277 . 18 1 1 A 39 39 ASP H H 26 6.756 8.543 -1.787 1
1 278 . 18 1 1 A 39 39 ASP HA H 26 5.077 4.898 0.179 1
1 281 . 18 1 1 A 39 39 ASP C C 26 177.463 175.467 1.996 1
1 282 . 18 1 1 A 39 39 ASP CA C 26 53.447 53.848 -0.401 1
1 283 . 18 1 1 A 39 39 ASP CB C 26 42.580 41.773 0.807 1
1 284 . 18 1 1 A 39 39 ASP N N 26 111.309 120.774 -9.465 1
1 285 . 18 1 1 A 40 40 ASN H H 27 7.495 7.756 -0.261 1
1 286 . 18 1 1 A 40 40 ASN HA H 27 4.820 5.014 -0.194 1
1 289 . 18 1 1 A 40 40 ASN C C 27 176.228 175.726 0.502 1
1 290 . 18 1 1 A 40 40 ASN CA C 27 52.510 51.863 0.647 1
1 291 . 18 1 1 A 40 40 ASN CB C 27 40.321 40.625 -0.304 1
1 292 . 18 1 1 A 40 40 ASN N N 27 118.385 118.153 0.232 1
1 293 . 18 1 1 A 41 41 VAL H H 28 9.192 8.602 0.590 1
1 294 . 18 1 1 A 41 41 VAL HA H 28 3.550 3.574 -0.024 1
1 302 . 18 1 1 A 41 41 VAL C C 28 176.429 177.475 -1.046 1
1 303 . 18 1 1 A 41 41 VAL CA C 28 65.636 65.795 -0.159 1
1 304 . 18 1 1 A 41 41 VAL CB C 28 31.883 31.556 0.327 1
1 307 . 18 1 1 A 41 41 VAL N N 28 125.741 125.975 -0.234 1
1 308 . 18 1 1 A 42 42 GLN H H 29 8.203 8.008 0.195 1
1 309 . 18 1 1 A 42 42 GLN HA H 29 4.129 3.986 0.143 1
1 314 . 18 1 1 A 42 42 GLN C C 29 176.591 179.036 -2.445 1
1 315 . 18 1 1 A 42 42 GLN CA C 29 57.198 59.213 -2.015 1
1 316 . 18 1 1 A 42 42 GLN CB C 29 28.133 28.073 0.060 1
1 318 . 18 1 1 A 42 42 GLN N N 29 116.452 118.738 -2.286 1
1 319 . 18 1 1 A 43 43 ALA H H 30 7.781 8.181 -0.400 1
1 320 . 18 1 1 A 43 43 ALA HA H 30 4.650 4.075 0.575 1
1 324 . 18 1 1 A 43 43 ALA C C 30 175.976 179.114 -3.138 1
1 325 . 18 1 1 A 43 43 ALA CA C 30 50.840 54.028 -3.188 1
1 326 . 18 1 1 A 43 43 ALA CB C 30 19.150 18.252 0.898 1
1 327 . 18 1 1 A 43 43 ALA N N 30 122.150 121.211 0.939 1
1 328 . 18 1 1 A 44 44 MET H H 31 7.739 7.902 -0.163 1
1 332 . 18 1 1 A 44 44 MET C C 31 178.275 176.993 1.282 1
1 333 . 18 1 1 A 44 44 MET CA C 31 55.323 56.096 -0.773 1
1 334 . 18 1 1 A 44 44 MET CB C 31 34.696 32.609 2.087 1
1 336 . 18 1 1 A 44 44 MET N N 31 118.149 115.739 2.410 1
1 337 . 18 1 1 A 45 45 GLY H H 32 7.611 8.279 -0.668 1
1 338 . 18 1 1 A 45 45 GLY N N 32 101.530 108.863 -7.333 1
1 339 . 18 1 1 A 47 47 ASN HA H 34 4.480 4.928 -0.448 1
1 342 . 18 1 1 A 47 47 ASN CA C 34 56.260 51.978 4.282 1
1 343 . 18 1 1 A 47 47 ASN CB C 34 39.384 39.035 0.349 1
1 344 . 18 1 1 A 49 49 MET HA H 36 4.646 4.630 0.016 1
1 350 . 18 1 1 A 49 49 MET C C 36 173.651 176.351 -2.700 1
1 351 . 18 1 1 A 49 49 MET CA C 36 55.323 56.090 -0.767 1
1 352 . 18 1 1 A 49 49 MET CB C 36 35.633 33.023 2.610 1
1 355 . 18 1 1 A 50 50 GLU H H 37 9.203 8.590 0.613 1
1 356 . 18 1 1 A 50 50 GLU HA H 37 4.650 4.622 0.028 1
1 361 . 18 1 1 A 50 50 GLU C C 37 177.008 175.506 1.502 1
1 362 . 18 1 1 A 50 50 GLU CA C 37 54.385 55.569 -1.184 1
1 363 . 18 1 1 A 50 50 GLU CB C 37 33.758 33.152 0.606 1
1 365 . 18 1 1 A 50 50 GLU N N 37 123.229 121.028 2.201 1
1 366 . 18 1 1 A 51 51 ASP H H 38 9.032 9.115 -0.083 1
1 367 . 18 1 1 A 51 51 ASP HA H 38 4.149 4.436 -0.287 1
1 370 . 18 1 1 A 51 51 ASP C C 38 177.994 178.209 -0.215 1
1 371 . 18 1 1 A 51 51 ASP CA C 38 59.073 56.959 2.114 1
1 372 . 18 1 1 A 51 51 ASP CB C 38 43.134 39.763 3.371 1
1 373 . 18 1 1 A 51 51 ASP N N 38 122.717 121.479 1.238 1
1 374 . 18 1 1 A 52 52 GLN H H 39 8.950 8.217 0.733 1
1 375 . 18 1 1 A 52 52 GLN HA H 39 3.940 3.960 -0.020 1
1 378 . 18 1 1 A 52 52 GLN C C 39 177.817 178.510 -0.693 1
1 379 . 18 1 1 A 52 52 GLN CA C 39 59.073 59.087 -0.014 1
1 380 . 18 1 1 A 52 52 GLN CB C 39 28.133 28.452 -0.319 1
1 381 . 18 1 1 A 52 52 GLN N N 39 114.086 119.760 -5.674 1
1 382 . 18 1 1 A 53 53 ASP H H 40 7.214 8.231 -1.017 1
1 383 . 18 1 1 A 53 53 ASP HA H 40 4.370 4.514 -0.144 1
1 386 . 18 1 1 A 53 53 ASP C C 40 177.667 178.511 -0.844 1
1 387 . 18 1 1 A 53 53 ASP CA C 40 57.198 57.419 -0.221 1
1 388 . 18 1 1 A 53 53 ASP CB C 40 41.800 40.468 1.332 1
1 389 . 18 1 1 A 53 53 ASP N N 40 118.734 120.338 -1.604 1
1 390 . 18 1 1 A 54 54 LEU H H 41 7.180 8.126 -0.946 1
1 391 . 18 1 1 A 54 54 LEU HA H 41 3.990 3.946 0.044 1
1 400 . 18 1 1 A 54 54 LEU C C 41 178.204 178.231 -0.027 1
1 401 . 18 1 1 A 54 54 LEU CA C 41 56.260 58.099 -1.839 1
1 402 . 18 1 1 A 54 54 LEU CB C 41 41.259 41.370 -0.111 1
1 405 . 18 1 1 A 54 54 LEU N N 41 115.795 122.399 -6.604 1
1 406 . 18 1 1 A 55 55 LEU H H 42 7.823 7.914 -0.091 1
1 407 . 18 1 1 A 55 55 LEU HA H 42 3.920 4.149 -0.229 1
1 416 . 18 1 1 A 55 55 LEU C C 42 180.876 178.435 2.441 1
1 417 . 18 1 1 A 55 55 LEU CA C 42 58.135 57.071 1.064 1
1 418 . 18 1 1 A 55 55 LEU CB C 42 42.196 42.001 0.195 1
1 421 . 18 1 1 A 55 55 LEU N N 42 120.499 119.507 0.992 1
1 422 . 18 1 1 A 56 56 GLU H H 43 8.127 8.222 -0.095 1
1 423 . 18 1 1 A 56 56 GLU HA H 43 3.966 4.116 -0.150 1
1 428 . 18 1 1 A 56 56 GLU C C 43 178.801 179.437 -0.636 1
1 429 . 18 1 1 A 56 56 GLU CA C 43 60.010 59.123 0.887 1
1 430 . 18 1 1 A 56 56 GLU CB C 43 29.070 29.379 -0.309 1
1 432 . 18 1 1 A 56 56 GLU N N 43 120.955 118.664 2.291 1
1 433 . 18 1 1 A 57 57 ILE H H 44 7.504 7.647 -0.143 1
1 434 . 18 1 1 A 57 57 ILE HA H 44 4.524 3.917 0.607 1
1 444 . 18 1 1 A 57 57 ILE C C 44 175.691 176.780 -1.089 1
1 445 . 18 1 1 A 57 57 ILE CA C 44 61.886 63.934 -2.048 1
1 446 . 18 1 1 A 57 57 ILE CB C 44 37.300 38.475 -1.175 1
1 450 . 18 1 1 A 57 57 ILE N N 44 109.594 118.189 -8.595 1
1 451 . 18 1 1 A 58 58 GLY H H 45 7.724 7.696 0.028 1
1 452 . 18 1 1 A 58 58 GLY HA2 H 45 3.650 4.152 -0.502 1
1 453 . 18 1 1 A 58 58 GLY HA3 H 45 4.530 4.301 0.229 1
1 454 . 18 1 1 A 58 58 GLY C C 45 174.613 175.696 -1.083 1
1 455 . 18 1 1 A 58 58 GLY CA C 45 45.947 45.193 0.754 1
1 456 . 18 1 1 A 58 58 GLY N N 45 106.680 107.363 -0.683 1
1 457 . 18 1 1 A 59 59 ILE H H 46 8.180 8.100 0.080 1
1 458 . 18 1 1 A 59 59 ILE HA H 46 3.907 4.279 -0.372 1
1 468 . 18 1 1 A 59 59 ILE C C 46 174.235 177.462 -3.227 1
1 469 . 18 1 1 A 59 59 ILE CA C 46 60.948 62.251 -1.303 1
1 470 . 18 1 1 A 59 59 ILE CB C 46 33.980 38.115 -4.135 1
1 474 . 18 1 1 A 59 59 ILE N N 46 122.454 117.579 4.875 1
1 475 . 18 1 1 A 60 60 LEU H H 47 7.367 8.033 -0.666 1
1 476 . 18 1 1 A 60 60 LEU HA H 47 3.900 4.168 -0.268 1
1 479 . 18 1 1 A 60 60 LEU C C 47 177.753 179.062 -1.309 1
1 480 . 18 1 1 A 60 60 LEU CA C 47 56.260 57.099 -0.839 1
1 481 . 18 1 1 A 60 60 LEU CB C 47 42.196 41.418 0.778 1
1 482 . 18 1 1 A 60 60 LEU N N 47 125.835 120.080 5.755 1
1 483 . 18 1 1 A 63 63 GLY HA2 H 50 3.980 4.070 -0.090 1
1 484 . 18 1 1 A 63 63 GLY HA3 H 50 3.950 4.090 -0.140 1
1 485 . 18 1 1 A 63 63 GLY C C 50 177.130 173.771 3.359 1
1 486 . 18 1 1 A 63 63 GLY CA C 50 46.884 44.609 2.275 1
1 487 . 18 1 1 A 64 64 HIS H H 51 7.926 8.788 -0.862 1
1 488 . 18 1 1 A 64 64 HIS HA H 51 4.451 4.194 0.257 1
1 493 . 18 1 1 A 64 64 HIS C C 51 177.613 175.160 2.453 1
1 494 . 18 1 1 A 64 64 HIS CA C 51 57.198 56.897 0.301 1
1 495 . 18 1 1 A 64 64 HIS CB C 51 30.945 29.261 1.684 1
1 498 . 18 1 1 A 64 64 HIS N N 51 122.284 120.333 1.951 1
1 499 . 18 1 1 A 65 65 ARG H H 52 8.105 8.039 0.066 1
1 500 . 18 1 1 A 65 65 ARG HA H 52 3.685 3.767 -0.082 1
1 507 . 18 1 1 A 65 65 ARG C C 52 177.769 178.403 -0.634 1
1 508 . 18 1 1 A 65 65 ARG CA C 52 61.886 59.373 2.513 1
1 509 . 18 1 1 A 65 65 ARG CB C 52 30.945 29.879 1.066 1
1 511 . 18 1 1 A 65 65 ARG N N 52 117.775 119.835 -2.060 1
1 513 . 18 1 1 A 66 66 GLN H H 53 8.090 8.049 0.041 1
1 514 . 18 1 1 A 66 66 GLN HA H 53 3.940 3.976 -0.036 1
1 519 . 18 1 1 A 66 66 GLN C C 53 178.583 178.295 0.288 1
1 520 . 18 1 1 A 66 66 GLN CA C 53 59.073 58.829 0.244 1
1 521 . 18 1 1 A 66 66 GLN CB C 53 28.133 28.898 -0.765 1
1 523 . 18 1 1 A 66 66 GLN N N 53 116.452 119.083 -2.631 1
1 524 . 18 1 1 A 67 67 ARG H H 54 7.845 7.643 0.202 1
1 525 . 18 1 1 A 67 67 ARG HA H 54 4.010 3.866 0.144 1
1 528 . 18 1 1 A 67 67 ARG C C 54 179.766 178.630 1.136 1
1 529 . 18 1 1 A 67 67 ARG CA C 54 59.073 59.084 -0.011 1
1 530 . 18 1 1 A 67 67 ARG CB C 54 30.720 29.323 1.397 1
1 532 . 18 1 1 A 67 67 ARG N N 54 119.275 118.672 0.603 1
1 533 . 18 1 1 A 68 68 ILE H H 55 8.032 7.797 0.235 1
1 534 . 18 1 1 A 68 68 ILE HA H 55 3.495 3.513 -0.018 1
1 544 . 18 1 1 A 68 68 ILE C C 55 177.108 177.965 -0.857 1
1 545 . 18 1 1 A 68 68 ILE CA C 55 66.230 65.110 1.120 1
1 546 . 18 1 1 A 68 68 ILE CB C 55 38.020 37.248 0.772 1
1 550 . 18 1 1 A 68 68 ILE N N 55 121.152 120.459 0.693 1
1 551 . 18 1 1 A 69 69 LEU H H 56 8.490 8.408 0.082 1
1 552 . 18 1 1 A 69 69 LEU HA H 56 4.010 3.925 0.085 1
1 561 . 18 1 1 A 69 69 LEU C C 56 179.917 178.510 1.407 1
1 562 . 18 1 1 A 69 69 LEU CA C 56 58.135 58.436 -0.301 1
1 563 . 18 1 1 A 69 69 LEU CB C 56 41.259 41.814 -0.555 1
1 566 . 18 1 1 A 69 69 LEU N N 56 119.072 121.455 -2.383 1
1 567 . 18 1 1 A 70 70 GLN H H 57 8.327 8.400 -0.073 1
1 568 . 18 1 1 A 70 70 GLN HA H 57 4.100 3.908 0.192 1
1 573 . 18 1 1 A 70 70 GLN C C 57 178.798 178.056 0.742 1
1 574 . 18 1 1 A 70 70 GLN CA C 57 59.073 58.898 0.175 1
1 575 . 18 1 1 A 70 70 GLN CB C 57 28.133 28.354 -0.221 1
1 577 . 18 1 1 A 70 70 GLN N N 57 118.172 118.163 0.009 1
1 578 . 18 1 1 A 71 71 ALA H H 58 7.810 7.843 -0.033 1
1 579 . 18 1 1 A 71 71 ALA HA H 58 4.320 4.098 0.222 1
1 583 . 18 1 1 A 71 71 ALA C C 58 172.232 179.317 -7.085 1
1 584 . 18 1 1 A 71 71 ALA CA C 58 55.323 55.191 0.132 1
1 585 . 18 1 1 A 71 71 ALA CB C 58 19.720 18.929 0.791 1
1 586 . 18 1 1 A 71 71 ALA N N 58 122.536 122.070 0.466 1
1 587 . 18 1 1 A 72 72 ILE H H 59 8.840 8.532 0.308 1
1 588 . 18 1 1 A 72 72 ILE HA H 59 4.030 4.050 -0.020 1
1 598 . 18 1 1 A 72 72 ILE C C 59 178.678 177.390 1.288 1
1 599 . 18 1 1 A 72 72 ILE CA C 59 64.698 63.872 0.826 1
1 600 . 18 1 1 A 72 72 ILE CB C 59 37.850 37.492 0.358 1
1 604 . 18 1 1 A 72 72 ILE N N 59 118.111 119.069 -0.958 1
1 605 . 18 1 1 A 73 73 GLN H H 60 7.547 8.045 -0.498 1
1 606 . 18 1 1 A 73 73 GLN HA H 60 4.121 4.112 0.009 1
1 611 . 18 1 1 A 73 73 GLN C C 60 176.556 177.860 -1.304 1
1 612 . 18 1 1 A 73 73 GLN CA C 60 58.135 58.440 -0.305 1
1 613 . 18 1 1 A 73 73 GLN CB C 60 28.300 28.516 -0.216 1
1 615 . 18 1 1 A 73 73 GLN N N 60 119.094 120.863 -1.769 1
1 616 . 18 1 1 A 74 74 LEU H H 61 7.350 7.949 -0.599 1
1 617 . 18 1 1 A 74 74 LEU HA H 61 4.408 4.175 0.233 1
1 626 . 18 1 1 A 74 74 LEU C C 61 177.960 177.277 0.683 1
1 627 . 18 1 1 A 74 74 LEU CA C 61 54.900 56.786 -1.886 1
1 628 . 18 1 1 A 74 74 LEU CB C 61 42.196 41.731 0.465 1
1 631 . 18 1 1 A 74 74 LEU N N 61 115.853 120.209 -4.356 1
1 632 . 18 1 1 A 75 75 LEU H H 62 7.358 7.484 -0.126 1
1 633 . 18 1 1 A 75 75 LEU HA H 62 4.530 4.439 0.091 1
1 642 . 18 1 1 A 75 75 LEU C C 62 177.035 174.836 2.199 1
1 643 . 18 1 1 A 75 75 LEU CA C 62 53.200 53.900 -0.700 1
1 644 . 18 1 1 A 75 75 LEU CB C 62 40.700 41.211 -0.511 1
1 647 . 18 1 1 A 75 75 LEU N N 62 121.010 122.534 -1.524 1
1 648 . 18 1 1 A 76 76 PRO HA H 63 4.382 4.646 -0.264 1
1 655 . 18 1 1 A 76 76 PRO CB C 63 31.883 33.056 -1.173 1
1 657 . 18 1 1 A 77 77 LYS H H 64 8.418 8.530 -0.112 1
1 658 . 18 1 1 A 77 77 LYS HA H 64 4.140 5.238 -1.098 1
1 663 . 18 1 1 A 77 77 LYS C C 64 177.122 174.433 2.689 1
1 664 . 18 1 1 A 77 77 LYS CA C 64 56.260 54.571 1.689 1
1 665 . 18 1 1 A 77 77 LYS CB C 64 33.340 36.616 -3.276 1
1 668 . 18 1 1 A 77 77 LYS N N 64 121.932 115.348 6.584 1
1 669 . 18 1 1 A 78 78 MET H H 65 8.550 8.727 -0.177 1
1 670 . 18 1 1 A 78 78 MET HA H 65 4.304 5.118 -0.814 1
1 676 . 18 1 1 A 78 78 MET C C 65 176.105 176.194 -0.089 1
1 677 . 18 1 1 A 78 78 MET CA C 65 56.260 54.384 1.876 1
1 678 . 18 1 1 A 78 78 MET CB C 65 32.821 35.705 -2.884 1
1 680 . 18 1 1 A 78 78 MET N N 65 123.498 119.315 4.183 1
1 681 . 18 1 1 A 79 79 ARG H H 66 8.731 8.719 0.012 1
1 682 . 18 1 1 A 79 79 ARG C C 66 173.577 176.758 -3.181 1
1 683 . 18 1 1 A 79 79 ARG CA C 66 53.447 61.050 -7.603 1
1 684 . 18 1 1 A 79 79 ARG CB C 66 30.008 28.730 1.278 1
1 685 . 18 1 1 A 79 79 ARG N N 66 127.355 125.654 1.701 1
1 686 . 18 1 1 A 80 80 PRO HA H 67 4.780 4.684 0.096 1
1 693 . 18 1 1 A 80 80 PRO C C 67 177.043 175.371 1.672 1
1 694 . 18 1 1 A 80 80 PRO CA C 67 61.886 62.519 -0.633 1
1 695 . 18 1 1 A 80 80 PRO CB C 67 32.821 32.531 0.290 1
1 698 . 18 1 1 A 81 81 ILE H H 68 8.580 8.410 0.170 1
1 699 . 18 1 1 A 81 81 ILE HA H 68 4.040 4.478 -0.438 1
1 709 . 18 1 1 A 81 81 ILE C C 68 176.831 175.427 1.404 1
1 710 . 18 1 1 A 81 81 ILE CA C 68 62.823 60.318 2.505 1
1 711 . 18 1 1 A 81 81 ILE CB C 68 38.580 38.233 0.347 1
1 715 . 18 1 1 A 81 81 ILE N N 68 118.491 121.317 -2.826 1
1 716 . 18 1 1 A 82 82 GLY H H 69 8.602 8.981 -0.379 1
1 717 . 18 1 1 A 82 82 GLY CA C 69 45.009 46.553 -1.544 1
1 718 . 18 1 1 A 82 82 GLY N N 69 111.377 115.122 -3.745 1
1 721 . 18 1 1 A 84 84 ASP HA H 71 4.490 5.381 -0.891 1
1 724 . 18 1 1 A 84 84 ASP CA C 71 54.385 52.763 1.622 1
1 725 . 18 1 1 A 84 84 ASP CB C 71 40.321 45.347 -5.026 1
1 726 . 18 1 1 A 85 85 GLY H H 72 8.054 8.159 -0.105 1
1 727 . 18 1 1 A 85 85 GLY HA2 H 72 4.040 4.123 -0.083 1
1 728 . 18 1 1 A 85 85 GLY HA3 H 72 3.750 4.154 -0.404 1
1 729 . 18 1 1 A 85 85 GLY C C 72 173.474 172.380 1.094 1
1 730 . 18 1 1 A 85 85 GLY CA C 72 45.009 45.214 -0.205 1
1 731 . 18 1 1 A 85 85 GLY N N 72 108.038 109.933 -1.895 1
1 732 . 18 1 1 A 86 86 ALA H H 73 7.858 8.191 -0.333 1
1 733 . 18 1 1 A 86 86 ALA HA H 73 4.370 4.996 -0.626 1
1 737 . 18 1 1 A 86 86 ALA CA C 73 51.990 50.475 1.515 1
1 738 . 18 1 1 A 86 86 ALA CB C 73 19.220 22.335 -3.115 1
1 739 . 18 1 1 A 86 86 ALA N N 73 123.819 125.185 -1.366 1
1 742 . 18 1 1 A 90 90 SER H H 77 7.839 7.959 -0.120 1
1 743 . 18 1 1 A 90 90 SER HA H 77 4.770 4.910 -0.140 1
1 746 . 18 1 1 A 90 90 SER N N 77 115.163 113.402 1.761 1
1 747 . 18 1 1 A 91 91 VAL H H 78 8.578 8.557 0.021 1
1 748 . 18 1 1 A 91 91 VAL HA H 78 3.981 3.920 0.061 1
1 756 . 18 1 1 A 91 91 VAL C C 78 177.480 177.332 0.148 1
1 757 . 18 1 1 A 91 91 VAL CA C 78 67.060 66.230 0.830 1
1 758 . 18 1 1 A 91 91 VAL CB C 78 32.500 31.586 0.914 1
1 761 . 18 1 1 A 91 91 VAL N N 78 123.481 125.378 -1.897 1
1 762 . 18 1 1 A 92 92 ALA H H 79 8.607 8.396 0.211 1
1 763 . 18 1 1 A 92 92 ALA HA H 79 4.113 4.036 0.077 1
1 767 . 18 1 1 A 92 92 ALA C C 79 179.868 180.474 -0.606 1
1 768 . 18 1 1 A 92 92 ALA CA C 79 54.890 55.475 -0.585 1
1 769 . 18 1 1 A 92 92 ALA CB C 79 18.790 18.654 0.136 1
1 770 . 18 1 1 A 92 92 ALA N N 79 120.334 122.447 -2.113 1
1 771 . 18 1 1 A 93 93 GLU H H 80 7.886 8.180 -0.294 1
1 772 . 18 1 1 A 93 93 GLU HA H 80 4.010 4.099 -0.089 1
1 777 . 18 1 1 A 93 93 GLU C C 80 179.719 178.890 0.829 1
1 778 . 18 1 1 A 93 93 GLU CA C 80 59.073 59.035 0.038 1
1 779 . 18 1 1 A 93 93 GLU CB C 80 30.630 29.307 1.323 1
1 781 . 18 1 1 A 93 93 GLU N N 80 117.643 117.405 0.238 1
1 782 . 18 1 1 A 94 94 TRP H H 81 8.299 8.281 0.018 1
1 783 . 18 1 1 A 94 94 TRP HA H 81 4.251 4.195 0.056 1
1 792 . 18 1 1 A 94 94 TRP C C 81 178.772 177.859 0.913 1
1 793 . 18 1 1 A 94 94 TRP CA C 81 60.010 61.190 -1.180 1
1 794 . 18 1 1 A 94 94 TRP CB C 81 27.650 29.761 -2.111 1
1 800 . 18 1 1 A 94 94 TRP N N 81 122.545 122.480 0.065 1
1 802 . 18 1 1 A 95 95 LEU H H 82 8.505 8.278 0.227 1
1 803 . 18 1 1 A 95 95 LEU HA H 82 2.880 3.224 -0.344 1
1 812 . 18 1 1 A 95 95 LEU C C 82 180.235 177.713 2.522 1
1 813 . 18 1 1 A 95 95 LEU CA C 82 57.400 56.785 0.615 1
1 814 . 18 1 1 A 95 95 LEU CB C 82 40.321 41.033 -0.712 1
1 817 . 18 1 1 A 95 95 LEU N N 82 121.110 118.962 2.148 1
1 818 . 18 1 1 A 96 96 ASP H H 83 8.185 8.113 0.072 1
1 819 . 18 1 1 A 96 96 ASP HA H 83 4.280 4.447 -0.167 1
1 822 . 18 1 1 A 96 96 ASP C C 83 175.224 176.961 -1.737 1
1 823 . 18 1 1 A 96 96 ASP CA C 83 57.310 55.586 1.724 1
1 824 . 18 1 1 A 96 96 ASP CB C 83 40.321 40.339 -0.018 1
1 825 . 18 1 1 A 96 96 ASP N N 83 119.082 119.669 -0.587 1
1 826 . 18 1 1 A 97 97 SER H H 84 7.989 7.973 0.016 1
1 827 . 18 1 1 A 97 97 SER HA H 84 4.250 4.604 -0.354 1
1 830 . 18 1 1 A 97 97 SER C C 84 175.346 175.285 0.061 1
1 831 . 18 1 1 A 97 97 SER CA C 84 60.948 57.699 3.249 1
1 832 . 18 1 1 A 97 97 SER CB C 84 63.370 63.556 -0.186 1
1 833 . 18 1 1 A 97 97 SER N N 84 117.579 114.004 3.575 1
1 834 . 18 1 1 A 98 98 ILE H H 85 6.862 7.233 -0.371 1
1 835 . 18 1 1 A 98 98 ILE HA H 85 4.550 3.973 0.577 1
1 843 . 18 1 1 A 98 98 ILE C C 85 173.308 177.160 -3.852 1
1 844 . 18 1 1 A 98 98 ILE CA C 85 60.948 62.571 -1.623 1
1 845 . 18 1 1 A 98 98 ILE CB C 85 37.760 38.137 -0.377 1
1 848 . 18 1 1 A 98 98 ILE N N 85 113.733 119.904 -6.171 1
1 849 . 18 1 1 A 99 99 GLU H H 86 7.705 7.570 0.135 1
1 850 . 18 1 1 A 99 99 GLU HA H 86 4.280 4.479 -0.199 1
1 853 . 18 1 1 A 99 99 GLU C C 86 175.224 175.699 -0.475 1
1 854 . 18 1 1 A 99 99 GLU CA C 86 56.260 55.771 0.489 1
1 855 . 18 1 1 A 99 99 GLU CB C 86 26.258 30.187 -3.929 1
1 857 . 18 1 1 A 99 99 GLU N N 86 115.493 115.815 -0.322 1
1 858 . 18 1 1 A 100 100 LEU H H 87 7.989 7.169 0.820 1
1 859 . 18 1 1 A 100 100 LEU HA H 87 4.220 4.715 -0.495 1
1 868 . 18 1 1 A 100 100 LEU C C 87 176.965 175.591 1.374 1
1 869 . 18 1 1 A 100 100 LEU CA C 87 52.510 52.926 -0.416 1
1 870 . 18 1 1 A 100 100 LEU CB C 87 42.196 46.661 -4.465 1
1 873 . 18 1 1 A 100 100 LEU N N 87 117.579 120.270 -2.691 1
1 874 . 18 1 1 A 101 101 GLY H H 88 8.503 8.162 0.341 1
1 875 . 18 1 1 A 101 101 GLY CA C 88 46.884 45.742 1.142 1
1 876 . 18 1 1 A 101 101 GLY N N 88 107.794 108.631 -0.837 1
1 877 . 18 1 1 A 102 102 ASP HA H 89 4.431 4.297 0.134 1
1 880 . 18 1 1 A 102 102 ASP C C 89 178.075 178.467 -0.392 1
1 881 . 18 1 1 A 102 102 ASP CA C 89 57.198 56.839 0.359 1
1 882 . 18 1 1 A 102 102 ASP CB C 89 40.321 40.236 0.085 1
1 883 . 18 1 1 A 103 103 TYR H H 90 7.899 8.099 -0.200 1
1 884 . 18 1 1 A 103 103 TYR HA H 90 4.940 4.445 0.495 1
1 889 . 18 1 1 A 103 103 TYR C C 90 175.527 178.536 -3.009 1
1 890 . 18 1 1 A 103 103 TYR CA C 90 58.135 60.559 -2.424 1
1 891 . 18 1 1 A 103 103 TYR CB C 90 38.446 37.549 0.897 1
1 894 . 18 1 1 A 103 103 TYR N N 90 115.595 119.413 -3.818 1
1 895 . 18 1 1 A 104 104 THR H H 91 7.971 8.409 -0.438 1
1 896 . 18 1 1 A 104 104 THR HA H 91 4.234 4.036 0.198 1
1 901 . 18 1 1 A 104 104 THR C C 91 175.905 176.593 -0.688 1
1 902 . 18 1 1 A 104 104 THR CA C 91 68.449 67.179 1.270 1
1 904 . 18 1 1 A 104 104 THR N N 91 118.867 116.735 2.132 1
1 905 . 18 1 1 A 105 105 LYS H H 92 8.555 7.913 0.642 1
1 906 . 18 1 1 A 105 105 LYS HA H 92 3.940 4.052 -0.112 1
1 912 . 18 1 1 A 105 105 LYS C C 92 177.310 178.660 -1.350 1
1 913 . 18 1 1 A 105 105 LYS CA C 92 60.948 59.475 1.473 1
1 914 . 18 1 1 A 105 105 LYS CB C 92 31.883 32.349 -0.466 1
1 917 . 18 1 1 A 105 105 LYS N N 92 119.259 121.564 -2.305 1
1 918 . 18 1 1 A 106 106 ALA H H 93 7.920 8.052 -0.132 1
1 919 . 18 1 1 A 106 106 ALA HA H 93 4.128 4.187 -0.059 1
1 923 . 18 1 1 A 106 106 ALA C C 93 180.972 180.350 0.622 1
1 924 . 18 1 1 A 106 106 ALA CA C 93 55.070 55.179 -0.109 1
1 925 . 18 1 1 A 106 106 ALA CB C 93 17.750 18.407 -0.657 1
1 926 . 18 1 1 A 106 106 ALA N N 93 120.398 122.266 -1.868 1
1 927 . 18 1 1 A 107 107 PHE H H 94 8.136 8.579 -0.443 1
1 928 . 18 1 1 A 107 107 PHE HA H 94 4.190 4.596 -0.406 1
1 934 . 18 1 1 A 107 107 PHE C C 94 177.955 178.340 -0.385 1
1 935 . 18 1 1 A 107 107 PHE CA C 94 63.761 61.582 2.179 1
1 936 . 18 1 1 A 107 107 PHE CB C 94 38.446 38.901 -0.455 1
1 940 . 18 1 1 A 107 107 PHE N N 94 117.119 116.288 0.831 1
1 941 . 18 1 1 A 108 108 LEU H H 95 8.351 8.673 -0.322 1
1 942 . 18 1 1 A 108 108 LEU HA H 95 3.889 4.006 -0.117 1
1 951 . 18 1 1 A 108 108 LEU C C 95 182.043 179.228 2.815 1
1 952 . 18 1 1 A 108 108 LEU CA C 95 59.073 58.559 0.514 1
1 953 . 18 1 1 A 108 108 LEU CB C 95 41.259 42.021 -0.762 1
1 956 . 18 1 1 A 108 108 LEU N N 95 118.450 119.821 -1.371 1
1 957 . 18 1 1 A 109 109 ILE H H 96 8.992 8.142 0.850 1
1 958 . 18 1 1 A 109 109 ILE HA H 96 4.069 3.859 0.210 1
1 968 . 18 1 1 A 109 109 ILE C C 96 177.094 177.678 -0.584 1
1 969 . 18 1 1 A 109 109 ILE CA C 96 63.761 64.452 -0.691 1
1 970 . 18 1 1 A 109 109 ILE CB C 96 37.509 37.716 -0.207 1
1 974 . 18 1 1 A 109 109 ILE N N 96 118.177 115.052 3.125 1
1 975 . 18 1 1 A 110 110 ASN H H 97 7.067 8.012 -0.945 1
1 976 . 18 1 1 A 110 110 ASN HA H 97 4.797 4.668 0.129 1
1 981 . 18 1 1 A 110 110 ASN C C 97 173.595 175.313 -1.718 1
1 982 . 18 1 1 A 110 110 ASN CA C 97 54.385 53.334 1.051 1
1 983 . 18 1 1 A 110 110 ASN CB C 97 40.321 38.917 1.404 1
1 984 . 18 1 1 A 110 110 ASN N N 97 116.407 119.437 -3.030 1
1 986 . 18 1 1 A 111 111 GLY H H 98 7.681 8.082 -0.401 1
1 987 . 18 1 1 A 111 111 GLY HA2 H 98 4.080 3.909 0.171 1
1 988 . 18 1 1 A 111 111 GLY HA3 H 98 3.640 4.005 -0.365 1
1 989 . 18 1 1 A 111 111 GLY C C 98 174.552 174.148 0.404 1
1 990 . 18 1 1 A 111 111 GLY CA C 98 45.947 44.889 1.058 1
1 991 . 18 1 1 A 111 111 GLY N N 98 104.440 105.748 -1.308 1
1 992 . 18 1 1 A 112 112 TYR H H 99 8.427 8.231 0.196 1
1 993 . 18 1 1 A 112 112 TYR HA H 99 4.661 4.829 -0.168 1
1 998 . 18 1 1 A 112 112 TYR C C 99 174.425 176.666 -2.241 1
1 999 . 18 1 1 A 112 112 TYR CA C 99 57.198 57.452 -0.254 1
1 1000 . 18 1 1 A 112 112 TYR CB C 99 36.571 37.663 -1.092 1
1 1003 . 18 1 1 A 112 112 TYR N N 99 122.830 120.316 2.514 1
1 1004 . 18 1 1 A 113 113 THR H H 100 7.166 7.945 -0.779 1
1 1005 . 18 1 1 A 113 113 THR HA H 100 4.248 4.433 -0.185 1
1 1009 . 18 1 1 A 113 113 THR C C 100 174.897 175.104 -0.207 1
1 1010 . 18 1 1 A 113 113 THR CA C 100 62.290 63.459 -1.169 1
1 1011 . 18 1 1 A 113 113 THR CB C 100 68.970 69.012 -0.042 1
1 1013 . 18 1 1 A 113 113 THR N N 100 104.304 115.910 -11.606 1
1 1014 . 18 1 1 A 114 114 SER H H 101 7.695 7.953 -0.258 1
1 1015 . 18 1 1 A 114 114 SER C C 101 174.372 175.208 -0.836 1
1 1016 . 18 1 1 A 114 114 SER CA C 101 56.260 58.121 -1.861 1
1 1017 . 18 1 1 A 114 114 SER CB C 101 65.636 64.581 1.055 1
1 1018 . 18 1 1 A 114 114 SER N N 101 115.613 117.368 -1.755 1
1 1023 . 18 1 1 A 116 116 ASP HA H 103 4.260 4.296 -0.036 1
1 1026 . 18 1 1 A 116 116 ASP CA C 103 57.198 57.644 -0.446 1
1 1027 . 18 1 1 A 116 116 ASP CB C 103 40.321 40.313 0.008 1
1 1028 . 18 1 1 A 117 117 LEU H H 104 7.345 7.862 -0.517 1
1 1029 . 18 1 1 A 117 117 LEU HA H 104 4.290 3.996 0.294 1
1 1038 . 18 1 1 A 117 117 LEU C C 104 178.488 178.641 -0.153 1
1 1039 . 18 1 1 A 117 117 LEU CA C 104 56.260 57.917 -1.657 1
1 1040 . 18 1 1 A 117 117 LEU CB C 104 42.196 41.279 0.917 1
1 1043 . 18 1 1 A 117 117 LEU N N 104 117.878 117.816 0.062 1
1 1044 . 18 1 1 A 118 118 LEU H H 105 7.514 8.112 -0.598 1
1 1045 . 18 1 1 A 118 118 LEU HA H 105 4.210 4.099 0.111 1
1 1054 . 18 1 1 A 118 118 LEU C C 105 177.002 177.672 -0.670 1
1 1055 . 18 1 1 A 118 118 LEU CA C 105 55.323 56.840 -1.517 1
1 1056 . 18 1 1 A 118 118 LEU CB C 105 42.196 41.195 1.001 1
1 1059 . 18 1 1 A 118 118 LEU N N 105 119.094 118.919 0.175 1
1 1060 . 18 1 1 A 120 120 LYS HA H 107 4.340 4.482 -0.142 1
1 1063 . 18 1 1 A 120 120 LYS C C 107 176.603 176.192 0.411 1
1 1064 . 18 1 1 A 120 120 LYS CA C 107 55.323 57.656 -2.333 1
1 1065 . 18 1 1 A 120 120 LYS CB C 107 31.883 34.475 -2.592 1
1 1068 . 18 1 1 A 121 121 ILE H H 108 7.539 7.050 0.489 1
1 1069 . 18 1 1 A 121 121 ILE HA H 108 3.987 4.195 -0.208 1
1 1079 . 18 1 1 A 121 121 ILE C C 108 173.247 175.843 -2.596 1
1 1080 . 18 1 1 A 121 121 ILE CA C 108 62.823 61.183 1.640 1
1 1081 . 18 1 1 A 121 121 ILE CB C 108 38.446 38.886 -0.440 1
1 1085 . 18 1 1 A 121 121 ILE N N 108 122.417 115.883 6.534 1
1 1086 . 18 1 1 A 122 122 ALA H H 109 8.290 8.236 0.054 1
1 1087 . 18 1 1 A 122 122 ALA HA H 109 3.970 4.716 -0.746 1
1 1091 . 18 1 1 A 122 122 ALA C C 109 178.318 178.015 0.303 1
1 1092 . 18 1 1 A 122 122 ALA CA C 109 50.150 50.085 0.065 1
1 1093 . 18 1 1 A 122 122 ALA CB C 109 21.630 20.828 0.802 1
1 1094 . 18 1 1 A 122 122 ALA N N 109 127.784 125.245 2.539 1
1 1095 . 18 1 1 A 123 123 GLU HA H 110 3.707 3.951 -0.244 1
1 1099 . 18 1 1 A 123 123 GLU C C 110 178.290 178.773 -0.483 1
1 1100 . 18 1 1 A 123 123 GLU CA C 110 60.948 59.725 1.223 1
1 1101 . 18 1 1 A 123 123 GLU CB C 110 29.070 29.494 -0.424 1
1 1102 . 18 1 1 A 124 124 VAL H H 111 8.333 8.177 0.156 1
1 1103 . 18 1 1 A 124 124 VAL HA H 111 3.850 3.769 0.081 1
1 1111 . 18 1 1 A 124 124 VAL C C 111 177.406 177.680 -0.274 1
1 1112 . 18 1 1 A 124 124 VAL CA C 111 65.636 65.089 0.547 1
1 1113 . 18 1 1 A 124 124 VAL CB C 111 30.730 31.241 -0.511 1
1 1116 . 18 1 1 A 124 124 VAL N N 111 114.438 120.480 -6.042 1
1 1117 . 18 1 1 A 125 125 GLU H H 112 7.442 8.396 -0.954 1
1 1118 . 18 1 1 A 125 125 GLU HA H 112 4.152 4.004 0.148 1
1 1123 . 18 1 1 A 125 125 GLU C C 112 179.982 178.929 1.053 1
1 1124 . 18 1 1 A 125 125 GLU CA C 112 60.010 59.113 0.897 1
1 1125 . 18 1 1 A 125 125 GLU CB C 112 30.008 29.231 0.777 1
1 1127 . 18 1 1 A 125 125 GLU N N 112 121.032 122.520 -1.488 1
1 1128 . 18 1 1 A 126 126 LEU H H 113 7.666 7.916 -0.250 1
1 1129 . 18 1 1 A 126 126 LEU HA H 113 3.846 3.945 -0.099 1
1 1138 . 18 1 1 A 126 126 LEU C C 113 176.991 178.610 -1.619 1
1 1139 . 18 1 1 A 126 126 LEU CA C 113 58.135 57.864 0.271 1
1 1140 . 18 1 1 A 126 126 LEU CB C 113 41.259 41.019 0.240 1
1 1143 . 18 1 1 A 126 126 LEU N N 113 118.731 118.587 0.144 1
1 1144 . 18 1 1 A 127 127 ILE H H 114 7.781 8.120 -0.339 1
1 1145 . 18 1 1 A 127 127 ILE HA H 114 3.502 3.840 -0.338 1
1 1153 . 18 1 1 A 127 127 ILE C C 114 178.195 176.995 1.200 1
1 1154 . 18 1 1 A 127 127 ILE CA C 114 65.636 63.766 1.870 1
1 1155 . 18 1 1 A 127 127 ILE CB C 114 40.321 37.470 2.851 1
1 1159 . 18 1 1 A 127 127 ILE N N 114 115.084 119.119 -4.035 1
1 1160 . 18 1 1 A 128 128 ASN H H 115 8.470 7.904 0.566 1
1 1161 . 18 1 1 A 128 128 ASN HA H 115 4.502 4.729 -0.227 1
1 1166 . 18 1 1 A 128 128 ASN C C 115 176.295 177.171 -0.876 1
1 1167 . 18 1 1 A 128 128 ASN CA C 115 56.260 54.217 2.043 1
1 1168 . 18 1 1 A 128 128 ASN CB C 115 39.384 39.299 0.085 1
1 1169 . 18 1 1 A 128 128 ASN N N 115 115.158 119.371 -4.213 1
1 1171 . 18 1 1 A 129 129 VAL H H 116 8.116 7.844 0.272 1
1 1172 . 18 1 1 A 129 129 VAL HA H 116 4.090 3.816 0.274 1
1 1180 . 18 1 1 A 129 129 VAL C C 116 176.740 177.736 -0.996 1
1 1181 . 18 1 1 A 129 129 VAL CA C 116 64.400 65.219 -0.819 1
1 1182 . 18 1 1 A 129 129 VAL CB C 116 32.050 32.298 -0.248 1
1 1185 . 18 1 1 A 129 129 VAL N N 116 118.698 119.600 -0.902 1
1 1186 . 18 1 1 A 130 130 LEU H H 117 7.294 7.926 -0.632 1
1 1187 . 18 1 1 A 130 130 LEU HA H 117 3.970 4.151 -0.181 1
1 1196 . 18 1 1 A 130 130 LEU C C 117 175.127 176.046 -0.919 1
1 1197 . 18 1 1 A 130 130 LEU CA C 117 56.260 54.869 1.391 1
1 1198 . 18 1 1 A 130 130 LEU CB C 117 41.259 42.071 -0.812 1
1 1201 . 18 1 1 A 130 130 LEU N N 117 116.201 119.005 -2.804 1
1 1202 . 18 1 1 A 131 131 LYS H H 118 6.594 7.378 -0.784 1
1 1203 . 18 1 1 A 131 131 LYS HA H 118 3.980 4.195 -0.215 1
1 1208 . 18 1 1 A 131 131 LYS C C 118 175.589 175.380 0.209 1
1 1209 . 18 1 1 A 131 131 LYS CA C 118 56.260 57.435 -1.175 1
1 1210 . 18 1 1 A 131 131 LYS CB C 118 28.133 29.253 -1.120 1
1 1212 . 18 1 1 A 131 131 LYS N N 118 111.172 115.925 -4.753 1
1 1213 . 18 1 1 A 132 132 ILE H H 119 8.245 7.951 0.294 1
1 1214 . 18 1 1 A 132 132 ILE HA H 119 4.090 4.368 -0.278 1
1 1224 . 18 1 1 A 132 132 ILE C C 119 175.161 175.820 -0.659 1
1 1225 . 18 1 1 A 132 132 ILE CA C 119 60.010 61.436 -1.426 1
1 1226 . 18 1 1 A 132 132 ILE CB C 119 35.633 37.169 -1.536 1
1 1230 . 18 1 1 A 132 132 ILE N N 119 119.484 120.106 -0.622 1
1 1231 . 18 1 1 A 133 133 ASN H H 120 8.054 9.145 -1.091 1
1 1232 . 18 1 1 A 133 133 ASN HA H 120 4.350 4.757 -0.407 1
1 1235 . 18 1 1 A 133 133 ASN C C 120 175.136 175.775 -0.639 1
1 1236 . 18 1 1 A 133 133 ASN CA C 120 54.385 54.876 -0.491 1
1 1237 . 18 1 1 A 133 133 ASN CB C 120 39.384 39.565 -0.181 1
1 1238 . 18 1 1 A 133 133 ASN N N 120 124.670 127.063 -2.393 1
1 1239 . 18 1 1 A 134 134 LEU H H 121 7.517 7.369 0.148 1
1 1240 . 18 1 1 A 134 134 LEU HA H 121 4.678 4.121 0.557 1
1 1249 . 18 1 1 A 134 134 LEU C C 121 178.051 177.641 0.410 1
1 1250 . 18 1 1 A 134 134 LEU CA C 121 53.447 56.102 -2.655 1
1 1251 . 18 1 1 A 134 134 LEU CB C 121 41.259 42.739 -1.480 1
1 1254 . 18 1 1 A 134 134 LEU N N 121 119.918 119.124 0.794 1
1 1255 . 18 1 1 A 135 135 ILE H H 122 9.389 8.644 0.745 1
1 1256 . 18 1 1 A 135 135 ILE HA H 122 3.540 3.715 -0.175 1
1 1266 . 18 1 1 A 135 135 ILE C C 122 176.425 177.971 -1.546 1
1 1267 . 18 1 1 A 135 135 ILE CA C 122 65.636 65.313 0.323 1
1 1268 . 18 1 1 A 135 135 ILE CB C 122 38.446 38.105 0.341 1
1 1272 . 18 1 1 A 135 135 ILE N N 122 129.949 126.147 3.802 1
1 1273 . 18 1 1 A 136 136 GLY H H 123 8.675 8.357 0.318 1
1 1274 . 18 1 1 A 136 136 GLY HA2 H 123 2.650 3.136 -0.486 1
1 1275 . 18 1 1 A 136 136 GLY HA3 H 123 2.060 3.488 -1.428 1
1 1276 . 18 1 1 A 136 136 GLY C C 123 176.854 176.710 0.144 1
1 1277 . 18 1 1 A 136 136 GLY CA C 123 45.500 47.096 -1.596 1
1 1278 . 18 1 1 A 136 136 GLY N N 123 106.314 107.611 -1.297 1
1 1279 . 18 1 1 A 137 137 HIS H H 124 6.869 7.838 -0.969 1
1 1280 . 18 1 1 A 137 137 HIS HA H 124 4.558 4.602 -0.044 1
1 1285 . 18 1 1 A 137 137 HIS C C 124 176.977 177.749 -0.772 1
1 1286 . 18 1 1 A 137 137 HIS CA C 124 57.198 58.408 -1.210 1
1 1287 . 18 1 1 A 137 137 HIS CB C 124 30.945 29.502 1.443 1
1 1290 . 18 1 1 A 137 137 HIS N N 124 118.865 120.115 -1.250 1
1 1291 . 18 1 1 A 138 138 ARG H H 125 7.730 8.200 -0.470 1
1 1292 . 18 1 1 A 138 138 ARG HA H 125 3.770 3.972 -0.202 1
1 1299 . 18 1 1 A 138 138 ARG C C 125 178.288 178.481 -0.193 1
1 1300 . 18 1 1 A 138 138 ARG CA C 125 61.886 58.660 3.226 1
1 1301 . 18 1 1 A 138 138 ARG CB C 125 30.945 29.956 0.989 1
1 1304 . 18 1 1 A 138 138 ARG N N 125 118.149 118.095 0.054 1
1 1306 . 18 1 1 A 139 139 LYS H H 126 8.679 8.160 0.519 1
1 1307 . 18 1 1 A 139 139 LYS HA H 126 3.990 3.966 0.024 1
1 1310 . 18 1 1 A 139 139 LYS C C 126 179.184 178.838 0.346 1
1 1311 . 18 1 1 A 139 139 LYS CA C 126 58.135 59.455 -1.320 1
1 1312 . 18 1 1 A 139 139 LYS CB C 126 30.945 32.073 -1.128 1
1 1314 . 18 1 1 A 139 139 LYS N N 126 114.003 119.414 -5.411 1
1 1315 . 18 1 1 A 140 140 ARG H H 127 7.248 7.987 -0.739 1
1 1316 . 18 1 1 A 140 140 ARG HA H 127 3.870 3.946 -0.076 1
1 1324 . 18 1 1 A 140 140 ARG C C 127 177.772 178.681 -0.909 1
1 1325 . 18 1 1 A 140 140 ARG CA C 127 60.010 59.056 0.954 1
1 1326 . 18 1 1 A 140 140 ARG CB C 127 30.945 29.949 0.996 1
1 1329 . 18 1 1 A 140 140 ARG N N 127 120.072 118.286 1.786 1
1 1331 . 18 1 1 A 141 141 ILE H H 128 7.706 7.889 -0.183 1
1 1332 . 18 1 1 A 141 141 ILE HA H 128 3.530 3.671 -0.141 1
1 1340 . 18 1 1 A 141 141 ILE C C 128 177.669 178.162 -0.493 1
1 1341 . 18 1 1 A 141 141 ILE CA C 128 65.636 65.279 0.357 1
1 1342 . 18 1 1 A 141 141 ILE CB C 128 38.680 38.055 0.625 1
1 1345 . 18 1 1 A 141 141 ILE N N 128 118.730 120.719 -1.989 1
1 1346 . 18 1 1 A 142 142 LEU H H 129 8.194 7.979 0.215 1
1 1347 . 18 1 1 A 142 142 LEU HA H 129 3.950 3.982 -0.032 1
1 1356 . 18 1 1 A 142 142 LEU C C 129 179.960 178.525 1.435 1
1 1357 . 18 1 1 A 142 142 LEU CA C 129 58.135 57.951 0.184 1
1 1358 . 18 1 1 A 142 142 LEU CB C 129 41.259 41.350 -0.091 1
1 1361 . 18 1 1 A 142 142 LEU N N 129 117.675 121.338 -3.663 1
1 1362 . 18 1 1 A 143 143 ALA H H 130 8.294 8.312 -0.018 1
1 1363 . 18 1 1 A 143 143 ALA HA H 130 4.220 4.160 0.060 1
1 1367 . 18 1 1 A 143 143 ALA C C 130 179.899 179.621 0.278 1
1 1368 . 18 1 1 A 143 143 ALA CA C 130 54.385 55.084 -0.699 1
1 1369 . 18 1 1 A 143 143 ALA CB C 130 19.270 18.314 0.956 1
1 1370 . 18 1 1 A 143 143 ALA N N 130 121.096 121.431 -0.335 1
1 1371 . 18 1 1 A 144 144 SER H H 131 7.813 8.013 -0.200 1
1 1372 . 18 1 1 A 144 144 SER HA H 131 4.180 4.264 -0.084 1
1 1375 . 18 1 1 A 144 144 SER C C 131 175.457 175.950 -0.493 1
1 1376 . 18 1 1 A 144 144 SER CA C 131 60.948 61.298 -0.350 1
1 1377 . 18 1 1 A 144 144 SER CB C 131 63.761 63.199 0.562 1
1 1378 . 18 1 1 A 144 144 SER N N 131 112.102 113.772 -1.670 1
1 1379 . 18 1 1 A 145 145 LEU H H 132 7.747 7.939 -0.192 1
1 1380 . 18 1 1 A 145 145 LEU HA H 132 4.140 4.319 -0.179 1
1 1389 . 18 1 1 A 145 145 LEU C C 132 178.589 176.752 1.837 1
1 1390 . 18 1 1 A 145 145 LEU CA C 132 56.260 55.837 0.423 1
1 1391 . 18 1 1 A 145 145 LEU CB C 132 42.196 42.745 -0.549 1
1 1394 . 18 1 1 A 145 145 LEU N N 132 117.536 118.887 -1.351 1
1 1395 . 18 1 1 A 146 146 GLY H H 133 7.544 7.452 0.092 1
1 1396 . 18 1 1 A 146 146 GLY HA2 H 133 3.950 4.013 -0.063 1
1 1397 . 18 1 1 A 146 146 GLY HA3 H 133 3.100 4.019 -0.919 1
1 1398 . 18 1 1 A 146 146 GLY C C 133 173.372 171.762 1.610 1
1 1399 . 18 1 1 A 146 146 GLY CA C 133 45.947 45.440 0.507 1
1 1400 . 18 1 1 A 146 146 GLY N N 133 105.351 104.743 0.608 1
1 1401 . 18 1 1 A 147 147 ASP H H 134 8.342 8.602 -0.260 1
1 1402 . 18 1 1 A 147 147 ASP HA H 134 4.650 5.457 -0.807 1
1 1405 . 18 1 1 A 147 147 ASP C C 134 175.462 175.086 0.376 1
1 1406 . 18 1 1 A 147 147 ASP CA C 134 54.385 52.709 1.676 1
1 1407 . 18 1 1 A 147 147 ASP CB C 134 41.259 44.560 -3.301 1
1 1408 . 18 1 1 A 147 147 ASP N N 134 120.133 122.677 -2.544 1
1 14 . 19 1 1 A 15 15 GLN H H 2 8.439 8.912 -0.473 1
1 15 . 19 1 1 A 15 15 GLN HA H 2 4.594 5.052 -0.458 1
1 20 . 19 1 1 A 15 15 GLN C C 2 175.972 174.985 0.987 1
1 21 . 19 1 1 A 15 15 GLN CA C 2 56.260 54.029 2.231 1
1 22 . 19 1 1 A 15 15 GLN CB C 2 30.945 32.156 -1.211 1
1 24 . 19 1 1 A 15 15 GLN N N 2 124.997 126.042 -1.045 1
1 25 . 19 1 1 A 16 16 THR H H 3 8.347 8.523 -0.176 1
1 26 . 19 1 1 A 16 16 THR HA H 3 4.555 4.751 -0.196 1
1 31 . 19 1 1 A 16 16 THR C C 3 175.495 174.645 0.850 1
1 32 . 19 1 1 A 16 16 THR CA C 3 60.010 61.490 -1.480 1
1 33 . 19 1 1 A 16 16 THR CB C 3 71.261 72.055 -0.794 1
1 34 . 19 1 1 A 16 16 THR N N 3 113.011 117.308 -4.297 1
1 35 . 19 1 1 A 17 17 VAL H H 4 8.895 9.016 -0.121 1
1 36 . 19 1 1 A 17 17 VAL HA H 4 3.670 3.768 -0.098 1
1 44 . 19 1 1 A 17 17 VAL C C 4 178.449 177.808 0.641 1
1 45 . 19 1 1 A 17 17 VAL CA C 4 67.511 66.488 1.023 1
1 46 . 19 1 1 A 17 17 VAL CB C 4 31.883 31.626 0.257 1
1 49 . 19 1 1 A 17 17 VAL N N 4 121.854 125.687 -3.833 1
1 50 . 19 1 1 A 18 18 GLY H H 5 9.017 8.344 0.673 1
1 51 . 19 1 1 A 18 18 GLY HA2 H 5 3.940 3.793 0.147 1
1 52 . 19 1 1 A 18 18 GLY HA3 H 5 3.610 3.808 -0.198 1
1 53 . 19 1 1 A 18 18 GLY C C 5 176.186 175.844 0.342 1
1 54 . 19 1 1 A 18 18 GLY CA C 5 47.822 47.145 0.677 1
1 55 . 19 1 1 A 18 18 GLY N N 5 106.966 107.450 -0.484 1
1 56 . 19 1 1 A 19 19 GLN H H 6 8.072 8.035 0.037 1
1 57 . 19 1 1 A 19 19 GLN HA H 6 4.037 4.110 -0.073 1
1 62 . 19 1 1 A 19 19 GLN C C 6 179.488 178.706 0.782 1
1 63 . 19 1 1 A 19 19 GLN CA C 6 59.073 58.972 0.101 1
1 64 . 19 1 1 A 19 19 GLN CB C 6 28.489 28.804 -0.315 1
1 66 . 19 1 1 A 19 19 GLN N N 6 122.431 121.233 1.198 1
1 67 . 19 1 1 A 20 20 TRP H H 7 8.756 8.211 0.545 1
1 68 . 19 1 1 A 20 20 TRP HA H 7 4.160 4.323 -0.163 1
1 77 . 19 1 1 A 20 20 TRP C C 7 179.620 177.884 1.736 1
1 78 . 19 1 1 A 20 20 TRP CA C 7 61.886 61.144 0.742 1
1 79 . 19 1 1 A 20 20 TRP CB C 7 28.133 29.546 -1.413 1
1 85 . 19 1 1 A 20 20 TRP N N 7 124.265 122.763 1.502 1
1 87 . 19 1 1 A 21 21 LEU H H 8 9.148 8.771 0.377 1
1 88 . 19 1 1 A 21 21 LEU HA H 8 3.440 3.531 -0.091 1
1 97 . 19 1 1 A 21 21 LEU C C 8 180.521 178.357 2.164 1
1 98 . 19 1 1 A 21 21 LEU CA C 8 56.920 58.033 -1.113 1
1 99 . 19 1 1 A 21 21 LEU CB C 8 41.700 41.378 0.322 1
1 102 . 19 1 1 A 21 21 LEU N N 8 120.548 120.698 -0.150 1
1 103 . 19 1 1 A 22 22 GLU H H 9 8.284 8.499 -0.215 1
1 104 . 19 1 1 A 22 22 GLU HA H 9 3.740 3.924 -0.184 1
1 109 . 19 1 1 A 22 22 GLU C C 9 179.960 178.487 1.473 1
1 110 . 19 1 1 A 22 22 GLU CA C 9 60.010 59.794 0.216 1
1 111 . 19 1 1 A 22 22 GLU CB C 9 29.070 29.065 0.005 1
1 113 . 19 1 1 A 22 22 GLU N N 9 120.133 119.574 0.559 1
1 114 . 19 1 1 A 23 23 SER H H 10 7.891 7.791 0.100 1
1 115 . 19 1 1 A 23 23 SER HA H 10 4.250 4.185 0.065 1
1 118 . 19 1 1 A 23 23 SER C C 10 175.346 176.389 -1.043 1
1 119 . 19 1 1 A 23 23 SER CA C 10 60.948 61.327 -0.379 1
1 120 . 19 1 1 A 23 23 SER CB C 10 63.280 62.973 0.307 1
1 121 . 19 1 1 A 23 23 SER N N 10 117.044 114.242 2.802 1
1 122 . 19 1 1 A 24 24 ILE H H 11 6.862 7.580 -0.718 1
1 123 . 19 1 1 A 24 24 ILE HA H 11 4.487 3.870 0.617 1
1 133 . 19 1 1 A 24 24 ILE C C 11 175.812 175.771 0.041 1
1 134 . 19 1 1 A 24 24 ILE CA C 11 60.948 63.039 -2.091 1
1 135 . 19 1 1 A 24 24 ILE CB C 11 38.250 37.085 1.165 1
1 139 . 19 1 1 A 24 24 ILE N N 11 113.733 117.978 -4.245 1
1 140 . 19 1 1 A 25 25 GLY H H 12 7.628 7.483 0.145 1
1 141 . 19 1 1 A 25 25 GLY HA2 H 12 3.990 4.026 -0.036 1
1 142 . 19 1 1 A 25 25 GLY HA3 H 12 3.800 4.032 -0.232 1
1 143 . 19 1 1 A 25 25 GLY C C 12 173.647 171.765 1.882 1
1 144 . 19 1 1 A 25 25 GLY CA C 12 45.947 46.038 -0.091 1
1 145 . 19 1 1 A 25 25 GLY N N 12 109.763 109.600 0.163 1
1 146 . 19 1 1 A 26 26 LEU H H 13 7.620 8.107 -0.487 1
1 147 . 19 1 1 A 26 26 LEU C C 13 176.186 174.239 1.947 1
1 148 . 19 1 1 A 26 26 LEU CA C 13 52.700 51.932 0.768 1
1 149 . 19 1 1 A 26 26 LEU CB C 13 43.134 45.581 -2.447 1
1 150 . 19 1 1 A 26 26 LEU N N 13 118.778 122.274 -3.496 1
1 151 . 19 1 1 A 27 27 PRO HA H 14 4.120 4.654 -0.534 1
1 154 . 19 1 1 A 27 27 PRO C C 14 177.955 176.027 1.928 1
1 155 . 19 1 1 A 27 27 PRO CA C 14 64.698 62.274 2.424 1
1 156 . 19 1 1 A 27 27 PRO CB C 14 31.883 29.051 2.832 1
1 158 . 19 1 1 A 28 28 GLN H H 15 9.838 8.496 1.342 1
1 159 . 19 1 1 A 28 28 GLN HA H 15 4.240 4.347 -0.107 1
1 162 . 19 1 1 A 28 28 GLN C C 15 176.836 175.721 1.115 1
1 163 . 19 1 1 A 28 28 GLN CA C 15 58.135 55.300 2.835 1
1 164 . 19 1 1 A 28 28 GLN CB C 15 27.195 30.538 -3.343 1
1 166 . 19 1 1 A 28 28 GLN N N 15 120.414 122.336 -1.922 1
1 167 . 19 1 1 A 29 29 TYR H H 16 6.810 7.746 -0.936 1
1 168 . 19 1 1 A 29 29 TYR HA H 16 5.720 4.741 0.979 1
1 173 . 19 1 1 A 29 29 TYR C C 16 174.814 176.484 -1.670 1
1 174 . 19 1 1 A 29 29 TYR CA C 16 57.198 57.671 -0.473 1
1 175 . 19 1 1 A 29 29 TYR CB C 16 37.509 39.684 -2.175 1
1 178 . 19 1 1 A 29 29 TYR N N 16 119.718 118.694 1.024 1
1 179 . 19 1 1 A 30 30 GLU H H 17 7.509 8.171 -0.662 1
1 180 . 19 1 1 A 30 30 GLU HA H 17 3.650 4.069 -0.419 1
1 184 . 19 1 1 A 30 30 GLU C C 17 177.552 178.446 -0.894 1
1 185 . 19 1 1 A 30 30 GLU CA C 17 60.948 59.752 1.196 1
1 186 . 19 1 1 A 30 30 GLU CB C 17 30.008 28.759 1.249 1
1 188 . 19 1 1 A 30 30 GLU N N 17 122.417 123.165 -0.748 1
1 189 . 19 1 1 A 31 31 ASN H H 18 9.259 8.192 1.067 1
1 190 . 19 1 1 A 31 31 ASN HA H 18 4.451 4.474 -0.023 1
1 193 . 19 1 1 A 31 31 ASN C C 18 176.868 177.948 -1.080 1
1 194 . 19 1 1 A 31 31 ASN CA C 18 57.198 56.250 0.948 1
1 195 . 19 1 1 A 31 31 ASN CB C 18 38.446 39.524 -1.078 1
1 196 . 19 1 1 A 31 31 ASN N N 18 116.613 118.094 -1.481 1
1 197 . 19 1 1 A 32 32 HIS H H 19 8.898 8.064 0.834 1
1 198 . 19 1 1 A 32 32 HIS HA H 19 4.140 4.312 -0.172 1
1 202 . 19 1 1 A 32 32 HIS C C 19 178.269 177.784 0.485 1
1 203 . 19 1 1 A 32 32 HIS CA C 19 60.948 59.307 1.641 1
1 204 . 19 1 1 A 32 32 HIS CB C 19 30.008 29.889 0.119 1
1 206 . 19 1 1 A 32 32 HIS N N 19 118.926 118.253 0.673 1
1 207 . 19 1 1 A 33 33 LEU H H 20 7.825 9.055 -1.230 1
1 208 . 19 1 1 A 33 33 LEU HA H 20 4.305 3.936 0.369 1
1 218 . 19 1 1 A 33 33 LEU C C 20 179.190 179.105 0.085 1
1 219 . 19 1 1 A 33 33 LEU CA C 20 60.010 58.356 1.654 1
1 220 . 19 1 1 A 33 33 LEU CB C 20 40.321 41.942 -1.621 1
1 224 . 19 1 1 A 33 33 LEU N N 20 117.434 119.882 -2.448 1
1 225 . 19 1 1 A 34 34 MET H H 21 8.861 8.668 0.193 1
1 226 . 19 1 1 A 34 34 MET HA H 21 3.980 4.095 -0.115 1
1 234 . 19 1 1 A 34 34 MET C C 21 180.340 177.853 2.487 1
1 235 . 19 1 1 A 34 34 MET CA C 21 58.135 59.053 -0.918 1
1 236 . 19 1 1 A 34 34 MET CB C 21 30.945 32.068 -1.123 1
1 238 . 19 1 1 A 34 34 MET N N 21 118.111 118.589 -0.478 1
1 239 . 19 1 1 A 35 35 ALA H H 22 9.015 8.258 0.757 1
1 240 . 19 1 1 A 35 35 ALA HA H 22 4.239 4.152 0.087 1
1 244 . 19 1 1 A 35 35 ALA C C 22 178.058 178.598 -0.540 1
1 245 . 19 1 1 A 35 35 ALA CA C 22 53.800 54.563 -0.763 1
1 246 . 19 1 1 A 35 35 ALA CB C 22 18.397 18.325 0.072 1
1 247 . 19 1 1 A 35 35 ALA N N 22 120.068 121.585 -1.517 1
1 248 . 19 1 1 A 36 36 ASN H H 23 7.143 8.034 -0.891 1
1 249 . 19 1 1 A 36 36 ASN HA H 23 4.959 4.862 0.097 1
1 254 . 19 1 1 A 36 36 ASN C C 23 174.083 175.363 -1.280 1
1 255 . 19 1 1 A 36 36 ASN CA C 23 54.000 52.727 1.273 1
1 256 . 19 1 1 A 36 36 ASN CB C 23 41.300 38.881 2.419 1
1 257 . 19 1 1 A 36 36 ASN N N 23 111.560 114.983 -3.423 1
1 259 . 19 1 1 A 37 37 GLY H H 24 7.797 8.439 -0.642 1
1 260 . 19 1 1 A 37 37 GLY HA2 H 24 3.430 3.830 -0.400 1
1 261 . 19 1 1 A 37 37 GLY HA3 H 24 3.290 3.928 -0.638 1
1 262 . 19 1 1 A 37 37 GLY C C 24 173.163 174.657 -1.494 1
1 263 . 19 1 1 A 37 37 GLY CA C 24 45.947 45.181 0.766 1
1 264 . 19 1 1 A 37 37 GLY N N 24 106.170 108.075 -1.905 1
1 265 . 19 1 1 A 38 38 PHE H H 25 8.191 7.886 0.305 1
1 266 . 19 1 1 A 38 38 PHE HA H 25 4.910 4.751 0.159 1
1 271 . 19 1 1 A 38 38 PHE C C 25 173.496 175.497 -2.001 1
1 272 . 19 1 1 A 38 38 PHE CA C 25 56.550 56.456 0.094 1
1 273 . 19 1 1 A 38 38 PHE CB C 25 37.220 37.263 -0.043 1
1 276 . 19 1 1 A 38 38 PHE N N 25 122.454 119.786 2.668 1
1 277 . 19 1 1 A 39 39 ASP H H 26 6.756 8.487 -1.731 1
1 278 . 19 1 1 A 39 39 ASP HA H 26 5.077 4.912 0.165 1
1 281 . 19 1 1 A 39 39 ASP C C 26 177.463 175.405 2.058 1
1 282 . 19 1 1 A 39 39 ASP CA C 26 53.447 54.138 -0.691 1
1 283 . 19 1 1 A 39 39 ASP CB C 26 42.580 41.957 0.623 1
1 284 . 19 1 1 A 39 39 ASP N N 26 111.309 120.842 -9.533 1
1 285 . 19 1 1 A 40 40 ASN H H 27 7.495 7.905 -0.410 1
1 286 . 19 1 1 A 40 40 ASN HA H 27 4.820 4.960 -0.140 1
1 289 . 19 1 1 A 40 40 ASN C C 27 176.228 175.873 0.355 1
1 290 . 19 1 1 A 40 40 ASN CA C 27 52.510 52.003 0.507 1
1 291 . 19 1 1 A 40 40 ASN CB C 27 40.321 39.798 0.523 1
1 292 . 19 1 1 A 40 40 ASN N N 27 118.385 117.978 0.407 1
1 293 . 19 1 1 A 41 41 VAL H H 28 9.192 8.591 0.601 1
1 294 . 19 1 1 A 41 41 VAL HA H 28 3.550 3.592 -0.042 1
1 302 . 19 1 1 A 41 41 VAL C C 28 176.429 177.714 -1.285 1
1 303 . 19 1 1 A 41 41 VAL CA C 28 65.636 65.927 -0.291 1
1 304 . 19 1 1 A 41 41 VAL CB C 28 31.883 31.556 0.327 1
1 307 . 19 1 1 A 41 41 VAL N N 28 125.741 125.830 -0.089 1
1 308 . 19 1 1 A 42 42 GLN H H 29 8.203 8.143 0.060 1
1 309 . 19 1 1 A 42 42 GLN HA H 29 4.129 4.005 0.124 1
1 314 . 19 1 1 A 42 42 GLN C C 29 176.591 178.533 -1.942 1
1 315 . 19 1 1 A 42 42 GLN CA C 29 57.198 58.669 -1.471 1
1 316 . 19 1 1 A 42 42 GLN CB C 29 28.133 28.498 -0.365 1
1 318 . 19 1 1 A 42 42 GLN N N 29 116.452 120.291 -3.839 1
1 319 . 19 1 1 A 43 43 ALA H H 30 7.781 8.555 -0.774 1
1 320 . 19 1 1 A 43 43 ALA HA H 30 4.650 4.032 0.618 1
1 324 . 19 1 1 A 43 43 ALA C C 30 175.976 179.983 -4.007 1
1 325 . 19 1 1 A 43 43 ALA CA C 30 50.840 54.454 -3.614 1
1 326 . 19 1 1 A 43 43 ALA CB C 30 19.150 18.230 0.920 1
1 327 . 19 1 1 A 43 43 ALA N N 30 122.150 121.508 0.642 1
1 328 . 19 1 1 A 44 44 MET H H 31 7.739 8.039 -0.300 1
1 332 . 19 1 1 A 44 44 MET C C 31 178.275 177.054 1.221 1
1 333 . 19 1 1 A 44 44 MET CA C 31 55.323 56.262 -0.939 1
1 334 . 19 1 1 A 44 44 MET CB C 31 34.696 32.352 2.344 1
1 336 . 19 1 1 A 44 44 MET N N 31 118.149 116.522 1.627 1
1 337 . 19 1 1 A 45 45 GLY H H 32 7.611 8.254 -0.643 1
1 338 . 19 1 1 A 45 45 GLY N N 32 101.530 108.587 -7.057 1
1 339 . 19 1 1 A 47 47 ASN HA H 34 4.480 4.828 -0.348 1
1 342 . 19 1 1 A 47 47 ASN CA C 34 56.260 54.108 2.152 1
1 343 . 19 1 1 A 47 47 ASN CB C 34 39.384 40.675 -1.291 1
1 344 . 19 1 1 A 49 49 MET HA H 36 4.646 4.177 0.469 1
1 350 . 19 1 1 A 49 49 MET C C 36 173.651 175.182 -1.531 1
1 351 . 19 1 1 A 49 49 MET CA C 36 55.323 56.101 -0.778 1
1 352 . 19 1 1 A 49 49 MET CB C 36 35.633 31.194 4.439 1
1 355 . 19 1 1 A 50 50 GLU H H 37 9.203 8.172 1.031 1
1 356 . 19 1 1 A 50 50 GLU HA H 37 4.650 4.736 -0.086 1
1 361 . 19 1 1 A 50 50 GLU C C 37 177.008 177.292 -0.284 1
1 362 . 19 1 1 A 50 50 GLU CA C 37 54.385 54.826 -0.441 1
1 363 . 19 1 1 A 50 50 GLU CB C 37 33.758 32.553 1.205 1
1 365 . 19 1 1 A 50 50 GLU N N 37 123.229 120.864 2.365 1
1 366 . 19 1 1 A 51 51 ASP H H 38 9.032 8.963 0.069 1
1 367 . 19 1 1 A 51 51 ASP HA H 38 4.149 4.365 -0.216 1
1 370 . 19 1 1 A 51 51 ASP C C 38 177.994 178.238 -0.244 1
1 371 . 19 1 1 A 51 51 ASP CA C 38 59.073 56.974 2.099 1
1 372 . 19 1 1 A 51 51 ASP CB C 38 43.134 39.930 3.204 1
1 373 . 19 1 1 A 51 51 ASP N N 38 122.717 121.441 1.276 1
1 374 . 19 1 1 A 52 52 GLN H H 39 8.950 8.146 0.804 1
1 375 . 19 1 1 A 52 52 GLN HA H 39 3.940 3.968 -0.028 1
1 378 . 19 1 1 A 52 52 GLN C C 39 177.817 178.439 -0.622 1
1 379 . 19 1 1 A 52 52 GLN CA C 39 59.073 58.836 0.237 1
1 380 . 19 1 1 A 52 52 GLN CB C 39 28.133 28.321 -0.188 1
1 381 . 19 1 1 A 52 52 GLN N N 39 114.086 119.973 -5.887 1
1 382 . 19 1 1 A 53 53 ASP H H 40 7.214 8.181 -0.967 1
1 383 . 19 1 1 A 53 53 ASP HA H 40 4.370 4.535 -0.165 1
1 386 . 19 1 1 A 53 53 ASP C C 40 177.667 178.723 -1.056 1
1 387 . 19 1 1 A 53 53 ASP CA C 40 57.198 57.407 -0.209 1
1 388 . 19 1 1 A 53 53 ASP CB C 40 41.800 40.478 1.322 1
1 389 . 19 1 1 A 53 53 ASP N N 40 118.734 120.371 -1.637 1
1 390 . 19 1 1 A 54 54 LEU H H 41 7.180 8.261 -1.081 1
1 391 . 19 1 1 A 54 54 LEU HA H 41 3.990 4.073 -0.083 1
1 400 . 19 1 1 A 54 54 LEU C C 41 178.204 178.092 0.112 1
1 401 . 19 1 1 A 54 54 LEU CA C 41 56.260 57.989 -1.729 1
1 402 . 19 1 1 A 54 54 LEU CB C 41 41.259 41.714 -0.455 1
1 405 . 19 1 1 A 54 54 LEU N N 41 115.795 122.026 -6.231 1
1 406 . 19 1 1 A 55 55 LEU H H 42 7.823 7.851 -0.028 1
1 407 . 19 1 1 A 55 55 LEU HA H 42 3.920 4.189 -0.269 1
1 416 . 19 1 1 A 55 55 LEU C C 42 180.876 178.960 1.916 1
1 417 . 19 1 1 A 55 55 LEU CA C 42 58.135 57.183 0.952 1
1 418 . 19 1 1 A 55 55 LEU CB C 42 42.196 41.802 0.394 1
1 421 . 19 1 1 A 55 55 LEU N N 42 120.499 119.418 1.081 1
1 422 . 19 1 1 A 56 56 GLU H H 43 8.127 8.282 -0.155 1
1 423 . 19 1 1 A 56 56 GLU HA H 43 3.966 4.096 -0.130 1
1 428 . 19 1 1 A 56 56 GLU C C 43 178.801 179.092 -0.291 1
1 429 . 19 1 1 A 56 56 GLU CA C 43 60.010 59.447 0.563 1
1 430 . 19 1 1 A 56 56 GLU CB C 43 29.070 28.976 0.094 1
1 432 . 19 1 1 A 56 56 GLU N N 43 120.955 118.988 1.967 1
1 433 . 19 1 1 A 57 57 ILE H H 44 7.504 7.621 -0.117 1
1 434 . 19 1 1 A 57 57 ILE HA H 44 4.524 3.922 0.602 1
1 444 . 19 1 1 A 57 57 ILE C C 44 175.691 177.239 -1.548 1
1 445 . 19 1 1 A 57 57 ILE CA C 44 61.886 64.625 -2.739 1
1 446 . 19 1 1 A 57 57 ILE CB C 44 37.300 38.489 -1.189 1
1 450 . 19 1 1 A 57 57 ILE N N 44 109.594 118.776 -9.182 1
1 451 . 19 1 1 A 58 58 GLY H H 45 7.724 7.527 0.197 1
1 452 . 19 1 1 A 58 58 GLY HA2 H 45 3.650 4.272 -0.622 1
1 453 . 19 1 1 A 58 58 GLY HA3 H 45 4.530 4.405 0.125 1
1 454 . 19 1 1 A 58 58 GLY C C 45 174.613 173.343 1.270 1
1 455 . 19 1 1 A 58 58 GLY CA C 45 45.947 45.684 0.263 1
1 456 . 19 1 1 A 58 58 GLY N N 45 106.680 105.849 0.831 1
1 457 . 19 1 1 A 59 59 ILE H H 46 8.180 8.263 -0.083 1
1 458 . 19 1 1 A 59 59 ILE HA H 46 3.907 4.732 -0.825 1
1 468 . 19 1 1 A 59 59 ILE C C 46 174.235 175.880 -1.645 1
1 469 . 19 1 1 A 59 59 ILE CA C 46 60.948 59.913 1.035 1
1 470 . 19 1 1 A 59 59 ILE CB C 46 33.980 41.079 -7.099 1
1 474 . 19 1 1 A 59 59 ILE N N 46 122.454 120.545 1.909 1
1 475 . 19 1 1 A 60 60 LEU H H 47 7.367 8.726 -1.359 1
1 476 . 19 1 1 A 60 60 LEU HA H 47 3.900 4.312 -0.412 1
1 479 . 19 1 1 A 60 60 LEU C C 47 177.753 176.096 1.657 1
1 480 . 19 1 1 A 60 60 LEU CA C 47 56.260 54.221 2.039 1
1 481 . 19 1 1 A 60 60 LEU CB C 47 42.196 43.761 -1.565 1
1 482 . 19 1 1 A 60 60 LEU N N 47 125.835 126.468 -0.633 1
1 483 . 19 1 1 A 63 63 GLY HA2 H 50 3.980 3.781 0.199 1
1 484 . 19 1 1 A 63 63 GLY HA3 H 50 3.950 3.953 -0.003 1
1 485 . 19 1 1 A 63 63 GLY C C 50 177.130 174.429 2.701 1
1 486 . 19 1 1 A 63 63 GLY CA C 50 46.884 45.943 0.941 1
1 487 . 19 1 1 A 64 64 HIS H H 51 7.926 8.089 -0.163 1
1 488 . 19 1 1 A 64 64 HIS HA H 51 4.451 4.478 -0.027 1
1 493 . 19 1 1 A 64 64 HIS C C 51 177.613 176.758 0.855 1
1 494 . 19 1 1 A 64 64 HIS CA C 51 57.198 58.355 -1.157 1
1 495 . 19 1 1 A 64 64 HIS CB C 51 30.945 29.348 1.597 1
1 498 . 19 1 1 A 64 64 HIS N N 51 122.284 121.069 1.215 1
1 499 . 19 1 1 A 65 65 ARG H H 52 8.105 8.223 -0.118 1
1 500 . 19 1 1 A 65 65 ARG HA H 52 3.685 3.844 -0.159 1
1 507 . 19 1 1 A 65 65 ARG C C 52 177.769 179.439 -1.670 1
1 508 . 19 1 1 A 65 65 ARG CA C 52 61.886 59.785 2.101 1
1 509 . 19 1 1 A 65 65 ARG CB C 52 30.945 29.952 0.993 1
1 511 . 19 1 1 A 65 65 ARG N N 52 117.775 120.317 -2.542 1
1 513 . 19 1 1 A 66 66 GLN H H 53 8.090 8.326 -0.236 1
1 514 . 19 1 1 A 66 66 GLN HA H 53 3.940 3.943 -0.003 1
1 519 . 19 1 1 A 66 66 GLN C C 53 178.583 178.411 0.172 1
1 520 . 19 1 1 A 66 66 GLN CA C 53 59.073 59.387 -0.314 1
1 521 . 19 1 1 A 66 66 GLN CB C 53 28.133 27.921 0.212 1
1 523 . 19 1 1 A 66 66 GLN N N 53 116.452 119.145 -2.693 1
1 524 . 19 1 1 A 67 67 ARG H H 54 7.845 7.883 -0.038 1
1 525 . 19 1 1 A 67 67 ARG HA H 54 4.010 3.943 0.067 1
1 528 . 19 1 1 A 67 67 ARG C C 54 179.766 178.835 0.931 1
1 529 . 19 1 1 A 67 67 ARG CA C 54 59.073 59.127 -0.054 1
1 530 . 19 1 1 A 67 67 ARG CB C 54 30.720 30.040 0.680 1
1 532 . 19 1 1 A 67 67 ARG N N 54 119.275 119.723 -0.448 1
1 533 . 19 1 1 A 68 68 ILE H H 55 8.032 8.151 -0.119 1
1 534 . 19 1 1 A 68 68 ILE HA H 55 3.495 3.572 -0.077 1
1 544 . 19 1 1 A 68 68 ILE C C 55 177.108 178.374 -1.266 1
1 545 . 19 1 1 A 68 68 ILE CA C 55 66.230 65.839 0.391 1
1 546 . 19 1 1 A 68 68 ILE CB C 55 38.020 37.959 0.061 1
1 550 . 19 1 1 A 68 68 ILE N N 55 121.152 120.406 0.746 1
1 551 . 19 1 1 A 69 69 LEU H H 56 8.490 8.526 -0.036 1
1 552 . 19 1 1 A 69 69 LEU HA H 56 4.010 3.883 0.127 1
1 561 . 19 1 1 A 69 69 LEU C C 56 179.917 178.595 1.322 1
1 562 . 19 1 1 A 69 69 LEU CA C 56 58.135 58.135 0.000 1
1 563 . 19 1 1 A 69 69 LEU CB C 56 41.259 41.708 -0.449 1
1 566 . 19 1 1 A 69 69 LEU N N 56 119.072 119.740 -0.668 1
1 567 . 19 1 1 A 70 70 GLN H H 57 8.327 8.747 -0.420 1
1 568 . 19 1 1 A 70 70 GLN HA H 57 4.100 3.993 0.107 1
1 573 . 19 1 1 A 70 70 GLN C C 57 178.798 178.417 0.381 1
1 574 . 19 1 1 A 70 70 GLN CA C 57 59.073 59.010 0.063 1
1 575 . 19 1 1 A 70 70 GLN CB C 57 28.133 28.326 -0.193 1
1 577 . 19 1 1 A 70 70 GLN N N 57 118.172 117.069 1.103 1
1 578 . 19 1 1 A 71 71 ALA H H 58 7.810 7.893 -0.083 1
1 579 . 19 1 1 A 71 71 ALA HA H 58 4.320 4.166 0.154 1
1 583 . 19 1 1 A 71 71 ALA C C 58 172.232 180.149 -7.917 1
1 584 . 19 1 1 A 71 71 ALA CA C 58 55.323 55.343 -0.020 1
1 585 . 19 1 1 A 71 71 ALA CB C 58 19.720 18.103 1.617 1
1 586 . 19 1 1 A 71 71 ALA N N 58 122.536 121.968 0.568 1
1 587 . 19 1 1 A 72 72 ILE H H 59 8.840 8.552 0.288 1
1 588 . 19 1 1 A 72 72 ILE HA H 59 4.030 3.640 0.390 1
1 598 . 19 1 1 A 72 72 ILE C C 59 178.678 178.485 0.193 1
1 599 . 19 1 1 A 72 72 ILE CA C 59 64.698 65.153 -0.455 1
1 600 . 19 1 1 A 72 72 ILE CB C 59 37.850 37.412 0.438 1
1 604 . 19 1 1 A 72 72 ILE N N 59 118.111 118.382 -0.271 1
1 605 . 19 1 1 A 73 73 GLN H H 60 7.547 8.214 -0.667 1
1 606 . 19 1 1 A 73 73 GLN HA H 60 4.121 4.076 0.045 1
1 611 . 19 1 1 A 73 73 GLN C C 60 176.556 178.042 -1.486 1
1 612 . 19 1 1 A 73 73 GLN CA C 60 58.135 58.475 -0.340 1
1 613 . 19 1 1 A 73 73 GLN CB C 60 28.300 28.470 -0.170 1
1 615 . 19 1 1 A 73 73 GLN N N 60 119.094 119.629 -0.535 1
1 616 . 19 1 1 A 74 74 LEU H H 61 7.350 8.080 -0.730 1
1 617 . 19 1 1 A 74 74 LEU HA H 61 4.408 4.195 0.213 1
1 626 . 19 1 1 A 74 74 LEU C C 61 177.960 176.734 1.226 1
1 627 . 19 1 1 A 74 74 LEU CA C 61 54.900 57.402 -2.502 1
1 628 . 19 1 1 A 74 74 LEU CB C 61 42.196 41.958 0.238 1
1 631 . 19 1 1 A 74 74 LEU N N 61 115.853 119.176 -3.323 1
1 632 . 19 1 1 A 75 75 LEU H H 62 7.358 8.056 -0.698 1
1 633 . 19 1 1 A 75 75 LEU HA H 62 4.530 4.145 0.385 1
1 642 . 19 1 1 A 75 75 LEU C C 62 177.035 175.700 1.335 1
1 643 . 19 1 1 A 75 75 LEU CA C 62 53.200 55.668 -2.468 1
1 644 . 19 1 1 A 75 75 LEU CB C 62 40.700 40.736 -0.036 1
1 647 . 19 1 1 A 75 75 LEU N N 62 121.010 117.528 3.482 1
1 648 . 19 1 1 A 76 76 PRO HA H 63 4.382 4.693 -0.311 1
1 655 . 19 1 1 A 76 76 PRO CB C 63 31.883 29.495 2.388 1
1 657 . 19 1 1 A 77 77 LYS H H 64 8.418 8.327 0.091 1
1 658 . 19 1 1 A 77 77 LYS HA H 64 4.140 4.796 -0.656 1
1 663 . 19 1 1 A 77 77 LYS C C 64 177.122 174.434 2.688 1
1 664 . 19 1 1 A 77 77 LYS CA C 64 56.260 55.080 1.180 1
1 665 . 19 1 1 A 77 77 LYS CB C 64 33.340 35.175 -1.835 1
1 668 . 19 1 1 A 77 77 LYS N N 64 121.932 123.248 -1.316 1
1 669 . 19 1 1 A 78 78 MET H H 65 8.550 9.042 -0.492 1
1 670 . 19 1 1 A 78 78 MET HA H 65 4.304 5.235 -0.931 1
1 676 . 19 1 1 A 78 78 MET C C 65 176.105 174.875 1.230 1
1 677 . 19 1 1 A 78 78 MET CA C 65 56.260 54.190 2.070 1
1 678 . 19 1 1 A 78 78 MET CB C 65 32.821 35.682 -2.861 1
1 680 . 19 1 1 A 78 78 MET N N 65 123.498 125.654 -2.156 1
1 681 . 19 1 1 A 79 79 ARG H H 66 8.731 8.770 -0.039 1
1 682 . 19 1 1 A 79 79 ARG C C 66 173.577 174.606 -1.029 1
1 683 . 19 1 1 A 79 79 ARG CA C 66 53.447 53.708 -0.261 1
1 684 . 19 1 1 A 79 79 ARG CB C 66 30.008 31.058 -1.050 1
1 685 . 19 1 1 A 79 79 ARG N N 66 127.355 126.071 1.284 1
1 686 . 19 1 1 A 80 80 PRO HA H 67 4.780 4.523 0.257 1
1 693 . 19 1 1 A 80 80 PRO C C 67 177.043 175.230 1.813 1
1 694 . 19 1 1 A 80 80 PRO CA C 67 61.886 64.274 -2.388 1
1 695 . 19 1 1 A 80 80 PRO CB C 67 32.821 31.927 0.894 1
1 698 . 19 1 1 A 81 81 ILE H H 68 8.580 7.578 1.002 1
1 699 . 19 1 1 A 81 81 ILE HA H 68 4.040 4.816 -0.776 1
1 709 . 19 1 1 A 81 81 ILE C C 68 176.831 174.955 1.876 1
1 710 . 19 1 1 A 81 81 ILE CA C 68 62.823 58.700 4.123 1
1 711 . 19 1 1 A 81 81 ILE CB C 68 38.580 40.700 -2.120 1
1 715 . 19 1 1 A 81 81 ILE N N 68 118.491 113.144 5.347 1
1 716 . 19 1 1 A 82 82 GLY H H 69 8.602 8.277 0.325 1
1 717 . 19 1 1 A 82 82 GLY CA C 69 45.009 45.658 -0.649 1
1 718 . 19 1 1 A 82 82 GLY N N 69 111.377 109.207 2.170 1
1 721 . 19 1 1 A 84 84 ASP HA H 71 4.490 5.220 -0.730 1
1 724 . 19 1 1 A 84 84 ASP CA C 71 54.385 52.549 1.836 1
1 725 . 19 1 1 A 84 84 ASP CB C 71 40.321 44.168 -3.847 1
1 726 . 19 1 1 A 85 85 GLY H H 72 8.054 8.516 -0.462 1
1 727 . 19 1 1 A 85 85 GLY HA2 H 72 4.040 4.041 -0.001 1
1 728 . 19 1 1 A 85 85 GLY HA3 H 72 3.750 4.134 -0.384 1
1 729 . 19 1 1 A 85 85 GLY C C 72 173.474 172.863 0.611 1
1 730 . 19 1 1 A 85 85 GLY CA C 72 45.009 45.104 -0.095 1
1 731 . 19 1 1 A 85 85 GLY N N 72 108.038 108.104 -0.066 1
1 732 . 19 1 1 A 86 86 ALA H H 73 7.858 8.549 -0.691 1
1 733 . 19 1 1 A 86 86 ALA HA H 73 4.370 5.096 -0.726 1
1 737 . 19 1 1 A 86 86 ALA CA C 73 51.990 51.037 0.953 1
1 738 . 19 1 1 A 86 86 ALA CB C 73 19.220 22.047 -2.827 1
1 739 . 19 1 1 A 86 86 ALA N N 73 123.819 127.014 -3.195 1
1 742 . 19 1 1 A 90 90 SER H H 77 7.839 8.004 -0.165 1
1 743 . 19 1 1 A 90 90 SER HA H 77 4.770 4.840 -0.070 1
1 746 . 19 1 1 A 90 90 SER N N 77 115.163 116.453 -1.290 1
1 747 . 19 1 1 A 91 91 VAL H H 78 8.578 9.079 -0.501 1
1 748 . 19 1 1 A 91 91 VAL HA H 78 3.981 3.956 0.025 1
1 756 . 19 1 1 A 91 91 VAL C C 78 177.480 177.324 0.156 1
1 757 . 19 1 1 A 91 91 VAL CA C 78 67.060 66.262 0.798 1
1 758 . 19 1 1 A 91 91 VAL CB C 78 32.500 31.633 0.867 1
1 761 . 19 1 1 A 91 91 VAL N N 78 123.481 122.221 1.260 1
1 762 . 19 1 1 A 92 92 ALA H H 79 8.607 8.350 0.257 1
1 763 . 19 1 1 A 92 92 ALA HA H 79 4.113 4.010 0.103 1
1 767 . 19 1 1 A 92 92 ALA C C 79 179.868 180.473 -0.605 1
1 768 . 19 1 1 A 92 92 ALA CA C 79 54.890 55.397 -0.507 1
1 769 . 19 1 1 A 92 92 ALA CB C 79 18.790 18.585 0.205 1
1 770 . 19 1 1 A 92 92 ALA N N 79 120.334 122.435 -2.101 1
1 771 . 19 1 1 A 93 93 GLU H H 80 7.886 8.200 -0.314 1
1 772 . 19 1 1 A 93 93 GLU HA H 80 4.010 4.108 -0.098 1
1 777 . 19 1 1 A 93 93 GLU C C 80 179.719 178.957 0.762 1
1 778 . 19 1 1 A 93 93 GLU CA C 80 59.073 58.970 0.103 1
1 779 . 19 1 1 A 93 93 GLU CB C 80 30.630 29.259 1.371 1
1 781 . 19 1 1 A 93 93 GLU N N 80 117.643 117.122 0.521 1
1 782 . 19 1 1 A 94 94 TRP H H 81 8.299 8.285 0.014 1
1 783 . 19 1 1 A 94 94 TRP HA H 81 4.251 4.290 -0.039 1
1 792 . 19 1 1 A 94 94 TRP C C 81 178.772 178.050 0.722 1
1 793 . 19 1 1 A 94 94 TRP CA C 81 60.010 61.450 -1.440 1
1 794 . 19 1 1 A 94 94 TRP CB C 81 27.650 29.920 -2.270 1
1 800 . 19 1 1 A 94 94 TRP N N 81 122.545 122.944 -0.399 1
1 802 . 19 1 1 A 95 95 LEU H H 82 8.505 8.472 0.033 1
1 803 . 19 1 1 A 95 95 LEU HA H 82 2.880 3.256 -0.376 1
1 812 . 19 1 1 A 95 95 LEU C C 82 180.235 178.846 1.389 1
1 813 . 19 1 1 A 95 95 LEU CA C 82 57.400 56.847 0.553 1
1 814 . 19 1 1 A 95 95 LEU CB C 82 40.321 40.744 -0.423 1
1 817 . 19 1 1 A 95 95 LEU N N 82 121.110 119.202 1.908 1
1 818 . 19 1 1 A 96 96 ASP H H 83 8.185 8.290 -0.105 1
1 819 . 19 1 1 A 96 96 ASP HA H 83 4.280 4.349 -0.069 1
1 822 . 19 1 1 A 96 96 ASP C C 83 175.224 177.584 -2.360 1
1 823 . 19 1 1 A 96 96 ASP CA C 83 57.310 57.142 0.168 1
1 824 . 19 1 1 A 96 96 ASP CB C 83 40.321 41.624 -1.303 1
1 825 . 19 1 1 A 96 96 ASP N N 83 119.082 120.583 -1.501 1
1 826 . 19 1 1 A 97 97 SER H H 84 7.989 7.468 0.521 1
1 827 . 19 1 1 A 97 97 SER HA H 84 4.250 4.447 -0.197 1
1 830 . 19 1 1 A 97 97 SER C C 84 175.346 174.880 0.466 1
1 831 . 19 1 1 A 97 97 SER CA C 84 60.948 58.263 2.685 1
1 832 . 19 1 1 A 97 97 SER CB C 84 63.370 63.496 -0.126 1
1 833 . 19 1 1 A 97 97 SER N N 84 117.579 111.543 6.036 1
1 834 . 19 1 1 A 98 98 ILE H H 85 6.862 7.542 -0.680 1
1 835 . 19 1 1 A 98 98 ILE HA H 85 4.550 4.300 0.250 1
1 843 . 19 1 1 A 98 98 ILE C C 85 173.308 175.240 -1.932 1
1 844 . 19 1 1 A 98 98 ILE CA C 85 60.948 60.276 0.672 1
1 845 . 19 1 1 A 98 98 ILE CB C 85 37.760 37.845 -0.085 1
1 848 . 19 1 1 A 98 98 ILE N N 85 113.733 119.906 -6.173 1
1 849 . 19 1 1 A 99 99 GLU H H 86 7.705 7.894 -0.189 1
1 850 . 19 1 1 A 99 99 GLU HA H 86 4.280 3.828 0.452 1
1 853 . 19 1 1 A 99 99 GLU C C 86 175.224 174.637 0.587 1
1 854 . 19 1 1 A 99 99 GLU CA C 86 56.260 57.564 -1.304 1
1 855 . 19 1 1 A 99 99 GLU CB C 86 26.258 27.042 -0.784 1
1 857 . 19 1 1 A 99 99 GLU N N 86 115.493 118.736 -3.243 1
1 858 . 19 1 1 A 100 100 LEU H H 87 7.989 7.186 0.803 1
1 859 . 19 1 1 A 100 100 LEU HA H 87 4.220 4.616 -0.396 1
1 868 . 19 1 1 A 100 100 LEU C C 87 176.965 175.786 1.179 1
1 869 . 19 1 1 A 100 100 LEU CA C 87 52.510 53.200 -0.690 1
1 870 . 19 1 1 A 100 100 LEU CB C 87 42.196 44.539 -2.343 1
1 873 . 19 1 1 A 100 100 LEU N N 87 117.579 119.113 -1.534 1
1 874 . 19 1 1 A 101 101 GLY H H 88 8.503 8.107 0.396 1
1 875 . 19 1 1 A 101 101 GLY CA C 88 46.884 45.821 1.063 1
1 876 . 19 1 1 A 101 101 GLY N N 88 107.794 114.231 -6.437 1
1 877 . 19 1 1 A 102 102 ASP HA H 89 4.431 4.266 0.165 1
1 880 . 19 1 1 A 102 102 ASP C C 89 178.075 178.020 0.055 1
1 881 . 19 1 1 A 102 102 ASP CA C 89 57.198 57.168 0.030 1
1 882 . 19 1 1 A 102 102 ASP CB C 89 40.321 41.001 -0.680 1
1 883 . 19 1 1 A 103 103 TYR H H 90 7.899 8.054 -0.155 1
1 884 . 19 1 1 A 103 103 TYR HA H 90 4.940 4.446 0.494 1
1 889 . 19 1 1 A 103 103 TYR C C 90 175.527 178.529 -3.002 1
1 890 . 19 1 1 A 103 103 TYR CA C 90 58.135 60.461 -2.326 1
1 891 . 19 1 1 A 103 103 TYR CB C 90 38.446 37.469 0.977 1
1 894 . 19 1 1 A 103 103 TYR N N 90 115.595 119.428 -3.833 1
1 895 . 19 1 1 A 104 104 THR H H 91 7.971 8.323 -0.352 1
1 896 . 19 1 1 A 104 104 THR HA H 91 4.234 4.008 0.226 1
1 901 . 19 1 1 A 104 104 THR C C 91 175.905 176.622 -0.717 1
1 902 . 19 1 1 A 104 104 THR CA C 91 68.449 67.123 1.326 1
1 904 . 19 1 1 A 104 104 THR N N 91 118.867 116.640 2.227 1
1 905 . 19 1 1 A 105 105 LYS H H 92 8.555 7.863 0.692 1
1 906 . 19 1 1 A 105 105 LYS HA H 92 3.940 4.083 -0.143 1
1 912 . 19 1 1 A 105 105 LYS C C 92 177.310 178.588 -1.278 1
1 913 . 19 1 1 A 105 105 LYS CA C 92 60.948 59.488 1.460 1
1 914 . 19 1 1 A 105 105 LYS CB C 92 31.883 32.427 -0.544 1
1 917 . 19 1 1 A 105 105 LYS N N 92 119.259 121.095 -1.836 1
1 918 . 19 1 1 A 106 106 ALA H H 93 7.920 8.186 -0.266 1
1 919 . 19 1 1 A 106 106 ALA HA H 93 4.128 4.240 -0.112 1
1 923 . 19 1 1 A 106 106 ALA C C 93 180.972 180.291 0.681 1
1 924 . 19 1 1 A 106 106 ALA CA C 93 55.070 54.982 0.088 1
1 925 . 19 1 1 A 106 106 ALA CB C 93 17.750 18.395 -0.645 1
1 926 . 19 1 1 A 106 106 ALA N N 93 120.398 121.122 -0.724 1
1 927 . 19 1 1 A 107 107 PHE H H 94 8.136 8.755 -0.619 1
1 928 . 19 1 1 A 107 107 PHE HA H 94 4.190 4.549 -0.359 1
1 934 . 19 1 1 A 107 107 PHE C C 94 177.955 178.310 -0.355 1
1 935 . 19 1 1 A 107 107 PHE CA C 94 63.761 61.480 2.281 1
1 936 . 19 1 1 A 107 107 PHE CB C 94 38.446 39.220 -0.774 1
1 940 . 19 1 1 A 107 107 PHE N N 94 117.119 116.200 0.919 1
1 941 . 19 1 1 A 108 108 LEU H H 95 8.351 8.751 -0.400 1
1 942 . 19 1 1 A 108 108 LEU HA H 95 3.889 3.932 -0.043 1
1 951 . 19 1 1 A 108 108 LEU C C 95 182.043 179.493 2.550 1
1 952 . 19 1 1 A 108 108 LEU CA C 95 59.073 58.562 0.511 1
1 953 . 19 1 1 A 108 108 LEU CB C 95 41.259 42.174 -0.915 1
1 956 . 19 1 1 A 108 108 LEU N N 95 118.450 119.763 -1.313 1
1 957 . 19 1 1 A 109 109 ILE H H 96 8.992 8.077 0.915 1
1 958 . 19 1 1 A 109 109 ILE HA H 96 4.069 3.864 0.205 1
1 968 . 19 1 1 A 109 109 ILE C C 96 177.094 177.717 -0.623 1
1 969 . 19 1 1 A 109 109 ILE CA C 96 63.761 64.397 -0.636 1
1 970 . 19 1 1 A 109 109 ILE CB C 96 37.509 37.559 -0.050 1
1 974 . 19 1 1 A 109 109 ILE N N 96 118.177 115.194 2.983 1
1 975 . 19 1 1 A 110 110 ASN H H 97 7.067 8.133 -1.066 1
1 976 . 19 1 1 A 110 110 ASN HA H 97 4.797 4.715 0.082 1
1 981 . 19 1 1 A 110 110 ASN C C 97 173.595 175.606 -2.011 1
1 982 . 19 1 1 A 110 110 ASN CA C 97 54.385 53.178 1.207 1
1 983 . 19 1 1 A 110 110 ASN CB C 97 40.321 38.821 1.500 1
1 984 . 19 1 1 A 110 110 ASN N N 97 116.407 119.049 -2.642 1
1 986 . 19 1 1 A 111 111 GLY H H 98 7.681 8.033 -0.352 1
1 987 . 19 1 1 A 111 111 GLY HA2 H 98 4.080 3.915 0.165 1
1 988 . 19 1 1 A 111 111 GLY HA3 H 98 3.640 3.993 -0.353 1
1 989 . 19 1 1 A 111 111 GLY C C 98 174.552 174.267 0.285 1
1 990 . 19 1 1 A 111 111 GLY CA C 98 45.947 45.567 0.380 1
1 991 . 19 1 1 A 111 111 GLY N N 98 104.440 106.232 -1.792 1
1 992 . 19 1 1 A 112 112 TYR H H 99 8.427 8.052 0.375 1
1 993 . 19 1 1 A 112 112 TYR HA H 99 4.661 4.836 -0.175 1
1 998 . 19 1 1 A 112 112 TYR C C 99 174.425 176.564 -2.139 1
1 999 . 19 1 1 A 112 112 TYR CA C 99 57.198 56.714 0.484 1
1 1000 . 19 1 1 A 112 112 TYR CB C 99 36.571 37.247 -0.676 1
1 1003 . 19 1 1 A 112 112 TYR N N 99 122.830 119.793 3.037 1
1 1004 . 19 1 1 A 113 113 THR H H 100 7.166 8.045 -0.879 1
1 1005 . 19 1 1 A 113 113 THR HA H 100 4.248 4.131 0.117 1
1 1009 . 19 1 1 A 113 113 THR C C 100 174.897 174.965 -0.068 1
1 1010 . 19 1 1 A 113 113 THR CA C 100 62.290 65.102 -2.812 1
1 1011 . 19 1 1 A 113 113 THR CB C 100 68.970 68.159 0.811 1
1 1013 . 19 1 1 A 113 113 THR N N 100 104.304 112.927 -8.623 1
1 1014 . 19 1 1 A 114 114 SER H H 101 7.695 7.877 -0.182 1
1 1015 . 19 1 1 A 114 114 SER C C 101 174.372 175.116 -0.744 1
1 1016 . 19 1 1 A 114 114 SER CA C 101 56.260 58.148 -1.888 1
1 1017 . 19 1 1 A 114 114 SER CB C 101 65.636 63.834 1.802 1
1 1018 . 19 1 1 A 114 114 SER N N 101 115.613 117.129 -1.516 1
1 1023 . 19 1 1 A 116 116 ASP HA H 103 4.260 4.315 -0.055 1
1 1026 . 19 1 1 A 116 116 ASP CA C 103 57.198 57.694 -0.496 1
1 1027 . 19 1 1 A 116 116 ASP CB C 103 40.321 40.526 -0.205 1
1 1028 . 19 1 1 A 117 117 LEU H H 104 7.345 8.217 -0.872 1
1 1029 . 19 1 1 A 117 117 LEU HA H 104 4.290 3.910 0.380 1
1 1038 . 19 1 1 A 117 117 LEU C C 104 178.488 178.695 -0.207 1
1 1039 . 19 1 1 A 117 117 LEU CA C 104 56.260 57.976 -1.716 1
1 1040 . 19 1 1 A 117 117 LEU CB C 104 42.196 41.798 0.398 1
1 1043 . 19 1 1 A 117 117 LEU N N 104 117.878 120.597 -2.719 1
1 1044 . 19 1 1 A 118 118 LEU H H 105 7.514 8.385 -0.871 1
1 1045 . 19 1 1 A 118 118 LEU HA H 105 4.210 4.043 0.167 1
1 1054 . 19 1 1 A 118 118 LEU C C 105 177.002 178.879 -1.877 1
1 1055 . 19 1 1 A 118 118 LEU CA C 105 55.323 57.103 -1.780 1
1 1056 . 19 1 1 A 118 118 LEU CB C 105 42.196 40.736 1.460 1
1 1059 . 19 1 1 A 118 118 LEU N N 105 119.094 118.122 0.972 1
1 1060 . 19 1 1 A 120 120 LYS HA H 107 4.340 4.539 -0.199 1
1 1063 . 19 1 1 A 120 120 LYS C C 107 176.603 174.725 1.878 1
1 1064 . 19 1 1 A 120 120 LYS CA C 107 55.323 55.003 0.320 1
1 1065 . 19 1 1 A 120 120 LYS CB C 107 31.883 33.011 -1.128 1
1 1068 . 19 1 1 A 121 121 ILE H H 108 7.539 7.596 -0.057 1
1 1069 . 19 1 1 A 121 121 ILE HA H 108 3.987 4.765 -0.778 1
1 1079 . 19 1 1 A 121 121 ILE C C 108 173.247 175.186 -1.939 1
1 1080 . 19 1 1 A 121 121 ILE CA C 108 62.823 59.814 3.009 1
1 1081 . 19 1 1 A 121 121 ILE CB C 108 38.446 40.781 -2.335 1
1 1085 . 19 1 1 A 121 121 ILE N N 108 122.417 122.746 -0.329 1
1 1086 . 19 1 1 A 122 122 ALA H H 109 8.290 8.305 -0.015 1
1 1087 . 19 1 1 A 122 122 ALA HA H 109 3.970 4.766 -0.796 1
1 1091 . 19 1 1 A 122 122 ALA C C 109 178.318 177.756 0.562 1
1 1092 . 19 1 1 A 122 122 ALA CA C 109 50.150 50.050 0.100 1
1 1093 . 19 1 1 A 122 122 ALA CB C 109 21.630 22.198 -0.568 1
1 1094 . 19 1 1 A 122 122 ALA N N 109 127.784 129.223 -1.439 1
1 1095 . 19 1 1 A 123 123 GLU HA H 110 3.707 4.001 -0.294 1
1 1099 . 19 1 1 A 123 123 GLU C C 110 178.290 178.708 -0.418 1
1 1100 . 19 1 1 A 123 123 GLU CA C 110 60.948 59.840 1.108 1
1 1101 . 19 1 1 A 123 123 GLU CB C 110 29.070 29.601 -0.531 1
1 1102 . 19 1 1 A 124 124 VAL H H 111 8.333 8.213 0.120 1
1 1103 . 19 1 1 A 124 124 VAL HA H 111 3.850 3.788 0.062 1
1 1111 . 19 1 1 A 124 124 VAL C C 111 177.406 177.673 -0.267 1
1 1112 . 19 1 1 A 124 124 VAL CA C 111 65.636 65.343 0.293 1
1 1113 . 19 1 1 A 124 124 VAL CB C 111 30.730 31.251 -0.521 1
1 1116 . 19 1 1 A 124 124 VAL N N 111 114.438 120.114 -5.676 1
1 1117 . 19 1 1 A 125 125 GLU H H 112 7.442 8.261 -0.819 1
1 1118 . 19 1 1 A 125 125 GLU HA H 112 4.152 4.059 0.093 1
1 1123 . 19 1 1 A 125 125 GLU C C 112 179.982 179.546 0.436 1
1 1124 . 19 1 1 A 125 125 GLU CA C 112 60.010 59.423 0.587 1
1 1125 . 19 1 1 A 125 125 GLU CB C 112 30.008 29.539 0.469 1
1 1127 . 19 1 1 A 125 125 GLU N N 112 121.032 122.640 -1.608 1
1 1128 . 19 1 1 A 126 126 LEU H H 113 7.666 7.941 -0.275 1
1 1129 . 19 1 1 A 126 126 LEU HA H 113 3.846 3.979 -0.133 1
1 1138 . 19 1 1 A 126 126 LEU C C 113 176.991 178.712 -1.721 1
1 1139 . 19 1 1 A 126 126 LEU CA C 113 58.135 57.686 0.449 1
1 1140 . 19 1 1 A 126 126 LEU CB C 113 41.259 41.123 0.136 1
1 1143 . 19 1 1 A 126 126 LEU N N 113 118.731 118.558 0.173 1
1 1144 . 19 1 1 A 127 127 ILE H H 114 7.781 7.911 -0.130 1
1 1145 . 19 1 1 A 127 127 ILE HA H 114 3.502 3.831 -0.329 1
1 1153 . 19 1 1 A 127 127 ILE C C 114 178.195 177.157 1.038 1
1 1154 . 19 1 1 A 127 127 ILE CA C 114 65.636 64.099 1.537 1
1 1155 . 19 1 1 A 127 127 ILE CB C 114 40.321 37.424 2.897 1
1 1159 . 19 1 1 A 127 127 ILE N N 114 115.084 119.110 -4.026 1
1 1160 . 19 1 1 A 128 128 ASN H H 115 8.470 7.797 0.673 1
1 1161 . 19 1 1 A 128 128 ASN HA H 115 4.502 4.742 -0.240 1
1 1166 . 19 1 1 A 128 128 ASN C C 115 176.295 177.449 -1.154 1
1 1167 . 19 1 1 A 128 128 ASN CA C 115 56.260 54.438 1.822 1
1 1168 . 19 1 1 A 128 128 ASN CB C 115 39.384 39.222 0.162 1
1 1169 . 19 1 1 A 128 128 ASN N N 115 115.158 119.915 -4.757 1
1 1171 . 19 1 1 A 129 129 VAL H H 116 8.116 8.030 0.086 1
1 1172 . 19 1 1 A 129 129 VAL HA H 116 4.090 3.794 0.296 1
1 1180 . 19 1 1 A 129 129 VAL C C 116 176.740 177.834 -1.094 1
1 1181 . 19 1 1 A 129 129 VAL CA C 116 64.400 65.424 -1.024 1
1 1182 . 19 1 1 A 129 129 VAL CB C 116 32.050 32.158 -0.108 1
1 1185 . 19 1 1 A 129 129 VAL N N 116 118.698 119.733 -1.035 1
1 1186 . 19 1 1 A 130 130 LEU H H 117 7.294 7.958 -0.664 1
1 1187 . 19 1 1 A 130 130 LEU HA H 117 3.970 4.155 -0.185 1
1 1196 . 19 1 1 A 130 130 LEU C C 117 175.127 176.061 -0.934 1
1 1197 . 19 1 1 A 130 130 LEU CA C 117 56.260 55.023 1.237 1
1 1198 . 19 1 1 A 130 130 LEU CB C 117 41.259 42.050 -0.791 1
1 1201 . 19 1 1 A 130 130 LEU N N 117 116.201 118.924 -2.723 1
1 1202 . 19 1 1 A 131 131 LYS H H 118 6.594 7.466 -0.872 1
1 1203 . 19 1 1 A 131 131 LYS HA H 118 3.980 4.263 -0.283 1
1 1208 . 19 1 1 A 131 131 LYS C C 118 175.589 176.213 -0.624 1
1 1209 . 19 1 1 A 131 131 LYS CA C 118 56.260 57.303 -1.043 1
1 1210 . 19 1 1 A 131 131 LYS CB C 118 28.133 29.305 -1.172 1
1 1212 . 19 1 1 A 131 131 LYS N N 118 111.172 114.963 -3.791 1
1 1213 . 19 1 1 A 132 132 ILE H H 119 8.245 8.047 0.198 1
1 1214 . 19 1 1 A 132 132 ILE HA H 119 4.090 3.791 0.299 1
1 1224 . 19 1 1 A 132 132 ILE C C 119 175.161 176.390 -1.229 1
1 1225 . 19 1 1 A 132 132 ILE CA C 119 60.010 65.394 -5.384 1
1 1226 . 19 1 1 A 132 132 ILE CB C 119 35.633 37.828 -2.195 1
1 1230 . 19 1 1 A 132 132 ILE N N 119 119.484 118.640 0.844 1
1 1231 . 19 1 1 A 133 133 ASN H H 120 8.054 8.262 -0.208 1
1 1232 . 19 1 1 A 133 133 ASN HA H 120 4.350 4.371 -0.021 1
1 1235 . 19 1 1 A 133 133 ASN C C 120 175.136 174.636 0.500 1
1 1236 . 19 1 1 A 133 133 ASN CA C 120 54.385 54.215 0.170 1
1 1237 . 19 1 1 A 133 133 ASN CB C 120 39.384 37.581 1.803 1
1 1238 . 19 1 1 A 133 133 ASN N N 120 124.670 120.184 4.486 1
1 1239 . 19 1 1 A 134 134 LEU H H 121 7.517 7.816 -0.299 1
1 1240 . 19 1 1 A 134 134 LEU HA H 121 4.678 4.632 0.046 1
1 1249 . 19 1 1 A 134 134 LEU C C 121 178.051 176.602 1.449 1
1 1250 . 19 1 1 A 134 134 LEU CA C 121 53.447 54.064 -0.617 1
1 1251 . 19 1 1 A 134 134 LEU CB C 121 41.259 44.864 -3.605 1
1 1254 . 19 1 1 A 134 134 LEU N N 121 119.918 119.050 0.868 1
1 1255 . 19 1 1 A 135 135 ILE H H 122 9.389 8.475 0.914 1
1 1256 . 19 1 1 A 135 135 ILE HA H 122 3.540 3.716 -0.176 1
1 1266 . 19 1 1 A 135 135 ILE C C 122 176.425 177.497 -1.072 1
1 1267 . 19 1 1 A 135 135 ILE CA C 122 65.636 65.067 0.569 1
1 1268 . 19 1 1 A 135 135 ILE CB C 122 38.446 38.057 0.389 1
1 1272 . 19 1 1 A 135 135 ILE N N 122 129.949 127.152 2.797 1
1 1273 . 19 1 1 A 136 136 GLY H H 123 8.675 8.411 0.264 1
1 1274 . 19 1 1 A 136 136 GLY HA2 H 123 2.650 3.170 -0.520 1
1 1275 . 19 1 1 A 136 136 GLY HA3 H 123 2.060 3.591 -1.531 1
1 1276 . 19 1 1 A 136 136 GLY C C 123 176.854 176.408 0.446 1
1 1277 . 19 1 1 A 136 136 GLY CA C 123 45.500 47.080 -1.580 1
1 1278 . 19 1 1 A 136 136 GLY N N 123 106.314 107.733 -1.419 1
1 1279 . 19 1 1 A 137 137 HIS H H 124 6.869 7.800 -0.931 1
1 1280 . 19 1 1 A 137 137 HIS HA H 124 4.558 4.547 0.011 1
1 1285 . 19 1 1 A 137 137 HIS C C 124 176.977 177.824 -0.847 1
1 1286 . 19 1 1 A 137 137 HIS CA C 124 57.198 58.524 -1.326 1
1 1287 . 19 1 1 A 137 137 HIS CB C 124 30.945 29.388 1.557 1
1 1290 . 19 1 1 A 137 137 HIS N N 124 118.865 120.194 -1.329 1
1 1291 . 19 1 1 A 138 138 ARG H H 125 7.730 8.495 -0.765 1
1 1292 . 19 1 1 A 138 138 ARG HA H 125 3.770 3.993 -0.223 1
1 1299 . 19 1 1 A 138 138 ARG C C 125 178.288 178.525 -0.237 1
1 1300 . 19 1 1 A 138 138 ARG CA C 125 61.886 58.507 3.379 1
1 1301 . 19 1 1 A 138 138 ARG CB C 125 30.945 29.763 1.182 1
1 1304 . 19 1 1 A 138 138 ARG N N 125 118.149 118.070 0.079 1
1 1306 . 19 1 1 A 139 139 LYS H H 126 8.679 7.977 0.702 1
1 1307 . 19 1 1 A 139 139 LYS HA H 126 3.990 3.987 0.003 1
1 1310 . 19 1 1 A 139 139 LYS C C 126 179.184 178.869 0.315 1
1 1311 . 19 1 1 A 139 139 LYS CA C 126 58.135 59.350 -1.215 1
1 1312 . 19 1 1 A 139 139 LYS CB C 126 30.945 31.986 -1.041 1
1 1314 . 19 1 1 A 139 139 LYS N N 126 114.003 119.456 -5.453 1
1 1315 . 19 1 1 A 140 140 ARG H H 127 7.248 8.022 -0.774 1
1 1316 . 19 1 1 A 140 140 ARG HA H 127 3.870 3.950 -0.080 1
1 1324 . 19 1 1 A 140 140 ARG C C 127 177.772 178.691 -0.919 1
1 1325 . 19 1 1 A 140 140 ARG CA C 127 60.010 59.091 0.919 1
1 1326 . 19 1 1 A 140 140 ARG CB C 127 30.945 29.828 1.117 1
1 1329 . 19 1 1 A 140 140 ARG N N 127 120.072 118.198 1.874 1
1 1331 . 19 1 1 A 141 141 ILE H H 128 7.706 8.011 -0.305 1
1 1332 . 19 1 1 A 141 141 ILE HA H 128 3.530 3.693 -0.163 1
1 1340 . 19 1 1 A 141 141 ILE C C 128 177.669 178.146 -0.477 1
1 1341 . 19 1 1 A 141 141 ILE CA C 128 65.636 65.434 0.202 1
1 1342 . 19 1 1 A 141 141 ILE CB C 128 38.680 38.195 0.485 1
1 1345 . 19 1 1 A 141 141 ILE N N 128 118.730 120.725 -1.995 1
1 1346 . 19 1 1 A 142 142 LEU H H 129 8.194 8.015 0.179 1
1 1347 . 19 1 1 A 142 142 LEU HA H 129 3.950 4.019 -0.069 1
1 1356 . 19 1 1 A 142 142 LEU C C 129 179.960 178.260 1.700 1
1 1357 . 19 1 1 A 142 142 LEU CA C 129 58.135 58.128 0.007 1
1 1358 . 19 1 1 A 142 142 LEU CB C 129 41.259 41.421 -0.162 1
1 1361 . 19 1 1 A 142 142 LEU N N 129 117.675 121.374 -3.699 1
1 1362 . 19 1 1 A 143 143 ALA H H 130 8.294 8.441 -0.147 1
1 1363 . 19 1 1 A 143 143 ALA HA H 130 4.220 4.079 0.141 1
1 1367 . 19 1 1 A 143 143 ALA C C 130 179.899 179.670 0.229 1
1 1368 . 19 1 1 A 143 143 ALA CA C 130 54.385 55.155 -0.770 1
1 1369 . 19 1 1 A 143 143 ALA CB C 130 19.270 18.220 1.050 1
1 1370 . 19 1 1 A 143 143 ALA N N 130 121.096 121.112 -0.016 1
1 1371 . 19 1 1 A 144 144 SER H H 131 7.813 8.054 -0.241 1
1 1372 . 19 1 1 A 144 144 SER HA H 131 4.180 4.269 -0.089 1
1 1375 . 19 1 1 A 144 144 SER C C 131 175.457 176.499 -1.042 1
1 1376 . 19 1 1 A 144 144 SER CA C 131 60.948 61.322 -0.374 1
1 1377 . 19 1 1 A 144 144 SER CB C 131 63.761 63.275 0.486 1
1 1378 . 19 1 1 A 144 144 SER N N 131 112.102 113.815 -1.713 1
1 1379 . 19 1 1 A 145 145 LEU H H 132 7.747 8.066 -0.319 1
1 1380 . 19 1 1 A 145 145 LEU HA H 132 4.140 4.223 -0.083 1
1 1389 . 19 1 1 A 145 145 LEU C C 132 178.589 177.172 1.417 1
1 1390 . 19 1 1 A 145 145 LEU CA C 132 56.260 56.608 -0.348 1
1 1391 . 19 1 1 A 145 145 LEU CB C 132 42.196 42.355 -0.159 1
1 1394 . 19 1 1 A 145 145 LEU N N 132 117.536 118.867 -1.331 1
1 1395 . 19 1 1 A 146 146 GLY H H 133 7.544 7.805 -0.261 1
1 1396 . 19 1 1 A 146 146 GLY HA2 H 133 3.950 4.029 -0.079 1
1 1397 . 19 1 1 A 146 146 GLY HA3 H 133 3.100 4.039 -0.939 1
1 1398 . 19 1 1 A 146 146 GLY C C 133 173.372 171.521 1.851 1
1 1399 . 19 1 1 A 146 146 GLY CA C 133 45.947 44.100 1.847 1
1 1400 . 19 1 1 A 146 146 GLY N N 133 105.351 104.032 1.319 1
1 1401 . 19 1 1 A 147 147 ASP H H 134 8.342 8.563 -0.221 1
1 1402 . 19 1 1 A 147 147 ASP HA H 134 4.650 5.450 -0.800 1
1 1405 . 19 1 1 A 147 147 ASP C C 134 175.462 174.910 0.552 1
1 1406 . 19 1 1 A 147 147 ASP CA C 134 54.385 52.309 2.076 1
1 1407 . 19 1 1 A 147 147 ASP CB C 134 41.259 44.943 -3.684 1
1 1408 . 19 1 1 A 147 147 ASP N N 134 120.133 117.377 2.756 1
1 14 . 20 1 1 A 15 15 GLN H H 2 8.439 8.954 -0.515 1
1 15 . 20 1 1 A 15 15 GLN HA H 2 4.594 5.198 -0.604 1
1 20 . 20 1 1 A 15 15 GLN C C 2 175.972 174.014 1.958 1
1 21 . 20 1 1 A 15 15 GLN CA C 2 56.260 54.069 2.191 1
1 22 . 20 1 1 A 15 15 GLN CB C 2 30.945 32.325 -1.380 1
1 24 . 20 1 1 A 15 15 GLN N N 2 124.997 128.475 -3.478 1
1 25 . 20 1 1 A 16 16 THR H H 3 8.347 8.576 -0.229 1
1 26 . 20 1 1 A 16 16 THR HA H 3 4.555 4.817 -0.262 1
1 31 . 20 1 1 A 16 16 THR C C 3 175.495 174.933 0.562 1
1 32 . 20 1 1 A 16 16 THR CA C 3 60.010 61.496 -1.486 1
1 33 . 20 1 1 A 16 16 THR CB C 3 71.261 72.118 -0.857 1
1 34 . 20 1 1 A 16 16 THR N N 3 113.011 116.193 -3.182 1
1 35 . 20 1 1 A 17 17 VAL H H 4 8.895 8.965 -0.070 1
1 36 . 20 1 1 A 17 17 VAL HA H 4 3.670 3.803 -0.133 1
1 44 . 20 1 1 A 17 17 VAL C C 4 178.449 177.744 0.705 1
1 45 . 20 1 1 A 17 17 VAL CA C 4 67.511 66.401 1.110 1
1 46 . 20 1 1 A 17 17 VAL CB C 4 31.883 31.675 0.208 1
1 49 . 20 1 1 A 17 17 VAL N N 4 121.854 124.587 -2.733 1
1 50 . 20 1 1 A 18 18 GLY H H 5 9.017 8.308 0.709 1
1 51 . 20 1 1 A 18 18 GLY HA2 H 5 3.940 3.801 0.139 1
1 52 . 20 1 1 A 18 18 GLY HA3 H 5 3.610 3.817 -0.207 1
1 53 . 20 1 1 A 18 18 GLY C C 5 176.186 175.978 0.208 1
1 54 . 20 1 1 A 18 18 GLY CA C 5 47.822 47.154 0.668 1
1 55 . 20 1 1 A 18 18 GLY N N 5 106.966 107.630 -0.664 1
1 56 . 20 1 1 A 19 19 GLN H H 6 8.072 8.057 0.015 1
1 57 . 20 1 1 A 19 19 GLN HA H 6 4.037 4.107 -0.070 1
1 62 . 20 1 1 A 19 19 GLN C C 6 179.488 178.623 0.865 1
1 63 . 20 1 1 A 19 19 GLN CA C 6 59.073 59.014 0.059 1
1 64 . 20 1 1 A 19 19 GLN CB C 6 28.489 28.624 -0.135 1
1 66 . 20 1 1 A 19 19 GLN N N 6 122.431 121.078 1.353 1
1 67 . 20 1 1 A 20 20 TRP H H 7 8.756 8.257 0.499 1
1 68 . 20 1 1 A 20 20 TRP HA H 7 4.160 4.323 -0.163 1
1 77 . 20 1 1 A 20 20 TRP C C 7 179.620 177.893 1.727 1
1 78 . 20 1 1 A 20 20 TRP CA C 7 61.886 61.140 0.746 1
1 79 . 20 1 1 A 20 20 TRP CB C 7 28.133 29.507 -1.374 1
1 85 . 20 1 1 A 20 20 TRP N N 7 124.265 122.488 1.777 1
1 87 . 20 1 1 A 21 21 LEU H H 8 9.148 8.712 0.436 1
1 88 . 20 1 1 A 21 21 LEU HA H 8 3.440 3.412 0.028 1
1 97 . 20 1 1 A 21 21 LEU C C 8 180.521 178.449 2.072 1
1 98 . 20 1 1 A 21 21 LEU CA C 8 56.920 57.820 -0.900 1
1 99 . 20 1 1 A 21 21 LEU CB C 8 41.700 41.611 0.089 1
1 102 . 20 1 1 A 21 21 LEU N N 8 120.548 120.731 -0.183 1
1 103 . 20 1 1 A 22 22 GLU H H 9 8.284 8.358 -0.074 1
1 104 . 20 1 1 A 22 22 GLU HA H 9 3.740 4.026 -0.286 1
1 109 . 20 1 1 A 22 22 GLU C C 9 179.960 178.432 1.528 1
1 110 . 20 1 1 A 22 22 GLU CA C 9 60.010 59.589 0.421 1
1 111 . 20 1 1 A 22 22 GLU CB C 9 29.070 29.033 0.037 1
1 113 . 20 1 1 A 22 22 GLU N N 9 120.133 119.691 0.442 1
1 114 . 20 1 1 A 23 23 SER H H 10 7.891 7.827 0.064 1
1 115 . 20 1 1 A 23 23 SER HA H 10 4.250 4.196 0.054 1
1 118 . 20 1 1 A 23 23 SER C C 10 175.346 176.441 -1.095 1
1 119 . 20 1 1 A 23 23 SER CA C 10 60.948 61.307 -0.359 1
1 120 . 20 1 1 A 23 23 SER CB C 10 63.280 62.959 0.321 1
1 121 . 20 1 1 A 23 23 SER N N 10 117.044 114.298 2.746 1
1 122 . 20 1 1 A 24 24 ILE H H 11 6.862 7.591 -0.729 1
1 123 . 20 1 1 A 24 24 ILE HA H 11 4.487 3.886 0.601 1
1 133 . 20 1 1 A 24 24 ILE C C 11 175.812 175.822 -0.010 1
1 134 . 20 1 1 A 24 24 ILE CA C 11 60.948 63.043 -2.095 1
1 135 . 20 1 1 A 24 24 ILE CB C 11 38.250 37.370 0.880 1
1 139 . 20 1 1 A 24 24 ILE N N 11 113.733 118.038 -4.305 1
1 140 . 20 1 1 A 25 25 GLY H H 12 7.628 7.525 0.103 1
1 141 . 20 1 1 A 25 25 GLY HA2 H 12 3.990 3.940 0.050 1
1 142 . 20 1 1 A 25 25 GLY HA3 H 12 3.800 3.994 -0.194 1
1 143 . 20 1 1 A 25 25 GLY C C 12 173.647 171.973 1.674 1
1 144 . 20 1 1 A 25 25 GLY CA C 12 45.947 45.884 0.063 1
1 145 . 20 1 1 A 25 25 GLY N N 12 109.763 109.770 -0.007 1
1 146 . 20 1 1 A 26 26 LEU H H 13 7.620 8.373 -0.753 1
1 147 . 20 1 1 A 26 26 LEU C C 13 176.186 176.797 -0.611 1
1 148 . 20 1 1 A 26 26 LEU CA C 13 52.700 51.969 0.731 1
1 149 . 20 1 1 A 26 26 LEU CB C 13 43.134 45.889 -2.755 1
1 150 . 20 1 1 A 26 26 LEU N N 13 118.778 122.044 -3.266 1
1 151 . 20 1 1 A 27 27 PRO HA H 14 4.120 4.515 -0.395 1
1 154 . 20 1 1 A 27 27 PRO C C 14 177.955 177.804 0.151 1
1 155 . 20 1 1 A 27 27 PRO CA C 14 64.698 64.392 0.306 1
1 156 . 20 1 1 A 27 27 PRO CB C 14 31.883 31.934 -0.051 1
1 158 . 20 1 1 A 28 28 GLN H H 15 9.838 8.466 1.372 1
1 159 . 20 1 1 A 28 28 GLN HA H 15 4.240 3.956 0.284 1
1 162 . 20 1 1 A 28 28 GLN C C 15 176.836 176.591 0.245 1
1 163 . 20 1 1 A 28 28 GLN CA C 15 58.135 58.287 -0.152 1
1 164 . 20 1 1 A 28 28 GLN CB C 15 27.195 28.025 -0.830 1
1 166 . 20 1 1 A 28 28 GLN N N 15 120.414 117.524 2.890 1
1 167 . 20 1 1 A 29 29 TYR H H 16 6.810 7.154 -0.344 1
1 168 . 20 1 1 A 29 29 TYR HA H 16 5.720 4.405 1.315 1
1 173 . 20 1 1 A 29 29 TYR C C 16 174.814 177.428 -2.614 1
1 174 . 20 1 1 A 29 29 TYR CA C 16 57.198 59.370 -2.172 1
1 175 . 20 1 1 A 29 29 TYR CB C 16 37.509 39.807 -2.298 1
1 178 . 20 1 1 A 29 29 TYR N N 16 119.718 117.348 2.370 1
1 179 . 20 1 1 A 30 30 GLU H H 17 7.509 8.380 -0.871 1
1 180 . 20 1 1 A 30 30 GLU HA H 17 3.650 4.096 -0.446 1
1 184 . 20 1 1 A 30 30 GLU C C 17 177.552 178.684 -1.132 1
1 185 . 20 1 1 A 30 30 GLU CA C 17 60.948 60.053 0.895 1
1 186 . 20 1 1 A 30 30 GLU CB C 17 30.008 29.407 0.601 1
1 188 . 20 1 1 A 30 30 GLU N N 17 122.417 122.125 0.292 1
1 189 . 20 1 1 A 31 31 ASN H H 18 9.259 8.151 1.108 1
1 190 . 20 1 1 A 31 31 ASN HA H 18 4.451 4.379 0.072 1
1 193 . 20 1 1 A 31 31 ASN C C 18 176.868 178.321 -1.453 1
1 194 . 20 1 1 A 31 31 ASN CA C 18 57.198 56.559 0.639 1
1 195 . 20 1 1 A 31 31 ASN CB C 18 38.446 38.172 0.274 1
1 196 . 20 1 1 A 31 31 ASN N N 18 116.613 118.202 -1.589 1
1 197 . 20 1 1 A 32 32 HIS H H 19 8.898 7.979 0.919 1
1 198 . 20 1 1 A 32 32 HIS HA H 19 4.140 4.350 -0.210 1
1 202 . 20 1 1 A 32 32 HIS C C 19 178.269 177.727 0.542 1
1 203 . 20 1 1 A 32 32 HIS CA C 19 60.948 59.672 1.276 1
1 204 . 20 1 1 A 32 32 HIS CB C 19 30.008 30.101 -0.093 1
1 206 . 20 1 1 A 32 32 HIS N N 19 118.926 119.242 -0.316 1
1 207 . 20 1 1 A 33 33 LEU H H 20 7.825 8.661 -0.836 1
1 208 . 20 1 1 A 33 33 LEU HA H 20 4.305 3.956 0.349 1
1 218 . 20 1 1 A 33 33 LEU C C 20 179.190 179.189 0.001 1
1 219 . 20 1 1 A 33 33 LEU CA C 20 60.010 58.437 1.573 1
1 220 . 20 1 1 A 33 33 LEU CB C 20 40.321 42.074 -1.753 1
1 224 . 20 1 1 A 33 33 LEU N N 20 117.434 119.969 -2.535 1
1 225 . 20 1 1 A 34 34 MET H H 21 8.861 8.740 0.121 1
1 226 . 20 1 1 A 34 34 MET HA H 21 3.980 4.292 -0.312 1
1 234 . 20 1 1 A 34 34 MET C C 21 180.340 178.695 1.645 1
1 235 . 20 1 1 A 34 34 MET CA C 21 58.135 58.508 -0.373 1
1 236 . 20 1 1 A 34 34 MET CB C 21 30.945 32.096 -1.151 1
1 238 . 20 1 1 A 34 34 MET N N 21 118.111 117.660 0.451 1
1 239 . 20 1 1 A 35 35 ALA H H 22 9.015 8.252 0.763 1
1 240 . 20 1 1 A 35 35 ALA HA H 22 4.239 4.102 0.137 1
1 244 . 20 1 1 A 35 35 ALA C C 22 178.058 178.495 -0.437 1
1 245 . 20 1 1 A 35 35 ALA CA C 22 53.800 54.680 -0.880 1
1 246 . 20 1 1 A 35 35 ALA CB C 22 18.397 18.237 0.160 1
1 247 . 20 1 1 A 35 35 ALA N N 22 120.068 122.139 -2.071 1
1 248 . 20 1 1 A 36 36 ASN H H 23 7.143 8.070 -0.927 1
1 249 . 20 1 1 A 36 36 ASN HA H 23 4.959 4.884 0.075 1
1 254 . 20 1 1 A 36 36 ASN C C 23 174.083 175.355 -1.272 1
1 255 . 20 1 1 A 36 36 ASN CA C 23 54.000 52.658 1.342 1
1 256 . 20 1 1 A 36 36 ASN CB C 23 41.300 38.898 2.402 1
1 257 . 20 1 1 A 36 36 ASN N N 23 111.560 114.958 -3.398 1
1 259 . 20 1 1 A 37 37 GLY H H 24 7.797 8.228 -0.431 1
1 260 . 20 1 1 A 37 37 GLY HA2 H 24 3.430 3.833 -0.403 1
1 261 . 20 1 1 A 37 37 GLY HA3 H 24 3.290 3.933 -0.643 1
1 262 . 20 1 1 A 37 37 GLY C C 24 173.163 174.998 -1.835 1
1 263 . 20 1 1 A 37 37 GLY CA C 24 45.947 45.215 0.732 1
1 264 . 20 1 1 A 37 37 GLY N N 24 106.170 107.893 -1.723 1
1 265 . 20 1 1 A 38 38 PHE H H 25 8.191 7.960 0.231 1
1 266 . 20 1 1 A 38 38 PHE HA H 25 4.910 4.764 0.146 1
1 271 . 20 1 1 A 38 38 PHE C C 25 173.496 175.655 -2.159 1
1 272 . 20 1 1 A 38 38 PHE CA C 25 56.550 56.305 0.245 1
1 273 . 20 1 1 A 38 38 PHE CB C 25 37.220 36.787 0.433 1
1 276 . 20 1 1 A 38 38 PHE N N 25 122.454 119.892 2.562 1
1 277 . 20 1 1 A 39 39 ASP H H 26 6.756 8.366 -1.610 1
1 278 . 20 1 1 A 39 39 ASP HA H 26 5.077 4.910 0.167 1
1 281 . 20 1 1 A 39 39 ASP C C 26 177.463 175.642 1.821 1
1 282 . 20 1 1 A 39 39 ASP CA C 26 53.447 53.729 -0.282 1
1 283 . 20 1 1 A 39 39 ASP CB C 26 42.580 41.407 1.173 1
1 284 . 20 1 1 A 39 39 ASP N N 26 111.309 120.047 -8.738 1
1 285 . 20 1 1 A 40 40 ASN H H 27 7.495 7.745 -0.250 1
1 286 . 20 1 1 A 40 40 ASN HA H 27 4.820 5.030 -0.210 1
1 289 . 20 1 1 A 40 40 ASN C C 27 176.228 175.723 0.505 1
1 290 . 20 1 1 A 40 40 ASN CA C 27 52.510 52.200 0.310 1
1 291 . 20 1 1 A 40 40 ASN CB C 27 40.321 40.186 0.135 1
1 292 . 20 1 1 A 40 40 ASN N N 27 118.385 118.762 -0.377 1
1 293 . 20 1 1 A 41 41 VAL H H 28 9.192 8.615 0.577 1
1 294 . 20 1 1 A 41 41 VAL HA H 28 3.550 3.679 -0.129 1
1 302 . 20 1 1 A 41 41 VAL C C 28 176.429 177.843 -1.414 1
1 303 . 20 1 1 A 41 41 VAL CA C 28 65.636 66.042 -0.406 1
1 304 . 20 1 1 A 41 41 VAL CB C 28 31.883 31.645 0.238 1
1 307 . 20 1 1 A 41 41 VAL N N 28 125.741 124.912 0.829 1
1 308 . 20 1 1 A 42 42 GLN H H 29 8.203 8.011 0.192 1
1 309 . 20 1 1 A 42 42 GLN HA H 29 4.129 3.990 0.139 1
1 314 . 20 1 1 A 42 42 GLN C C 29 176.591 178.420 -1.829 1
1 315 . 20 1 1 A 42 42 GLN CA C 29 57.198 58.627 -1.429 1
1 316 . 20 1 1 A 42 42 GLN CB C 29 28.133 28.635 -0.502 1
1 318 . 20 1 1 A 42 42 GLN N N 29 116.452 120.714 -4.262 1
1 319 . 20 1 1 A 43 43 ALA H H 30 7.781 7.981 -0.200 1
1 320 . 20 1 1 A 43 43 ALA HA H 30 4.650 4.176 0.474 1
1 324 . 20 1 1 A 43 43 ALA C C 30 175.976 178.316 -2.340 1
1 325 . 20 1 1 A 43 43 ALA CA C 30 50.840 54.146 -3.306 1
1 326 . 20 1 1 A 43 43 ALA CB C 30 19.150 18.334 0.816 1
1 327 . 20 1 1 A 43 43 ALA N N 30 122.150 121.139 1.011 1
1 328 . 20 1 1 A 44 44 MET H H 31 7.739 7.822 -0.083 1
1 332 . 20 1 1 A 44 44 MET C C 31 178.275 177.075 1.200 1
1 333 . 20 1 1 A 44 44 MET CA C 31 55.323 55.225 0.098 1
1 334 . 20 1 1 A 44 44 MET CB C 31 34.696 33.097 1.599 1
1 336 . 20 1 1 A 44 44 MET N N 31 118.149 115.854 2.295 1
1 337 . 20 1 1 A 45 45 GLY H H 32 7.611 8.360 -0.749 1
1 338 . 20 1 1 A 45 45 GLY N N 32 101.530 109.129 -7.599 1
1 339 . 20 1 1 A 47 47 ASN HA H 34 4.480 5.061 -0.581 1
1 342 . 20 1 1 A 47 47 ASN CA C 34 56.260 52.941 3.319 1
1 343 . 20 1 1 A 47 47 ASN CB C 34 39.384 38.845 0.539 1
1 344 . 20 1 1 A 49 49 MET HA H 36 4.646 4.533 0.113 1
1 350 . 20 1 1 A 49 49 MET C C 36 173.651 175.663 -2.012 1
1 351 . 20 1 1 A 49 49 MET CA C 36 55.323 54.801 0.522 1
1 352 . 20 1 1 A 49 49 MET CB C 36 35.633 32.386 3.247 1
1 355 . 20 1 1 A 50 50 GLU H H 37 9.203 8.545 0.658 1
1 356 . 20 1 1 A 50 50 GLU HA H 37 4.650 4.702 -0.052 1
1 361 . 20 1 1 A 50 50 GLU C C 37 177.008 177.242 -0.234 1
1 362 . 20 1 1 A 50 50 GLU CA C 37 54.385 54.616 -0.231 1
1 363 . 20 1 1 A 50 50 GLU CB C 37 33.758 32.252 1.506 1
1 365 . 20 1 1 A 50 50 GLU N N 37 123.229 124.736 -1.507 1
1 366 . 20 1 1 A 51 51 ASP H H 38 9.032 8.928 0.104 1
1 367 . 20 1 1 A 51 51 ASP HA H 38 4.149 4.355 -0.206 1
1 370 . 20 1 1 A 51 51 ASP C C 38 177.994 178.165 -0.171 1
1 371 . 20 1 1 A 51 51 ASP CA C 38 59.073 57.065 2.008 1
1 372 . 20 1 1 A 51 51 ASP CB C 38 43.134 39.972 3.162 1
1 373 . 20 1 1 A 51 51 ASP N N 38 122.717 121.540 1.177 1
1 374 . 20 1 1 A 52 52 GLN H H 39 8.950 8.282 0.668 1
1 375 . 20 1 1 A 52 52 GLN HA H 39 3.940 3.966 -0.026 1
1 378 . 20 1 1 A 52 52 GLN C C 39 177.817 178.339 -0.522 1
1 379 . 20 1 1 A 52 52 GLN CA C 39 59.073 59.187 -0.114 1
1 380 . 20 1 1 A 52 52 GLN CB C 39 28.133 28.492 -0.359 1
1 381 . 20 1 1 A 52 52 GLN N N 39 114.086 119.595 -5.509 1
1 382 . 20 1 1 A 53 53 ASP H H 40 7.214 8.221 -1.007 1
1 383 . 20 1 1 A 53 53 ASP HA H 40 4.370 4.533 -0.163 1
1 386 . 20 1 1 A 53 53 ASP C C 40 177.667 178.598 -0.931 1
1 387 . 20 1 1 A 53 53 ASP CA C 40 57.198 57.457 -0.259 1
1 388 . 20 1 1 A 53 53 ASP CB C 40 41.800 40.357 1.443 1
1 389 . 20 1 1 A 53 53 ASP N N 40 118.734 120.356 -1.622 1
1 390 . 20 1 1 A 54 54 LEU H H 41 7.180 8.140 -0.960 1
1 391 . 20 1 1 A 54 54 LEU HA H 41 3.990 4.042 -0.052 1
1 400 . 20 1 1 A 54 54 LEU C C 41 178.204 178.106 0.098 1
1 401 . 20 1 1 A 54 54 LEU CA C 41 56.260 58.007 -1.747 1
1 402 . 20 1 1 A 54 54 LEU CB C 41 41.259 41.781 -0.522 1
1 405 . 20 1 1 A 54 54 LEU N N 41 115.795 122.325 -6.530 1
1 406 . 20 1 1 A 55 55 LEU H H 42 7.823 7.785 0.038 1
1 407 . 20 1 1 A 55 55 LEU HA H 42 3.920 4.178 -0.258 1
1 416 . 20 1 1 A 55 55 LEU C C 42 180.876 178.443 2.433 1
1 417 . 20 1 1 A 55 55 LEU CA C 42 58.135 56.612 1.523 1
1 418 . 20 1 1 A 55 55 LEU CB C 42 42.196 41.758 0.438 1
1 421 . 20 1 1 A 55 55 LEU N N 42 120.499 119.390 1.109 1
1 422 . 20 1 1 A 56 56 GLU H H 43 8.127 8.023 0.104 1
1 423 . 20 1 1 A 56 56 GLU HA H 43 3.966 4.147 -0.181 1
1 428 . 20 1 1 A 56 56 GLU C C 43 178.801 179.329 -0.528 1
1 429 . 20 1 1 A 56 56 GLU CA C 43 60.010 58.788 1.222 1
1 430 . 20 1 1 A 56 56 GLU CB C 43 29.070 29.404 -0.334 1
1 432 . 20 1 1 A 56 56 GLU N N 43 120.955 118.753 2.202 1
1 433 . 20 1 1 A 57 57 ILE H H 44 7.504 7.701 -0.197 1
1 434 . 20 1 1 A 57 57 ILE HA H 44 4.524 3.966 0.558 1
1 444 . 20 1 1 A 57 57 ILE C C 44 175.691 176.026 -0.335 1
1 445 . 20 1 1 A 57 57 ILE CA C 44 61.886 63.729 -1.843 1
1 446 . 20 1 1 A 57 57 ILE CB C 44 37.300 38.766 -1.466 1
1 450 . 20 1 1 A 57 57 ILE N N 44 109.594 117.880 -8.286 1
1 451 . 20 1 1 A 58 58 GLY H H 45 7.724 7.813 -0.089 1
1 452 . 20 1 1 A 58 58 GLY HA2 H 45 3.650 4.126 -0.476 1
1 453 . 20 1 1 A 58 58 GLY HA3 H 45 4.530 4.262 0.268 1
1 454 . 20 1 1 A 58 58 GLY C C 45 174.613 174.794 -0.181 1
1 455 . 20 1 1 A 58 58 GLY CA C 45 45.947 45.299 0.648 1
1 456 . 20 1 1 A 58 58 GLY N N 45 106.680 108.034 -1.354 1
1 457 . 20 1 1 A 59 59 ILE H H 46 8.180 7.909 0.271 1
1 458 . 20 1 1 A 59 59 ILE HA H 46 3.907 4.123 -0.216 1
1 468 . 20 1 1 A 59 59 ILE C C 46 174.235 175.811 -1.576 1
1 469 . 20 1 1 A 59 59 ILE CA C 46 60.948 61.951 -1.003 1
1 470 . 20 1 1 A 59 59 ILE CB C 46 33.980 37.477 -3.497 1
1 474 . 20 1 1 A 59 59 ILE N N 46 122.454 122.527 -0.073 1
1 475 . 20 1 1 A 60 60 LEU H H 47 7.367 9.022 -1.655 1
1 476 . 20 1 1 A 60 60 LEU HA H 47 3.900 4.498 -0.598 1
1 479 . 20 1 1 A 60 60 LEU C C 47 177.753 176.470 1.283 1
1 480 . 20 1 1 A 60 60 LEU CA C 47 56.260 56.571 -0.311 1
1 481 . 20 1 1 A 60 60 LEU CB C 47 42.196 43.462 -1.266 1
1 482 . 20 1 1 A 60 60 LEU N N 47 125.835 129.815 -3.980 1
1 483 . 20 1 1 A 63 63 GLY HA2 H 50 3.980 3.928 0.052 1
1 484 . 20 1 1 A 63 63 GLY HA3 H 50 3.950 3.952 -0.002 1
1 485 . 20 1 1 A 63 63 GLY C C 50 177.130 174.801 2.329 1
1 486 . 20 1 1 A 63 63 GLY CA C 50 46.884 45.454 1.430 1
1 487 . 20 1 1 A 64 64 HIS H H 51 7.926 8.127 -0.201 1
1 488 . 20 1 1 A 64 64 HIS HA H 51 4.451 4.070 0.381 1
1 493 . 20 1 1 A 64 64 HIS C C 51 177.613 177.190 0.423 1
1 494 . 20 1 1 A 64 64 HIS CA C 51 57.198 59.479 -2.281 1
1 495 . 20 1 1 A 64 64 HIS CB C 51 30.945 30.581 0.364 1
1 498 . 20 1 1 A 64 64 HIS N N 51 122.284 121.346 0.938 1
1 499 . 20 1 1 A 65 65 ARG H H 52 8.105 8.046 0.059 1
1 500 . 20 1 1 A 65 65 ARG HA H 52 3.685 3.926 -0.241 1
1 507 . 20 1 1 A 65 65 ARG C C 52 177.769 178.265 -0.496 1
1 508 . 20 1 1 A 65 65 ARG CA C 52 61.886 58.623 3.263 1
1 509 . 20 1 1 A 65 65 ARG CB C 52 30.945 30.220 0.725 1
1 511 . 20 1 1 A 65 65 ARG N N 52 117.775 117.281 0.494 1
1 513 . 20 1 1 A 66 66 GLN H H 53 8.090 7.959 0.131 1
1 514 . 20 1 1 A 66 66 GLN HA H 53 3.940 4.003 -0.063 1
1 519 . 20 1 1 A 66 66 GLN C C 53 178.583 178.290 0.293 1
1 520 . 20 1 1 A 66 66 GLN CA C 53 59.073 58.957 0.116 1
1 521 . 20 1 1 A 66 66 GLN CB C 53 28.133 28.213 -0.080 1
1 523 . 20 1 1 A 66 66 GLN N N 53 116.452 118.729 -2.277 1
1 524 . 20 1 1 A 67 67 ARG H H 54 7.845 7.312 0.533 1
1 525 . 20 1 1 A 67 67 ARG HA H 54 4.010 3.945 0.065 1
1 528 . 20 1 1 A 67 67 ARG C C 54 179.766 178.501 1.265 1
1 529 . 20 1 1 A 67 67 ARG CA C 54 59.073 59.049 0.024 1
1 530 . 20 1 1 A 67 67 ARG CB C 54 30.720 29.835 0.885 1
1 532 . 20 1 1 A 67 67 ARG N N 54 119.275 118.498 0.777 1
1 533 . 20 1 1 A 68 68 ILE H H 55 8.032 7.855 0.177 1
1 534 . 20 1 1 A 68 68 ILE HA H 55 3.495 3.499 -0.004 1
1 544 . 20 1 1 A 68 68 ILE C C 55 177.108 178.096 -0.988 1
1 545 . 20 1 1 A 68 68 ILE CA C 55 66.230 65.637 0.593 1
1 546 . 20 1 1 A 68 68 ILE CB C 55 38.020 38.011 0.009 1
1 550 . 20 1 1 A 68 68 ILE N N 55 121.152 120.726 0.426 1
1 551 . 20 1 1 A 69 69 LEU H H 56 8.490 8.025 0.465 1
1 552 . 20 1 1 A 69 69 LEU HA H 56 4.010 3.999 0.011 1
1 561 . 20 1 1 A 69 69 LEU C C 56 179.917 178.583 1.334 1
1 562 . 20 1 1 A 69 69 LEU CA C 56 58.135 58.574 -0.439 1
1 563 . 20 1 1 A 69 69 LEU CB C 56 41.259 41.626 -0.367 1
1 566 . 20 1 1 A 69 69 LEU N N 56 119.072 121.442 -2.370 1
1 567 . 20 1 1 A 70 70 GLN H H 57 8.327 8.309 0.018 1
1 568 . 20 1 1 A 70 70 GLN HA H 57 4.100 4.036 0.064 1
1 573 . 20 1 1 A 70 70 GLN C C 57 178.798 177.766 1.032 1
1 574 . 20 1 1 A 70 70 GLN CA C 57 59.073 58.712 0.361 1
1 575 . 20 1 1 A 70 70 GLN CB C 57 28.133 28.818 -0.685 1
1 577 . 20 1 1 A 70 70 GLN N N 57 118.172 118.021 0.151 1
1 578 . 20 1 1 A 71 71 ALA H H 58 7.810 8.369 -0.559 1
1 579 . 20 1 1 A 71 71 ALA HA H 58 4.320 4.118 0.202 1
1 583 . 20 1 1 A 71 71 ALA C C 58 172.232 179.930 -7.698 1
1 584 . 20 1 1 A 71 71 ALA CA C 58 55.323 55.213 0.110 1
1 585 . 20 1 1 A 71 71 ALA CB C 58 19.720 18.535 1.185 1
1 586 . 20 1 1 A 71 71 ALA N N 58 122.536 120.892 1.644 1
1 587 . 20 1 1 A 72 72 ILE H H 59 8.840 8.535 0.305 1
1 588 . 20 1 1 A 72 72 ILE HA H 59 4.030 3.997 0.033 1
1 598 . 20 1 1 A 72 72 ILE C C 59 178.678 177.928 0.750 1
1 599 . 20 1 1 A 72 72 ILE CA C 59 64.698 62.998 1.700 1
1 600 . 20 1 1 A 72 72 ILE CB C 59 37.850 37.513 0.337 1
1 604 . 20 1 1 A 72 72 ILE N N 59 118.111 118.385 -0.274 1
1 605 . 20 1 1 A 73 73 GLN H H 60 7.547 8.220 -0.673 1
1 606 . 20 1 1 A 73 73 GLN HA H 60 4.121 4.133 -0.012 1
1 611 . 20 1 1 A 73 73 GLN C C 60 176.556 178.062 -1.506 1
1 612 . 20 1 1 A 73 73 GLN CA C 60 58.135 58.740 -0.605 1
1 613 . 20 1 1 A 73 73 GLN CB C 60 28.300 28.228 0.072 1
1 615 . 20 1 1 A 73 73 GLN N N 60 119.094 122.733 -3.639 1
1 616 . 20 1 1 A 74 74 LEU H H 61 7.350 7.823 -0.473 1
1 617 . 20 1 1 A 74 74 LEU HA H 61 4.408 4.250 0.158 1
1 626 . 20 1 1 A 74 74 LEU C C 61 177.960 176.404 1.556 1
1 627 . 20 1 1 A 74 74 LEU CA C 61 54.900 57.421 -2.521 1
1 628 . 20 1 1 A 74 74 LEU CB C 61 42.196 42.508 -0.312 1
1 631 . 20 1 1 A 74 74 LEU N N 61 115.853 120.548 -4.695 1
1 632 . 20 1 1 A 75 75 LEU H H 62 7.358 8.045 -0.687 1
1 633 . 20 1 1 A 75 75 LEU HA H 62 4.530 4.122 0.408 1
1 642 . 20 1 1 A 75 75 LEU C C 62 177.035 175.611 1.424 1
1 643 . 20 1 1 A 75 75 LEU CA C 62 53.200 55.668 -2.468 1
1 644 . 20 1 1 A 75 75 LEU CB C 62 40.700 40.745 -0.045 1
1 647 . 20 1 1 A 75 75 LEU N N 62 121.010 118.871 2.139 1
1 648 . 20 1 1 A 76 76 PRO HA H 63 4.382 4.691 -0.309 1
1 655 . 20 1 1 A 76 76 PRO CB C 63 31.883 30.331 1.552 1
1 657 . 20 1 1 A 77 77 LYS H H 64 8.418 8.370 0.048 1
1 658 . 20 1 1 A 77 77 LYS HA H 64 4.140 4.793 -0.653 1
1 663 . 20 1 1 A 77 77 LYS C C 64 177.122 175.605 1.517 1
1 664 . 20 1 1 A 77 77 LYS CA C 64 56.260 54.904 1.356 1
1 665 . 20 1 1 A 77 77 LYS CB C 64 33.340 36.233 -2.893 1
1 668 . 20 1 1 A 77 77 LYS N N 64 121.932 123.476 -1.544 1
1 669 . 20 1 1 A 78 78 MET H H 65 8.550 8.493 0.057 1
1 670 . 20 1 1 A 78 78 MET HA H 65 4.304 4.588 -0.284 1
1 676 . 20 1 1 A 78 78 MET C C 65 176.105 177.681 -1.576 1
1 677 . 20 1 1 A 78 78 MET CA C 65 56.260 55.967 0.293 1
1 678 . 20 1 1 A 78 78 MET CB C 65 32.821 33.801 -0.980 1
1 680 . 20 1 1 A 78 78 MET N N 65 123.498 120.026 3.472 1
1 681 . 20 1 1 A 79 79 ARG H H 66 8.731 8.120 0.611 1
1 682 . 20 1 1 A 79 79 ARG C C 66 173.577 177.150 -3.573 1
1 683 . 20 1 1 A 79 79 ARG CA C 66 53.447 61.122 -7.675 1
1 684 . 20 1 1 A 79 79 ARG CB C 66 30.008 28.144 1.864 1
1 685 . 20 1 1 A 79 79 ARG N N 66 127.355 121.038 6.317 1
1 686 . 20 1 1 A 80 80 PRO HA H 67 4.780 4.532 0.248 1
1 693 . 20 1 1 A 80 80 PRO C C 67 177.043 175.921 1.122 1
1 694 . 20 1 1 A 80 80 PRO CA C 67 61.886 62.684 -0.798 1
1 695 . 20 1 1 A 80 80 PRO CB C 67 32.821 29.970 2.851 1
1 698 . 20 1 1 A 81 81 ILE H H 68 8.580 8.134 0.446 1
1 699 . 20 1 1 A 81 81 ILE HA H 68 4.040 5.022 -0.982 1
1 709 . 20 1 1 A 81 81 ILE C C 68 176.831 174.758 2.073 1
1 710 . 20 1 1 A 81 81 ILE CA C 68 62.823 58.750 4.073 1
1 711 . 20 1 1 A 81 81 ILE CB C 68 38.580 41.349 -2.769 1
1 715 . 20 1 1 A 81 81 ILE N N 68 118.491 117.642 0.849 1
1 716 . 20 1 1 A 82 82 GLY H H 69 8.602 8.407 0.195 1
1 717 . 20 1 1 A 82 82 GLY CA C 69 45.009 45.923 -0.914 1
1 718 . 20 1 1 A 82 82 GLY N N 69 111.377 109.443 1.934 1
1 721 . 20 1 1 A 84 84 ASP HA H 71 4.490 5.139 -0.649 1
1 724 . 20 1 1 A 84 84 ASP CA C 71 54.385 53.193 1.192 1
1 725 . 20 1 1 A 84 84 ASP CB C 71 40.321 44.164 -3.843 1
1 726 . 20 1 1 A 85 85 GLY H H 72 8.054 8.427 -0.373 1
1 727 . 20 1 1 A 85 85 GLY HA2 H 72 4.040 4.168 -0.128 1
1 728 . 20 1 1 A 85 85 GLY HA3 H 72 3.750 4.176 -0.426 1
1 729 . 20 1 1 A 85 85 GLY C C 72 173.474 172.654 0.820 1
1 730 . 20 1 1 A 85 85 GLY CA C 72 45.009 44.675 0.334 1
1 731 . 20 1 1 A 85 85 GLY N N 72 108.038 111.546 -3.508 1
1 732 . 20 1 1 A 86 86 ALA H H 73 7.858 8.587 -0.729 1
1 733 . 20 1 1 A 86 86 ALA HA H 73 4.370 5.214 -0.844 1
1 737 . 20 1 1 A 86 86 ALA CA C 73 51.990 51.535 0.455 1
1 738 . 20 1 1 A 86 86 ALA CB C 73 19.220 22.006 -2.786 1
1 739 . 20 1 1 A 86 86 ALA N N 73 123.819 123.228 0.591 1
1 742 . 20 1 1 A 90 90 SER H H 77 7.839 8.729 -0.890 1
1 743 . 20 1 1 A 90 90 SER HA H 77 4.770 4.764 0.006 1
1 746 . 20 1 1 A 90 90 SER N N 77 115.163 118.432 -3.269 1
1 747 . 20 1 1 A 91 91 VAL H H 78 8.578 8.860 -0.282 1
1 748 . 20 1 1 A 91 91 VAL HA H 78 3.981 3.871 0.110 1
1 756 . 20 1 1 A 91 91 VAL C C 78 177.480 177.594 -0.114 1
1 757 . 20 1 1 A 91 91 VAL CA C 78 67.060 66.175 0.885 1
1 758 . 20 1 1 A 91 91 VAL CB C 78 32.500 31.670 0.830 1
1 761 . 20 1 1 A 91 91 VAL N N 78 123.481 126.154 -2.673 1
1 762 . 20 1 1 A 92 92 ALA H H 79 8.607 8.289 0.318 1
1 763 . 20 1 1 A 92 92 ALA HA H 79 4.113 4.370 -0.257 1
1 767 . 20 1 1 A 92 92 ALA C C 79 179.868 180.332 -0.464 1
1 768 . 20 1 1 A 92 92 ALA CA C 79 54.890 55.502 -0.612 1
1 769 . 20 1 1 A 92 92 ALA CB C 79 18.790 18.610 0.180 1
1 770 . 20 1 1 A 92 92 ALA N N 79 120.334 121.868 -1.534 1
1 771 . 20 1 1 A 93 93 GLU H H 80 7.886 8.466 -0.580 1
1 772 . 20 1 1 A 93 93 GLU HA H 80 4.010 4.133 -0.123 1
1 777 . 20 1 1 A 93 93 GLU C C 80 179.719 178.720 0.999 1
1 778 . 20 1 1 A 93 93 GLU CA C 80 59.073 58.673 0.400 1
1 779 . 20 1 1 A 93 93 GLU CB C 80 30.630 29.591 1.039 1
1 781 . 20 1 1 A 93 93 GLU N N 80 117.643 116.999 0.644 1
1 782 . 20 1 1 A 94 94 TRP H H 81 8.299 8.136 0.163 1
1 783 . 20 1 1 A 94 94 TRP HA H 81 4.251 4.280 -0.029 1
1 792 . 20 1 1 A 94 94 TRP C C 81 178.772 177.698 1.074 1
1 793 . 20 1 1 A 94 94 TRP CA C 81 60.010 60.852 -0.842 1
1 794 . 20 1 1 A 94 94 TRP CB C 81 27.650 29.383 -1.733 1
1 800 . 20 1 1 A 94 94 TRP N N 81 122.545 123.727 -1.182 1
1 802 . 20 1 1 A 95 95 LEU H H 82 8.505 7.839 0.666 1
1 803 . 20 1 1 A 95 95 LEU HA H 82 2.880 3.633 -0.753 1
1 812 . 20 1 1 A 95 95 LEU C C 82 180.235 178.842 1.393 1
1 813 . 20 1 1 A 95 95 LEU CA C 82 57.400 56.469 0.931 1
1 814 . 20 1 1 A 95 95 LEU CB C 82 40.321 41.400 -1.079 1
1 817 . 20 1 1 A 95 95 LEU N N 82 121.110 118.975 2.135 1
1 818 . 20 1 1 A 96 96 ASP H H 83 8.185 8.357 -0.172 1
1 819 . 20 1 1 A 96 96 ASP HA H 83 4.280 4.416 -0.136 1
1 822 . 20 1 1 A 96 96 ASP C C 83 175.224 177.677 -2.453 1
1 823 . 20 1 1 A 96 96 ASP CA C 83 57.310 56.096 1.214 1
1 824 . 20 1 1 A 96 96 ASP CB C 83 40.321 40.886 -0.565 1
1 825 . 20 1 1 A 96 96 ASP N N 83 119.082 120.091 -1.009 1
1 826 . 20 1 1 A 97 97 SER H H 84 7.989 7.755 0.234 1
1 827 . 20 1 1 A 97 97 SER HA H 84 4.250 4.368 -0.118 1
1 830 . 20 1 1 A 97 97 SER C C 84 175.346 176.340 -0.994 1
1 831 . 20 1 1 A 97 97 SER CA C 84 60.948 59.981 0.967 1
1 832 . 20 1 1 A 97 97 SER CB C 84 63.370 63.623 -0.253 1
1 833 . 20 1 1 A 97 97 SER N N 84 117.579 113.954 3.625 1
1 834 . 20 1 1 A 98 98 ILE H H 85 6.862 7.321 -0.459 1
1 835 . 20 1 1 A 98 98 ILE HA H 85 4.550 3.831 0.719 1
1 843 . 20 1 1 A 98 98 ILE C C 85 173.308 177.550 -4.242 1
1 844 . 20 1 1 A 98 98 ILE CA C 85 60.948 63.775 -2.827 1
1 845 . 20 1 1 A 98 98 ILE CB C 85 37.760 37.701 0.059 1
1 848 . 20 1 1 A 98 98 ILE N N 85 113.733 120.229 -6.496 1
1 849 . 20 1 1 A 99 99 GLU H H 86 7.705 7.722 -0.017 1
1 850 . 20 1 1 A 99 99 GLU HA H 86 4.280 4.469 -0.189 1
1 853 . 20 1 1 A 99 99 GLU C C 86 175.224 176.025 -0.801 1
1 854 . 20 1 1 A 99 99 GLU CA C 86 56.260 57.169 -0.909 1
1 855 . 20 1 1 A 99 99 GLU CB C 86 26.258 32.127 -5.869 1
1 857 . 20 1 1 A 99 99 GLU N N 86 115.493 116.882 -1.389 1
1 858 . 20 1 1 A 100 100 LEU H H 87 7.989 7.597 0.392 1
1 859 . 20 1 1 A 100 100 LEU HA H 87 4.220 4.591 -0.371 1
1 868 . 20 1 1 A 100 100 LEU C C 87 176.965 177.108 -0.143 1
1 869 . 20 1 1 A 100 100 LEU CA C 87 52.510 52.892 -0.382 1
1 870 . 20 1 1 A 100 100 LEU CB C 87 42.196 44.571 -2.375 1
1 873 . 20 1 1 A 100 100 LEU N N 87 117.579 117.165 0.414 1
1 874 . 20 1 1 A 101 101 GLY H H 88 8.503 8.664 -0.161 1
1 875 . 20 1 1 A 101 101 GLY CA C 88 46.884 45.469 1.415 1
1 876 . 20 1 1 A 101 101 GLY N N 88 107.794 108.774 -0.980 1
1 877 . 20 1 1 A 102 102 ASP HA H 89 4.431 4.291 0.140 1
1 880 . 20 1 1 A 102 102 ASP C C 89 178.075 178.139 -0.064 1
1 881 . 20 1 1 A 102 102 ASP CA C 89 57.198 57.062 0.136 1
1 882 . 20 1 1 A 102 102 ASP CB C 89 40.321 41.388 -1.067 1
1 883 . 20 1 1 A 103 103 TYR H H 90 7.899 8.168 -0.269 1
1 884 . 20 1 1 A 103 103 TYR HA H 90 4.940 4.378 0.562 1
1 889 . 20 1 1 A 103 103 TYR C C 90 175.527 178.455 -2.928 1
1 890 . 20 1 1 A 103 103 TYR CA C 90 58.135 60.657 -2.522 1
1 891 . 20 1 1 A 103 103 TYR CB C 90 38.446 37.925 0.521 1
1 894 . 20 1 1 A 103 103 TYR N N 90 115.595 119.685 -4.090 1
1 895 . 20 1 1 A 104 104 THR H H 91 7.971 8.368 -0.397 1
1 896 . 20 1 1 A 104 104 THR HA H 91 4.234 4.095 0.139 1
1 901 . 20 1 1 A 104 104 THR C C 91 175.905 176.536 -0.631 1
1 902 . 20 1 1 A 104 104 THR CA C 91 68.449 67.022 1.427 1
1 904 . 20 1 1 A 104 104 THR N N 91 118.867 116.590 2.277 1
1 905 . 20 1 1 A 105 105 LYS H H 92 8.555 7.851 0.704 1
1 906 . 20 1 1 A 105 105 LYS HA H 92 3.940 4.085 -0.145 1
1 912 . 20 1 1 A 105 105 LYS C C 92 177.310 178.673 -1.363 1
1 913 . 20 1 1 A 105 105 LYS CA C 92 60.948 59.394 1.554 1
1 914 . 20 1 1 A 105 105 LYS CB C 92 31.883 32.392 -0.509 1
1 917 . 20 1 1 A 105 105 LYS N N 92 119.259 120.825 -1.566 1
1 918 . 20 1 1 A 106 106 ALA H H 93 7.920 8.094 -0.174 1
1 919 . 20 1 1 A 106 106 ALA HA H 93 4.128 4.201 -0.073 1
1 923 . 20 1 1 A 106 106 ALA C C 93 180.972 180.284 0.688 1
1 924 . 20 1 1 A 106 106 ALA CA C 93 55.070 54.980 0.090 1
1 925 . 20 1 1 A 106 106 ALA CB C 93 17.750 18.384 -0.634 1
1 926 . 20 1 1 A 106 106 ALA N N 93 120.398 121.427 -1.029 1
1 927 . 20 1 1 A 107 107 PHE H H 94 8.136 8.414 -0.278 1
1 928 . 20 1 1 A 107 107 PHE HA H 94 4.190 4.629 -0.439 1
1 934 . 20 1 1 A 107 107 PHE C C 94 177.955 178.312 -0.357 1
1 935 . 20 1 1 A 107 107 PHE CA C 94 63.761 61.542 2.219 1
1 936 . 20 1 1 A 107 107 PHE CB C 94 38.446 39.256 -0.810 1
1 940 . 20 1 1 A 107 107 PHE N N 94 117.119 116.196 0.923 1
1 941 . 20 1 1 A 108 108 LEU H H 95 8.351 8.707 -0.356 1
1 942 . 20 1 1 A 108 108 LEU HA H 95 3.889 3.959 -0.070 1
1 951 . 20 1 1 A 108 108 LEU C C 95 182.043 179.358 2.685 1
1 952 . 20 1 1 A 108 108 LEU CA C 95 59.073 58.538 0.535 1
1 953 . 20 1 1 A 108 108 LEU CB C 95 41.259 42.066 -0.807 1
1 956 . 20 1 1 A 108 108 LEU N N 95 118.450 119.781 -1.331 1
1 957 . 20 1 1 A 109 109 ILE H H 96 8.992 8.102 0.890 1
1 958 . 20 1 1 A 109 109 ILE HA H 96 4.069 3.849 0.220 1
1 968 . 20 1 1 A 109 109 ILE C C 96 177.094 177.738 -0.644 1
1 969 . 20 1 1 A 109 109 ILE CA C 96 63.761 64.417 -0.656 1
1 970 . 20 1 1 A 109 109 ILE CB C 96 37.509 37.722 -0.213 1
1 974 . 20 1 1 A 109 109 ILE N N 96 118.177 115.126 3.051 1
1 975 . 20 1 1 A 110 110 ASN H H 97 7.067 8.073 -1.006 1
1 976 . 20 1 1 A 110 110 ASN HA H 97 4.797 4.622 0.175 1
1 981 . 20 1 1 A 110 110 ASN C C 97 173.595 175.583 -1.988 1
1 982 . 20 1 1 A 110 110 ASN CA C 97 54.385 53.273 1.112 1
1 983 . 20 1 1 A 110 110 ASN CB C 97 40.321 38.908 1.413 1
1 984 . 20 1 1 A 110 110 ASN N N 97 116.407 119.527 -3.120 1
1 986 . 20 1 1 A 111 111 GLY H H 98 7.681 7.924 -0.243 1
1 987 . 20 1 1 A 111 111 GLY HA2 H 98 4.080 3.901 0.179 1
1 988 . 20 1 1 A 111 111 GLY HA3 H 98 3.640 3.990 -0.350 1
1 989 . 20 1 1 A 111 111 GLY C C 98 174.552 174.397 0.155 1
1 990 . 20 1 1 A 111 111 GLY CA C 98 45.947 45.411 0.536 1
1 991 . 20 1 1 A 111 111 GLY N N 98 104.440 105.929 -1.489 1
1 992 . 20 1 1 A 112 112 TYR H H 99 8.427 8.083 0.344 1
1 993 . 20 1 1 A 112 112 TYR HA H 99 4.661 4.749 -0.088 1
1 998 . 20 1 1 A 112 112 TYR C C 99 174.425 176.483 -2.058 1
1 999 . 20 1 1 A 112 112 TYR CA C 99 57.198 57.922 -0.724 1
1 1000 . 20 1 1 A 112 112 TYR CB C 99 36.571 38.084 -1.513 1
1 1003 . 20 1 1 A 112 112 TYR N N 99 122.830 119.785 3.045 1
1 1004 . 20 1 1 A 113 113 THR H H 100 7.166 8.161 -0.995 1
1 1005 . 20 1 1 A 113 113 THR HA H 100 4.248 4.189 0.059 1
1 1009 . 20 1 1 A 113 113 THR C C 100 174.897 174.642 0.255 1
1 1010 . 20 1 1 A 113 113 THR CA C 100 62.290 64.870 -2.580 1
1 1011 . 20 1 1 A 113 113 THR CB C 100 68.970 68.809 0.161 1
1 1013 . 20 1 1 A 113 113 THR N N 100 104.304 113.476 -9.172 1
1 1014 . 20 1 1 A 114 114 SER H H 101 7.695 7.813 -0.118 1
1 1015 . 20 1 1 A 114 114 SER C C 101 174.372 174.456 -0.084 1
1 1016 . 20 1 1 A 114 114 SER CA C 101 56.260 56.525 -0.265 1
1 1017 . 20 1 1 A 114 114 SER CB C 101 65.636 64.595 1.041 1
1 1018 . 20 1 1 A 114 114 SER N N 101 115.613 117.509 -1.896 1
1 1023 . 20 1 1 A 116 116 ASP HA H 103 4.260 4.309 -0.049 1
1 1026 . 20 1 1 A 116 116 ASP CA C 103 57.198 57.398 -0.200 1
1 1027 . 20 1 1 A 116 116 ASP CB C 103 40.321 41.738 -1.417 1
1 1028 . 20 1 1 A 117 117 LEU H H 104 7.345 7.729 -0.384 1
1 1029 . 20 1 1 A 117 117 LEU HA H 104 4.290 4.068 0.222 1
1 1038 . 20 1 1 A 117 117 LEU C C 104 178.488 179.072 -0.584 1
1 1039 . 20 1 1 A 117 117 LEU CA C 104 56.260 57.804 -1.544 1
1 1040 . 20 1 1 A 117 117 LEU CB C 104 42.196 41.847 0.349 1
1 1043 . 20 1 1 A 117 117 LEU N N 104 117.878 120.933 -3.055 1
1 1044 . 20 1 1 A 118 118 LEU H H 105 7.514 8.386 -0.872 1
1 1045 . 20 1 1 A 118 118 LEU HA H 105 4.210 4.086 0.124 1
1 1054 . 20 1 1 A 118 118 LEU C C 105 177.002 178.220 -1.218 1
1 1055 . 20 1 1 A 118 118 LEU CA C 105 55.323 57.081 -1.758 1
1 1056 . 20 1 1 A 118 118 LEU CB C 105 42.196 40.993 1.203 1
1 1059 . 20 1 1 A 118 118 LEU N N 105 119.094 118.744 0.350 1
1 1060 . 20 1 1 A 120 120 LYS HA H 107 4.340 4.458 -0.118 1
1 1063 . 20 1 1 A 120 120 LYS C C 107 176.603 175.594 1.009 1
1 1064 . 20 1 1 A 120 120 LYS CA C 107 55.323 55.669 -0.346 1
1 1065 . 20 1 1 A 120 120 LYS CB C 107 31.883 33.109 -1.226 1
1 1068 . 20 1 1 A 121 121 ILE H H 108 7.539 7.620 -0.081 1
1 1069 . 20 1 1 A 121 121 ILE HA H 108 3.987 4.946 -0.959 1
1 1079 . 20 1 1 A 121 121 ILE C C 108 173.247 174.954 -1.707 1
1 1080 . 20 1 1 A 121 121 ILE CA C 108 62.823 58.945 3.878 1
1 1081 . 20 1 1 A 121 121 ILE CB C 108 38.446 42.321 -3.875 1
1 1085 . 20 1 1 A 121 121 ILE N N 108 122.417 117.266 5.151 1
1 1086 . 20 1 1 A 122 122 ALA H H 109 8.290 8.319 -0.029 1
1 1087 . 20 1 1 A 122 122 ALA HA H 109 3.970 4.677 -0.707 1
1 1091 . 20 1 1 A 122 122 ALA C C 109 178.318 177.819 0.499 1
1 1092 . 20 1 1 A 122 122 ALA CA C 109 50.150 49.726 0.424 1
1 1093 . 20 1 1 A 122 122 ALA CB C 109 21.630 20.991 0.639 1
1 1094 . 20 1 1 A 122 122 ALA N N 109 127.784 124.550 3.234 1
1 1095 . 20 1 1 A 123 123 GLU HA H 110 3.707 3.922 -0.215 1
1 1099 . 20 1 1 A 123 123 GLU C C 110 178.290 178.139 0.151 1
1 1100 . 20 1 1 A 123 123 GLU CA C 110 60.948 60.241 0.707 1
1 1101 . 20 1 1 A 123 123 GLU CB C 110 29.070 29.741 -0.671 1
1 1102 . 20 1 1 A 124 124 VAL H H 111 8.333 8.230 0.103 1
1 1103 . 20 1 1 A 124 124 VAL HA H 111 3.850 3.777 0.073 1
1 1111 . 20 1 1 A 124 124 VAL C C 111 177.406 177.545 -0.139 1
1 1112 . 20 1 1 A 124 124 VAL CA C 111 65.636 64.945 0.691 1
1 1113 . 20 1 1 A 124 124 VAL CB C 111 30.730 31.114 -0.384 1
1 1116 . 20 1 1 A 124 124 VAL N N 111 114.438 118.742 -4.304 1
1 1117 . 20 1 1 A 125 125 GLU H H 112 7.442 8.368 -0.926 1
1 1118 . 20 1 1 A 125 125 GLU HA H 112 4.152 4.094 0.058 1
1 1123 . 20 1 1 A 125 125 GLU C C 112 179.982 179.376 0.606 1
1 1124 . 20 1 1 A 125 125 GLU CA C 112 60.010 59.444 0.566 1
1 1125 . 20 1 1 A 125 125 GLU CB C 112 30.008 29.237 0.771 1
1 1127 . 20 1 1 A 125 125 GLU N N 112 121.032 121.904 -0.872 1
1 1128 . 20 1 1 A 126 126 LEU H H 113 7.666 7.928 -0.262 1
1 1129 . 20 1 1 A 126 126 LEU HA H 113 3.846 4.046 -0.200 1
1 1138 . 20 1 1 A 126 126 LEU C C 113 176.991 178.995 -2.004 1
1 1139 . 20 1 1 A 126 126 LEU CA C 113 58.135 57.996 0.139 1
1 1140 . 20 1 1 A 126 126 LEU CB C 113 41.259 41.753 -0.494 1
1 1143 . 20 1 1 A 126 126 LEU N N 113 118.731 121.530 -2.799 1
1 1144 . 20 1 1 A 127 127 ILE H H 114 7.781 8.109 -0.328 1
1 1145 . 20 1 1 A 127 127 ILE HA H 114 3.502 3.797 -0.295 1
1 1153 . 20 1 1 A 127 127 ILE C C 114 178.195 176.878 1.317 1
1 1154 . 20 1 1 A 127 127 ILE CA C 114 65.636 63.630 2.006 1
1 1155 . 20 1 1 A 127 127 ILE CB C 114 40.321 37.431 2.890 1
1 1159 . 20 1 1 A 127 127 ILE N N 114 115.084 119.422 -4.338 1
1 1160 . 20 1 1 A 128 128 ASN H H 115 8.470 8.056 0.414 1
1 1161 . 20 1 1 A 128 128 ASN HA H 115 4.502 4.689 -0.187 1
1 1166 . 20 1 1 A 128 128 ASN C C 115 176.295 176.013 0.282 1
1 1167 . 20 1 1 A 128 128 ASN CA C 115 56.260 54.630 1.630 1
1 1168 . 20 1 1 A 128 128 ASN CB C 115 39.384 39.217 0.167 1
1 1169 . 20 1 1 A 128 128 ASN N N 115 115.158 119.309 -4.151 1
1 1171 . 20 1 1 A 129 129 VAL H H 116 8.116 7.783 0.333 1
1 1172 . 20 1 1 A 129 129 VAL HA H 116 4.090 3.973 0.117 1
1 1180 . 20 1 1 A 129 129 VAL C C 116 176.740 177.871 -1.131 1
1 1181 . 20 1 1 A 129 129 VAL CA C 116 64.400 64.676 -0.276 1
1 1182 . 20 1 1 A 129 129 VAL CB C 116 32.050 32.198 -0.148 1
1 1185 . 20 1 1 A 129 129 VAL N N 116 118.698 118.036 0.662 1
1 1186 . 20 1 1 A 130 130 LEU H H 117 7.294 7.872 -0.578 1
1 1187 . 20 1 1 A 130 130 LEU HA H 117 3.970 4.113 -0.143 1
1 1196 . 20 1 1 A 130 130 LEU C C 117 175.127 176.182 -1.055 1
1 1197 . 20 1 1 A 130 130 LEU CA C 117 56.260 55.197 1.063 1
1 1198 . 20 1 1 A 130 130 LEU CB C 117 41.259 41.892 -0.633 1
1 1201 . 20 1 1 A 130 130 LEU N N 117 116.201 119.063 -2.862 1
1 1202 . 20 1 1 A 131 131 LYS H H 118 6.594 7.547 -0.953 1
1 1203 . 20 1 1 A 131 131 LYS HA H 118 3.980 4.187 -0.207 1
1 1208 . 20 1 1 A 131 131 LYS C C 118 175.589 175.569 0.020 1
1 1209 . 20 1 1 A 131 131 LYS CA C 118 56.260 57.442 -1.182 1
1 1210 . 20 1 1 A 131 131 LYS CB C 118 28.133 29.276 -1.143 1
1 1212 . 20 1 1 A 131 131 LYS N N 118 111.172 115.826 -4.654 1
1 1213 . 20 1 1 A 132 132 ILE H H 119 8.245 7.929 0.316 1
1 1214 . 20 1 1 A 132 132 ILE HA H 119 4.090 4.270 -0.180 1
1 1224 . 20 1 1 A 132 132 ILE C C 119 175.161 175.670 -0.509 1
1 1225 . 20 1 1 A 132 132 ILE CA C 119 60.010 61.291 -1.281 1
1 1226 . 20 1 1 A 132 132 ILE CB C 119 35.633 37.290 -1.657 1
1 1230 . 20 1 1 A 132 132 ILE N N 119 119.484 120.293 -0.809 1
1 1231 . 20 1 1 A 133 133 ASN H H 120 8.054 8.732 -0.678 1
1 1232 . 20 1 1 A 133 133 ASN HA H 120 4.350 4.979 -0.629 1
1 1235 . 20 1 1 A 133 133 ASN C C 120 175.136 175.164 -0.028 1
1 1236 . 20 1 1 A 133 133 ASN CA C 120 54.385 54.041 0.344 1
1 1237 . 20 1 1 A 133 133 ASN CB C 120 39.384 40.071 -0.687 1
1 1238 . 20 1 1 A 133 133 ASN N N 120 124.670 125.713 -1.043 1
1 1239 . 20 1 1 A 134 134 LEU H H 121 7.517 7.315 0.202 1
1 1240 . 20 1 1 A 134 134 LEU HA H 121 4.678 4.073 0.605 1
1 1249 . 20 1 1 A 134 134 LEU C C 121 178.051 177.291 0.760 1
1 1250 . 20 1 1 A 134 134 LEU CA C 121 53.447 56.031 -2.584 1
1 1251 . 20 1 1 A 134 134 LEU CB C 121 41.259 43.012 -1.753 1
1 1254 . 20 1 1 A 134 134 LEU N N 121 119.918 119.439 0.479 1
1 1255 . 20 1 1 A 135 135 ILE H H 122 9.389 8.600 0.789 1
1 1256 . 20 1 1 A 135 135 ILE HA H 122 3.540 3.673 -0.133 1
1 1266 . 20 1 1 A 135 135 ILE C C 122 176.425 177.452 -1.027 1
1 1267 . 20 1 1 A 135 135 ILE CA C 122 65.636 65.222 0.414 1
1 1268 . 20 1 1 A 135 135 ILE CB C 122 38.446 38.310 0.136 1
1 1272 . 20 1 1 A 135 135 ILE N N 122 129.949 126.243 3.706 1
1 1273 . 20 1 1 A 136 136 GLY H H 123 8.675 8.532 0.143 1
1 1274 . 20 1 1 A 136 136 GLY HA2 H 123 2.650 2.997 -0.347 1
1 1275 . 20 1 1 A 136 136 GLY HA3 H 123 2.060 3.475 -1.415 1
1 1276 . 20 1 1 A 136 136 GLY C C 123 176.854 176.230 0.624 1
1 1277 . 20 1 1 A 136 136 GLY CA C 123 45.500 47.037 -1.537 1
1 1278 . 20 1 1 A 136 136 GLY N N 123 106.314 107.824 -1.510 1
1 1279 . 20 1 1 A 137 137 HIS H H 124 6.869 7.869 -1.000 1
1 1280 . 20 1 1 A 137 137 HIS HA H 124 4.558 4.438 0.120 1
1 1285 . 20 1 1 A 137 137 HIS C C 124 176.977 177.334 -0.357 1
1 1286 . 20 1 1 A 137 137 HIS CA C 124 57.198 58.701 -1.503 1
1 1287 . 20 1 1 A 137 137 HIS CB C 124 30.945 29.858 1.087 1
1 1290 . 20 1 1 A 137 137 HIS N N 124 118.865 120.093 -1.228 1
1 1291 . 20 1 1 A 138 138 ARG H H 125 7.730 8.260 -0.530 1
1 1292 . 20 1 1 A 138 138 ARG HA H 125 3.770 3.843 -0.073 1
1 1299 . 20 1 1 A 138 138 ARG C C 125 178.288 178.403 -0.115 1
1 1300 . 20 1 1 A 138 138 ARG CA C 125 61.886 59.547 2.339 1
1 1301 . 20 1 1 A 138 138 ARG CB C 125 30.945 30.186 0.759 1
1 1304 . 20 1 1 A 138 138 ARG N N 125 118.149 119.250 -1.101 1
1 1306 . 20 1 1 A 139 139 LYS H H 126 8.679 8.426 0.253 1
1 1307 . 20 1 1 A 139 139 LYS HA H 126 3.990 3.942 0.048 1
1 1310 . 20 1 1 A 139 139 LYS C C 126 179.184 179.158 0.026 1
1 1311 . 20 1 1 A 139 139 LYS CA C 126 58.135 59.610 -1.475 1
1 1312 . 20 1 1 A 139 139 LYS CB C 126 30.945 32.166 -1.221 1
1 1314 . 20 1 1 A 139 139 LYS N N 126 114.003 118.476 -4.473 1
1 1315 . 20 1 1 A 140 140 ARG H H 127 7.248 7.723 -0.475 1
1 1316 . 20 1 1 A 140 140 ARG HA H 127 3.870 4.029 -0.159 1
1 1324 . 20 1 1 A 140 140 ARG C C 127 177.772 178.566 -0.794 1
1 1325 . 20 1 1 A 140 140 ARG CA C 127 60.010 58.515 1.495 1
1 1326 . 20 1 1 A 140 140 ARG CB C 127 30.945 29.360 1.585 1
1 1329 . 20 1 1 A 140 140 ARG N N 127 120.072 119.691 0.381 1
1 1331 . 20 1 1 A 141 141 ILE H H 128 7.706 8.022 -0.316 1
1 1332 . 20 1 1 A 141 141 ILE HA H 128 3.530 3.561 -0.031 1
1 1340 . 20 1 1 A 141 141 ILE C C 128 177.669 177.913 -0.244 1
1 1341 . 20 1 1 A 141 141 ILE CA C 128 65.636 65.527 0.109 1
1 1342 . 20 1 1 A 141 141 ILE CB C 128 38.680 38.171 0.509 1
1 1345 . 20 1 1 A 141 141 ILE N N 128 118.730 119.268 -0.538 1
1 1346 . 20 1 1 A 142 142 LEU H H 129 8.194 8.301 -0.107 1
1 1347 . 20 1 1 A 142 142 LEU HA H 129 3.950 3.904 0.046 1
1 1356 . 20 1 1 A 142 142 LEU C C 129 179.960 179.027 0.933 1
1 1357 . 20 1 1 A 142 142 LEU CA C 129 58.135 58.251 -0.116 1
1 1358 . 20 1 1 A 142 142 LEU CB C 129 41.259 41.644 -0.385 1
1 1361 . 20 1 1 A 142 142 LEU N N 129 117.675 119.112 -1.437 1
1 1362 . 20 1 1 A 143 143 ALA H H 130 8.294 8.507 -0.213 1
1 1363 . 20 1 1 A 143 143 ALA HA H 130 4.220 4.045 0.175 1
1 1367 . 20 1 1 A 143 143 ALA C C 130 179.899 179.789 0.110 1
1 1368 . 20 1 1 A 143 143 ALA CA C 130 54.385 55.590 -1.205 1
1 1369 . 20 1 1 A 143 143 ALA CB C 130 19.270 18.503 0.767 1
1 1370 . 20 1 1 A 143 143 ALA N N 130 121.096 120.637 0.459 1
1 1371 . 20 1 1 A 144 144 SER H H 131 7.813 8.167 -0.354 1
1 1372 . 20 1 1 A 144 144 SER HA H 131 4.180 4.177 0.003 1
1 1375 . 20 1 1 A 144 144 SER C C 131 175.457 177.606 -2.149 1
1 1376 . 20 1 1 A 144 144 SER CA C 131 60.948 61.738 -0.790 1
1 1377 . 20 1 1 A 144 144 SER CB C 131 63.761 63.202 0.559 1
1 1378 . 20 1 1 A 144 144 SER N N 131 112.102 113.327 -1.225 1
1 1379 . 20 1 1 A 145 145 LEU H H 132 7.747 7.953 -0.206 1
1 1380 . 20 1 1 A 145 145 LEU HA H 132 4.140 4.112 0.028 1
1 1389 . 20 1 1 A 145 145 LEU C C 132 178.589 177.419 1.170 1
1 1390 . 20 1 1 A 145 145 LEU CA C 132 56.260 56.766 -0.506 1
1 1391 . 20 1 1 A 145 145 LEU CB C 132 42.196 42.667 -0.471 1
1 1394 . 20 1 1 A 145 145 LEU N N 132 117.536 120.780 -3.244 1
1 1395 . 20 1 1 A 146 146 GLY H H 133 7.544 8.493 -0.949 1
1 1396 . 20 1 1 A 146 146 GLY HA2 H 133 3.950 3.979 -0.029 1
1 1397 . 20 1 1 A 146 146 GLY HA3 H 133 3.100 3.980 -0.880 1
1 1398 . 20 1 1 A 146 146 GLY C C 133 173.372 174.519 -1.147 1
1 1399 . 20 1 1 A 146 146 GLY CA C 133 45.947 46.400 -0.453 1
1 1400 . 20 1 1 A 146 146 GLY N N 133 105.351 106.877 -1.526 1
1 1401 . 20 1 1 A 147 147 ASP H H 134 8.342 8.078 0.264 1
1 1402 . 20 1 1 A 147 147 ASP HA H 134 4.650 4.887 -0.237 1
1 1405 . 20 1 1 A 147 147 ASP C C 134 175.462 175.586 -0.124 1
1 1406 . 20 1 1 A 147 147 ASP CA C 134 54.385 53.615 0.770 1
1 1407 . 20 1 1 A 147 147 ASP CB C 134 41.259 42.241 -0.982 1
1 1408 . 20 1 1 A 147 147 ASP N N 134 120.133 120.598 -0.465 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 114 1.462 1
2 1 1 1 "RMS(OBS, PRED)" CA 120 1.429 1
3 1 1 1 "RMS(OBS, PRED)" CB 109 1.429 1
4 1 1 1 "RMS(OBS, PRED)" H 112 0.588 1
5 1 1 1 "RMS(OBS, PRED)" HA 125 0.346 1
6 1 1 1 "RMS(OBS, PRED)" N 112 3.426 1
7 1 2 1 "RMS(OBS, PRED)" C 114 1.511 1
8 1 2 1 "RMS(OBS, PRED)" CA 120 1.382 1
9 1 2 1 "RMS(OBS, PRED)" CB 109 1.529 1
10 1 2 1 "RMS(OBS, PRED)" H 112 0.596 1
11 1 2 1 "RMS(OBS, PRED)" HA 125 0.312 1
12 1 2 1 "RMS(OBS, PRED)" N 112 3.379 1
13 1 3 1 "RMS(OBS, PRED)" C 114 1.506 1
14 1 3 1 "RMS(OBS, PRED)" CA 120 1.431 1
15 1 3 1 "RMS(OBS, PRED)" CB 109 1.408 1
16 1 3 1 "RMS(OBS, PRED)" H 112 0.591 1
17 1 3 1 "RMS(OBS, PRED)" HA 125 0.362 1
18 1 3 1 "RMS(OBS, PRED)" N 112 3.442 1
19 1 4 1 "RMS(OBS, PRED)" C 114 1.505 1
20 1 4 1 "RMS(OBS, PRED)" CA 120 1.503 1
21 1 4 1 "RMS(OBS, PRED)" CB 109 1.374 1
22 1 4 1 "RMS(OBS, PRED)" H 112 0.577 1
23 1 4 1 "RMS(OBS, PRED)" HA 125 0.338 1
24 1 4 1 "RMS(OBS, PRED)" N 112 3.144 1
25 1 5 1 "RMS(OBS, PRED)" C 114 1.397 1
26 1 5 1 "RMS(OBS, PRED)" CA 120 1.496 1
27 1 5 1 "RMS(OBS, PRED)" CB 109 1.291 1
28 1 5 1 "RMS(OBS, PRED)" H 112 0.588 1
29 1 5 1 "RMS(OBS, PRED)" HA 125 0.344 1
30 1 5 1 "RMS(OBS, PRED)" N 112 3.270 1
31 1 6 1 "RMS(OBS, PRED)" C 114 1.494 1
32 1 6 1 "RMS(OBS, PRED)" CA 120 1.463 1
33 1 6 1 "RMS(OBS, PRED)" CB 109 1.589 1
34 1 6 1 "RMS(OBS, PRED)" H 112 0.589 1
35 1 6 1 "RMS(OBS, PRED)" HA 125 0.376 1
36 1 6 1 "RMS(OBS, PRED)" N 112 3.254 1
37 1 7 1 "RMS(OBS, PRED)" C 114 1.459 1
38 1 7 1 "RMS(OBS, PRED)" CA 120 1.421 1
39 1 7 1 "RMS(OBS, PRED)" CB 109 1.482 1
40 1 7 1 "RMS(OBS, PRED)" H 112 0.571 1
41 1 7 1 "RMS(OBS, PRED)" HA 125 0.345 1
42 1 7 1 "RMS(OBS, PRED)" N 112 3.007 1
43 1 8 1 "RMS(OBS, PRED)" C 114 1.484 1
44 1 8 1 "RMS(OBS, PRED)" CA 120 1.348 1
45 1 8 1 "RMS(OBS, PRED)" CB 109 1.171 1
46 1 8 1 "RMS(OBS, PRED)" H 112 0.622 1
47 1 8 1 "RMS(OBS, PRED)" HA 125 0.330 1
48 1 8 1 "RMS(OBS, PRED)" N 112 3.394 1
49 1 9 1 "RMS(OBS, PRED)" C 114 1.504 1
50 1 9 1 "RMS(OBS, PRED)" CA 120 1.570 1
51 1 9 1 "RMS(OBS, PRED)" CB 109 1.432 1
52 1 9 1 "RMS(OBS, PRED)" H 112 0.569 1
53 1 9 1 "RMS(OBS, PRED)" HA 125 0.335 1
54 1 9 1 "RMS(OBS, PRED)" N 112 3.182 1
55 1 10 1 "RMS(OBS, PRED)" C 114 1.470 1
56 1 10 1 "RMS(OBS, PRED)" CA 120 1.439 1
57 1 10 1 "RMS(OBS, PRED)" CB 109 1.367 1
58 1 10 1 "RMS(OBS, PRED)" H 112 0.573 1
59 1 10 1 "RMS(OBS, PRED)" HA 125 0.346 1
60 1 10 1 "RMS(OBS, PRED)" N 112 3.113 1
61 1 11 1 "RMS(OBS, PRED)" C 114 1.505 1
62 1 11 1 "RMS(OBS, PRED)" CA 120 1.333 1
63 1 11 1 "RMS(OBS, PRED)" CB 109 1.491 1
64 1 11 1 "RMS(OBS, PRED)" H 112 0.564 1
65 1 11 1 "RMS(OBS, PRED)" HA 125 0.365 1
66 1 11 1 "RMS(OBS, PRED)" N 112 3.082 1
67 1 12 1 "RMS(OBS, PRED)" C 114 1.529 1
68 1 12 1 "RMS(OBS, PRED)" CA 120 1.489 1
69 1 12 1 "RMS(OBS, PRED)" CB 109 1.480 1
70 1 12 1 "RMS(OBS, PRED)" H 112 0.600 1
71 1 12 1 "RMS(OBS, PRED)" HA 125 0.352 1
72 1 12 1 "RMS(OBS, PRED)" N 112 3.075 1
73 1 13 1 "RMS(OBS, PRED)" C 114 1.455 1
74 1 13 1 "RMS(OBS, PRED)" CA 120 1.629 1
75 1 13 1 "RMS(OBS, PRED)" CB 109 1.426 1
76 1 13 1 "RMS(OBS, PRED)" H 112 0.599 1
77 1 13 1 "RMS(OBS, PRED)" HA 125 0.332 1
78 1 13 1 "RMS(OBS, PRED)" N 112 3.140 1
79 1 14 1 "RMS(OBS, PRED)" C 114 1.429 1
80 1 14 1 "RMS(OBS, PRED)" CA 120 1.392 1
81 1 14 1 "RMS(OBS, PRED)" CB 109 1.525 1
82 1 14 1 "RMS(OBS, PRED)" H 112 0.587 1
83 1 14 1 "RMS(OBS, PRED)" HA 125 0.349 1
84 1 14 1 "RMS(OBS, PRED)" N 112 3.320 1
85 1 15 1 "RMS(OBS, PRED)" C 114 1.435 1
86 1 15 1 "RMS(OBS, PRED)" CA 120 1.402 1
87 1 15 1 "RMS(OBS, PRED)" CB 109 1.175 1
88 1 15 1 "RMS(OBS, PRED)" H 112 0.580 1
89 1 15 1 "RMS(OBS, PRED)" HA 125 0.328 1
90 1 15 1 "RMS(OBS, PRED)" N 112 3.089 1
91 1 16 1 "RMS(OBS, PRED)" C 114 1.479 1
92 1 16 1 "RMS(OBS, PRED)" CA 120 1.640 1
93 1 16 1 "RMS(OBS, PRED)" CB 109 1.357 1
94 1 16 1 "RMS(OBS, PRED)" H 112 0.588 1
95 1 16 1 "RMS(OBS, PRED)" HA 125 0.327 1
96 1 16 1 "RMS(OBS, PRED)" N 112 3.411 1
97 1 17 1 "RMS(OBS, PRED)" C 114 1.490 1
98 1 17 1 "RMS(OBS, PRED)" CA 120 1.523 1
99 1 17 1 "RMS(OBS, PRED)" CB 109 1.277 1
100 1 17 1 "RMS(OBS, PRED)" H 112 0.533 1
101 1 17 1 "RMS(OBS, PRED)" HA 125 0.323 1
102 1 17 1 "RMS(OBS, PRED)" N 112 3.241 1
103 1 18 1 "RMS(OBS, PRED)" C 114 1.620 1
104 1 18 1 "RMS(OBS, PRED)" CA 120 1.564 1
105 1 18 1 "RMS(OBS, PRED)" CB 109 1.496 1
106 1 18 1 "RMS(OBS, PRED)" H 112 0.542 1
107 1 18 1 "RMS(OBS, PRED)" HA 125 0.354 1
108 1 18 1 "RMS(OBS, PRED)" N 112 3.280 1
109 1 19 1 "RMS(OBS, PRED)" C 114 1.544 1
110 1 19 1 "RMS(OBS, PRED)" CA 120 1.488 1
111 1 19 1 "RMS(OBS, PRED)" CB 109 1.632 1
112 1 19 1 "RMS(OBS, PRED)" H 112 0.592 1
113 1 19 1 "RMS(OBS, PRED)" HA 125 0.364 1
114 1 19 1 "RMS(OBS, PRED)" N 112 3.037 1
115 1 20 1 "RMS(OBS, PRED)" C 114 1.514 1
116 1 20 1 "RMS(OBS, PRED)" CA 120 1.543 1
117 1 20 1 "RMS(OBS, PRED)" CB 109 1.477 1
118 1 20 1 "RMS(OBS, PRED)" H 112 0.571 1
119 1 20 1 "RMS(OBS, PRED)" HA 125 0.365 1
120 1 20 1 "RMS(OBS, PRED)" N 112 3.015 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 14 . 1 1 A 15 15 GLN H H 2 8.439 8.438 0.001 2
1 15 . 1 1 A 15 15 GLN HA H 2 4.594 4.904 -0.310 2
1 20 . 1 1 A 15 15 GLN C C 2 175.972 174.397 1.575 2
1 21 . 1 1 A 15 15 GLN CA C 2 56.260 54.622 1.638 2
1 22 . 1 1 A 15 15 GLN CB C 2 30.945 31.633 -0.688 2
1 24 . 1 1 A 15 15 GLN N N 2 124.997 122.867 2.130 2
1 25 . 1 1 A 16 16 THR H H 3 8.347 8.645 -0.298 2
1 26 . 1 1 A 16 16 THR HA H 3 4.555 4.814 -0.259 2
1 31 . 1 1 A 16 16 THR C C 3 175.495 174.951 0.544 2
1 32 . 1 1 A 16 16 THR CA C 3 60.010 61.454 -1.444 2
1 33 . 1 1 A 16 16 THR CB C 3 71.261 71.683 -0.422 2
1 34 . 1 1 A 16 16 THR N N 3 113.011 116.718 -3.707 2
1 35 . 1 1 A 17 17 VAL H H 4 8.895 8.879 0.016 2
1 36 . 1 1 A 17 17 VAL HA H 4 3.670 3.801 -0.131 2
1 44 . 1 1 A 17 17 VAL C C 4 178.449 177.883 0.566 2
1 45 . 1 1 A 17 17 VAL CA C 4 67.511 66.456 1.055 2
1 46 . 1 1 A 17 17 VAL CB C 4 31.883 31.793 0.090 2
1 49 . 1 1 A 17 17 VAL N N 4 121.854 124.905 -3.051 2
1 50 . 1 1 A 18 18 GLY H H 5 9.017 8.301 0.716 2
1 51 . 1 1 A 18 18 GLY HA2 H 5 3.940 3.797 0.143 2
1 52 . 1 1 A 18 18 GLY HA3 H 5 3.610 3.810 -0.200 2
1 53 . 1 1 A 18 18 GLY C C 5 176.186 175.737 0.449 2
1 54 . 1 1 A 18 18 GLY CA C 5 47.822 47.223 0.599 2
1 55 . 1 1 A 18 18 GLY N N 5 106.966 107.779 -0.813 2
1 56 . 1 1 A 19 19 GLN H H 6 8.072 8.159 -0.087 2
1 57 . 1 1 A 19 19 GLN HA H 6 4.037 4.112 -0.075 2
1 62 . 1 1 A 19 19 GLN C C 6 179.488 178.183 1.305 2
1 63 . 1 1 A 19 19 GLN CA C 6 59.073 58.781 0.292 2
1 64 . 1 1 A 19 19 GLN CB C 6 28.489 28.758 -0.269 2
1 66 . 1 1 A 19 19 GLN N N 6 122.431 121.058 1.373 2
1 67 . 1 1 A 20 20 TRP H H 7 8.756 8.252 0.504 2
1 68 . 1 1 A 20 20 TRP HA H 7 4.160 4.309 -0.149 2
1 77 . 1 1 A 20 20 TRP C C 7 179.620 177.892 1.728 2
1 78 . 1 1 A 20 20 TRP CA C 7 61.886 61.158 0.728 2
1 79 . 1 1 A 20 20 TRP CB C 7 28.133 29.720 -1.587 2
1 85 . 1 1 A 20 20 TRP N N 7 124.265 122.248 2.017 2
1 87 . 1 1 A 21 21 LEU H H 8 9.148 8.685 0.463 2
1 88 . 1 1 A 21 21 LEU HA H 8 3.440 3.515 -0.075 2
1 97 . 1 1 A 21 21 LEU C C 8 180.521 178.444 2.077 2
1 98 . 1 1 A 21 21 LEU CA C 8 56.920 57.927 -1.007 2
1 99 . 1 1 A 21 21 LEU CB C 8 41.700 41.519 0.181 2
1 102 . 1 1 A 21 21 LEU N N 8 120.548 120.708 -0.160 2
1 103 . 1 1 A 22 22 GLU H H 9 8.284 8.401 -0.117 2
1 104 . 1 1 A 22 22 GLU HA H 9 3.740 3.971 -0.231 2
1 109 . 1 1 A 22 22 GLU C C 9 179.960 178.547 1.413 2
1 110 . 1 1 A 22 22 GLU CA C 9 60.010 59.458 0.552 2
1 111 . 1 1 A 22 22 GLU CB C 9 29.070 29.009 0.061 2
1 113 . 1 1 A 22 22 GLU N N 9 120.133 119.251 0.881 2
1 114 . 1 1 A 23 23 SER H H 10 7.891 7.809 0.083 2
1 115 . 1 1 A 23 23 SER HA H 10 4.250 4.217 0.033 2
1 118 . 1 1 A 23 23 SER C C 10 175.346 176.387 -1.041 2
1 119 . 1 1 A 23 23 SER CA C 10 60.948 61.325 -0.377 2
1 120 . 1 1 A 23 23 SER CB C 10 63.280 62.963 0.317 2
1 121 . 1 1 A 23 23 SER N N 10 117.044 114.793 2.251 2
1 122 . 1 1 A 24 24 ILE H H 11 6.862 7.594 -0.732 2
1 123 . 1 1 A 24 24 ILE HA H 11 4.487 3.879 0.608 2
1 133 . 1 1 A 24 24 ILE C C 11 175.812 175.883 -0.071 2
1 134 . 1 1 A 24 24 ILE CA C 11 60.948 63.094 -2.146 2
1 135 . 1 1 A 24 24 ILE CB C 11 38.250 37.456 0.794 2
1 139 . 1 1 A 24 24 ILE N N 11 113.733 117.846 -4.113 2
1 140 . 1 1 A 25 25 GLY H H 12 7.628 7.604 0.024 2
1 141 . 1 1 A 25 25 GLY HA2 H 12 3.990 4.006 -0.016 2
1 142 . 1 1 A 25 25 GLY HA3 H 12 3.800 4.066 -0.266 2
1 143 . 1 1 A 25 25 GLY C C 12 173.647 171.894 1.753 2
1 144 . 1 1 A 25 25 GLY CA C 12 45.947 45.829 0.118 2
1 145 . 1 1 A 25 25 GLY N N 12 109.763 109.979 -0.216 2
1 146 . 1 1 A 26 26 LEU H H 13 7.620 8.249 -0.629 2
1 147 . 1 1 A 26 26 LEU C C 13 176.186 174.856 1.330 2
1 148 . 1 1 A 26 26 LEU CA C 13 52.700 51.771 0.929 2
1 149 . 1 1 A 26 26 LEU CB C 13 43.134 45.312 -2.177 2
1 150 . 1 1 A 26 26 LEU N N 13 118.778 122.206 -3.428 2
1 151 . 1 1 A 27 27 PRO HA H 14 4.120 4.617 -0.497 2
1 154 . 1 1 A 27 27 PRO C C 14 177.955 176.235 1.720 2
1 155 . 1 1 A 27 27 PRO CA C 14 64.698 62.793 1.905 2
1 156 . 1 1 A 27 27 PRO CB C 14 31.883 30.046 1.837 2
1 158 . 1 1 A 28 28 GLN H H 15 9.838 8.516 1.322 2
1 159 . 1 1 A 28 28 GLN HA H 15 4.240 4.239 0.001 2
1 162 . 1 1 A 28 28 GLN C C 15 176.836 176.260 0.576 2
1 163 . 1 1 A 28 28 GLN CA C 15 58.135 56.675 1.460 2
1 164 . 1 1 A 28 28 GLN CB C 15 27.195 29.773 -2.578 2
1 166 . 1 1 A 28 28 GLN N N 15 120.414 120.162 0.252 2
1 167 . 1 1 A 29 29 TYR H H 16 6.810 7.684 -0.875 2
1 168 . 1 1 A 29 29 TYR HA H 16 5.720 4.587 1.133 2
1 173 . 1 1 A 29 29 TYR C C 16 174.814 176.908 -2.094 2
1 174 . 1 1 A 29 29 TYR CA C 16 57.198 58.336 -1.138 2
1 175 . 1 1 A 29 29 TYR CB C 16 37.509 39.203 -1.694 2
1 178 . 1 1 A 29 29 TYR N N 16 119.718 117.576 2.142 2
1 179 . 1 1 A 30 30 GLU H H 17 7.509 8.297 -0.788 2
1 180 . 1 1 A 30 30 GLU HA H 17 3.650 4.091 -0.441 2
1 184 . 1 1 A 30 30 GLU C C 17 177.552 178.557 -1.005 2
1 185 . 1 1 A 30 30 GLU CA C 17 60.948 59.642 1.306 2
1 186 . 1 1 A 30 30 GLU CB C 17 30.008 29.245 0.762 2
1 188 . 1 1 A 30 30 GLU N N 17 122.417 121.689 0.728 2
1 189 . 1 1 A 31 31 ASN H H 18 9.259 8.152 1.107 2
1 190 . 1 1 A 31 31 ASN HA H 18 4.451 4.467 -0.016 2
1 193 . 1 1 A 31 31 ASN C C 18 176.868 178.105 -1.237 2
1 194 . 1 1 A 31 31 ASN CA C 18 57.198 56.409 0.789 2
1 195 . 1 1 A 31 31 ASN CB C 18 38.446 39.060 -0.614 2
1 196 . 1 1 A 31 31 ASN N N 18 116.613 118.391 -1.778 2
1 197 . 1 1 A 32 32 HIS H H 19 8.898 8.181 0.717 2
1 198 . 1 1 A 32 32 HIS HA H 19 4.140 4.353 -0.212 2
1 202 . 1 1 A 32 32 HIS C C 19 178.269 177.769 0.500 2
1 203 . 1 1 A 32 32 HIS CA C 19 60.948 59.233 1.715 2
1 204 . 1 1 A 32 32 HIS CB C 19 30.008 30.177 -0.169 2
1 206 . 1 1 A 32 32 HIS N N 19 118.926 118.487 0.439 2
1 207 . 1 1 A 33 33 LEU H H 20 7.825 8.844 -1.018 2
1 208 . 1 1 A 33 33 LEU HA H 20 4.305 3.940 0.365 2
1 218 . 1 1 A 33 33 LEU C C 20 179.190 179.093 0.097 2
1 219 . 1 1 A 33 33 LEU CA C 20 60.010 58.388 1.622 2
1 220 . 1 1 A 33 33 LEU CB C 20 40.321 41.959 -1.639 2
1 224 . 1 1 A 33 33 LEU N N 20 117.434 119.914 -2.480 2
1 225 . 1 1 A 34 34 MET H H 21 8.861 8.597 0.264 2
1 226 . 1 1 A 34 34 MET HA H 21 3.980 4.170 -0.190 2
1 234 . 1 1 A 34 34 MET C C 21 180.340 178.390 1.950 2
1 235 . 1 1 A 34 34 MET CA C 21 58.135 58.801 -0.666 2
1 236 . 1 1 A 34 34 MET CB C 21 30.945 32.256 -1.311 2
1 238 . 1 1 A 34 34 MET N N 21 118.111 117.590 0.521 2
1 239 . 1 1 A 35 35 ALA H H 22 9.015 8.410 0.605 2
1 240 . 1 1 A 35 35 ALA HA H 22 4.239 4.143 0.096 2
1 244 . 1 1 A 35 35 ALA C C 22 178.058 178.662 -0.604 2
1 245 . 1 1 A 35 35 ALA CA C 22 53.800 54.582 -0.782 2
1 246 . 1 1 A 35 35 ALA CB C 22 18.397 18.253 0.144 2
1 247 . 1 1 A 35 35 ALA N N 22 120.068 121.730 -1.662 2
1 248 . 1 1 A 36 36 ASN H H 23 7.143 8.008 -0.865 2
1 249 . 1 1 A 36 36 ASN HA H 23 4.959 4.815 0.144 2
1 254 . 1 1 A 36 36 ASN C C 23 174.083 175.514 -1.431 2
1 255 . 1 1 A 36 36 ASN CA C 23 54.000 52.907 1.093 2
1 256 . 1 1 A 36 36 ASN CB C 23 41.300 39.001 2.299 2
1 257 . 1 1 A 36 36 ASN N N 23 111.560 115.035 -3.475 2
1 259 . 1 1 A 37 37 GLY H H 24 7.797 8.290 -0.493 2
1 260 . 1 1 A 37 37 GLY HA2 H 24 3.430 3.829 -0.399 2
1 261 . 1 1 A 37 37 GLY HA3 H 24 3.290 3.914 -0.624 2
1 262 . 1 1 A 37 37 GLY C C 24 173.163 174.906 -1.743 2
1 263 . 1 1 A 37 37 GLY CA C 24 45.947 45.221 0.726 2
1 264 . 1 1 A 37 37 GLY N N 24 106.170 107.727 -1.557 2
1 265 . 1 1 A 38 38 PHE H H 25 8.191 7.950 0.241 2
1 266 . 1 1 A 38 38 PHE HA H 25 4.910 4.764 0.146 2
1 271 . 1 1 A 38 38 PHE C C 25 173.496 175.689 -2.193 2
1 272 . 1 1 A 38 38 PHE CA C 25 56.550 56.368 0.182 2
1 273 . 1 1 A 38 38 PHE CB C 25 37.220 37.011 0.209 2
1 276 . 1 1 A 38 38 PHE N N 25 122.454 119.807 2.647 2
1 277 . 1 1 A 39 39 ASP H H 26 6.756 8.453 -1.697 2
1 278 . 1 1 A 39 39 ASP HA H 26 5.077 4.882 0.195 2
1 281 . 1 1 A 39 39 ASP C C 26 177.463 175.535 1.928 2
1 282 . 1 1 A 39 39 ASP CA C 26 53.447 54.264 -0.817 2
1 283 . 1 1 A 39 39 ASP CB C 26 42.580 41.892 0.688 2
1 284 . 1 1 A 39 39 ASP N N 26 111.309 120.572 -9.263 2
1 285 . 1 1 A 40 40 ASN H H 27 7.495 7.879 -0.384 2
1 286 . 1 1 A 40 40 ASN HA H 27 4.820 5.018 -0.198 2
1 289 . 1 1 A 40 40 ASN C C 27 176.228 175.742 0.487 2
1 290 . 1 1 A 40 40 ASN CA C 27 52.510 51.937 0.573 2
1 291 . 1 1 A 40 40 ASN CB C 27 40.321 40.394 -0.073 2
1 292 . 1 1 A 40 40 ASN N N 27 118.385 118.124 0.261 2
1 293 . 1 1 A 41 41 VAL H H 28 9.192 8.637 0.555 2
1 294 . 1 1 A 41 41 VAL HA H 28 3.550 3.655 -0.105 2
1 302 . 1 1 A 41 41 VAL C C 28 176.429 177.568 -1.139 2
1 303 . 1 1 A 41 41 VAL CA C 28 65.636 65.973 -0.337 2
1 304 . 1 1 A 41 41 VAL CB C 28 31.883 31.589 0.294 2
1 307 . 1 1 A 41 41 VAL N N 28 125.741 125.703 0.038 2
1 308 . 1 1 A 42 42 GLN H H 29 8.203 8.228 -0.025 2
1 309 . 1 1 A 42 42 GLN HA H 29 4.129 4.001 0.128 2
1 314 . 1 1 A 42 42 GLN C C 29 176.591 178.495 -1.904 2
1 315 . 1 1 A 42 42 GLN CA C 29 57.198 58.754 -1.556 2
1 316 . 1 1 A 42 42 GLN CB C 29 28.133 28.381 -0.248 2
1 318 . 1 1 A 42 42 GLN N N 29 116.452 119.828 -3.376 2
1 319 . 1 1 A 43 43 ALA H H 30 7.781 8.318 -0.537 2
1 320 . 1 1 A 43 43 ALA HA H 30 4.650 4.069 0.581 2
1 324 . 1 1 A 43 43 ALA C C 30 175.976 178.982 -3.006 2
1 325 . 1 1 A 43 43 ALA CA C 30 50.840 54.406 -3.566 2
1 326 . 1 1 A 43 43 ALA CB C 30 19.150 18.322 0.828 2
1 327 . 1 1 A 43 43 ALA N N 30 122.150 121.299 0.851 2
1 328 . 1 1 A 44 44 MET H H 31 7.739 8.065 -0.326 2
1 332 . 1 1 A 44 44 MET C C 31 178.275 177.340 0.935 2
1 333 . 1 1 A 44 44 MET CA C 31 55.323 55.877 -0.554 2
1 334 . 1 1 A 44 44 MET CB C 31 34.696 32.219 2.477 2
1 336 . 1 1 A 44 44 MET N N 31 118.149 115.550 2.599 2
1 337 . 1 1 A 45 45 GLY H H 32 7.611 8.310 -0.699 2
1 338 . 1 1 A 45 45 GLY N N 32 101.530 109.000 -7.470 2
1 339 . 1 1 A 47 47 ASN HA H 34 4.480 4.910 -0.430 2
1 342 . 1 1 A 47 47 ASN CA C 34 56.260 52.794 3.466 2
1 343 . 1 1 A 47 47 ASN CB C 34 39.384 39.588 -0.204 2
1 344 . 1 1 A 49 49 MET HA H 36 4.646 4.446 0.200 2
1 350 . 1 1 A 49 49 MET C C 36 173.651 175.789 -2.138 2
1 351 . 1 1 A 49 49 MET CA C 36 55.323 56.066 -0.743 2
1 352 . 1 1 A 49 49 MET CB C 36 35.633 33.009 2.624 2
1 355 . 1 1 A 50 50 GLU H H 37 9.203 8.637 0.566 2
1 356 . 1 1 A 50 50 GLU HA H 37 4.650 4.663 -0.013 2
1 361 . 1 1 A 50 50 GLU C C 37 177.008 177.046 -0.038 2
1 362 . 1 1 A 50 50 GLU CA C 37 54.385 55.069 -0.684 2
1 363 . 1 1 A 50 50 GLU CB C 37 33.758 32.196 1.562 2
1 365 . 1 1 A 50 50 GLU N N 37 123.229 123.811 -0.582 2
1 366 . 1 1 A 51 51 ASP H H 38 9.032 8.979 0.053 2
1 367 . 1 1 A 51 51 ASP HA H 38 4.149 4.339 -0.190 2
1 370 . 1 1 A 51 51 ASP C C 38 177.994 178.217 -0.223 2
1 371 . 1 1 A 51 51 ASP CA C 38 59.073 57.248 1.825 2
1 372 . 1 1 A 51 51 ASP CB C 38 43.134 40.021 3.113 2
1 373 . 1 1 A 51 51 ASP N N 38 122.717 122.835 -0.118 2
1 374 . 1 1 A 52 52 GLN H H 39 8.950 8.222 0.728 2
1 375 . 1 1 A 52 52 GLN HA H 39 3.940 3.993 -0.053 2
1 378 . 1 1 A 52 52 GLN C C 39 177.817 178.378 -0.561 2
1 379 . 1 1 A 52 52 GLN CA C 39 59.073 59.035 0.038 2
1 380 . 1 1 A 52 52 GLN CB C 39 28.133 28.485 -0.352 2
1 381 . 1 1 A 52 52 GLN N N 39 114.086 119.163 -5.077 2
1 382 . 1 1 A 53 53 ASP H H 40 7.214 8.100 -0.886 2
1 383 . 1 1 A 53 53 ASP HA H 40 4.370 4.496 -0.126 2
1 386 . 1 1 A 53 53 ASP C C 40 177.667 178.715 -1.048 2
1 387 . 1 1 A 53 53 ASP CA C 40 57.198 57.264 -0.066 2
1 388 . 1 1 A 53 53 ASP CB C 40 41.800 40.629 1.171 2
1 389 . 1 1 A 53 53 ASP N N 40 118.734 120.075 -1.341 2
1 390 . 1 1 A 54 54 LEU H H 41 7.180 8.108 -0.928 2
1 391 . 1 1 A 54 54 LEU HA H 41 3.990 3.990 -0.000 2
1 400 . 1 1 A 54 54 LEU C C 41 178.204 178.345 -0.141 2
1 401 . 1 1 A 54 54 LEU CA C 41 56.260 58.086 -1.826 2
1 402 . 1 1 A 54 54 LEU CB C 41 41.259 41.643 -0.384 2
1 405 . 1 1 A 54 54 LEU N N 41 115.795 120.564 -4.769 2
1 406 . 1 1 A 55 55 LEU H H 42 7.823 8.001 -0.178 2
1 407 . 1 1 A 55 55 LEU HA H 42 3.920 4.137 -0.217 2
1 416 . 1 1 A 55 55 LEU C C 42 180.876 178.492 2.384 2
1 417 . 1 1 A 55 55 LEU CA C 42 58.135 57.190 0.945 2
1 418 . 1 1 A 55 55 LEU CB C 42 42.196 41.896 0.300 2
1 421 . 1 1 A 55 55 LEU N N 42 120.499 120.151 0.348 2
1 422 . 1 1 A 56 56 GLU H H 43 8.127 8.224 -0.097 2
1 423 . 1 1 A 56 56 GLU HA H 43 3.966 4.118 -0.152 2
1 428 . 1 1 A 56 56 GLU C C 43 178.801 179.179 -0.378 2
1 429 . 1 1 A 56 56 GLU CA C 43 60.010 59.170 0.840 2
1 430 . 1 1 A 56 56 GLU CB C 43 29.070 29.362 -0.292 2
1 432 . 1 1 A 56 56 GLU N N 43 120.955 118.926 2.029 2
1 433 . 1 1 A 57 57 ILE H H 44 7.504 7.662 -0.158 2
1 434 . 1 1 A 57 57 ILE HA H 44 4.524 3.923 0.601 2
1 444 . 1 1 A 57 57 ILE C C 44 175.691 176.975 -1.284 2
1 445 . 1 1 A 57 57 ILE CA C 44 61.886 64.428 -2.542 2
1 446 . 1 1 A 57 57 ILE CB C 44 37.300 38.407 -1.107 2
1 450 . 1 1 A 57 57 ILE N N 44 109.594 118.570 -8.976 2
1 451 . 1 1 A 58 58 GLY H H 45 7.724 7.524 0.200 2
1 452 . 1 1 A 58 58 GLY HA2 H 45 3.650 4.186 -0.536 2
1 453 . 1 1 A 58 58 GLY HA3 H 45 4.530 4.323 0.207 2
1 454 . 1 1 A 58 58 GLY C C 45 174.613 174.428 0.185 2
1 455 . 1 1 A 58 58 GLY CA C 45 45.947 45.438 0.509 2
1 456 . 1 1 A 58 58 GLY N N 45 106.680 106.850 -0.170 2
1 457 . 1 1 A 59 59 ILE H H 46 8.180 8.070 0.110 2
1 458 . 1 1 A 59 59 ILE HA H 46 3.907 4.339 -0.432 2
1 468 . 1 1 A 59 59 ILE C C 46 174.235 176.003 -1.768 2
1 469 . 1 1 A 59 59 ILE CA C 46 60.948 60.959 -0.011 2
1 470 . 1 1 A 59 59 ILE CB C 46 33.980 38.575 -4.595 2
1 474 . 1 1 A 59 59 ILE N N 46 122.454 120.705 1.749 2
1 475 . 1 1 A 60 60 LEU H H 47 7.367 8.403 -1.036 2
1 476 . 1 1 A 60 60 LEU HA H 47 3.900 4.329 -0.429 2
1 479 . 1 1 A 60 60 LEU C C 47 177.753 177.420 0.333 2
1 480 . 1 1 A 60 60 LEU CA C 47 56.260 55.985 0.275 2
1 481 . 1 1 A 60 60 LEU CB C 47 42.196 42.524 -0.328 2
1 482 . 1 1 A 60 60 LEU N N 47 125.835 126.230 -0.395 2
1 483 . 1 1 A 63 63 GLY HA2 H 50 3.980 3.945 0.035 2
1 484 . 1 1 A 63 63 GLY HA3 H 50 3.950 3.977 -0.027 2
1 485 . 1 1 A 63 63 GLY C C 50 177.130 174.816 2.313 2
1 486 . 1 1 A 63 63 GLY CA C 50 46.884 45.901 0.983 2
1 487 . 1 1 A 64 64 HIS H H 51 7.926 8.013 -0.087 2
1 488 . 1 1 A 64 64 HIS HA H 51 4.451 4.429 0.022 2
1 493 . 1 1 A 64 64 HIS C C 51 177.613 176.742 0.871 2
1 494 . 1 1 A 64 64 HIS CA C 51 57.198 57.585 -0.387 2
1 495 . 1 1 A 64 64 HIS CB C 51 30.945 30.533 0.412 2
1 498 . 1 1 A 64 64 HIS N N 51 122.284 120.208 2.076 2
1 499 . 1 1 A 65 65 ARG H H 52 8.105 8.177 -0.072 2
1 500 . 1 1 A 65 65 ARG HA H 52 3.685 3.773 -0.088 2
1 507 . 1 1 A 65 65 ARG C C 52 177.769 178.748 -0.979 2
1 508 . 1 1 A 65 65 ARG CA C 52 61.886 59.624 2.262 2
1 509 . 1 1 A 65 65 ARG CB C 52 30.945 30.007 0.938 2
1 511 . 1 1 A 65 65 ARG N N 52 117.775 119.194 -1.419 2
1 513 . 1 1 A 66 66 GLN H H 53 8.090 8.076 0.014 2
1 514 . 1 1 A 66 66 GLN HA H 53 3.940 3.985 -0.045 2
1 519 . 1 1 A 66 66 GLN C C 53 178.583 178.188 0.395 2
1 520 . 1 1 A 66 66 GLN CA C 53 59.073 59.088 -0.015 2
1 521 . 1 1 A 66 66 GLN CB C 53 28.133 28.326 -0.193 2
1 523 . 1 1 A 66 66 GLN N N 53 116.452 118.762 -2.310 2
1 524 . 1 1 A 67 67 ARG H H 54 7.845 7.745 0.100 2
1 525 . 1 1 A 67 67 ARG HA H 54 4.010 3.962 0.048 2
1 528 . 1 1 A 67 67 ARG C C 54 179.766 178.829 0.937 2
1 529 . 1 1 A 67 67 ARG CA C 54 59.073 58.973 0.100 2
1 530 . 1 1 A 67 67 ARG CB C 54 30.720 29.737 0.983 2
1 532 . 1 1 A 67 67 ARG N N 54 119.275 119.378 -0.103 2
1 533 . 1 1 A 68 68 ILE H H 55 8.032 7.899 0.133 2
1 534 . 1 1 A 68 68 ILE HA H 55 3.495 3.509 -0.014 2
1 544 . 1 1 A 68 68 ILE C C 55 177.108 178.521 -1.413 2
1 545 . 1 1 A 68 68 ILE CA C 55 66.230 65.188 1.042 2
1 546 . 1 1 A 68 68 ILE CB C 55 38.020 37.515 0.505 2
1 550 . 1 1 A 68 68 ILE N N 55 121.152 119.801 1.351 2
1 551 . 1 1 A 69 69 LEU H H 56 8.490 8.221 0.269 2
1 552 . 1 1 A 69 69 LEU HA H 56 4.010 3.833 0.177 2
1 561 . 1 1 A 69 69 LEU C C 56 179.917 178.870 1.047 2
1 562 . 1 1 A 69 69 LEU CA C 56 58.135 58.183 -0.048 2
1 563 . 1 1 A 69 69 LEU CB C 56 41.259 41.667 -0.408 2
1 566 . 1 1 A 69 69 LEU N N 56 119.072 120.687 -1.615 2
1 567 . 1 1 A 70 70 GLN H H 57 8.327 8.558 -0.231 2
1 568 . 1 1 A 70 70 GLN HA H 57 4.100 3.978 0.122 2
1 573 . 1 1 A 70 70 GLN C C 57 178.798 178.114 0.684 2
1 574 . 1 1 A 70 70 GLN CA C 57 59.073 58.816 0.257 2
1 575 . 1 1 A 70 70 GLN CB C 57 28.133 28.515 -0.382 2
1 577 . 1 1 A 70 70 GLN N N 57 118.172 117.842 0.330 2
1 578 . 1 1 A 71 71 ALA H H 58 7.810 7.906 -0.096 2
1 579 . 1 1 A 71 71 ALA HA H 58 4.320 4.120 0.200 2
1 583 . 1 1 A 71 71 ALA C C 58 172.232 179.714 -7.482 2
1 584 . 1 1 A 71 71 ALA CA C 58 55.323 55.184 0.139 2
1 585 . 1 1 A 71 71 ALA CB C 58 19.720 18.711 1.009 2
1 586 . 1 1 A 71 71 ALA N N 58 122.536 121.939 0.597 2
1 587 . 1 1 A 72 72 ILE H H 59 8.840 8.484 0.356 2
1 588 . 1 1 A 72 72 ILE HA H 59 4.030 3.954 0.076 2
1 598 . 1 1 A 72 72 ILE C C 59 178.678 177.706 0.972 2
1 599 . 1 1 A 72 72 ILE CA C 59 64.698 63.848 0.850 2
1 600 . 1 1 A 72 72 ILE CB C 59 37.850 37.611 0.239 2
1 604 . 1 1 A 72 72 ILE N N 59 118.111 118.607 -0.496 2
1 605 . 1 1 A 73 73 GLN H H 60 7.547 8.133 -0.586 2
1 606 . 1 1 A 73 73 GLN HA H 60 4.121 4.141 -0.020 2
1 611 . 1 1 A 73 73 GLN C C 60 176.556 177.913 -1.357 2
1 612 . 1 1 A 73 73 GLN CA C 60 58.135 58.432 -0.297 2
1 613 . 1 1 A 73 73 GLN CB C 60 28.300 28.588 -0.288 2
1 615 . 1 1 A 73 73 GLN N N 60 119.094 120.981 -1.887 2
1 616 . 1 1 A 74 74 LEU H H 61 7.350 7.910 -0.560 2
1 617 . 1 1 A 74 74 LEU HA H 61 4.408 4.274 0.134 2
1 626 . 1 1 A 74 74 LEU C C 61 177.960 177.360 0.600 2
1 627 . 1 1 A 74 74 LEU CA C 61 54.900 56.395 -1.495 2
1 628 . 1 1 A 74 74 LEU CB C 61 42.196 42.361 -0.165 2
1 631 . 1 1 A 74 74 LEU N N 61 115.853 119.262 -3.409 2
1 632 . 1 1 A 75 75 LEU H H 62 7.358 7.691 -0.333 2
1 633 . 1 1 A 75 75 LEU HA H 62 4.530 4.346 0.184 2
1 642 . 1 1 A 75 75 LEU C C 62 177.035 175.850 1.185 2
1 643 . 1 1 A 75 75 LEU CA C 62 53.200 55.916 -2.716 2
1 644 . 1 1 A 75 75 LEU CB C 62 40.700 41.136 -0.436 2
1 647 . 1 1 A 75 75 LEU N N 62 121.010 120.620 0.390 2
1 648 . 1 1 A 76 76 PRO HA H 63 4.382 4.562 -0.180 2
1 655 . 1 1 A 76 76 PRO CB C 63 31.883 31.481 0.402 2
1 657 . 1 1 A 77 77 LYS H H 64 8.418 8.403 0.015 2
1 658 . 1 1 A 77 77 LYS HA H 64 4.140 4.490 -0.350 2
1 663 . 1 1 A 77 77 LYS C C 64 177.122 176.155 0.967 2
1 664 . 1 1 A 77 77 LYS CA C 64 56.260 56.685 -0.425 2
1 665 . 1 1 A 77 77 LYS CB C 64 33.340 33.539 -0.199 2
1 668 . 1 1 A 77 77 LYS N N 64 121.932 120.320 1.612 2
1 669 . 1 1 A 78 78 MET H H 65 8.550 8.290 0.260 2
1 670 . 1 1 A 78 78 MET HA H 65 4.304 4.720 -0.416 2
1 676 . 1 1 A 78 78 MET C C 65 176.105 176.154 -0.049 2
1 677 . 1 1 A 78 78 MET CA C 65 56.260 55.444 0.816 2
1 678 . 1 1 A 78 78 MET CB C 65 32.821 34.543 -1.722 2
1 680 . 1 1 A 78 78 MET N N 65 123.498 120.581 2.917 2
1 681 . 1 1 A 79 79 ARG H H 66 8.731 8.348 0.383 2
1 682 . 1 1 A 79 79 ARG C C 66 173.577 175.551 -1.974 2
1 683 . 1 1 A 79 79 ARG CA C 66 53.447 56.031 -2.584 2
1 684 . 1 1 A 79 79 ARG CB C 66 30.008 29.902 0.106 2
1 685 . 1 1 A 79 79 ARG N N 66 127.355 121.593 5.762 2
1 686 . 1 1 A 80 80 PRO HA H 67 4.780 4.496 0.284 2
1 693 . 1 1 A 80 80 PRO C C 67 177.043 176.516 0.527 2
1 694 . 1 1 A 80 80 PRO CA C 67 61.886 63.467 -1.581 2
1 695 . 1 1 A 80 80 PRO CB C 67 32.821 32.052 0.769 2
1 698 . 1 1 A 81 81 ILE H H 68 8.580 8.051 0.529 2
1 699 . 1 1 A 81 81 ILE HA H 68 4.040 4.312 -0.272 2
1 709 . 1 1 A 81 81 ILE C C 68 176.831 175.842 0.989 2
1 710 . 1 1 A 81 81 ILE CA C 68 62.823 60.963 1.860 2
1 711 . 1 1 A 81 81 ILE CB C 68 38.580 39.302 -0.722 2
1 715 . 1 1 A 81 81 ILE N N 68 118.491 118.260 0.231 2
1 716 . 1 1 A 82 82 GLY H H 69 8.602 8.228 0.374 2
1 717 . 1 1 A 82 82 GLY CA C 69 45.009 45.849 -0.840 2
1 718 . 1 1 A 82 82 GLY N N 69 111.377 111.792 -0.415 2
1 721 . 1 1 A 84 84 ASP HA H 71 4.490 4.887 -0.397 2
1 724 . 1 1 A 84 84 ASP CA C 71 54.385 53.443 0.942 2
1 725 . 1 1 A 84 84 ASP CB C 71 40.321 43.132 -2.811 2
1 726 . 1 1 A 85 85 GLY H H 72 8.054 8.365 -0.311 2
1 727 . 1 1 A 85 85 GLY HA2 H 72 4.040 4.076 -0.036 2
1 728 . 1 1 A 85 85 GLY HA3 H 72 3.750 4.099 -0.349 2
1 729 . 1 1 A 85 85 GLY C C 72 173.474 173.043 0.431 2
1 730 . 1 1 A 85 85 GLY CA C 72 45.009 45.289 -0.280 2
1 731 . 1 1 A 85 85 GLY N N 72 108.038 108.747 -0.709 2
1 732 . 1 1 A 86 86 ALA H H 73 7.858 8.320 -0.462 2
1 733 . 1 1 A 86 86 ALA HA H 73 4.370 4.864 -0.494 2
1 737 . 1 1 A 86 86 ALA CA C 73 51.990 51.275 0.715 2
1 738 . 1 1 A 86 86 ALA CB C 73 19.220 21.663 -2.443 2
1 739 . 1 1 A 86 86 ALA N N 73 123.819 124.018 -0.199 2
1 742 . 1 1 A 90 90 SER H H 77 7.839 8.260 -0.421 2
1 743 . 1 1 A 90 90 SER HA H 77 4.770 4.753 0.017 2
1 746 . 1 1 A 90 90 SER N N 77 115.163 116.010 -0.847 2
1 747 . 1 1 A 91 91 VAL H H 78 8.578 8.926 -0.348 2
1 748 . 1 1 A 91 91 VAL HA H 78 3.981 3.938 0.043 2
1 756 . 1 1 A 91 91 VAL C C 78 177.480 177.361 0.119 2
1 757 . 1 1 A 91 91 VAL CA C 78 67.060 66.302 0.758 2
1 758 . 1 1 A 91 91 VAL CB C 78 32.500 31.688 0.812 2
1 761 . 1 1 A 91 91 VAL N N 78 123.481 123.738 -0.257 2
1 762 . 1 1 A 92 92 ALA H H 79 8.607 8.349 0.258 2
1 763 . 1 1 A 92 92 ALA HA H 79 4.113 4.099 0.014 2
1 767 . 1 1 A 92 92 ALA C C 79 179.868 179.969 -0.101 2
1 768 . 1 1 A 92 92 ALA CA C 79 54.890 55.616 -0.726 2
1 769 . 1 1 A 92 92 ALA CB C 79 18.790 18.463 0.327 2
1 770 . 1 1 A 92 92 ALA N N 79 120.334 122.147 -1.813 2
1 771 . 1 1 A 93 93 GLU H H 80 7.886 8.196 -0.310 2
1 772 . 1 1 A 93 93 GLU HA H 80 4.010 4.071 -0.061 2
1 777 . 1 1 A 93 93 GLU C C 80 179.719 178.780 0.939 2
1 778 . 1 1 A 93 93 GLU CA C 80 59.073 59.013 0.060 2
1 779 . 1 1 A 93 93 GLU CB C 80 30.630 29.378 1.252 2
1 781 . 1 1 A 93 93 GLU N N 80 117.643 117.825 -0.182 2
1 782 . 1 1 A 94 94 TRP H H 81 8.299 8.128 0.171 2
1 783 . 1 1 A 94 94 TRP HA H 81 4.251 4.287 -0.036 2
1 792 . 1 1 A 94 94 TRP C C 81 178.772 178.044 0.728 2
1 793 . 1 1 A 94 94 TRP CA C 81 60.010 61.151 -1.142 2
1 794 . 1 1 A 94 94 TRP CB C 81 27.650 29.773 -2.123 2
1 800 . 1 1 A 94 94 TRP N N 81 122.545 122.857 -0.312 2
1 802 . 1 1 A 95 95 LEU H H 82 8.505 8.366 0.139 2
1 803 . 1 1 A 95 95 LEU HA H 82 2.880 3.227 -0.347 2
1 812 . 1 1 A 95 95 LEU C C 82 180.235 178.705 1.530 2
1 813 . 1 1 A 95 95 LEU CA C 82 57.400 56.855 0.545 2
1 814 . 1 1 A 95 95 LEU CB C 82 40.321 40.951 -0.630 2
1 817 . 1 1 A 95 95 LEU N N 82 121.110 119.115 1.995 2
1 818 . 1 1 A 96 96 ASP H H 83 8.185 8.307 -0.122 2
1 819 . 1 1 A 96 96 ASP HA H 83 4.280 4.364 -0.084 2
1 822 . 1 1 A 96 96 ASP C C 83 175.224 177.558 -2.334 2
1 823 . 1 1 A 96 96 ASP CA C 83 57.310 56.693 0.617 2
1 824 . 1 1 A 96 96 ASP CB C 83 40.321 41.275 -0.954 2
1 825 . 1 1 A 96 96 ASP N N 83 119.082 120.049 -0.967 2
1 826 . 1 1 A 97 97 SER H H 84 7.989 7.853 0.136 2
1 827 . 1 1 A 97 97 SER HA H 84 4.250 4.404 -0.154 2
1 830 . 1 1 A 97 97 SER C C 84 175.346 175.155 0.191 2
1 831 . 1 1 A 97 97 SER CA C 84 60.948 59.204 1.744 2
1 832 . 1 1 A 97 97 SER CB C 84 63.370 63.616 -0.246 2
1 833 . 1 1 A 97 97 SER N N 84 117.579 113.074 4.505 2
1 834 . 1 1 A 98 98 ILE H H 85 6.862 7.439 -0.576 2
1 835 . 1 1 A 98 98 ILE HA H 85 4.550 4.092 0.458 2
1 843 . 1 1 A 98 98 ILE C C 85 173.308 175.665 -2.357 2
1 844 . 1 1 A 98 98 ILE CA C 85 60.948 61.306 -0.358 2
1 845 . 1 1 A 98 98 ILE CB C 85 37.760 37.831 -0.071 2
1 848 . 1 1 A 98 98 ILE N N 85 113.733 118.758 -5.025 2
1 849 . 1 1 A 99 99 GLU H H 86 7.705 7.776 -0.071 2
1 850 . 1 1 A 99 99 GLU HA H 86 4.280 4.057 0.223 2
1 853 . 1 1 A 99 99 GLU C C 86 175.224 175.339 -0.115 2
1 854 . 1 1 A 99 99 GLU CA C 86 56.260 57.426 -1.166 2
1 855 . 1 1 A 99 99 GLU CB C 86 26.258 28.859 -2.601 2
1 857 . 1 1 A 99 99 GLU N N 86 115.493 118.579 -3.086 2
1 858 . 1 1 A 100 100 LEU H H 87 7.989 7.417 0.572 2
1 859 . 1 1 A 100 100 LEU HA H 87 4.220 4.587 -0.367 2
1 868 . 1 1 A 100 100 LEU C C 87 176.965 176.449 0.516 2
1 869 . 1 1 A 100 100 LEU CA C 87 52.510 53.651 -1.141 2
1 870 . 1 1 A 100 100 LEU CB C 87 42.196 44.298 -2.102 2
1 873 . 1 1 A 100 100 LEU N N 87 117.579 119.239 -1.660 2
1 874 . 1 1 A 101 101 GLY H H 88 8.503 8.197 0.306 2
1 875 . 1 1 A 101 101 GLY CA C 88 46.884 45.852 1.032 2
1 876 . 1 1 A 101 101 GLY N N 88 107.794 110.646 -2.852 2
1 877 . 1 1 A 102 102 ASP HA H 89 4.431 4.266 0.165 2
1 880 . 1 1 A 102 102 ASP C C 89 178.075 178.274 -0.199 2
1 881 . 1 1 A 102 102 ASP CA C 89 57.198 56.947 0.251 2
1 882 . 1 1 A 102 102 ASP CB C 89 40.321 40.659 -0.338 2
1 883 . 1 1 A 103 103 TYR H H 90 7.899 8.025 -0.126 2
1 884 . 1 1 A 103 103 TYR HA H 90 4.940 4.424 0.516 2
1 889 . 1 1 A 103 103 TYR C C 90 175.527 178.487 -2.960 2
1 890 . 1 1 A 103 103 TYR CA C 90 58.135 60.484 -2.349 2
1 891 . 1 1 A 103 103 TYR CB C 90 38.446 37.630 0.816 2
1 894 . 1 1 A 103 103 TYR N N 90 115.595 119.481 -3.885 2
1 895 . 1 1 A 104 104 THR H H 91 7.971 8.394 -0.423 2
1 896 . 1 1 A 104 104 THR HA H 91 4.234 4.025 0.209 2
1 901 . 1 1 A 104 104 THR C C 91 175.905 176.602 -0.697 2
1 902 . 1 1 A 104 104 THR CA C 91 68.449 67.098 1.351 2
1 904 . 1 1 A 104 104 THR N N 91 118.867 116.624 2.243 2
1 905 . 1 1 A 105 105 LYS H H 92 8.555 7.956 0.599 2
1 906 . 1 1 A 105 105 LYS HA H 92 3.940 4.070 -0.130 2
1 912 . 1 1 A 105 105 LYS C C 92 177.310 178.670 -1.360 2
1 913 . 1 1 A 105 105 LYS CA C 92 60.948 59.458 1.490 2
1 914 . 1 1 A 105 105 LYS CB C 92 31.883 32.387 -0.504 2
1 917 . 1 1 A 105 105 LYS N N 92 119.259 120.975 -1.716 2
1 918 . 1 1 A 106 106 ALA H H 93 7.920 8.047 -0.127 2
1 919 . 1 1 A 106 106 ALA HA H 93 4.128 4.191 -0.063 2
1 923 . 1 1 A 106 106 ALA C C 93 180.972 180.353 0.619 2
1 924 . 1 1 A 106 106 ALA CA C 93 55.070 55.142 -0.072 2
1 925 . 1 1 A 106 106 ALA CB C 93 17.750 18.511 -0.761 2
1 926 . 1 1 A 106 106 ALA N N 93 120.398 121.652 -1.254 2
1 927 . 1 1 A 107 107 PHE H H 94 8.136 8.686 -0.550 2
1 928 . 1 1 A 107 107 PHE HA H 94 4.190 4.606 -0.416 2
1 934 . 1 1 A 107 107 PHE C C 94 177.955 178.309 -0.354 2
1 935 . 1 1 A 107 107 PHE CA C 94 63.761 61.553 2.208 2
1 936 . 1 1 A 107 107 PHE CB C 94 38.446 39.013 -0.567 2
1 940 . 1 1 A 107 107 PHE N N 94 117.119 116.218 0.901 2
1 941 . 1 1 A 108 108 LEU H H 95 8.351 8.683 -0.332 2
1 942 . 1 1 A 108 108 LEU HA H 95 3.889 3.988 -0.099 2
1 951 . 1 1 A 108 108 LEU C C 95 182.043 179.267 2.776 2
1 952 . 1 1 A 108 108 LEU CA C 95 59.073 58.559 0.514 2
1 953 . 1 1 A 108 108 LEU CB C 95 41.259 42.012 -0.753 2
1 956 . 1 1 A 108 108 LEU N N 95 118.450 119.812 -1.362 2
1 957 . 1 1 A 109 109 ILE H H 96 8.992 8.133 0.859 2
1 958 . 1 1 A 109 109 ILE HA H 96 4.069 3.863 0.206 2
1 968 . 1 1 A 109 109 ILE C C 96 177.094 177.752 -0.658 2
1 969 . 1 1 A 109 109 ILE CA C 96 63.761 64.319 -0.558 2
1 970 . 1 1 A 109 109 ILE CB C 96 37.509 37.675 -0.166 2
1 974 . 1 1 A 109 109 ILE N N 96 118.177 115.126 3.051 2
1 975 . 1 1 A 110 110 ASN H H 97 7.067 8.065 -0.998 2
1 976 . 1 1 A 110 110 ASN HA H 97 4.797 4.679 0.118 2
1 981 . 1 1 A 110 110 ASN C C 97 173.595 175.450 -1.855 2
1 982 . 1 1 A 110 110 ASN CA C 97 54.385 53.386 0.999 2
1 983 . 1 1 A 110 110 ASN CB C 97 40.321 38.927 1.394 2
1 984 . 1 1 A 110 110 ASN N N 97 116.407 119.447 -3.040 2
1 986 . 1 1 A 111 111 GLY H H 98 7.681 8.011 -0.330 2
1 987 . 1 1 A 111 111 GLY HA2 H 98 4.080 3.918 0.162 2
1 988 . 1 1 A 111 111 GLY HA3 H 98 3.640 4.007 -0.367 2
1 989 . 1 1 A 111 111 GLY C C 98 174.552 174.281 0.271 2
1 990 . 1 1 A 111 111 GLY CA C 98 45.947 45.221 0.726 2
1 991 . 1 1 A 111 111 GLY N N 98 104.440 106.157 -1.718 2
1 992 . 1 1 A 112 112 TYR H H 99 8.427 8.213 0.214 2
1 993 . 1 1 A 112 112 TYR HA H 99 4.661 4.744 -0.083 2
1 998 . 1 1 A 112 112 TYR C C 99 174.425 176.055 -1.630 2
1 999 . 1 1 A 112 112 TYR CA C 99 57.198 57.851 -0.653 2
1 1000 . 1 1 A 112 112 TYR CB C 99 36.571 38.087 -1.516 2
1 1003 . 1 1 A 112 112 TYR N N 99 122.830 119.924 2.906 2
1 1004 . 1 1 A 113 113 THR H H 100 7.166 8.393 -1.227 2
1 1005 . 1 1 A 113 113 THR HA H 100 4.248 4.419 -0.171 2
1 1009 . 1 1 A 113 113 THR C C 100 174.897 174.768 0.129 2
1 1010 . 1 1 A 113 113 THR CA C 100 62.290 63.635 -1.345 2
1 1011 . 1 1 A 113 113 THR CB C 100 68.970 69.481 -0.511 2
1 1013 . 1 1 A 113 113 THR N N 100 104.304 116.224 -11.920 2
1 1014 . 1 1 A 114 114 SER H H 101 7.695 7.944 -0.249 2
1 1015 . 1 1 A 114 114 SER C C 101 174.372 174.536 -0.164 2
1 1016 . 1 1 A 114 114 SER CA C 101 56.260 57.812 -1.552 2
1 1017 . 1 1 A 114 114 SER CB C 101 65.636 64.781 0.855 2
1 1018 . 1 1 A 114 114 SER N N 101 115.613 116.541 -0.928 2
1 1023 . 1 1 A 116 116 ASP HA H 103 4.260 4.318 -0.058 2
1 1026 . 1 1 A 116 116 ASP CA C 103 57.198 57.478 -0.280 2
1 1027 . 1 1 A 116 116 ASP CB C 103 40.321 40.565 -0.244 2
1 1028 . 1 1 A 117 117 LEU H H 104 7.345 7.978 -0.633 2
1 1029 . 1 1 A 117 117 LEU HA H 104 4.290 4.024 0.266 2
1 1038 . 1 1 A 117 117 LEU C C 104 178.488 178.916 -0.428 2
1 1039 . 1 1 A 117 117 LEU CA C 104 56.260 58.069 -1.809 2
1 1040 . 1 1 A 117 117 LEU CB C 104 42.196 41.428 0.768 2
1 1043 . 1 1 A 117 117 LEU N N 104 117.878 120.189 -2.311 2
1 1044 . 1 1 A 118 118 LEU H H 105 7.514 8.212 -0.698 2
1 1045 . 1 1 A 118 118 LEU HA H 105 4.210 4.129 0.081 2
1 1054 . 1 1 A 118 118 LEU C C 105 177.002 178.066 -1.064 2
1 1055 . 1 1 A 118 118 LEU CA C 105 55.323 56.998 -1.675 2
1 1056 . 1 1 A 118 118 LEU CB C 105 42.196 41.289 0.907 2
1 1059 . 1 1 A 118 118 LEU N N 105 119.094 118.968 0.126 2
1 1060 . 1 1 A 120 120 LYS HA H 107 4.340 4.457 -0.117 2
1 1063 . 1 1 A 120 120 LYS C C 107 176.603 175.776 0.827 2
1 1064 . 1 1 A 120 120 LYS CA C 107 55.323 56.114 -0.791 2
1 1065 . 1 1 A 120 120 LYS CB C 107 31.883 33.066 -1.183 2
1 1068 . 1 1 A 121 121 ILE H H 108 7.539 7.454 0.085 2
1 1069 . 1 1 A 121 121 ILE HA H 108 3.987 4.713 -0.726 2
1 1079 . 1 1 A 121 121 ILE C C 108 173.247 175.244 -1.997 2
1 1080 . 1 1 A 121 121 ILE CA C 108 62.823 59.503 3.320 2
1 1081 . 1 1 A 121 121 ILE CB C 108 38.446 40.726 -2.280 2
1 1085 . 1 1 A 121 121 ILE N N 108 122.417 118.153 4.264 2
1 1086 . 1 1 A 122 122 ALA H H 109 8.290 8.292 -0.002 2
1 1087 . 1 1 A 122 122 ALA HA H 109 3.970 4.692 -0.722 2
1 1091 . 1 1 A 122 122 ALA C C 109 178.318 177.962 0.356 2
1 1092 . 1 1 A 122 122 ALA CA C 109 50.150 49.923 0.227 2
1 1093 . 1 1 A 122 122 ALA CB C 109 21.630 21.200 0.431 2
1 1094 . 1 1 A 122 122 ALA N N 109 127.784 126.141 1.643 2
1 1095 . 1 1 A 123 123 GLU HA H 110 3.707 3.952 -0.245 2
1 1099 . 1 1 A 123 123 GLU C C 110 178.290 178.526 -0.236 2
1 1100 . 1 1 A 123 123 GLU CA C 110 60.948 60.033 0.915 2
1 1101 . 1 1 A 123 123 GLU CB C 110 29.070 29.656 -0.586 2
1 1102 . 1 1 A 124 124 VAL H H 111 8.333 8.241 0.092 2
1 1103 . 1 1 A 124 124 VAL HA H 111 3.850 3.767 0.083 2
1 1111 . 1 1 A 124 124 VAL C C 111 177.406 177.570 -0.163 2
1 1112 . 1 1 A 124 124 VAL CA C 111 65.636 65.088 0.548 2
1 1113 . 1 1 A 124 124 VAL CB C 111 30.730 31.219 -0.489 2
1 1116 . 1 1 A 124 124 VAL N N 111 114.438 119.497 -5.059 2
1 1117 . 1 1 A 125 125 GLU H H 112 7.442 8.331 -0.888 2
1 1118 . 1 1 A 125 125 GLU HA H 112 4.152 4.067 0.085 2
1 1123 . 1 1 A 125 125 GLU C C 112 179.982 179.250 0.731 2
1 1124 . 1 1 A 125 125 GLU CA C 112 60.010 59.443 0.567 2
1 1125 . 1 1 A 125 125 GLU CB C 112 30.008 29.297 0.711 2
1 1127 . 1 1 A 125 125 GLU N N 112 121.032 121.871 -0.839 2
1 1128 . 1 1 A 126 126 LEU H H 113 7.666 7.867 -0.201 2
1 1129 . 1 1 A 126 126 LEU HA H 113 3.846 4.032 -0.186 2
1 1138 . 1 1 A 126 126 LEU C C 113 176.991 178.787 -1.796 2
1 1139 . 1 1 A 126 126 LEU CA C 113 58.135 57.940 0.195 2
1 1140 . 1 1 A 126 126 LEU CB C 113 41.259 41.666 -0.407 2
1 1143 . 1 1 A 126 126 LEU N N 113 118.731 120.849 -2.118 2
1 1144 . 1 1 A 127 127 ILE H H 114 7.781 8.050 -0.269 2
1 1145 . 1 1 A 127 127 ILE HA H 114 3.502 3.860 -0.358 2
1 1153 . 1 1 A 127 127 ILE C C 114 178.195 177.167 1.028 2
1 1154 . 1 1 A 127 127 ILE CA C 114 65.636 63.468 2.168 2
1 1155 . 1 1 A 127 127 ILE CB C 114 40.321 37.538 2.783 2
1 1159 . 1 1 A 127 127 ILE N N 114 115.084 119.318 -4.234 2
1 1160 . 1 1 A 128 128 ASN H H 115 8.470 8.014 0.456 2
1 1161 . 1 1 A 128 128 ASN HA H 115 4.502 4.704 -0.202 2
1 1166 . 1 1 A 128 128 ASN C C 115 176.295 176.365 -0.070 2
1 1167 . 1 1 A 128 128 ASN CA C 115 56.260 54.783 1.477 2
1 1168 . 1 1 A 128 128 ASN CB C 115 39.384 39.187 0.197 2
1 1169 . 1 1 A 128 128 ASN N N 115 115.158 119.359 -4.201 2
1 1171 . 1 1 A 129 129 VAL H H 116 8.116 7.809 0.307 2
1 1172 . 1 1 A 129 129 VAL HA H 116 4.090 3.912 0.178 2
1 1180 . 1 1 A 129 129 VAL C C 116 176.740 177.620 -0.880 2
1 1181 . 1 1 A 129 129 VAL CA C 116 64.400 64.897 -0.497 2
1 1182 . 1 1 A 129 129 VAL CB C 116 32.050 32.370 -0.320 2
1 1185 . 1 1 A 129 129 VAL N N 116 118.698 118.224 0.474 2
1 1186 . 1 1 A 130 130 LEU H H 117 7.294 7.901 -0.607 2
1 1187 . 1 1 A 130 130 LEU HA H 117 3.970 4.152 -0.182 2
1 1196 . 1 1 A 130 130 LEU C C 117 175.127 176.284 -1.157 2
1 1197 . 1 1 A 130 130 LEU CA C 117 56.260 55.252 1.008 2
1 1198 . 1 1 A 130 130 LEU CB C 117 41.259 42.043 -0.784 2
1 1201 . 1 1 A 130 130 LEU N N 117 116.201 118.927 -2.726 2
1 1202 . 1 1 A 131 131 LYS H H 118 6.594 7.823 -1.229 2
1 1203 . 1 1 A 131 131 LYS HA H 118 3.980 4.229 -0.249 2
1 1208 . 1 1 A 131 131 LYS C C 118 175.589 175.695 -0.106 2
1 1209 . 1 1 A 131 131 LYS CA C 118 56.260 57.389 -1.129 2
1 1210 . 1 1 A 131 131 LYS CB C 118 28.133 29.742 -1.609 2
1 1212 . 1 1 A 131 131 LYS N N 118 111.172 116.365 -5.193 2
1 1213 . 1 1 A 132 132 ILE H H 119 8.245 8.016 0.229 2
1 1214 . 1 1 A 132 132 ILE HA H 119 4.090 4.223 -0.132 2
1 1224 . 1 1 A 132 132 ILE C C 119 175.161 176.006 -0.845 2
1 1225 . 1 1 A 132 132 ILE CA C 119 60.010 62.462 -2.452 2
1 1226 . 1 1 A 132 132 ILE CB C 119 35.633 37.246 -1.613 2
1 1230 . 1 1 A 132 132 ILE N N 119 119.484 119.641 -0.157 2
1 1231 . 1 1 A 133 133 ASN H H 120 8.054 8.644 -0.590 2
1 1232 . 1 1 A 133 133 ASN HA H 120 4.350 4.694 -0.344 2
1 1235 . 1 1 A 133 133 ASN C C 120 175.136 175.153 -0.017 2
1 1236 . 1 1 A 133 133 ASN CA C 120 54.385 54.261 0.124 2
1 1237 . 1 1 A 133 133 ASN CB C 120 39.384 38.966 0.418 2
1 1238 . 1 1 A 133 133 ASN N N 120 124.670 124.182 0.488 2
1 1239 . 1 1 A 134 134 LEU H H 121 7.517 7.439 0.078 2
1 1240 . 1 1 A 134 134 LEU HA H 121 4.678 4.253 0.425 2
1 1249 . 1 1 A 134 134 LEU C C 121 178.051 177.029 1.022 2
1 1250 . 1 1 A 134 134 LEU CA C 121 53.447 55.380 -1.933 2
1 1251 . 1 1 A 134 134 LEU CB C 121 41.259 43.513 -2.254 2
1 1254 . 1 1 A 134 134 LEU N N 121 119.918 119.468 0.450 2
1 1255 . 1 1 A 135 135 ILE H H 122 9.389 8.629 0.760 2
1 1256 . 1 1 A 135 135 ILE HA H 122 3.540 3.699 -0.159 2
1 1266 . 1 1 A 135 135 ILE C C 122 176.425 177.672 -1.247 2
1 1267 . 1 1 A 135 135 ILE CA C 122 65.636 65.155 0.481 2
1 1268 . 1 1 A 135 135 ILE CB C 122 38.446 38.076 0.370 2
1 1272 . 1 1 A 135 135 ILE N N 122 129.949 126.631 3.318 2
1 1273 . 1 1 A 136 136 GLY H H 123 8.675 8.414 0.261 2
1 1274 . 1 1 A 136 136 GLY HA2 H 123 2.650 3.146 -0.496 2
1 1275 . 1 1 A 136 136 GLY HA3 H 123 2.060 3.541 -1.481 2
1 1276 . 1 1 A 136 136 GLY C C 123 176.854 176.434 0.421 2
1 1277 . 1 1 A 136 136 GLY CA C 123 45.500 47.076 -1.576 2
1 1278 . 1 1 A 136 136 GLY N N 123 106.314 108.009 -1.695 2
1 1279 . 1 1 A 137 137 HIS H H 124 6.869 7.848 -0.979 2
1 1280 . 1 1 A 137 137 HIS HA H 124 4.558 4.523 0.035 2
1 1285 . 1 1 A 137 137 HIS C C 124 176.977 177.528 -0.551 2
1 1286 . 1 1 A 137 137 HIS CA C 124 57.198 58.655 -1.457 2
1 1287 . 1 1 A 137 137 HIS CB C 124 30.945 29.723 1.222 2
1 1290 . 1 1 A 137 137 HIS N N 124 118.865 120.106 -1.241 2
1 1291 . 1 1 A 138 138 ARG H H 125 7.730 8.355 -0.625 2
1 1292 . 1 1 A 138 138 ARG HA H 125 3.770 3.907 -0.137 2
1 1299 . 1 1 A 138 138 ARG C C 125 178.288 178.433 -0.145 2
1 1300 . 1 1 A 138 138 ARG CA C 125 61.886 59.138 2.748 2
1 1301 . 1 1 A 138 138 ARG CB C 125 30.945 29.939 1.006 2
1 1304 . 1 1 A 138 138 ARG N N 125 118.149 118.959 -0.810 2
1 1306 . 1 1 A 139 139 LYS H H 126 8.679 8.190 0.489 2
1 1307 . 1 1 A 139 139 LYS HA H 126 3.990 3.968 0.022 2
1 1310 . 1 1 A 139 139 LYS C C 126 179.184 178.752 0.432 2
1 1311 . 1 1 A 139 139 LYS CA C 126 58.135 59.441 -1.306 2
1 1312 . 1 1 A 139 139 LYS CB C 126 30.945 32.146 -1.201 2
1 1314 . 1 1 A 139 139 LYS N N 126 114.003 119.138 -5.135 2
1 1315 . 1 1 A 140 140 ARG H H 127 7.248 8.011 -0.762 2
1 1316 . 1 1 A 140 140 ARG HA H 127 3.870 3.966 -0.096 2
1 1324 . 1 1 A 140 140 ARG C C 127 177.772 178.798 -1.026 2
1 1325 . 1 1 A 140 140 ARG CA C 127 60.010 59.087 0.923 2
1 1326 . 1 1 A 140 140 ARG CB C 127 30.945 29.852 1.093 2
1 1329 . 1 1 A 140 140 ARG N N 127 120.072 118.480 1.592 2
1 1331 . 1 1 A 141 141 ILE H H 128 7.706 7.996 -0.290 2
1 1332 . 1 1 A 141 141 ILE HA H 128 3.530 3.743 -0.213 2
1 1340 . 1 1 A 141 141 ILE C C 128 177.669 178.104 -0.435 2
1 1341 . 1 1 A 141 141 ILE CA C 128 65.636 65.382 0.254 2
1 1342 . 1 1 A 141 141 ILE CB C 128 38.680 37.955 0.725 2
1 1345 . 1 1 A 141 141 ILE N N 128 118.730 119.734 -1.004 2
1 1346 . 1 1 A 142 142 LEU H H 129 8.194 8.290 -0.096 2
1 1347 . 1 1 A 142 142 LEU HA H 129 3.950 4.001 -0.051 2
1 1356 . 1 1 A 142 142 LEU C C 129 179.960 178.702 1.258 2
1 1357 . 1 1 A 142 142 LEU CA C 129 58.135 58.023 0.112 2
1 1358 . 1 1 A 142 142 LEU CB C 129 41.259 41.422 -0.163 2
1 1361 . 1 1 A 142 142 LEU N N 129 117.675 121.121 -3.446 2
1 1362 . 1 1 A 143 143 ALA H H 130 8.294 8.506 -0.212 2
1 1363 . 1 1 A 143 143 ALA HA H 130 4.220 4.072 0.148 2
1 1367 . 1 1 A 143 143 ALA C C 130 179.899 179.687 0.212 2
1 1368 . 1 1 A 143 143 ALA CA C 130 54.385 55.207 -0.822 2
1 1369 . 1 1 A 143 143 ALA CB C 130 19.270 18.245 1.025 2
1 1370 . 1 1 A 143 143 ALA N N 130 121.096 121.521 -0.425 2
1 1371 . 1 1 A 144 144 SER H H 131 7.813 8.137 -0.324 2
1 1372 . 1 1 A 144 144 SER HA H 131 4.180 4.262 -0.082 2
1 1375 . 1 1 A 144 144 SER C C 131 175.457 177.090 -1.633 2
1 1376 . 1 1 A 144 144 SER CA C 131 60.948 61.582 -0.634 2
1 1377 . 1 1 A 144 144 SER CB C 131 63.761 62.989 0.772 2
1 1378 . 1 1 A 144 144 SER N N 131 112.102 113.658 -1.556 2
1 1379 . 1 1 A 145 145 LEU H H 132 7.747 7.962 -0.215 2
1 1380 . 1 1 A 145 145 LEU HA H 132 4.140 4.090 0.051 2
1 1389 . 1 1 A 145 145 LEU C C 132 178.589 177.337 1.252 2
1 1390 . 1 1 A 145 145 LEU CA C 132 56.260 56.737 -0.477 2
1 1391 . 1 1 A 145 145 LEU CB C 132 42.196 42.631 -0.435 2
1 1394 . 1 1 A 145 145 LEU N N 132 117.536 119.108 -1.572 2
1 1395 . 1 1 A 146 146 GLY H H 133 7.544 7.721 -0.177 2
1 1396 . 1 1 A 146 146 GLY HA2 H 133 3.950 4.021 -0.071 2
1 1397 . 1 1 A 146 146 GLY HA3 H 133 3.100 4.031 -0.931 2
1 1398 . 1 1 A 146 146 GLY C C 133 173.372 172.982 0.390 2
1 1399 . 1 1 A 146 146 GLY CA C 133 45.947 45.131 0.816 2
1 1400 . 1 1 A 146 146 GLY N N 133 105.351 105.171 0.180 2
1 1401 . 1 1 A 147 147 ASP H H 134 8.342 8.593 -0.251 2
1 1402 . 1 1 A 147 147 ASP HA H 134 4.650 4.908 -0.258 2
1 1405 . 1 1 A 147 147 ASP C C 134 175.462 176.116 -0.654 2
1 1406 . 1 1 A 147 147 ASP CA C 134 54.385 54.149 0.236 2
1 1407 . 1 1 A 147 147 ASP CB C 134 41.259 42.563 -1.304 2
1 1408 . 1 1 A 147 147 ASP N N 134 120.133 121.549 -1.416 2
stop_
save_